A0A077ZDW7_TRITR Loading...

NACHT domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZDW7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 802 aa.

						>A0A077ZDW7_TRITR|A0A077ZDW7
MSANTAKVDSRGRPQAHLPSINSLELIHSLLDNLMSCSKERKLDVRPHLSQVLIFFWCPKELSDERRLFYLEILPELQLTCLSYGAEMTVVDPFEWYDWSIALQPDMVNLFLQELTYCKNFSGGPFFMAVVCDHCNTLVLPPVLAEEVVSQLSDYFSENQSPFVLDDLYQSAEDAVGQRCYKLKTFDSIGQRGFDTYARLCQRLRAYHETEPNGPWLSKIFPYLHELIIAHASEGEKHISQRSLVVCKKGIAVTQFASLHQNEGSPCERLSPVGSQHSSGLLACDVEILMAPLPHLQTLNDSLSNTTKQSSLDSYLRRFYYRVSANMKCKIQAALDLRHSEDDEHQLLVSFKEDSIVHRNYALDRRKDIFIGQADLIGQVKTAFENVNAGQRSIVLVRGSHGQGKTTVLCHVSEIVTAWMDVGCVIVRFARLTPLASTIQEMLLGCCLELCQQFKLEMDLPDLASKYSTQQIFDWLETCCDQVAYKTCGKPVALFVDDIHRLKENSSISDSKLSFWLPPRLPPNMLFLATLNDEVSLDERSCPDVVTWDYVLIIPPLSMENCRILYERLKDKRCECSESSATESYIGDLSSCPLAVQMLAEMPATIKWLSVDQMNEANVLAKLTAITDARLRMAEHRCGPSVCRFALCFIECARFGLTLGELLDLLTFCEPGMLEVISTRGNVQEIFQFPLSVWLKLKQCLGCLLEEVVCDGRSVYKWSHLFVIGVIRRRYLCTVQHLKDCHMSLVALFNNTLPSAEIVEPALLNAKLRPVMPRPLVCTSHDGRAAARGCAQFIMSHRCDEA
					

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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	35.3	Very low	40.5	Very low	250 Å²	250	140.8 Å²	140.8	100%	1.232	80%	0.795	S	S	*	*				0	93.7	0	-73.2	-167.4	176.1	0	0	108.9
2	S	33.8	Very low	40.4	Very low	107 Å²	107	134.1 Å²	134.1	75%	0.748	78%	0.78	S	S	*	*			trans	-149.7	92.4	164.1	55.9	0	0	0	0	106.2	N4	S2-N4 PolarHBondContact O-N 2.8Å; S2-N4 VanDerWaalsContact O-N 3.17Å
3	A	36.2	Very low	40.1	Very low	94 Å²	94	139.5 Å²	139.5	78%	0.777	78%	0.779	S	S	*	*			trans	-61.9	114.2	176.7	0	0	0	0	0	108.3	T5	A3-T5 PolarHBondContact O-N 2.97Å
4	N	38.6	Very low	39.8	Very low	163 Å²	163	138.2 Å²	138.2	87%	0.872	78%	0.78	S	S	*	*			trans	-64.9	101	169.8	-91.3	-11.4	0	0	0	107.8	S2 A6	S2-N4 PolarHBondContact O-N 2.8Å; S2-N4 VanDerWaalsContact O-N 3.17Å; N4-A6 PolarHBondContact O-N 3.24Å
5	T	39.4	Very low	39.9	Very low	123 Å²	123	134.1 Å²	134.1	76%	0.755	75%	0.752	S	S	*	*			trans	-67.8	96.4	171.6	40.3	0	0	0	0	108.3	A3 K7	A3-T5 PolarHBondContact O-N 2.97Å; T5-K7 PolarHBondContact O-N 3.06Å
6	A	40.5	Very low	40.2	Very low	88 Å²	88	131.6 Å²	131.6	73%	0.727	75%	0.753	S	S	*	*			trans	-60.8	103.5	167.8	0	0	0	0	0	108.1	N4 V8	N4-A6 PolarHBondContact O-N 3.24Å; A6-V8 PolarHBondContact O-N 3.14Å; A6-V8 VanDerWaalsContact O-N 3.14Å
7	K	40.4	Very low	40.9	Very low	170 Å²	170	133.4 Å²	133.4	74%	0.739	75%	0.753	S	S	*	*			trans	-68.5	107.7	173.9	-79.6	-178.6	175.7	177.9	0	108.2	T5	T5-K7 PolarHBondContact O-N 3.06Å
8	V	37.7	Very low	41.2	Very low	109 Å²	109	134.5 Å²	134.5	66%	0.661	76%	0.756	S	S	*	*			trans	-90.1	119.6	173.8	178.4	0	0	0	0	107.5	A6	A6-V8 PolarHBondContact O-N 3.14Å; A6-V8 VanDerWaalsContact O-N 3.14Å
9	D	42	Very low	41.7	Very low	92 Å²	92	130.8 Å²	130.8	49%	0.492	74%	0.738	S	S	.	*			trans	-70.2	155.2	169.3	-96.6	-24	0	0	0	110.8	R11 G12 Q15	D9-R11 PolarHBondContact O-N 2.83Å; D9-G12 PolarHBondContact O-N 2.97Å; D9-Q15 PolarHBondContact OD1-NE2 2.91Å; D9-Q15 PolarHBondContact OD2-NE2 2.84Å
10	S	50.1	Low	43.2	Very low	127 Å²	127	127.5 Å²	127.5	89%	0.888	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	4.9	-171	57.6	0	0	0	0	116.7
11	R	52.2	Low	44.5	Very low	226 Å²	226	127.4 Å²	127.4	85%	0.853	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	15.1	172.3	-67.2	-171.1	179.6	-172.8	0.8	114.4	D9 R13	D9-R11 PolarHBondContact O-N 2.83Å; R11-R13 PolarHBondContact O-N 3.47Å; R11-R13 VanDerWaalsContact O-N 3.11Å
12	G	38.5	Very low	46.2	Very low	60 Å²	60	121.2 Å²	121.2	62%	0.619	69%	0.692	S	S	*	*			trans	65.2	17.7	168.9	0	0	0	0	0	115	D9	D9-G12 PolarHBondContact O-N 2.97Å
13	R	36.7	Very low	47.7	Very low	204 Å²	204	118.4 Å²	118.4	77%	0.77	67%	0.672	S	S	*	*			trans	-98.3	136.4	173.8	-68.3	-173.1	-180	-174.7	-1	109.5	R11 Q15	R11-R13 PolarHBondContact O-N 3.47Å; R11-R13 VanDerWaalsContact O-N 3.11Å; R13-Q15 PolarHBondContact O-N 3.27Å
14	P	36	Very low	48.8	Very low	122 Å²	122	117.3 Å²	117.3	79%	0.792	65%	0.653	S	S	*	*			trans	-59	127.5	175.2	24.2	-30.8	0	0	0	108.6	A16	P14-A16 PolarHBondContact O-N 3.06Å
15	Q	41.8	Very low	50.2	Low	77 Å²	77	115.7 Å²	115.7	36%	0.36	64%	0.64	S	S	.	*			trans	-61.1	107.3	171.9	-79.8	-176.8	-18.2	0	0	107.6	D9 R13 H17	D9-Q15 PolarHBondContact OD1-NE2 2.91Å; D9-Q15 PolarHBondContact OD2-NE2 2.84Å; R13-Q15 PolarHBondContact O-N 3.27Å; Q15-H17 VanDerWaalsContact C-N 3.29Å; Q15-H17 PolarHBondContact O-N 3.19Å
16	A	43.5	Very low	51.7	Low	93 Å²	93	115.2 Å²	115.2	77%	0.769	63%	0.633	S	S	*	*			trans	-64.7	96.2	167.3	0	0	0	0	0	106.9	P14 L18	P14-A16 PolarHBondContact O-N 3.06Å; A16-L18 PolarHBondContact O-N 2.89Å
17	H	53.5	Low	53.1	Low	163 Å²	163	114.9 Å²	114.9	76%	0.755	62%	0.617	S	S	*	*			trans	-61.7	106.9	172.4	-74.7	-68.4	0	0	0	107.3	Q15	Q15-H17 VanDerWaalsContact C-N 3.29Å; Q15-H17 PolarHBondContact O-N 3.19Å
18	L	46.3	Very low	54.5	Low	153 Å²	153	112 Å²	112	80%	0.801	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-54.4	134.5	166.1	-106.4	88.7	0	0	0	107.8	A16 S20	A16-L18 PolarHBondContact O-N 2.89Å; L18-S20 PolarHBondContact O-N 3.16Å
19	P	50.9	Low	55.6	Low	65 Å²	65	109.7 Å²	109.7	42%	0.422	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-55.1	138.3	175.3	20.7	-29.7	0	0	0	109.6	L24	P19-L24 HydrophobicContact CB-CG 4.49Å; P19-L24 HydrophobicContact CG-CD2 4.38Å; P19-L24 HydrophobicContact CG-CG 4.17Å
20	S	71.5	Confident	56.2	Low	64 Å²	64	109.9 Å²	109.9	45%	0.448	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-58.3	156.2	176.4	73.4	0	0	0	0	110.7	L18 N22 S23 L24	L18-S20 PolarHBondContact O-N 3.16Å; S20-N22 PolarHBondContact O-N 2.78Å; S20-S23 WeakPolarHBondContact O-CA 3.41Å; S20-S23 VanDerWaalsContact O-CB 3.27Å; S20-S23 WeakPolarHBondContact O-CB 3.1Å; S20-S23 PolarHBondContact O-N 3.48Å; S20-S23 PolarHBondContact OG-N 3.42Å; S20-S23 PolarHBondContact OG-OG 3.03Å; S20-L24 PolarHBondContact O-N 3.42Å
21	I	70.8	Confident	56.4	Low	126 Å²	126	108 Å²	108	65%	0.646	58%	0.575	S	S	*	*	H	α-helix	trans	-50.9	-41.1	175.8	-77.4	168.1	0	0	0	111.4	S23 L24 E25	I21-S23 VanDerWaalsContact C-N 3.3Å; I21-S23 PolarHBondContact O-N 3.36Å; I21-L24 WeakPolarHBondContact O-CB 3.46Å; I21-L24 PolarHBondContact O-N 2.85Å; I21-L24 VanDerWaalsContact O-N 3.16Å; I21-E25 PolarHBondContact O-N 2.89Å
22	N	69.4	Low	56.4	Low	120 Å²	120	102.3 Å²	102.3	64%	0.642	56%	0.562	S	S	*	*	H	α-helix	trans	-64.7	-33.8	176.7	-63.4	0.2	0	0	0	112.6	S20 L26	S20-N22 PolarHBondContact O-N 2.78Å; N22-L26 WeakPolarHBondContact O-CB 3.44Å; N22-L26 PolarHBondContact O-N 3.28Å
23	S	64.9	Low	56.7	Low	47 Å²	47	103.9 Å²	103.9	33%	0.329	56%	0.556	S	S	.	*	H	α-helix	trans	-70.3	-38.1	174.8	-49.1	0	0	0	0	111.2	S20 I21 L26 I27	S20-S23 WeakPolarHBondContact O-CA 3.41Å; S20-S23 VanDerWaalsContact O-CB 3.27Å; S20-S23 WeakPolarHBondContact O-CB 3.1Å; S20-S23 PolarHBondContact O-N 3.48Å; S20-S23 PolarHBondContact OG-N 3.42Å; S20-S23 PolarHBondContact OG-OG 3.03Å; I21-S23 VanDerWaalsContact C-N 3.3Å; I21-S23 PolarHBondContact O-N 3.36Å; S23-L26 PolarHBondContact O-N 2.99Å; S23-I27 WeakPolarHBondContact O-CD1 3.38Å; S23-I27 WeakPolarHBondContact O-CG1 3.07Å; S23-I27 PolarHBondContact O-N 3.37Å
24	L	61	Low	56.8	Low	72 Å²	72	100.5 Å²	100.5	38%	0.377	55%	0.553	S	S	.	*	H	α-helix	trans	-66.3	-42.3	173.6	-82.6	163.3	0	0	0	111.5	P19 S20 I21 L26 I27 H28	P19-L24 HydrophobicContact CB-CG 4.49Å; P19-L24 HydrophobicContact CG-CD2 4.38Å; P19-L24 HydrophobicContact CG-CG 4.17Å; S20-L24 PolarHBondContact O-N 3.42Å; I21-L24 WeakPolarHBondContact O-CB 3.46Å; I21-L24 PolarHBondContact O-N 2.85Å; I21-L24 VanDerWaalsContact O-N 3.16Å; L24-L26 VanDerWaalsContact C-N 3.32Å; L24-L26 PolarHBondContact O-N 3.12Å; L24-I27 PolarHBondContact O-N 2.74Å; L24-H28 WeakPolarHBondContact O-CB 3.43Å; L24-H28 PolarHBondContact O-CD2 3.28Å; L24-H28 VanDerWaalsContact O-CD2 3.26Å; L24-H28 PolarHBondContact O-N 3.32Å
25	E	67.7	Low	57.1	Low	128 Å²	128	102 Å²	102	60%	0.598	55%	0.55	S	S	*	*	H	α-helix	trans	-61.6	-39	173.1	-79.8	-175.7	162.2	0	0	112.1	I21 H28 S29	I21-E25 PolarHBondContact O-N 2.89Å; E25-H28 PolarHBondContact O-N 3.4Å; E25-S29 VanDerWaalsContact O-CB 3.27Å; E25-S29 WeakPolarHBondContact O-CB 3.05Å; E25-S29 PolarHBondContact O-N 3.07Å
26	L	70	Confident	56.7	Low	114 Å²	114	101.6 Å²	101.6	60%	0.597	56%	0.556	S	S	*	*	H	α-helix	trans	-65.9	-41.3	174.8	-161.6	92.6	0	0	0	111.7	N22 S23 L24 S29 L30	N22-L26 WeakPolarHBondContact O-CB 3.44Å; N22-L26 PolarHBondContact O-N 3.28Å; S23-L26 PolarHBondContact O-N 2.99Å; L24-L26 VanDerWaalsContact C-N 3.32Å; L24-L26 PolarHBondContact O-N 3.12Å; L26-S29 PolarHBondContact O-N 3.46Å; L26-L30 HydrophobicContact CD2-CD1 4.35Å; L26-L30 HydrophobicContact CG-CD1 4.44Å; L26-L30 WeakPolarHBondContact O-CB 3.26Å; L26-L30 WeakPolarHBondContact O-CG 3.11Å; L26-L30 PolarHBondContact O-N 2.91Å
27	I	69.4	Low	56.1	Low	80 Å²	80	101.7 Å²	101.7	41%	0.41	55%	0.551	S	S	.	*	H	α-helix	trans	-66	-42.1	176.1	-69.3	164	0	0	0	110.5	S23 L24 L30 L31	S23-I27 WeakPolarHBondContact O-CD1 3.38Å; S23-I27 WeakPolarHBondContact O-CG1 3.07Å; S23-I27 PolarHBondContact O-N 3.37Å; L24-I27 PolarHBondContact O-N 2.74Å; I27-L30 PolarHBondContact O-N 3.46Å; I27-L31 HydrophobicContact CG2-CD1 3.92Å; I27-L31 WeakPolarHBondContact O-CB 3.19Å; I27-L31 WeakPolarHBondContact O-CG 3.35Å; I27-L31 PolarHBondContact O-N 3.18Å
28	H	70.5	Confident	54.9	Low	110 Å²	110	99 Å²	99	51%	0.509	55%	0.55	S	S	.	.	H	α-helix	trans	-64.4	-42.1	174.3	-88.3	-75	0	0	0	111.4	L24 E25 L30 L31 D32	L24-H28 WeakPolarHBondContact O-CB 3.43Å; L24-H28 PolarHBondContact O-CD2 3.28Å; L24-H28 VanDerWaalsContact O-CD2 3.26Å; L24-H28 PolarHBondContact O-N 3.32Å; E25-H28 PolarHBondContact O-N 3.4Å; H28-L30 VanDerWaalsContact C-N 3.35Å; H28-L30 PolarHBondContact O-N 3.24Å; H28-L31 PolarHBondContact O-N 2.96Å; H28-D32 VanDerWaalsContact O-CB 3.31Å; H28-D32 WeakPolarHBondContact O-CB 3.23Å; H28-D32 PolarHBondContact O-N 3.39Å
29	S	60.3	Low	54.1	Low	60 Å²	60	100.5 Å²	100.5	42%	0.42	55%	0.55	S	S	.	.	H	α-helix	trans	-63.7	-38.8	174.3	-176.4	0	0	0	0	112.1	E25 L26 N33	E25-S29 VanDerWaalsContact O-CB 3.27Å; E25-S29 WeakPolarHBondContact O-CB 3.05Å; E25-S29 PolarHBondContact O-N 3.07Å; L26-S29 PolarHBondContact O-N 3.46Å; S29-N33 VanDerWaalsContact O-CB 3.29Å; S29-N33 WeakPolarHBondContact O-CB 3.41Å; S29-N33 PolarHBondContact O-N 2.95Å; S29-N33 PolarHBondContact O-ND2 3.35Å
30	L	56	Low	53	Low	97 Å²	97	104.9 Å²	104.9	51%	0.508	57%	0.565	S	S	.	*	H	α-helix	trans	-69	-39.7	175.1	-78	167.4	0	0	0	112.2	L26 I27 H28 N33 L34	L26-L30 HydrophobicContact CD2-CD1 4.35Å; L26-L30 HydrophobicContact CG-CD1 4.44Å; L26-L30 WeakPolarHBondContact O-CB 3.26Å; L26-L30 WeakPolarHBondContact O-CG 3.11Å; L26-L30 PolarHBondContact O-N 2.91Å; I27-L30 PolarHBondContact O-N 3.46Å; H28-L30 VanDerWaalsContact C-N 3.35Å; H28-L30 PolarHBondContact O-N 3.24Å; L30-N33 PolarHBondContact O-N 3.34Å; L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 WeakPolarHBondContact O-CG 3.47Å; L30-L34 PolarHBondContact O-N 2.95Å
31	L	54	Low	50.9	Low	88 Å²	88	112.7 Å²	112.7	46%	0.461	58%	0.584	S	S	.	*	H	α-helix	trans	-66.5	-43.1	174	-83	164.6	0	0	0	111.3	I27 H28 N33 L34 M35	I27-L31 HydrophobicContact CG2-CD1 3.92Å; I27-L31 WeakPolarHBondContact O-CB 3.19Å; I27-L31 WeakPolarHBondContact O-CG 3.35Å; I27-L31 PolarHBondContact O-N 3.18Å; H28-L31 PolarHBondContact O-N 2.96Å; L31-N33 VanDerWaalsContact C-N 3.31Å; L31-N33 PolarHBondContact O-N 3.25Å; L31-L34 CarbonylContact O-C 3.59Å; L31-L34 PolarHBondContact O-N 3.5Å; L31-M35 WeakPolarHBondContact O-CB 3.42Å; L31-M35 WeakPolarHBondContact O-CG 3.44Å; L31-M35 PolarHBondContact O-N 3.34Å
32	D	52	Low	49.1	Very low	105 Å²	105	114.6 Å²	114.6	56%	0.561	59%	0.588	S	S	*	*	H	α-helix	trans	-65.3	-36	174.6	-79.7	-16.6	0	0	0	110.7	H28 M35 S36	H28-D32 VanDerWaalsContact O-CB 3.31Å; H28-D32 WeakPolarHBondContact O-CB 3.23Å; H28-D32 PolarHBondContact O-N 3.39Å; D32-M35 PolarHBondContact O-N 3.42Å; D32-S36 WeakPolarHBondContact O-CA 3.4Å; D32-S36 WeakPolarHBondContact O-CB 3.49Å; D32-S36 PolarHBondContact O-N 2.77Å; D32-S36 PolarHBondContact O-OG 3.2Å
33	N	45	Very low	47.4	Very low	94 Å²	94	114.1 Å²	114.1	50%	0.503	59%	0.585	S	S	.	*	H	α-helix	trans	-69.9	-33.2	173	-76.4	-44.8	0	0	0	112.8	S29 L30 L31 C37	S29-N33 VanDerWaalsContact O-CB 3.29Å; S29-N33 WeakPolarHBondContact O-CB 3.41Å; S29-N33 PolarHBondContact O-N 2.95Å; S29-N33 PolarHBondContact O-ND2 3.35Å; L30-N33 PolarHBondContact O-N 3.34Å; L31-N33 VanDerWaalsContact C-N 3.31Å; L31-N33 PolarHBondContact O-N 3.25Å; N33-C37 PolarHBondContact O-N 3.16Å; N33-C37 PolarHBondContact O-SG 3.04Å
34	L	39.6	Very low	46.4	Very low	133 Å²	133	116.2 Å²	116.2	70%	0.696	59%	0.592	S	S	*	*	H	α-helix	trans	-70.3	-37.1	172.8	-79.9	164.7	0	0	0	111.8	L30 L31	L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 WeakPolarHBondContact O-CG 3.47Å; L30-L34 PolarHBondContact O-N 2.95Å; L31-L34 CarbonylContact O-C 3.59Å; L31-L34 PolarHBondContact O-N 3.5Å
35	M	40.5	Very low	46.1	Very low	152 Å²	152	116.2 Å²	116.2	75%	0.749	60%	0.595	S	S	*	*	H	α-helix	trans	-86.5	-29	-179.1	-64.9	-64.4	-72.7	0	0	112.9	L31 D32 C37	L31-M35 WeakPolarHBondContact O-CB 3.42Å; L31-M35 WeakPolarHBondContact O-CG 3.44Å; L31-M35 PolarHBondContact O-N 3.34Å; D32-M35 PolarHBondContact O-N 3.42Å; M35-C37 VanDerWaalsContact C-N 3.28Å; M35-C37 PolarHBondContact O-N 3.37Å
36	S	33.6	Very low	45.8	Very low	69 Å²	69	117.7 Å²	117.7	48%	0.483	60%	0.595	S	S	.	*			trans	-87	7.6	177.2	70.5	0	0	0	0	113.5	D32 S38	D32-S36 WeakPolarHBondContact O-CA 3.4Å; D32-S36 WeakPolarHBondContact O-CB 3.49Å; D32-S36 PolarHBondContact O-N 2.77Å; D32-S36 PolarHBondContact O-OG 3.2Å; S36-S38 PolarHBondContact O-N 3.35Å; S36-S38 PolarHBondContact O-OG 3.02Å
37	C	31.5	Very low	45.4	Very low	96 Å²	96	113.3 Å²	113.3	65%	0.649	57%	0.574	S	S	*	*			trans	-66.4	54	150.5	-75.5	0	0	0	0	110.7	N33 M35 K39	N33-C37 PolarHBondContact O-N 3.16Å; N33-C37 PolarHBondContact O-SG 3.04Å; M35-C37 VanDerWaalsContact C-N 3.28Å; M35-C37 PolarHBondContact O-N 3.37Å; C37-K39 PolarHBondContact O-N 3.34Å
38	S	27.8	Very low	45.6	Very low	105 Å²	105	112.4 Å²	112.4	73%	0.734	57%	0.568	S	S	*	*			trans	-83.7	23.8	161.2	60	0	0	0	0	110.8	S36 E40	S36-S38 PolarHBondContact O-N 3.35Å; S36-S38 PolarHBondContact O-OG 3.02Å; S38-E40 VanDerWaalsContact C-N 3.33Å; S38-E40 PolarHBondContact O-N 2.63Å
39	K	29.6	Very low	45.9	Very low	185 Å²	185	108.1 Å²	108.1	80%	0.804	55%	0.548	S	S	*	.	S	Bend	trans	-65.1	100.4	165.3	-75.9	-174	176.3	-179.5	0	107	C37 R41	C37-K39 PolarHBondContact O-N 3.34Å; K39-R41 PolarHBondContact O-N 2.83Å
40	E	28.8	Very low	47	Very low	158 Å²	158	106.2 Å²	106.2	74%	0.738	54%	0.535	S	S	*	.			trans	31.6	93.7	158.4	-67.4	175	176.3	0	0	112.6	S38 K42	S38-E40 VanDerWaalsContact C-N 3.33Å; S38-E40 PolarHBondContact O-N 2.63Å; E40-K42 PolarHBondContact O-N 3.21Å
41	R	27.6	Very low	48.6	Very low	228 Å²	228	101.9 Å²	101.9	86%	0.86	51%	0.512	S	S	*	.			trans	-60.9	74.9	160.1	-80.2	176.2	174.5	-179.7	1.1	108.5	K39 L43	K39-R41 PolarHBondContact O-N 2.83Å; R41-L43 HydrophobicContact CB-CD1 4.1Å; R41-L43 HydrophobicContact CG-CD1 3.96Å; R41-L43 PolarHBondContact O-N 2.76Å
42	K	31.9	Very low	50.4	Low	166 Å²	166	97.7 Å²	97.7	72%	0.722	49%	0.49	S	S	*	.			trans	-66.8	67.9	141.6	-72.8	-175.3	179.8	179.5	0	105.8	E40 D44	E40-K42 PolarHBondContact O-N 3.21Å; K42-D44 PolarHBondContact O-N 2.93Å
43	L	34.7	Very low	52.3	Low	109 Å²	109	93 Å²	93	57%	0.571	47%	0.465	S	S	*	.			trans	-70.6	68.5	152.6	-88	149.3	0	0	0	104.7	R41 V45	R41-L43 HydrophobicContact CB-CD1 4.1Å; R41-L43 HydrophobicContact CG-CD1 3.96Å; R41-L43 PolarHBondContact O-N 2.76Å; L43-V45 HydrophobicContact CB-CG2 4.3Å; L43-V45 HydrophobicContact CD2-CG2 4.3Å; L43-V45 PolarHBondContact O-N 3.09Å
44	D	43.9	Very low	54.6	Low	91 Å²	91	88.5 Å²	88.5	49%	0.487	44%	0.441	S	S	.	.			trans	-65.5	85.2	150.4	-76.1	-20.9	0	0	0	102.7	K42 R46	K42-D44 PolarHBondContact O-N 2.93Å; D44-R46 PolarHBondContact O-N 3.31Å
45	V	54.7	Low	57.2	Low	72 Å²	72	82.2 Å²	82.2	44%	0.436	41%	0.408	S	S	.	.			trans	-59.7	101.3	167.6	-177.4	0	0	0	0	103.1	L43 I356 N360	L43-V45 HydrophobicContact CB-CG2 4.3Å; L43-V45 HydrophobicContact CD2-CG2 4.3Å; L43-V45 PolarHBondContact O-N 3.09Å; V45-I356 HydrophobicContact CB-CD1 4.44Å; V45-I356 HydrophobicContact CB-CG1 4.4Å; V45-I356 HydrophobicContact CB-CG2 4.43Å; V45-I356 HydrophobicContact CG1-CD1 3.53Å; V45-I356 HydrophobicContact CG1-CG1 4.01Å; V45-I356 HydrophobicContact CG1-CG2 4.4Å; V45-I356 WeakPolarHBondContact O-CG2 3.45Å; V45-N360 PolarHBondContact O-ND2 3.37Å; V45-N360 VanDerWaalsContact O-ND2 3.13Å
46	R	60.8	Low	59.7	Low	159 Å²	159	75 Å²	75	60%	0.6	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-64.1	134.9	177.7	-70.3	-174.2	179.2	-176	-1.3	106.2	D44	D44-R46 PolarHBondContact O-N 3.31Å
47	P	61.6	Low	62.3	Low	23 Å²	23	72 Å²	72	15%	0.149	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-58.8	148.7	174.5	28.4	-31.3	0	0	0	108	L49 I356 V357 N360 V709	P47-L49 PolarHBondContact O-N 3.25Å; P47-I356 HydrophobicContact CB-CG2 4.14Å; P47-V357 HydrophobicContact CB-CG2 4.32Å; P47-N360 WeakPolarHBondContact CD-ND2 3.47Å; P47-V709 HydrophobicContact CB-CG1 4.46Å; P47-V709 HydrophobicContact CG-CB 4.49Å; P47-V709 HydrophobicContact CG-CG1 4.29Å; P47-V709 HydrophobicContact CG-CG2 4.47Å
48	H	72.9	Confident	64.9	Low	61 Å²	61	67.4 Å²	67.4	28%	0.282	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-58.3	127.1	168.5	179.6	91.3	0	0	0	108.3	S50 E353 G712	H48-S50 PolarHBondContact CD2-OG 2.78Å; H48-S50 VanDerWaalsContact CD2-OG 3.24Å; H48-S50 PolarHBondContact NE2-OG 3.41Å; H48-E353 HydrophobicContact CB-CG 4.03Å; H48-E353 WeakPolarHBondContact CB-OE1 3.26Å; H48-E353 IonicContact CD2-OE1 2.57Å; H48-E353 IonicContact CG-OE1 3.85Å; H48-G712 WeakPolarHBondContact O-CA 3.4Å
49	L	77.6	Confident	67.4	Low	20 Å²	20	62.9 Å²	62.9	11%	0.105	29%	0.288	C	S	.	.			trans	-108.6	107.3	-178.6	-70.8	162.8	0	0	0	109.4	P47 Q51 F121 V709 G712	P47-L49 PolarHBondContact O-N 3.25Å; L49-Q51 PolarHBondContact O-N 3.15Å; L49-F121 WeakPolarHBondContact CD1-O 3.41Å; L49-F121 HydrophobicContact CD2-CD1 4.46Å; L49-V709 HydrophobicContact CD2-CG1 3.9Å; L49-V709 HydrophobicContact CD2-CG2 4.16Å; L49-G712 CarbonylContact C-O 3.11Å; L49-G712 WeakPolarHBondContact CA-O 3.45Å
50	S	82.2	Confident	69.5	Low	20 Å²	20	59 Å²	59	14%	0.14	27%	0.271	C	S	.	.			trans	-87.8	33.8	173.7	-45.8	0	0	0	0	111.6	H48 A86 E87 G712	H48-S50 PolarHBondContact CD2-OG 2.78Å; H48-S50 VanDerWaalsContact CD2-OG 3.24Å; H48-S50 PolarHBondContact NE2-OG 3.41Å; S50-A86 CarbonylContact O-C 3.19Å; S50-A86 VanDerWaalsContact O-CA 3.24Å; S50-A86 WeakPolarHBondContact O-CA 3.48Å; S50-E87 PolarHBondContact O-N 2.79Å; S50-G712 PolarHBondContact N-O 2.96Å
51	Q	89.7	Confident	71.9	Confident	5 Å²	5	55.7 Å²	55.7	2%	0.023	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.7	176.1	67.5	178.1	8.7	0	0	111.5	L49 L53 E87 F121 G123 R713 S714	L49-Q51 PolarHBondContact O-N 3.15Å; Q51-L53 HydrophobicContact CG-CG 4.36Å; Q51-E87 CarbonylContact C-O 3.57Å; Q51-E87 VanDerWaalsContact CA-O 3.28Å; Q51-E87 WeakPolarHBondContact CA-O 3.43Å; Q51-F121 WeakPolarHBondContact CG-O 3.47Å; Q51-F121 PolarHBondContact NE2-O 3.05Å; Q51-G123 PolarHBondContact O-N 3.45Å; Q51-R713 HydrophobicContact CB-CG 4.37Å; Q51-S714 PolarHBondContact NE2-OG 3.01Å
52	V	91.9	Very high	74.5	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	109.5	172.4	-179	0	0	0	0	107.5	I54 E87 M88 T89 S122 P125 L335	V52-I54 HydrophobicContact CG1-CD1 4.32Å; V52-I54 HydrophobicContact CG1-CG1 3.92Å; V52-E87 PolarHBondContact N-O 2.89Å; V52-M88 WeakPolarHBondContact O-CA 3.3Å; V52-T89 PolarHBondContact O-N 3.22Å; V52-S122 WeakPolarHBondContact CA-OG 3.34Å; V52-P125 HydrophobicContact CG1-CG 4.45Å; V52-P125 WeakPolarHBondContact CG1-O 3.26Å; V52-L335 HydrophobicContact CG2-CD2 4.27Å
53	L	93.5	Very high	76.9	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	108	178.8	-55.2	177.3	0	0	0	108.3	Q51 T89 Y117 C118 F121 S122 F126	Q51-L53 HydrophobicContact CG-CG 4.36Å; L53-T89 WeakPolarHBondContact CA-O 3.48Å; L53-Y117 HydrophobicContact CD1-CD1 4.01Å; L53-Y117 HydrophobicContact CD1-CE1 3.49Å; L53-Y117 VanDerWaalsContact CD1-CE1 3.49Å; L53-C118 HydrophobicContact CB-CB 4.22Å; L53-F121 HydrophobicContact CD1-CB 4.19Å; L53-S122 PolarHBondContact N-OG 3.42Å; L53-S122 PolarHBondContact O-OG 2.98Å; L53-F126 WeakPolarHBondContact O-CA 3.4Å
54	I	93.3	Very high	79.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	109.2	179.1	-55	-164.4	0	0	0	109.2	V52 F56 M88 T89 V90 V91 P125 M128	V52-I54 HydrophobicContact CG1-CD1 4.32Å; V52-I54 HydrophobicContact CG1-CG1 3.92Å; I54-F56 PolarHBondContact O-N 2.91Å; I54-F56 VanDerWaalsContact O-N 3.15Å; I54-M88 HydrophobicContact CD1-CE 3.3Å; I54-M88 HydrophobicContact CG1-CE 3.91Å; I54-T89 PolarHBondContact N-O 3.02Å; I54-V90 WeakPolarHBondContact O-CA 3.39Å; I54-V91 PolarHBondContact O-N 3.23Å; I54-P125 HydrophobicContact CD1-CG 4.34Å; I54-M128 HydrophobicContact CG2-CB 3.9Å
55	F	93.4	Very high	81.4	Confident	1 Å²	1	32.1 Å²	32.1	0%	0.004	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	106.5	163.5	-166.8	-82.2	0	0	0	108.9	W57 V91 P93 F111 L115 C118 F126 F127 M128 I228	F55-W57 HydrophobicContact CE1-CB 4.44Å; F55-W57 HydrophobicContact CE1-CE3 4.16Å; F55-V91 CarbonylContact C-O 3.26Å; F55-V91 VanDerWaalsContact CA-O 3.27Å; F55-V91 WeakPolarHBondContact CA-O 3.37Å; F55-V91 HydrophobicContact CD2-CG1 3.99Å; F55-P93 HydrophobicContact CE1-CG 3.98Å; F55-P93 HydrophobicContact CE2-CG 4.47Å; F55-P93 HydrophobicContact CZ-CB 4.23Å; F55-P93 HydrophobicContact CZ-CG 3.68Å; F55-F111 WeakPolarHBondContact CE2-O 3.41Å; F55-F111 HydrophobicContact CZ-CB 4.38Å; F55-L115 HydrophobicContact CB-CD1 3.65Å; F55-L115 HydrophobicContact CD1-CD1 3.87Å; F55-L115 HydrophobicContact CD2-CB 3.91Å; F55-L115 HydrophobicContact CD2-CD1 4.11Å; F55-L115 HydrophobicContact CE2-CB 3.98Å; F55-L115 HydrophobicContact CG-CB 4.27Å; F55-L115 HydrophobicContact CG-CD1 3.61Å; F55-L115 HydrophobicContact CG-CG 4.48Å; F55-L115 HydrophobicContact CZ-CB 4.4Å; F55-C118 HydrophobicContact CB-CB 4.3Å; F55-F126 WeakPolarHBondContact CB-O 3.41Å; F55-F126 PolarHBondContact N-O 3.17Å; F55-F127 HydrophobicContact CB-CD2 4.36Å; F55-F127 HydrophobicContact CD1-CD2 4.03Å; F55-F127 HydrophobicContact CD1-CE2 4.05Å; F55-M128 PolarHBondContact O-N 3.45Å; F55-I228 HydrophobicContact CE1-CG2 4.12Å
56	F	92	Very high	83	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	104.1	-175	177.5	-135.7	0	0	0	110.8	I54 C58 R66 F69 Y70 V90 V91 D92 P93 M128 V130	I54-F56 PolarHBondContact O-N 2.91Å; I54-F56 VanDerWaalsContact O-N 3.15Å; F56-C58 HydrophobicContact CD1-CB 4.46Å; F56-C58 HydrophobicContact CD2-CB 4.28Å; F56-C58 HydrophobicContact CE1-CB 3.79Å; F56-C58 HydrophobicContact CE2-CB 3.55Å; F56-C58 HydrophobicContact CZ-CB 3.3Å; F56-R66 HydrophobicContact CE1-CG 4.24Å; F56-F69 AromaticContact CD1-CD1 3.79Å; F56-F69 HydrophobicContact CD1-CD1 3.79Å; F56-F69 AromaticContact CD1-CE1 3.82Å; F56-F69 HydrophobicContact CD1-CE1 3.82Å; F56-F69 HydrophobicContact CD2-CE1 4.45Å; F56-F69 HydrophobicContact CE1-CB 4.3Å; F56-F69 AromaticContact CE1-CD1 3.4Å; F56-F69 HydrophobicContact CE1-CD1 3.4Å; F56-F69 AromaticContact CE1-CE1 3.93Å; F56-F69 HydrophobicContact CE1-CE1 3.93Å; F56-F69 HydrophobicContact CE1-CG 4Å; F56-F69 HydrophobicContact CE2-CD1 4.26Å; F56-F69 HydrophobicContact CE2-CG 4.27Å; F56-F69 HydrophobicContact CG-CD1 4.35Å; F56-F69 HydrophobicContact CG-CE1 4.07Å; F56-F69 HydrophobicContact CZ-CB 3.91Å; F56-F69 AromaticContact CZ-CD1 3.65Å; F56-F69 HydrophobicContact CZ-CD1 3.65Å; F56-F69 HydrophobicContact CZ-CE1 4.3Å; F56-F69 AromaticContact CZ-CG 3.76Å; F56-F69 HydrophobicContact CZ-CG 3.76Å; F56-Y70 AromaticContact CD1-CE2 3.83Å; F56-Y70 HydrophobicContact CD1-CE2 3.83Å; F56-Y70 HydrophobicContact CE1-CD2 4.13Å; F56-Y70 AromaticContact CE1-CE2 3.63Å; F56-Y70 HydrophobicContact CE1-CE2 3.63Å; F56-V90 HydrophobicContact CB-CG1 3.52Å; F56-V90 HydrophobicContact CD1-CG1 4.1Å; F56-V90 HydrophobicContact CG-CG1 4.23Å; F56-V91 PolarHBondContact N-O 2.99Å; F56-D92 HydrophobicContact CB-CB 4.42Å; F56-D92 HydrophobicContact CD1-CB 4.49Å; F56-P93 WeakPolarHBondContact O-CD 3.19Å; F56-M128 CarbonylContact C-O 3.55Å; F56-M128 WeakPolarHBondContact CA-O 3.33Å; F56-M128 HydrophobicContact CD2-CB 4.24Å; F56-M128 HydrophobicContact CD2-CE 3.46Å; F56-M128 VanDerWaalsContact CD2-CE 3.46Å; F56-M128 HydrophobicContact CD2-CG 4.47Å; F56-M128 HydrophobicContact CD2-SD 3.54Å; F56-M128 VanDerWaalsContact CD2-SD 3.54Å; F56-M128 HydrophobicContact CE2-CE 3.13Å; F56-M128 HydrophobicContact CE2-SD 3.39Å; F56-M128 WeakPolarHBondContact CE2-SD 3.46Å; F56-M128 HydrophobicContact CZ-CE 4.02Å; F56-V130 HydrophobicContact CE2-CG2 4.09Å
57	W	88.2	Confident	84.2	Confident	6 Å²	6	26.2 Å²	26.2	2%	0.023	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	99.5	175.6	-175.3	-98.9	0	0	0	110.7	F55 P93 F94 A102 M128 A129 V130 L224 I228	F55-W57 HydrophobicContact CE1-CB 4.44Å; F55-W57 HydrophobicContact CE1-CE3 4.16Å; W57-P93 HydrophobicContact CE3-CG 3.46Å; W57-P93 VanDerWaalsContact CE3-CG 3.46Å; W57-P93 HydrophobicContact CZ3-CB 4.31Å; W57-P93 HydrophobicContact CZ3-CG 3.52Å; W57-F94 HydrophobicContact CD2-CD2 4.27Å; W57-F94 AromaticContact CD2-CE2 3.44Å; W57-F94 HydrophobicContact CD2-CE2 3.44Å; W57-F94 VanDerWaalsContact CD2-CE2 3.44Å; W57-F94 HydrophobicContact CD2-CZ 4.18Å; W57-F94 AromaticContact CE2-CE2 3.41Å; W57-F94 VanDerWaalsContact CE2-CE2 3.41Å; W57-F94 AromaticContact CE2-CZ 3.76Å; W57-F94 AromaticContact CE3-CD2 3.89Å; W57-F94 HydrophobicContact CE3-CD2 3.89Å; W57-F94 AromaticContact CE3-CE2 3.3Å; W57-F94 HydrophobicContact CE3-CE2 3.3Å; W57-F94 AromaticContact CE3-CZ 3.97Å; W57-F94 HydrophobicContact CE3-CZ 3.97Å; W57-F94 HydrophobicContact CG-CE2 4.33Å; W57-F94 HydrophobicContact CH2-CD2 4.28Å; W57-F94 AromaticContact CH2-CE1 3.79Å; W57-F94 HydrophobicContact CH2-CE1 3.79Å; W57-F94 AromaticContact CH2-CE2 3.21Å; W57-F94 HydrophobicContact CH2-CE2 3.21Å; W57-F94 AromaticContact CH2-CZ 2.91Å; W57-F94 HydrophobicContact CH2-CZ 2.91Å; W57-F94 HydrophobicContact CZ2-CE1 4.33Å; W57-F94 AromaticContact CZ2-CE2 3.33Å; W57-F94 HydrophobicContact CZ2-CE2 3.33Å; W57-F94 AromaticContact CZ2-CZ 3.14Å; W57-F94 HydrophobicContact CZ2-CZ 3.14Å; W57-F94 AromaticContact CZ3-CD2 3.88Å; W57-F94 HydrophobicContact CZ3-CD2 3.88Å; W57-F94 HydrophobicContact CZ3-CE1 4.14Å; W57-F94 AromaticContact CZ3-CE2 3.18Å; W57-F94 HydrophobicContact CZ3-CE2 3.18Å; W57-F94 AromaticContact CZ3-CZ 3.36Å; W57-F94 HydrophobicContact CZ3-CZ 3.36Å; W57-A102 HydrophobicContact CH2-CB 4.49Å; W57-M128 PolarHBondContact N-O 2.96Å; W57-A129 HydrophobicContact CB-CB 3.91Å; W57-A129 HydrophobicContact CG-CB 4.38Å; W57-A129 CarbonylContact O-C 3.59Å; W57-A129 VanDerWaalsContact O-CA 3.29Å; W57-A129 WeakPolarHBondContact O-CA 3.49Å; W57-V130 PolarHBondContact O-N 3.33Å; W57-L224 HydrophobicContact CH2-CD1 4.15Å; W57-L224 HydrophobicContact CH2-CD2 3.44Å; W57-L224 VanDerWaalsContact CH2-CD2 3.44Å; W57-L224 HydrophobicContact CH2-CG 3.48Å; W57-L224 VanDerWaalsContact CH2-CG 3.48Å; W57-L224 HydrophobicContact CZ2-CB 4.38Å; W57-L224 HydrophobicContact CZ2-CD2 3.77Å; W57-L224 HydrophobicContact CZ2-CG 3.58Å; W57-I228 HydrophobicContact CD2-CD1 3.59Å; W57-I228 HydrophobicContact CE3-CD1 3.29Å; W57-I228 HydrophobicContact CH2-CD1 3.16Å; W57-I228 HydrophobicContact CZ2-CD1 3.5Å; W57-I228 VanDerWaalsContact CZ2-CD1 3.5Å; W57-I228 HydrophobicContact CZ3-CD1 3.08Å
58	C	87.2	Confident	85.5	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.			trans	-135.8	103.8	172.9	-167.2	0	0	0	0	110.1	F56 R66 F94 V130	F56-C58 HydrophobicContact CD1-CB 4.46Å; F56-C58 HydrophobicContact CD2-CB 4.28Å; F56-C58 HydrophobicContact CE1-CB 3.79Å; F56-C58 HydrophobicContact CE2-CB 3.55Å; F56-C58 HydrophobicContact CZ-CB 3.3Å; C58-R66 HydrophobicContact CB-CB 4.42Å; C58-R66 PolarHBondContact O-NH1 3.16Å; C58-F94 WeakPolarHBondContact O-CD2 3.46Å; C58-V130 HydrophobicContact CB-CG2 4.45Å
59	P	79.5	Confident	86.4	Confident	10 Å²	10	23 Å²	23	7%	0.065	11%	0.111	C	C	.	.			trans	-71.4	164.9	-177.6	32.9	-36.8	0	0	0	111.5	E61 L62 F94 V130	P59-E61 VanDerWaalsContact C-N 3.25Å; P59-E61 WeakPolarHBondContact CB-OE2 3.42Å; P59-E61 PolarHBondContact O-N 3.23Å; P59-L62 HydrophobicContact CG-CD1 3.96Å; P59-L62 PolarHBondContact O-N 3.33Å; P59-F94 HydrophobicContact CB-CE2 4.03Å; P59-F94 HydrophobicContact CB-CZ 4.11Å; P59-V130 VanDerWaalsContact CD-O 3.31Å; P59-V130 WeakPolarHBondContact CD-O 3.18Å
60	K	75.2	Confident	86.9	Confident	103 Å²	103	22.2 Å²	22.2	45%	0.448	11%	0.107	S	C	.	.	G	3₁₀ helix	trans	-63.3	-27.3	-169	-174	178.3	176.2	-178.8	0	114	L62 S63	K60-L62 PolarHBondContact O-N 3.06Å; K60-L62 VanDerWaalsContact O-N 3.09Å; K60-S63 PolarHBondContact O-N 2.95Å
61	E	77.4	Confident	87.2	Confident	89 Å²	89	23.1 Å²	23.1	42%	0.416	11%	0.11	S	C	.	.	G	3₁₀ helix	trans	-63	-12.6	175.8	-61.5	75.9	-167.1	0	0	112.9	P59	P59-E61 VanDerWaalsContact C-N 3.25Å; P59-E61 WeakPolarHBondContact CB-OE2 3.42Å; P59-E61 PolarHBondContact O-N 3.23Å
62	L	82.6	Confident	87.2	Confident	0 Å²	0	28 Å²	28	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-115.9	40.4	-178.3	-61.9	169.4	0	0	0	111.3	P59 K60 D64 E65 R66 V130 C132 K248	P59-L62 HydrophobicContact CG-CD1 3.96Å; P59-L62 PolarHBondContact O-N 3.33Å; K60-L62 PolarHBondContact O-N 3.06Å; K60-L62 VanDerWaalsContact O-N 3.09Å; L62-D64 PolarHBondContact O-N 3.14Å; L62-E65 WeakPolarHBondContact CA-OE2 3.43Å; L62-E65 HydrophobicContact CB-CB 4.44Å; L62-E65 PolarHBondContact O-N 2.95Å; L62-R66 WeakPolarHBondContact O-CB 3.39Å; L62-R66 PolarHBondContact O-N 3.08Å; L62-V130 HydrophobicContact CD1-CB 3.86Å; L62-V130 HydrophobicContact CD1-CG1 3.55Å; L62-V130 WeakPolarHBondContact CD1-O 3.4Å; L62-V130 HydrophobicContact CG-CG1 4.47Å; L62-C132 HydrophobicContact CD1-CB 4.45Å; L62-C132 HydrophobicContact CD2-CB 4.14Å; L62-K248 HydrophobicContact CD2-CB 4.39Å; L62-K248 HydrophobicContact CD2-CD 3.37Å
63	S	81.8	Confident	87.2	Confident	31 Å²	31	28 Å²	28	22%	0.217	13%	0.132	C	C	.	.	H	α-helix	trans	-57.9	-42.3	-179.4	46.8	0	0	0	0	113.7	K60 E65 R66 R67 E685	K60-S63 PolarHBondContact O-N 2.95Å; S63-E65 PolarHBondContact O-N 3.44Å; S63-R66 PolarHBondContact O-N 2.92Å; S63-R67 WeakPolarHBondContact O-CB 2.91Å; S63-R67 PolarHBondContact O-N 3.45Å; S63-E685 WeakPolarHBondContact CB-OE1 3.3Å; S63-E685 WeakPolarHBondContact CB-OE2 3.49Å
64	D	85.6	Confident	87.2	Confident	68 Å²	68	27.8 Å²	27.8	36%	0.364	13%	0.131	S	C	.	.	H	α-helix	trans	-61.9	-44.8	178.9	-67.8	-38.6	0	0	0	111.1	L62 L68 L316	L62-D64 PolarHBondContact O-N 3.14Å; D64-L68 VanDerWaalsContact O-CB 3.25Å; D64-L68 WeakPolarHBondContact O-CB 3.39Å; D64-L68 PolarHBondContact O-N 3.41Å; D64-L316 HydrophobicContact CB-CD1 4.13Å; D64-L316 HydrophobicContact CB-CD2 3.91Å
65	E	88.8	Confident	87	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-66.7	-43	176.9	-62.8	85.7	167.8	0	0	111.6	L62 S63 L68 F69 K248 Y315 L316 F319	L62-E65 WeakPolarHBondContact CA-OE2 3.43Å; L62-E65 HydrophobicContact CB-CB 4.44Å; L62-E65 PolarHBondContact O-N 2.95Å; S63-E65 PolarHBondContact O-N 3.44Å; E65-L68 PolarHBondContact O-N 2.94Å; E65-F69 WeakPolarHBondContact O-CB 3.45Å; E65-F69 PolarHBondContact O-N 3.46Å; E65-K248 WeakPolarHBondContact OE1-CD 3.42Å; E65-K248 VanDerWaalsContact OE1-CE 3.27Å; E65-K248 WeakPolarHBondContact OE1-CE 3.41Å; E65-K248 IonicContact OE1-NZ 3.78Å; E65-K248 PolarHBondContact OE1-NZ 3.46Å; E65-K248 IonicContact OE2-NZ 2.84Å; E65-Y315 HydrophobicContact CG-CE1 4.09Å; E65-Y315 WeakPolarHBondContact OE1-CE1 3.47Å; E65-Y315 PolarHBondContact OE1-OH 3.36Å; E65-L316 HydrophobicContact CG-CD2 4.33Å; E65-F319 HydrophobicContact CB-CD2 4.42Å; E65-F319 HydrophobicContact CB-CE1 4.1Å; E65-F319 HydrophobicContact CB-CE2 3.94Å; E65-F319 HydrophobicContact CB-CZ 3.76Å; E65-F319 HydrophobicContact CG-CD2 4Å; E65-F319 HydrophobicContact CG-CE2 3.94Å; E65-F319 HydrophobicContact CG-CG 4.37Å; E65-F319 HydrophobicContact CG-CZ 4.25Å
66	R	87.4	Confident	87	Confident	25 Å²	25	32 Å²	32	9%	0.094	15%	0.154	C	C	.	.	H	α-helix	trans	-59.8	-50	175.5	-174.5	-179.6	175	94.6	9	110.9	F56 C58 L62 S63 L68 F69 Y70 D92 I686	F56-R66 HydrophobicContact CE1-CG 4.24Å; C58-R66 HydrophobicContact CB-CB 4.42Å; C58-R66 PolarHBondContact O-NH1 3.16Å; L62-R66 WeakPolarHBondContact O-CB 3.39Å; L62-R66 PolarHBondContact O-N 3.08Å; S63-R66 PolarHBondContact O-N 2.92Å; R66-L68 PolarHBondContact O-N 3.29Å; R66-F69 PolarHBondContact O-N 3.41Å; R66-Y70 HydrophobicContact CG-CD2 4Å; R66-Y70 HydrophobicContact CG-CE2 4.03Å; R66-Y70 WeakPolarHBondContact O-CD2 3.44Å; R66-Y70 PolarHBondContact O-N 2.89Å; R66-D92 IonicContact CZ-OD1 3.36Å; R66-D92 IonicContact CZ-OD2 3.53Å; R66-D92 IonicContact NE-OD2 3.2Å; R66-D92 IonicContact NH1-OD1 3.83Å; R66-D92 PolarHBondContact NH1-OD1 2.8Å; R66-D92 IonicContact NH1-OD2 2.94Å; R66-D92 PolarHBondContact NH1-OD2 2.83Å; R66-D92 VanDerWaalsContact NH2-CG 3.25Å; R66-D92 IonicContact NH2-OD1 3.68Å; R66-D92 PolarHBondContact NH2-OD1 3.49Å; R66-D92 IonicContact NH2-OD2 2.98Å; R66-D92 PolarHBondContact NH2-OD2 2.83Å; R66-I686 HydrophobicContact CG-CD1 4.36Å
67	R	86	Confident	87	Confident	82 Å²	82	32 Å²	32	31%	0.309	15%	0.154	S	C	.	.	H	α-helix	trans	-58.7	-46.5	177.7	179.8	178.2	173.4	94	-10.7	111.4	S63 Y70 L71	S63-R67 WeakPolarHBondContact O-CB 2.91Å; S63-R67 PolarHBondContact O-N 3.45Å; R67-Y70 PolarHBondContact O-N 3.35Å; R67-L71 HydrophobicContact CG-CD1 3.57Å; R67-L71 HydrophobicContact CG-CG 4.35Å; R67-L71 WeakPolarHBondContact O-CB 3.43Å; R67-L71 VanDerWaalsContact O-CG 3.28Å; R67-L71 WeakPolarHBondContact O-CG 3.5Å; R67-L71 PolarHBondContact O-N 3.15Å
68	L	89.4	Confident	87.1	Confident	17 Å²	17	31.9 Å²	31.9	9%	0.089	15%	0.154	C	C	.	.	H	α-helix	trans	-62.6	-43	177.8	179.6	59.4	0	0	0	112	D64 E65 R66 E72 I73 L316 F319 Y320	D64-L68 VanDerWaalsContact O-CB 3.25Å; D64-L68 WeakPolarHBondContact O-CB 3.39Å; D64-L68 PolarHBondContact O-N 3.41Å; E65-L68 PolarHBondContact O-N 2.94Å; R66-L68 PolarHBondContact O-N 3.29Å; L68-E72 HydrophobicContact CD1-CB 4.01Å; L68-E72 HydrophobicContact CD1-CG 3.95Å; L68-E72 WeakPolarHBondContact CD1-OE2 3.37Å; L68-E72 PolarHBondContact O-N 3.41Å; L68-I73 PolarHBondContact O-N 2.98Å; L68-L316 HydrophobicContact CD2-CB 3.97Å; L68-L316 HydrophobicContact CD2-CD2 4.13Å; L68-L316 VanDerWaalsContact CD2-O 3.28Å; L68-L316 WeakPolarHBondContact CD2-O 3.38Å; L68-F319 HydrophobicContact CD2-CD1 3.74Å; L68-F319 HydrophobicContact CD2-CE1 4.46Å; L68-F319 HydrophobicContact CG-CD1 4.41Å; L68-Y320 HydrophobicContact CD1-CD2 4.21Å
69	F	91.7	Very high	87.2	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.18	C	C	.	.	I	π-helix	trans	-58.4	-52.1	176.4	177.4	-97	0	0	0	111.4	F56 E65 R66 I73 L74 L77 V90 M128 V323	F56-F69 AromaticContact CD1-CD1 3.79Å; F56-F69 HydrophobicContact CD1-CD1 3.79Å; F56-F69 AromaticContact CD1-CE1 3.82Å; F56-F69 HydrophobicContact CD1-CE1 3.82Å; F56-F69 HydrophobicContact CD2-CE1 4.45Å; F56-F69 HydrophobicContact CE1-CB 4.3Å; F56-F69 AromaticContact CE1-CD1 3.4Å; F56-F69 HydrophobicContact CE1-CD1 3.4Å; F56-F69 AromaticContact CE1-CE1 3.93Å; F56-F69 HydrophobicContact CE1-CE1 3.93Å; F56-F69 HydrophobicContact CE1-CG 4Å; F56-F69 HydrophobicContact CE2-CD1 4.26Å; F56-F69 HydrophobicContact CE2-CG 4.27Å; F56-F69 HydrophobicContact CG-CD1 4.35Å; F56-F69 HydrophobicContact CG-CE1 4.07Å; F56-F69 HydrophobicContact CZ-CB 3.91Å; F56-F69 AromaticContact CZ-CD1 3.65Å; F56-F69 HydrophobicContact CZ-CD1 3.65Å; F56-F69 HydrophobicContact CZ-CE1 4.3Å; F56-F69 AromaticContact CZ-CG 3.76Å; F56-F69 HydrophobicContact CZ-CG 3.76Å; E65-F69 WeakPolarHBondContact O-CB 3.45Å; E65-F69 PolarHBondContact O-N 3.46Å; R66-F69 PolarHBondContact O-N 3.41Å; F69-I73 HydrophobicContact CB-CD1 4.49Å; F69-I73 HydrophobicContact CD2-CB 4Å; F69-I73 HydrophobicContact CD2-CD1 4.2Å; F69-I73 HydrophobicContact CD2-CG2 3.97Å; F69-I73 HydrophobicContact CE2-CG2 4.1Å; F69-I73 CarbonylContact O-C 3.53Å; F69-I73 WeakPolarHBondContact O-CB 3.48Å; F69-I73 PolarHBondContact O-N 3.24Å; F69-L74 HydrophobicContact CE1-CB 4.46Å; F69-L74 WeakPolarHBondContact O-CB 3.41Å; F69-L74 PolarHBondContact O-N 3.44Å; F69-L77 HydrophobicContact CE2-CD1 4.31Å; F69-V90 HydrophobicContact CE1-CG1 4.29Å; F69-V90 HydrophobicContact CE1-CG2 3.97Å; F69-V90 HydrophobicContact CZ-CG2 4.27Å; F69-M128 HydrophobicContact CD2-CE 3.31Å; F69-M128 HydrophobicContact CE2-CE 3.35Å; F69-M128 HydrophobicContact CG-CE 4.01Å; F69-M128 HydrophobicContact CZ-CE 4.05Å; F69-V323 HydrophobicContact CD2-CG1 4.43Å
70	Y	88.7	Confident	87.6	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.008	18%	0.183	C	C	.	.	I	π-helix	trans	-69.6	-36.7	-176.6	-84.5	-75	0	0	0	114.3	F56 R66 R67 L74 V90 D92 I686 R769 P770	F56-Y70 AromaticContact CD1-CE2 3.83Å; F56-Y70 HydrophobicContact CD1-CE2 3.83Å; F56-Y70 HydrophobicContact CE1-CD2 4.13Å; F56-Y70 AromaticContact CE1-CE2 3.63Å; F56-Y70 HydrophobicContact CE1-CE2 3.63Å; R66-Y70 HydrophobicContact CG-CD2 4Å; R66-Y70 HydrophobicContact CG-CE2 4.03Å; R66-Y70 WeakPolarHBondContact O-CD2 3.44Å; R66-Y70 PolarHBondContact O-N 2.89Å; R67-Y70 PolarHBondContact O-N 3.35Å; Y70-L74 HydrophobicContact CD1-CD2 3.65Å; Y70-L74 HydrophobicContact CE1-CD2 4.09Å; Y70-V90 HydrophobicContact CE1-CB 4.44Å; Y70-V90 HydrophobicContact CE1-CG1 4.21Å; Y70-D92 WeakPolarHBondContact CE2-OD2 3.48Å; Y70-D92 WeakPolarHBondContact OH-CB 3.27Å; Y70-D92 VanDerWaalsContact OH-CG 3.3Å; Y70-D92 PolarHBondContact OH-OD2 2.84Å; Y70-I686 VanDerWaalsContact CB-CD1 3.49Å; Y70-I686 HydrophobicContact CD2-CD1 3.21Å; Y70-I686 HydrophobicContact CE2-CD1 4.04Å; Y70-I686 HydrophobicContact CG-CD1 3.53Å; Y70-R769 HydrophobicContact CD1-CG 3.94Å; Y70-R769 HydrophobicContact CE1-CG 4.24Å; Y70-P770 VanDerWaalsContact O-CD 3.29Å; Y70-P770 WeakPolarHBondContact O-CD 3.48Å; Y70-P770 VanDerWaalsContact O-CG 3.31Å; Y70-P770 WeakPolarHBondContact O-CG 3.43Å
71	L	87.4	Confident	88.3	Confident	40 Å²	40	32.4 Å²	32.4	21%	0.209	16%	0.161	C	C	.	.	I	π-helix	trans	-88.3	-28.6	-172.7	-63.8	178.4	0	0	0	113.9	R67 K767	R67-L71 HydrophobicContact CG-CD1 3.57Å; R67-L71 HydrophobicContact CG-CG 4.35Å; R67-L71 WeakPolarHBondContact O-CB 3.43Å; R67-L71 VanDerWaalsContact O-CG 3.28Å; R67-L71 WeakPolarHBondContact O-CG 3.5Å; R67-L71 PolarHBondContact O-N 3.15Å; L71-K767 HydrophobicContact CD1-CB 4.41Å; L71-K767 HydrophobicContact CD1-CD 3.47Å; L71-K767 VanDerWaalsContact CD1-CD 3.47Å; L71-K767 HydrophobicContact CD2-CB 3.81Å; L71-K767 HydrophobicContact CD2-CD 3.93Å; L71-K767 HydrophobicContact CG-CD 4.37Å
72	E	89.8	Confident	88.7	Confident	108 Å²	108	31 Å²	31	51%	0.505	16%	0.156	S	C	.	.	I	π-helix	trans	-119.8	-46.3	-173.7	-57.7	-173.9	-159.7	0	0	112.2	L68 Y320	L68-E72 HydrophobicContact CD1-CB 4.01Å; L68-E72 HydrophobicContact CD1-CG 3.95Å; L68-E72 WeakPolarHBondContact CD1-OE2 3.37Å; L68-E72 PolarHBondContact O-N 3.41Å; E72-Y320 HydrophobicContact CB-CD2 4.02Å; E72-Y320 HydrophobicContact CB-CE2 3.74Å
73	I	93.4	Very high	88.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	I	π-helix	trans	-77	-49.1	-175.4	-54.8	178.8	0	0	0	111.2	L68 F69 E76 L77 F319 Y320 V323	L68-I73 PolarHBondContact O-N 2.98Å; F69-I73 HydrophobicContact CB-CD1 4.49Å; F69-I73 HydrophobicContact CD2-CB 4Å; F69-I73 HydrophobicContact CD2-CD1 4.2Å; F69-I73 HydrophobicContact CD2-CG2 3.97Å; F69-I73 HydrophobicContact CE2-CG2 4.1Å; F69-I73 CarbonylContact O-C 3.53Å; F69-I73 WeakPolarHBondContact O-CB 3.48Å; F69-I73 PolarHBondContact O-N 3.24Å; I73-E76 WeakPolarHBondContact O-CB 3.49Å; I73-E76 PolarHBondContact O-N 3.34Å; I73-L77 HydrophobicContact CG2-CD1 3.76Å; I73-L77 HydrophobicContact CG2-CG 3.95Å; I73-L77 WeakPolarHBondContact O-CG 3.42Å; I73-L77 PolarHBondContact O-N 3.18Å; I73-F319 HydrophobicContact CD1-CD1 4.27Å; I73-F319 HydrophobicContact CD1-CE1 3.93Å; I73-Y320 HydrophobicContact CD1-CD2 4.34Å; I73-Y320 HydrophobicContact CG1-CD2 3.63Å; I73-Y320 HydrophobicContact CG1-CE2 4Å; I73-V323 HydrophobicContact CD1-CB 3.96Å; I73-V323 HydrophobicContact CD1-CG1 3.87Å; I73-V323 HydrophobicContact CG2-CG1 4.4Å
74	L	92.1	Very high	88.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57	-47.9	-175.2	174.1	62.8	0	0	0	112.8	F69 Y70 E76 L77 Q78 M88 V90 R769	F69-L74 HydrophobicContact CE1-CB 4.46Å; F69-L74 WeakPolarHBondContact O-CB 3.41Å; F69-L74 PolarHBondContact O-N 3.44Å; Y70-L74 HydrophobicContact CD1-CD2 3.65Å; Y70-L74 HydrophobicContact CE1-CD2 4.09Å; L74-E76 PolarHBondContact O-N 2.92Å; L74-L77 PolarHBondContact O-N 2.88Å; L74-Q78 HydrophobicContact CD1-CG 3.82Å; L74-Q78 HydrophobicContact CG-CG 4.2Å; L74-Q78 WeakPolarHBondContact O-CB 3.45Å; L74-Q78 VanDerWaalsContact O-CG 3.32Å; L74-Q78 WeakPolarHBondContact O-CG 3.47Å; L74-Q78 PolarHBondContact O-N 3.27Å; L74-M88 HydrophobicContact CD1-CE 3.75Å; L74-M88 HydrophobicContact CD1-SD 4.18Å; L74-V90 HydrophobicContact CD1-CG2 3.43Å; L74-V90 VanDerWaalsContact CD1-CG2 3.43Å; L74-V90 HydrophobicContact CD2-CG2 4.07Å; L74-V90 HydrophobicContact CG-CG2 4.36Å; L74-R769 HydrophobicContact CD2-CG 4.25Å
75	P	90.5	Very high	88.5	Confident	36 Å²	36	35 Å²	35	23%	0.234	19%	0.19	C	C	.	.	H	α-helix	trans	-56.3	-39.7	175.3	-27.2	35.9	0	0	0	113.1	Q78 L79 P770	P75-Q78 PolarHBondContact O-N 3.18Å; P75-L79 WeakPolarHBondContact O-CB 3.43Å; P75-L79 VanDerWaalsContact O-CG 3.29Å; P75-L79 WeakPolarHBondContact O-CG 3.19Å; P75-L79 PolarHBondContact O-N 3.06Å; P75-P770 HydrophobicContact CG-CB 3.89Å; P75-P770 HydrophobicContact CG-CG 3.65Å
76	E	91.9	Very high	88.3	Confident	54 Å²	54	35 Å²	35	25%	0.252	19%	0.19	S	C	.	.	H	α-helix	trans	-67	-40.9	-179.9	-157.1	-176.8	-169.1	0	0	111.5	I73 L74 T80 Y320 S324 K328	I73-E76 WeakPolarHBondContact O-CB 3.49Å; I73-E76 PolarHBondContact O-N 3.34Å; L74-E76 PolarHBondContact O-N 2.92Å; E76-T80 PolarHBondContact O-N 3.44Å; E76-T80 PolarHBondContact O-OG1 2.99Å; E76-Y320 PolarHBondContact OE2-OH 3.02Å; E76-S324 PolarHBondContact OE2-OG 3.34Å; E76-K328 VanDerWaalsContact CG-CE 3.4Å; E76-K328 WeakPolarHBondContact OE1-CE 3.38Å; E76-K328 IonicContact OE1-NZ 3.56Å; E76-K328 PolarHBondContact OE1-NZ 3.01Å; E76-K328 IonicContact OE2-NZ 2.78Å
77	L	92.7	Very high	88.4	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-70.3	-40.4	175.3	-59.4	-177.3	0	0	0	111.9	F69 I73 L74 L79 T80 C81 M88 M327 K328 I331	F69-L77 HydrophobicContact CE2-CD1 4.31Å; I73-L77 HydrophobicContact CG2-CD1 3.76Å; I73-L77 HydrophobicContact CG2-CG 3.95Å; I73-L77 WeakPolarHBondContact O-CG 3.42Å; I73-L77 PolarHBondContact O-N 3.18Å; L74-L77 PolarHBondContact O-N 2.88Å; L77-L79 PolarHBondContact O-N 2.9Å; L77-T80 CarbonylContact O-C 3.55Å; L77-T80 WeakPolarHBondContact O-CB 3.22Å; L77-T80 PolarHBondContact O-N 3.35Å; L77-C81 PolarHBondContact O-N 3.18Å; L77-C81 PolarHBondContact O-SG 3.17Å; L77-M88 HydrophobicContact CB-CE 3.91Å; L77-M88 HydrophobicContact CB-SD 3.47Å; L77-M88 WeakPolarHBondContact CB-SD 3.25Å; L77-M88 HydrophobicContact CD1-CE 3.86Å; L77-M88 HydrophobicContact CD1-SD 4.5Å; L77-M327 HydrophobicContact CD1-CB 3.77Å; L77-M327 HydrophobicContact CD1-CG 4.2Å; L77-M327 HydrophobicContact CD2-CB 3.74Å; L77-M327 HydrophobicContact CG-CB 4.43Å; L77-K328 HydrophobicContact CD2-CG 3.67Å; L77-I331 HydrophobicContact CB-CD1 4.19Å; L77-I331 HydrophobicContact CD2-CD1 4Å; L77-I331 HydrophobicContact CG-CD1 4.48Å
78	Q	90.8	Very high	88.6	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.019	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-46.2	175.1	-77.5	176.1	-35.3	0	0	111.5	L74 P75 T80 C81 L82 M88 M772	L74-Q78 HydrophobicContact CD1-CG 3.82Å; L74-Q78 HydrophobicContact CG-CG 4.2Å; L74-Q78 WeakPolarHBondContact O-CB 3.45Å; L74-Q78 VanDerWaalsContact O-CG 3.32Å; L74-Q78 WeakPolarHBondContact O-CG 3.47Å; L74-Q78 PolarHBondContact O-N 3.27Å; P75-Q78 PolarHBondContact O-N 3.18Å; Q78-T80 VanDerWaalsContact C-N 3.31Å; Q78-T80 PolarHBondContact O-N 3.48Å; Q78-C81 PolarHBondContact O-N 2.83Å; Q78-L82 VanDerWaalsContact O-CB 3.32Å; Q78-L82 WeakPolarHBondContact O-CB 3.18Å; Q78-L82 PolarHBondContact O-N 2.89Å; Q78-M88 HydrophobicContact CG-CB 4.16Å; Q78-M88 HydrophobicContact CG-CG 4.5Å; Q78-M88 HydrophobicContact CG-SD 4.47Å; Q78-M772 HydrophobicContact CB-SD 3.68Å; Q78-M772 HydrophobicContact CG-SD 3.59Å; Q78-M772 VanDerWaalsContact CG-SD 3.59Å
79	L	88.8	Confident	88.7	Confident	106 Å²	106	29.9 Å²	29.9	56%	0.555	17%	0.17	S	C	*	.	H	α-helix	trans	-63	-38.6	175	-72	172.7	0	0	0	112	P75 L77 L82 S83	P75-L79 WeakPolarHBondContact O-CB 3.43Å; P75-L79 VanDerWaalsContact O-CG 3.29Å; P75-L79 WeakPolarHBondContact O-CG 3.19Å; P75-L79 PolarHBondContact O-N 3.06Å; L77-L79 PolarHBondContact O-N 2.9Å; L79-L82 PolarHBondContact O-N 3.04Å; L79-S83 PolarHBondContact O-N 3.34Å
80	T	88.5	Confident	88.6	Confident	18 Å²	18	29.9 Å²	29.9	11%	0.11	17%	0.17	C	C	.	.	H	α-helix	trans	-63.4	-49.1	174.8	-54	0	0	0	0	110.4	E76 L77 Q78 L82 S83 Y84 I331 Q332	E76-T80 PolarHBondContact O-N 3.44Å; E76-T80 PolarHBondContact O-OG1 2.99Å; L77-T80 CarbonylContact O-C 3.55Å; L77-T80 WeakPolarHBondContact O-CB 3.22Å; L77-T80 PolarHBondContact O-N 3.35Å; Q78-T80 VanDerWaalsContact C-N 3.31Å; Q78-T80 PolarHBondContact O-N 3.48Å; T80-L82 VanDerWaalsContact C-N 3.3Å; T80-L82 PolarHBondContact O-N 2.88Å; T80-S83 PolarHBondContact O-N 3.02Å; T80-S83 PolarHBondContact O-OG 3.38Å; T80-Y84 HydrophobicContact CG2-CE2 4.38Å; T80-Y84 VanDerWaalsContact O-CD2 3.25Å; T80-Y84 WeakPolarHBondContact O-CD2 2.77Å; T80-I331 HydrophobicContact CG2-CG2 4.22Å; T80-Q332 HydrophobicContact CG2-CG 4.49Å
81	C	89.3	Confident	88.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.8	-41.5	176.3	-70.2	0	0	0	0	112.3	L77 Q78 S83 Y84 G85 A86 M88	L77-C81 PolarHBondContact O-N 3.18Å; L77-C81 PolarHBondContact O-SG 3.17Å; Q78-C81 PolarHBondContact O-N 2.83Å; C81-S83 VanDerWaalsContact C-N 3.31Å; C81-S83 PolarHBondContact O-N 3.41Å; C81-Y84 CarbonylContact O-C 3.44Å; C81-Y84 WeakPolarHBondContact O-CA 3.31Å; C81-Y84 PolarHBondContact O-N 3.45Å; C81-G85 PolarHBondContact O-N 3.25Å; C81-A86 CarbonylContact C-O 3.36Å; C81-A86 HydrophobicContact CB-CB 4.28Å; C81-A86 WeakPolarHBondContact CB-O 3.42Å; C81-A86 PolarHBondContact O-N 3.45Å; C81-M88 HydrophobicContact CB-CB 4.07Å
82	L	85.8	Confident	88.7	Confident	59 Å²	59	27.9 Å²	27.9	31%	0.309	16%	0.16	S	C	.	.	H	α-helix	trans	-63.5	-34.6	179.5	-172.5	66.8	0	0	0	112.3	Q78 L79 T80 Y84 G85 A86 M772 P773 P775	Q78-L82 VanDerWaalsContact O-CB 3.32Å; Q78-L82 WeakPolarHBondContact O-CB 3.18Å; Q78-L82 PolarHBondContact O-N 2.89Å; L79-L82 PolarHBondContact O-N 3.04Å; T80-L82 VanDerWaalsContact C-N 3.3Å; T80-L82 PolarHBondContact O-N 2.88Å; L82-Y84 PolarHBondContact O-N 2.87Å; L82-G85 PolarHBondContact O-N 2.87Å; L82-A86 PolarHBondContact N-O 2.76Å; L82-M772 HydrophobicContact CB-CE 4.06Å; L82-M772 HydrophobicContact CD1-CE 4.15Å; L82-P773 HydrophobicContact CD2-CB 4.26Å; L82-P775 HydrophobicContact CD2-CG 4.48Å
83	S	85.4	Confident	88.1	Confident	92 Å²	92	22.8 Å²	22.8	64%	0.643	14%	0.136	S	C	*	.	H	α-helix	trans	-64.4	-20	175.5	70.9	0	0	0	0	113.2	L79 T80 C81	L79-S83 PolarHBondContact O-N 3.34Å; T80-S83 PolarHBondContact O-N 3.02Å; T80-S83 PolarHBondContact O-OG 3.38Å; C81-S83 VanDerWaalsContact C-N 3.31Å; C81-S83 PolarHBondContact O-N 3.41Å
84	Y	81.1	Confident	86.9	Confident	48 Å²	48	23.6 Å²	23.6	19%	0.188	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	11.9	173.7	-71	-86.3	0	0	0	112.8	T80 C81 L82 A86 Q332 L335 D336 H339	T80-Y84 HydrophobicContact CG2-CE2 4.38Å; T80-Y84 VanDerWaalsContact O-CD2 3.25Å; T80-Y84 WeakPolarHBondContact O-CD2 2.77Å; C81-Y84 CarbonylContact O-C 3.44Å; C81-Y84 WeakPolarHBondContact O-CA 3.31Å; C81-Y84 PolarHBondContact O-N 3.45Å; L82-Y84 PolarHBondContact O-N 2.87Å; Y84-A86 PolarHBondContact O-N 3.3Å; Y84-Q332 HydrophobicContact CE2-CG 4.13Å; Y84-L335 HydrophobicContact CD1-CB 3.66Å; Y84-L335 HydrophobicContact CD1-CD1 4.34Å; Y84-L335 HydrophobicContact CD2-CB 4.26Å; Y84-L335 HydrophobicContact CD2-CD1 3.69Å; Y84-L335 HydrophobicContact CD2-CG 4.4Å; Y84-L335 HydrophobicContact CE1-CB 4.04Å; Y84-L335 HydrophobicContact CG-CB 3.79Å; Y84-L335 HydrophobicContact CG-CD1 3.55Å; Y84-L335 HydrophobicContact CG-CG 4.21Å; Y84-D336 WeakPolarHBondContact CE1-OD1 3.45Å; Y84-D336 VanDerWaalsContact CZ-OD1 3.29Å; Y84-D336 PolarHBondContact OH-OD1 3.19Å; Y84-H339 AromaticContact CD1-CD2 3.61Å; Y84-H339 AromaticContact CD1-NE2 3.39Å; Y84-H339 WeakPolarHBondContact CD1-NE2 3.43Å; Y84-H339 AromaticContact CE1-CD2 3.84Å
85	G	79.7	Confident	85.5	Confident	44 Å²	44	23.8 Å²	23.8	45%	0.454	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	9.1	-178.5	0	0	0	0	0	115.3	C81 L82	C81-G85 PolarHBondContact O-N 3.25Å; L82-G85 PolarHBondContact O-N 2.87Å
86	A	84.9	Confident	83.9	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.008	14%	0.135	C	C	.	.			trans	-96.7	142.8	-177.6	0	0	0	0	0	112.7	S50 C81 L82 Y84 L335	S50-A86 CarbonylContact O-C 3.19Å; S50-A86 VanDerWaalsContact O-CA 3.24Å; S50-A86 WeakPolarHBondContact O-CA 3.48Å; C81-A86 CarbonylContact C-O 3.36Å; C81-A86 HydrophobicContact CB-CB 4.28Å; C81-A86 WeakPolarHBondContact CB-O 3.42Å; C81-A86 PolarHBondContact O-N 3.45Å; L82-A86 PolarHBondContact N-O 2.76Å; Y84-A86 PolarHBondContact O-N 3.3Å; A86-L335 HydrophobicContact CB-CD1 4.24Å
87	E	87.9	Confident	82.1	Confident	9 Å²	9	21.7 Å²	21.7	4%	0.042	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	138.9	170.8	-177.5	172	-164.7	0	0	110.6	S50 Q51 V52 T658 M772 R774	S50-E87 PolarHBondContact O-N 2.79Å; Q51-E87 CarbonylContact C-O 3.57Å; Q51-E87 VanDerWaalsContact CA-O 3.28Å; Q51-E87 WeakPolarHBondContact CA-O 3.43Å; V52-E87 PolarHBondContact N-O 2.89Å; E87-T658 PolarHBondContact OE1-OG1 2.94Å; E87-T658 PolarHBondContact OE2-OG1 2.96Å; E87-M772 HydrophobicContact CG-CG 4.13Å; E87-R774 IonicContact OE1-CZ 3.26Å; E87-R774 IonicContact OE1-NE 2.63Å; E87-R774 IonicContact OE1-NH2 3.25Å; E87-R774 PolarHBondContact OE1-NH2 3.09Å
88	M	91	Very high	80.3	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.1	173.7	-179	173.2	173.5	0	0	111.2	V52 I54 L74 L77 Q78 C81 V90	V52-M88 WeakPolarHBondContact O-CA 3.3Å; I54-M88 HydrophobicContact CD1-CE 3.3Å; I54-M88 HydrophobicContact CG1-CE 3.91Å; L74-M88 HydrophobicContact CD1-CE 3.75Å; L74-M88 HydrophobicContact CD1-SD 4.18Å; L77-M88 HydrophobicContact CB-CE 3.91Å; L77-M88 HydrophobicContact CB-SD 3.47Å; L77-M88 WeakPolarHBondContact CB-SD 3.25Å; L77-M88 HydrophobicContact CD1-CE 3.86Å; L77-M88 HydrophobicContact CD1-SD 4.5Å; Q78-M88 HydrophobicContact CG-CB 4.16Å; Q78-M88 HydrophobicContact CG-CG 4.5Å; Q78-M88 HydrophobicContact CG-SD 4.47Å; C81-M88 HydrophobicContact CB-CB 4.07Å; M88-V90 HydrophobicContact CE-CG2 4.19Å
89	T	90.6	Very high	78.5	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.031	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.6	174	-60.2	0	0	0	0	109.8	V52 L53 I54 V91 L659	V52-T89 PolarHBondContact O-N 3.22Å; L53-T89 WeakPolarHBondContact CA-O 3.48Å; I54-T89 PolarHBondContact N-O 3.02Å; T89-V91 HydrophobicContact CG2-CG2 4.5Å; T89-L659 HydrophobicContact CG2-CD2 4.43Å; T89-L659 HydrophobicContact CG2-CG 4.43Å
90	V	91.3	Very high	77.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.6	167.6	-179.5	0	0	0	0	108.8	I54 F56 F69 Y70 L74 M88 D92 R769	I54-V90 WeakPolarHBondContact O-CA 3.39Å; F56-V90 HydrophobicContact CB-CG1 3.52Å; F56-V90 HydrophobicContact CD1-CG1 4.1Å; F56-V90 HydrophobicContact CG-CG1 4.23Å; F69-V90 HydrophobicContact CE1-CG1 4.29Å; F69-V90 HydrophobicContact CE1-CG2 3.97Å; F69-V90 HydrophobicContact CZ-CG2 4.27Å; Y70-V90 HydrophobicContact CE1-CB 4.44Å; Y70-V90 HydrophobicContact CE1-CG1 4.21Å; L74-V90 HydrophobicContact CD1-CG2 3.43Å; L74-V90 VanDerWaalsContact CD1-CG2 3.43Å; L74-V90 HydrophobicContact CD2-CG2 4.07Å; L74-V90 HydrophobicContact CG-CG2 4.36Å; M88-V90 HydrophobicContact CE-CG2 4.19Å; V90-D92 HydrophobicContact CG1-CB 4.18Å; V90-R769 PolarHBondContact O-NH1 2.9Å; V90-R769 PolarHBondContact O-NH2 3.37Å
91	V	89.9	Confident	75.9	Confident	1 Å²	1	24 Å²	24	1%	0.006	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	103.9	177.3	177.4	0	0	0	0	106.9	I54 F55 F56 T89 E114 L659 L691	I54-V91 PolarHBondContact O-N 3.23Å; F55-V91 CarbonylContact C-O 3.26Å; F55-V91 VanDerWaalsContact CA-O 3.27Å; F55-V91 WeakPolarHBondContact CA-O 3.37Å; F55-V91 HydrophobicContact CD2-CG1 3.99Å; F56-V91 PolarHBondContact N-O 2.99Å; T89-V91 HydrophobicContact CG2-CG2 4.5Å; V91-E114 HydrophobicContact CG1-CG 3.55Å; V91-L659 HydrophobicContact CG2-CD2 3.86Å; V91-L691 HydrophobicContact CB-CD2 4.41Å; V91-L691 HydrophobicContact CG1-CD2 3.38Å
92	D	86.7	Confident	74.6	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.135	C	C	.	.			trans	-123.7	113.6	-171.2	175.7	-17	0	0	0	111.2	F56 R66 Y70 V90 F94 E95	F56-D92 HydrophobicContact CB-CB 4.42Å; F56-D92 HydrophobicContact CD1-CB 4.49Å; R66-D92 IonicContact CZ-OD1 3.36Å; R66-D92 IonicContact CZ-OD2 3.53Å; R66-D92 IonicContact NE-OD2 3.2Å; R66-D92 IonicContact NH1-OD1 3.83Å; R66-D92 PolarHBondContact NH1-OD1 2.8Å; R66-D92 IonicContact NH1-OD2 2.94Å; R66-D92 PolarHBondContact NH1-OD2 2.83Å; R66-D92 VanDerWaalsContact NH2-CG 3.25Å; R66-D92 IonicContact NH2-OD1 3.68Å; R66-D92 PolarHBondContact NH2-OD1 3.49Å; R66-D92 IonicContact NH2-OD2 2.98Å; R66-D92 PolarHBondContact NH2-OD2 2.83Å; Y70-D92 WeakPolarHBondContact CE2-OD2 3.48Å; Y70-D92 WeakPolarHBondContact OH-CB 3.27Å; Y70-D92 VanDerWaalsContact OH-CG 3.3Å; Y70-D92 PolarHBondContact OH-OD2 2.84Å; V90-D92 HydrophobicContact CG1-CB 4.18Å; D92-F94 PolarHBondContact O-N 2.85Å; D92-F94 WeakPolarHBondContact OD1-CA 3.31Å; D92-F94 PolarHBondContact OD1-N 2.91Å; D92-E95 HydrophobicContact CB-CG 3.66Å; D92-E95 WeakPolarHBondContact CB-OE1 3.25Å; D92-E95 VanDerWaalsContact O-CG 3.28Å; D92-E95 WeakPolarHBondContact O-CG 3.42Å; D92-E95 PolarHBondContact O-N 3.39Å; D92-E95 PolarHBondContact OD1-N 3.45Å
93	P	77.7	Confident	73.4	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.006	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-18.1	-174.8	29.3	-35.7	0	0	0	113.5	F55 F56 W57 F111	F55-P93 HydrophobicContact CE1-CG 3.98Å; F55-P93 HydrophobicContact CE2-CG 4.47Å; F55-P93 HydrophobicContact CZ-CB 4.23Å; F55-P93 HydrophobicContact CZ-CG 3.68Å; F56-P93 WeakPolarHBondContact O-CD 3.19Å; W57-P93 HydrophobicContact CE3-CG 3.46Å; W57-P93 VanDerWaalsContact CE3-CG 3.46Å; W57-P93 HydrophobicContact CZ3-CB 4.31Å; W57-P93 HydrophobicContact CZ3-CG 3.52Å; P93-F111 HydrophobicContact CB-CB 4.45Å; P93-F111 HydrophobicContact CB-CD1 3.46Å; P93-F111 VanDerWaalsContact CB-CD1 3.46Å; P93-F111 HydrophobicContact CB-CD2 3.88Å; P93-F111 HydrophobicContact CB-CE1 3.43Å; P93-F111 VanDerWaalsContact CB-CE1 3.43Å; P93-F111 HydrophobicContact CB-CE2 3.85Å; P93-F111 HydrophobicContact CB-CG 3.69Å; P93-F111 HydrophobicContact CB-CZ 3.61Å; P93-F111 VanDerWaalsContact O-CZ 3.31Å; P93-F111 WeakPolarHBondContact O-CZ 3.45Å
94	F	69	Low	72.7	Confident	16 Å²	16	17.7 Å²	17.7	7%	0.07	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	5.6	-178.1	-66.1	-64.4	0	0	0	113.5	W57 C58 P59 D92 W96 Y97 W99 A102	W57-F94 HydrophobicContact CD2-CD2 4.27Å; W57-F94 AromaticContact CD2-CE2 3.44Å; W57-F94 HydrophobicContact CD2-CE2 3.44Å; W57-F94 VanDerWaalsContact CD2-CE2 3.44Å; W57-F94 HydrophobicContact CD2-CZ 4.18Å; W57-F94 AromaticContact CE2-CE2 3.41Å; W57-F94 VanDerWaalsContact CE2-CE2 3.41Å; W57-F94 AromaticContact CE2-CZ 3.76Å; W57-F94 AromaticContact CE3-CD2 3.89Å; W57-F94 HydrophobicContact CE3-CD2 3.89Å; W57-F94 AromaticContact CE3-CE2 3.3Å; W57-F94 HydrophobicContact CE3-CE2 3.3Å; W57-F94 AromaticContact CE3-CZ 3.97Å; W57-F94 HydrophobicContact CE3-CZ 3.97Å; W57-F94 HydrophobicContact CG-CE2 4.33Å; W57-F94 HydrophobicContact CH2-CD2 4.28Å; W57-F94 AromaticContact CH2-CE1 3.79Å; W57-F94 HydrophobicContact CH2-CE1 3.79Å; W57-F94 AromaticContact CH2-CE2 3.21Å; W57-F94 HydrophobicContact CH2-CE2 3.21Å; W57-F94 AromaticContact CH2-CZ 2.91Å; W57-F94 HydrophobicContact CH2-CZ 2.91Å; W57-F94 HydrophobicContact CZ2-CE1 4.33Å; W57-F94 AromaticContact CZ2-CE2 3.33Å; W57-F94 HydrophobicContact CZ2-CE2 3.33Å; W57-F94 AromaticContact CZ2-CZ 3.14Å; W57-F94 HydrophobicContact CZ2-CZ 3.14Å; W57-F94 AromaticContact CZ3-CD2 3.88Å; W57-F94 HydrophobicContact CZ3-CD2 3.88Å; W57-F94 HydrophobicContact CZ3-CE1 4.14Å; W57-F94 AromaticContact CZ3-CE2 3.18Å; W57-F94 HydrophobicContact CZ3-CE2 3.18Å; W57-F94 AromaticContact CZ3-CZ 3.36Å; W57-F94 HydrophobicContact CZ3-CZ 3.36Å; C58-F94 WeakPolarHBondContact O-CD2 3.46Å; P59-F94 HydrophobicContact CB-CE2 4.03Å; P59-F94 HydrophobicContact CB-CZ 4.11Å; D92-F94 PolarHBondContact O-N 2.85Å; D92-F94 WeakPolarHBondContact OD1-CA 3.31Å; D92-F94 PolarHBondContact OD1-N 2.91Å; F94-W96 PolarHBondContact O-N 3.37Å; F94-Y97 PolarHBondContact O-N 3.24Å; F94-Y97 VanDerWaalsContact O-N 3.12Å; F94-W99 HydrophobicContact CE1-CB 4.39Å; F94-A102 HydrophobicContact CD1-CB 4.21Å; F94-A102 HydrophobicContact CE1-CB 3.65Å; F94-A102 HydrophobicContact CZ-CB 4.44Å
95	E	63.2	Low	72.1	Confident	5 Å²	5	16.3 Å²	16.3	2%	0.023	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	109.1	172.4	-73.3	170.6	177.4	0	0	110	D92 Y97 Q688 P690 L691 R769	D92-E95 HydrophobicContact CB-CG 3.66Å; D92-E95 WeakPolarHBondContact CB-OE1 3.25Å; D92-E95 VanDerWaalsContact O-CG 3.28Å; D92-E95 WeakPolarHBondContact O-CG 3.42Å; D92-E95 PolarHBondContact O-N 3.39Å; D92-E95 PolarHBondContact OD1-N 3.45Å; E95-Y97 WeakPolarHBondContact O-CD2 2.95Å; E95-Y97 WeakPolarHBondContact O-CE2 3.34Å; E95-Y97 PolarHBondContact O-N 3.07Å; E95-Q688 PolarHBondContact OE1-OE1 3.5Å; E95-P690 HydrophobicContact CB-CB 4.47Å; E95-P690 WeakPolarHBondContact O-CB 3.34Å; E95-L691 WeakPolarHBondContact OE2-CB 3.22Å; E95-L691 PolarHBondContact OE2-N 3.37Å; E95-L691 VanDerWaalsContact OE2-N 3.13Å; E95-R769 IonicContact OE1-NH1 3.63Å; E95-R769 PolarHBondContact OE1-NH1 3.12Å
96	W	56.3	Low	71.8	Confident	31 Å²	31	15.6 Å²	15.6	12%	0.117	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	-1.4	176.3	-62.3	11.2	0	0	0	117.4	F94 M673 V676 I677 I686 F687 Q688 P690	F94-W96 PolarHBondContact O-N 3.37Å; W96-M673 HydrophobicContact CH2-CE 3.49Å; W96-M673 VanDerWaalsContact CH2-CE 3.49Å; W96-M673 HydrophobicContact CH2-CG 3.82Å; W96-M673 HydrophobicContact CH2-SD 3.19Å; W96-M673 WeakPolarHBondContact CH2-SD 3Å; W96-M673 HydrophobicContact CZ2-CE 3.47Å; W96-M673 VanDerWaalsContact CZ2-CE 3.47Å; W96-M673 HydrophobicContact CZ2-SD 3.84Å; W96-M673 HydrophobicContact CZ3-SD 3.98Å; W96-V676 HydrophobicContact CE3-CG1 3.66Å; W96-V676 HydrophobicContact CZ3-CB 4Å; W96-V676 HydrophobicContact CZ3-CG1 3.48Å; W96-V676 VanDerWaalsContact CZ3-CG1 3.48Å; W96-I677 HydrophobicContact CH2-CD1 4.26Å; W96-I677 HydrophobicContact CH2-CG1 3.77Å; W96-I677 HydrophobicContact CZ3-CG1 3.77Å; W96-I686 PolarHBondContact NE1-O 3.25Å; W96-F687 HydrophobicContact CH2-CE2 4.18Å; W96-F687 HydrophobicContact CH2-CZ 4.35Å; W96-F687 HydrophobicContact CZ2-CD2 4Å; W96-F687 HydrophobicContact CZ2-CE2 4.03Å; W96-F687 HydrophobicContact CZ2-CG 4.29Å; W96-F687 HydrophobicContact CZ2-CZ 4.37Å; W96-Q688 WeakPolarHBondContact CZ2-O 3.45Å; W96-Q688 PolarHBondContact NE1-O 2.98Å; W96-P690 HydrophobicContact CB-CB 4.07Å; W96-P690 HydrophobicContact CD2-CB 4.09Å; W96-P690 HydrophobicContact CD2-CG 4.03Å; W96-P690 HydrophobicContact CE3-CB 4.2Å; W96-P690 HydrophobicContact CE3-CG 3.64Å; W96-P690 HydrophobicContact CG-CB 4Å; W96-P690 HydrophobicContact CG-CG 4.43Å; W96-P690 HydrophobicContact CZ3-CG 4.29Å
97	Y	53.1	Low	71.8	Confident	15 Å²	15	15.6 Å²	15.6	6%	0.059	8%	0.076	C	C	.	.			trans	-108.2	139	-166	-60.3	-48.5	0	0	0	115.2	F94 E95 I101 R680 P690 S692 V693	F94-Y97 PolarHBondContact O-N 3.24Å; F94-Y97 VanDerWaalsContact O-N 3.12Å; E95-Y97 WeakPolarHBondContact O-CD2 2.95Å; E95-Y97 WeakPolarHBondContact O-CE2 3.34Å; E95-Y97 PolarHBondContact O-N 3.07Å; Y97-I101 HydrophobicContact CD1-CB 4.25Å; Y97-I101 HydrophobicContact CD1-CD1 2.92Å; Y97-I101 HydrophobicContact CD1-CG1 4.11Å; Y97-I101 HydrophobicContact CD2-CB 4.17Å; Y97-I101 HydrophobicContact CD2-CD1 4.17Å; Y97-I101 HydrophobicContact CD2-CG2 3.86Å; Y97-I101 HydrophobicContact CE1-CD1 3.25Å; Y97-I101 HydrophobicContact CE2-CD1 4.42Å; Y97-I101 HydrophobicContact CE2-CG2 4.24Å; Y97-I101 HydrophobicContact CG-CB 3.82Å; Y97-I101 HydrophobicContact CG-CD1 3.43Å; Y97-I101 VanDerWaalsContact CG-CD1 3.43Å; Y97-I101 HydrophobicContact CG-CG1 4.2Å; Y97-I101 HydrophobicContact CG-CG2 4.03Å; Y97-R680 HydrophobicContact CE1-CB 4.46Å; Y97-R680 HydrophobicContact CE1-CG 4.48Å; Y97-R680 PolarHBondContact OH-NH1 3.44Å; Y97-P690 HydrophobicContact CE2-CB 3.73Å; Y97-P690 WeakPolarHBondContact OH-CB 3.43Å; Y97-P690 WeakPolarHBondContact OH-CG 3.43Å; Y97-S692 WeakPolarHBondContact CE2-OG 3.32Å; Y97-S692 PolarHBondContact OH-OG 3.45Å; Y97-V693 WeakPolarHBondContact OH-CG2 3.48Å
98	D	56.1	Low	71.5	Confident	72 Å²	72	15.7 Å²	15.7	39%	0.385	8%	0.077	S	C	.	.			trans	-59.2	137.7	146.6	-165	38.1	0	0	0	107.6	S100 I101	D98-S100 WeakPolarHBondContact O-CA 3.42Å; D98-S100 PolarHBondContact O-N 3.03Å; D98-S100 PolarHBondContact O-OG 2.84Å; D98-I101 PolarHBondContact O-N 2.99Å
99	W	52.8	Low	71.2	Confident	69 Å²	69	19.1 Å²	19.1	26%	0.261	10%	0.096	S	C	.	.	G	3₁₀ helix	trans	-44.3	-22.3	179.4	44	-75.7	0	0	0	113.3	F94 I101 A102 L103 T137	F94-W99 HydrophobicContact CE1-CB 4.39Å; W99-I101 PolarHBondContact O-N 3.29Å; W99-I101 VanDerWaalsContact O-N 3.09Å; W99-A102 PolarHBondContact O-N 2.77Å; W99-L103 HydrophobicContact CE3-CD1 3.5Å; W99-L103 VanDerWaalsContact CE3-CD1 3.5Å; W99-L103 HydrophobicContact CE3-CG 4.34Å; W99-L103 HydrophobicContact CZ3-CD1 3.62Å; W99-L103 PolarHBondContact O-N 3.11Å; W99-L103 VanDerWaalsContact O-N 3.15Å; W99-T137 HydrophobicContact CE3-CG2 4.07Å
100	S	61.1	Low	71.1	Confident	22 Å²	22	19.3 Å²	19.3	15%	0.154	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-31.4	-44.2	161.8	71.3	0	0	0	0	116.7	D98 L103 Q104 F194	D98-S100 WeakPolarHBondContact O-CA 3.42Å; D98-S100 PolarHBondContact O-N 3.03Å; D98-S100 PolarHBondContact O-OG 2.84Å; S100-L103 WeakPolarHBondContact O-CB 3.37Å; S100-L103 PolarHBondContact O-N 3.3Å; S100-Q104 PolarHBondContact O-N 3.22Å; S100-F194 VanDerWaalsContact O-CE2 3.23Å; S100-F194 WeakPolarHBondContact O-CE2 3.5Å
101	I	61.2	Low	71	Confident	14 Å²	14	19.7 Å²	19.7	7%	0.072	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-79.6	-34.3	-176.9	-81.1	159.4	0	0	0	112.1	Y97 D98 W99 L103 Q104 M107 R680	Y97-I101 HydrophobicContact CD1-CB 4.25Å; Y97-I101 HydrophobicContact CD1-CD1 2.92Å; Y97-I101 HydrophobicContact CD1-CG1 4.11Å; Y97-I101 HydrophobicContact CD2-CB 4.17Å; Y97-I101 HydrophobicContact CD2-CD1 4.17Å; Y97-I101 HydrophobicContact CD2-CG2 3.86Å; Y97-I101 HydrophobicContact CE1-CD1 3.25Å; Y97-I101 HydrophobicContact CE2-CD1 4.42Å; Y97-I101 HydrophobicContact CE2-CG2 4.24Å; Y97-I101 HydrophobicContact CG-CB 3.82Å; Y97-I101 HydrophobicContact CG-CD1 3.43Å; Y97-I101 VanDerWaalsContact CG-CD1 3.43Å; Y97-I101 HydrophobicContact CG-CG1 4.2Å; Y97-I101 HydrophobicContact CG-CG2 4.03Å; D98-I101 PolarHBondContact O-N 2.99Å; W99-I101 PolarHBondContact O-N 3.29Å; W99-I101 VanDerWaalsContact O-N 3.09Å; I101-L103 PolarHBondContact O-N 3.46Å; I101-Q104 WeakPolarHBondContact O-CB 3.38Å; I101-Q104 PolarHBondContact O-N 3.39Å; I101-Q104 VanDerWaalsContact O-N 3.09Å; I101-M107 HydrophobicContact CG2-CG 4.23Å; I101-M107 VanDerWaalsContact O-CB 3.26Å; I101-M107 WeakPolarHBondContact O-CB 3.46Å; I101-R680 VanDerWaalsContact CD1-NH1 3.32Å
102	A	61.1	Low	71	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.008	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.4	169	0	0	0	0	0	112.4	W57 F94 W99 V108 F111 L224	W57-A102 HydrophobicContact CH2-CB 4.49Å; F94-A102 HydrophobicContact CD1-CB 4.21Å; F94-A102 HydrophobicContact CE1-CB 3.65Å; F94-A102 HydrophobicContact CZ-CB 4.44Å; W99-A102 PolarHBondContact O-N 2.77Å; A102-V108 WeakPolarHBondContact O-CG2 3.32Å; A102-F111 HydrophobicContact CB-CE2 4.24Å; A102-L224 HydrophobicContact CB-CD2 3.94Å
103	L	61.7	Low	71.2	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-10.3	171.7	-68.6	-179.2	0	0	0	113.9	W99 S100 I101 P105 T137 L138 F194 Y197	W99-L103 HydrophobicContact CE3-CD1 3.5Å; W99-L103 VanDerWaalsContact CE3-CD1 3.5Å; W99-L103 HydrophobicContact CE3-CG 4.34Å; W99-L103 HydrophobicContact CZ3-CD1 3.62Å; W99-L103 PolarHBondContact O-N 3.11Å; W99-L103 VanDerWaalsContact O-N 3.15Å; S100-L103 WeakPolarHBondContact O-CB 3.37Å; S100-L103 PolarHBondContact O-N 3.3Å; I101-L103 PolarHBondContact O-N 3.46Å; L103-P105 WeakPolarHBondContact O-CD 3.48Å; L103-T137 HydrophobicContact CD1-CG2 4.36Å; L103-T137 HydrophobicContact CD2-CG2 3.46Å; L103-T137 VanDerWaalsContact CD2-CG2 3.46Å; L103-T137 HydrophobicContact CG-CG2 4.15Å; L103-L138 WeakPolarHBondContact CD2-O 3.24Å; L103-F194 HydrophobicContact CB-CE2 4.48Å; L103-Y197 HydrophobicContact CB-CD1 4.22Å; L103-Y197 HydrophobicContact CB-CE1 3.68Å; L103-Y197 HydrophobicContact CD1-CE1 4.22Å; L103-Y197 HydrophobicContact CD2-CE1 3.93Å; L103-Y197 HydrophobicContact CG-CE1 4.16Å; L103-Y197 VanDerWaalsContact O-CZ 3.24Å; L103-Y197 PolarHBondContact O-OH 3.37Å
104	Q	71	Confident	71.9	Confident	16 Å²	16	26.6 Å²	26.6	8%	0.075	13%	0.131	C	C	.	.	S	Bend	trans	-67.3	125.4	176.4	-66.2	-179.3	-6.5	0	0	108.7	S100 I101 D106 M107 V108 F186	S100-Q104 PolarHBondContact O-N 3.22Å; I101-Q104 WeakPolarHBondContact O-CB 3.38Å; I101-Q104 PolarHBondContact O-N 3.39Å; I101-Q104 VanDerWaalsContact O-N 3.09Å; Q104-D106 VanDerWaalsContact C-N 3.26Å; Q104-D106 PolarHBondContact O-N 3.19Å; Q104-M107 HydrophobicContact CB-CB 3.92Å; Q104-M107 HydrophobicContact CB-CG 3.75Å; Q104-M107 WeakPolarHBondContact O-CA 3.37Å; Q104-M107 WeakPolarHBondContact O-CB 3.32Å; Q104-M107 PolarHBondContact O-N 3.24Å; Q104-V108 PolarHBondContact O-N 3.37Å; Q104-V108 VanDerWaalsContact O-N 3.07Å; Q104-F186 HydrophobicContact CB-CD2 4.38Å; Q104-F186 HydrophobicContact CG-CD2 3.68Å; Q104-F186 HydrophobicContact CG-CE2 3.99Å; Q104-F186 HydrophobicContact CG-CG 4.22Å; Q104-F186 VanDerWaalsContact NE2-CE2 3.34Å
105	P	67.1	Low	73.1	Confident	18 Å²	18	25.9 Å²	25.9	12%	0.117	13%	0.128	C	C	.	.	H	α-helix	trans	-53.4	-43.5	-173.8	-29.1	35.9	0	0	0	113.3	L103 M107 L183 Y197	L103-P105 WeakPolarHBondContact O-CD 3.48Å; P105-M107 VanDerWaalsContact C-N 3.29Å; P105-M107 PolarHBondContact O-N 3.25Å; P105-L183 HydrophobicContact CB-CD2 3.6Å; P105-L183 HydrophobicContact CB-CG 3.89Å; P105-L183 HydrophobicContact CG-CD1 4.2Å; P105-L183 HydrophobicContact CG-CD2 3.53Å; P105-L183 HydrophobicContact CG-CG 3.68Å; P105-Y197 HydrophobicContact CG-CD2 4.46Å; P105-Y197 HydrophobicContact CG-CE2 4.15Å
106	D	75.2	Confident	74.5	Confident	29 Å²	29	28.1 Å²	28.1	16%	0.155	14%	0.142	C	C	.	.	H	α-helix	trans	-66.7	-33.1	179.3	-51.8	-38.1	0	0	0	111.8	Q104 L110 T185 F186	Q104-D106 VanDerWaalsContact C-N 3.26Å; Q104-D106 PolarHBondContact O-N 3.19Å; D106-L110 WeakPolarHBondContact O-CG 3.39Å; D106-L110 PolarHBondContact O-N 3.46Å; D106-T185 WeakPolarHBondContact OD1-CG2 3.48Å; D106-T185 WeakPolarHBondContact OD2-CA 3.23Å; D106-T185 WeakPolarHBondContact OD2-CB 3.36Å; D106-F186 PolarHBondContact OD2-N 2.86Å
107	M	83.7	Confident	76.2	Confident	2 Å²	2	28 Å²	28	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-74.9	-38.3	-179.1	-71.8	-57.9	-42	0	0	112.9	I101 Q104 P105 N109 L110 F111 S692 K696	I101-M107 HydrophobicContact CG2-CG 4.23Å; I101-M107 VanDerWaalsContact O-CB 3.26Å; I101-M107 WeakPolarHBondContact O-CB 3.46Å; Q104-M107 HydrophobicContact CB-CB 3.92Å; Q104-M107 HydrophobicContact CB-CG 3.75Å; Q104-M107 WeakPolarHBondContact O-CA 3.37Å; Q104-M107 WeakPolarHBondContact O-CB 3.32Å; Q104-M107 PolarHBondContact O-N 3.24Å; P105-M107 VanDerWaalsContact C-N 3.29Å; P105-M107 PolarHBondContact O-N 3.25Å; M107-N109 PolarHBondContact O-N 2.89Å; M107-L110 HydrophobicContact CE-CB 4.46Å; M107-L110 HydrophobicContact CE-CD1 4.33Å; M107-L110 PolarHBondContact O-N 3.29Å; M107-L110 VanDerWaalsContact O-N 3.17Å; M107-L110 HydrophobicContact SD-CD1 3.95Å; M107-F111 HydrophobicContact CB-CD2 4.35Å; M107-F111 HydrophobicContact CB-CE2 4Å; M107-F111 HydrophobicContact CE-CD1 4.29Å; M107-F111 HydrophobicContact CE-CD2 4.41Å; M107-F111 HydrophobicContact CE-CE1 3.64Å; M107-F111 HydrophobicContact CE-CE2 3.78Å; M107-F111 HydrophobicContact CE-CZ 3.37Å; M107-F111 WeakPolarHBondContact O-CD2 3.4Å; M107-F111 VanDerWaalsContact O-CG 3.29Å; M107-F111 WeakPolarHBondContact O-CG 3.49Å; M107-F111 PolarHBondContact O-N 3.16Å; M107-S692 VanDerWaalsContact CE-CB 3.43Å; M107-K696 HydrophobicContact SD-CD 4.12Å; M107-K696 WeakPolarHBondContact SD-CE 3.5Å; M107-K696 HydrophobicContact SD-CG 3.79Å
108	V	82.9	Confident	78.1	Confident	11 Å²	11	27.2 Å²	27.2	7%	0.067	14%	0.139	C	C	.	.	H	α-helix	trans	-55.1	-47.8	174.7	176.9	0	0	0	0	109.5	A102 Q104 L110 F111 L112 V139 L227	A102-V108 WeakPolarHBondContact O-CG2 3.32Å; Q104-V108 PolarHBondContact O-N 3.37Å; Q104-V108 VanDerWaalsContact O-N 3.07Å; V108-L110 PolarHBondContact O-N 3.16Å; V108-F111 PolarHBondContact O-N 3.07Å; V108-L112 HydrophobicContact CG1-CD1 4.01Å; V108-L112 HydrophobicContact CG1-CG 4.28Å; V108-L112 VanDerWaalsContact O-CG 3.31Å; V108-L112 WeakPolarHBondContact O-CG 3.36Å; V108-L112 PolarHBondContact O-N 2.81Å; V108-V139 HydrophobicContact CG1-CG1 4.42Å; V108-V139 HydrophobicContact CG2-CG1 4.14Å; V108-L227 HydrophobicContact CG1-CD2 3.97Å
109	N	84.5	Confident	79.7	Confident	72 Å²	72	24.8 Å²	24.8	39%	0.385	13%	0.125	S	C	.	.	H	α-helix	trans	-61	-43.7	178.5	-71.3	-30.5	0	0	0	112.2	M107 F111 L112 Q113	M107-N109 PolarHBondContact O-N 2.89Å; N109-F111 VanDerWaalsContact C-N 3.34Å; N109-F111 PolarHBondContact O-N 3.25Å; N109-L112 PolarHBondContact O-N 3.02Å; N109-Q113 WeakPolarHBondContact O-CB 3.22Å; N109-Q113 VanDerWaalsContact O-CG 3.26Å; N109-Q113 WeakPolarHBondContact O-CG 3.44Å; N109-Q113 PolarHBondContact O-N 3.44Å
110	L	88.2	Confident	81.4	Confident	10 Å²	10	24.8 Å²	24.8	5%	0.052	13%	0.13	C	C	.	.	H	α-helix	trans	-62.4	-40.3	176.1	-69.2	173.7	0	0	0	112	D106 M107 V108 Q113 E114 L695 Q699	D106-L110 WeakPolarHBondContact O-CG 3.39Å; D106-L110 PolarHBondContact O-N 3.46Å; M107-L110 HydrophobicContact CE-CB 4.46Å; M107-L110 HydrophobicContact CE-CD1 4.33Å; M107-L110 PolarHBondContact O-N 3.29Å; M107-L110 VanDerWaalsContact O-N 3.17Å; M107-L110 HydrophobicContact SD-CD1 3.95Å; V108-L110 PolarHBondContact O-N 3.16Å; L110-Q113 PolarHBondContact O-N 3.03Å; L110-E114 WeakPolarHBondContact O-CB 3.32Å; L110-E114 PolarHBondContact O-N 3.28Å; L110-L695 HydrophobicContact CB-CB 4.41Å; L110-L695 HydrophobicContact CB-CD1 4.39Å; L110-L695 HydrophobicContact CD1-CB 4.31Å; L110-Q699 HydrophobicContact CD2-CB 4.08Å; L110-Q699 HydrophobicContact CD2-CG 4.29Å
111	F	89.6	Confident	82.7	Confident	7 Å²	7	27 Å²	27	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-68.5	-38.3	176.9	-65.3	-42.2	0	0	0	112.7	F55 P93 A102 M107 V108 N109 E114 L115 L695	F55-F111 WeakPolarHBondContact CE2-O 3.41Å; F55-F111 HydrophobicContact CZ-CB 4.38Å; P93-F111 HydrophobicContact CB-CB 4.45Å; P93-F111 HydrophobicContact CB-CD1 3.46Å; P93-F111 VanDerWaalsContact CB-CD1 3.46Å; P93-F111 HydrophobicContact CB-CD2 3.88Å; P93-F111 HydrophobicContact CB-CE1 3.43Å; P93-F111 VanDerWaalsContact CB-CE1 3.43Å; P93-F111 HydrophobicContact CB-CE2 3.85Å; P93-F111 HydrophobicContact CB-CG 3.69Å; P93-F111 HydrophobicContact CB-CZ 3.61Å; P93-F111 VanDerWaalsContact O-CZ 3.31Å; P93-F111 WeakPolarHBondContact O-CZ 3.45Å; A102-F111 HydrophobicContact CB-CE2 4.24Å; M107-F111 HydrophobicContact CB-CD2 4.35Å; M107-F111 HydrophobicContact CB-CE2 4Å; M107-F111 HydrophobicContact CE-CD1 4.29Å; M107-F111 HydrophobicContact CE-CD2 4.41Å; M107-F111 HydrophobicContact CE-CE1 3.64Å; M107-F111 HydrophobicContact CE-CE2 3.78Å; M107-F111 HydrophobicContact CE-CZ 3.37Å; M107-F111 WeakPolarHBondContact O-CD2 3.4Å; M107-F111 VanDerWaalsContact O-CG 3.29Å; M107-F111 WeakPolarHBondContact O-CG 3.49Å; M107-F111 PolarHBondContact O-N 3.16Å; V108-F111 PolarHBondContact O-N 3.07Å; N109-F111 VanDerWaalsContact C-N 3.34Å; N109-F111 PolarHBondContact O-N 3.25Å; F111-E114 PolarHBondContact O-N 3.44Å; F111-L115 WeakPolarHBondContact O-CB 3.21Å; F111-L115 PolarHBondContact O-N 3.05Å; F111-L695 HydrophobicContact CD1-CD1 3.7Å; F111-L695 HydrophobicContact CE1-CD1 3.84Å
112	L	89.8	Confident	84.1	Confident	23 Å²	23	26.5 Å²	26.5	12%	0.12	13%	0.134	C	C	.	.	H	α-helix	trans	-67.2	-37.5	174.5	-66.8	178.1	0	0	0	111.7	V108 N109 L115 T116 L227 I228 H231	V108-L112 HydrophobicContact CG1-CD1 4.01Å; V108-L112 HydrophobicContact CG1-CG 4.28Å; V108-L112 VanDerWaalsContact O-CG 3.31Å; V108-L112 WeakPolarHBondContact O-CG 3.36Å; V108-L112 PolarHBondContact O-N 2.81Å; N109-L112 PolarHBondContact O-N 3.02Å; L112-L115 PolarHBondContact O-N 3.28Å; L112-T116 PolarHBondContact O-N 3.09Å; L112-T116 PolarHBondContact O-OG1 3.29Å; L112-L227 HydrophobicContact CD1-CD2 4.33Å; L112-I228 HydrophobicContact CD2-CG1 4.3Å; L112-H231 HydrophobicContact CD2-CB 3.88Å; L112-H231 PolarHBondContact O-NE2 2.92Å
113	Q	90.7	Very high	85.3	Confident	119 Å²	119	27.4 Å²	27.4	56%	0.556	14%	0.144	S	C	*	.	H	α-helix	trans	-61.9	-44.9	171.8	-74.1	172.4	-0.5	0	0	111.1	N109 L110 L115 T116 Y117	N109-Q113 WeakPolarHBondContact O-CB 3.22Å; N109-Q113 VanDerWaalsContact O-CG 3.26Å; N109-Q113 WeakPolarHBondContact O-CG 3.44Å; N109-Q113 PolarHBondContact O-N 3.44Å; L110-Q113 PolarHBondContact O-N 3.03Å; Q113-L115 VanDerWaalsContact C-N 3.33Å; Q113-L115 PolarHBondContact O-N 3.5Å; Q113-T116 WeakPolarHBondContact O-CB 3.36Å; Q113-T116 PolarHBondContact O-N 3.17Å; Q113-Y117 WeakPolarHBondContact O-CB 3.29Å; Q113-Y117 PolarHBondContact O-N 3.47Å
114	E	92.5	Very high	86.6	Confident	6 Å²	6	27.4 Å²	27.4	3%	0.028	14%	0.144	C	C	.	.	H	α-helix	trans	-68.1	-32	178.5	-165.1	62.6	-156.1	0	0	112.4	V91 L110 F111 Y117 C118 L695 K698	V91-E114 HydrophobicContact CG1-CG 3.55Å; L110-E114 WeakPolarHBondContact O-CB 3.32Å; L110-E114 PolarHBondContact O-N 3.28Å; F111-E114 PolarHBondContact O-N 3.44Å; E114-Y117 WeakPolarHBondContact O-CB 3.35Å; E114-Y117 PolarHBondContact O-N 3.06Å; E114-C118 PolarHBondContact O-N 2.91Å; E114-C118 PolarHBondContact O-SG 3.41Å; E114-L695 HydrophobicContact CB-CD1 4.36Å; E114-L695 HydrophobicContact CG-CD2 4.32Å; E114-K698 IonicContact OE2-NZ 3.58Å
115	L	93.2	Very high	87.6	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-65.7	-46.2	171.2	177.8	58.2	0	0	0	111.6	F55 F111 L112 Q113 Y117 C118 K119 F126 F127 I228 H231 A232	F55-L115 HydrophobicContact CB-CD1 3.65Å; F55-L115 HydrophobicContact CD1-CD1 3.87Å; F55-L115 HydrophobicContact CD2-CB 3.91Å; F55-L115 HydrophobicContact CD2-CD1 4.11Å; F55-L115 HydrophobicContact CE2-CB 3.98Å; F55-L115 HydrophobicContact CG-CB 4.27Å; F55-L115 HydrophobicContact CG-CD1 3.61Å; F55-L115 HydrophobicContact CG-CG 4.48Å; F55-L115 HydrophobicContact CZ-CB 4.4Å; F111-L115 WeakPolarHBondContact O-CB 3.21Å; F111-L115 PolarHBondContact O-N 3.05Å; L112-L115 PolarHBondContact O-N 3.28Å; Q113-L115 VanDerWaalsContact C-N 3.33Å; Q113-L115 PolarHBondContact O-N 3.5Å; L115-Y117 PolarHBondContact O-N 3.33Å; L115-C118 PolarHBondContact O-N 3.27Å; L115-K119 WeakPolarHBondContact O-CB 3.48Å; L115-K119 PolarHBondContact O-N 3.15Å; L115-F126 HydrophobicContact CD1-CD2 4.3Å; L115-F126 HydrophobicContact CD1-CE2 4.17Å; L115-F127 HydrophobicContact CD1-CD2 3.65Å; L115-F127 HydrophobicContact CD1-CE2 4.25Å; L115-F127 HydrophobicContact CD1-CG 4.42Å; L115-I228 HydrophobicContact CD2-CG2 3.95Å; L115-H231 HydrophobicContact CD2-CB 4.26Å; L115-A232 HydrophobicContact CD1-CB 4.41Å; L115-A232 HydrophobicContact CD2-CB 4.14Å
116	T	92.2	Very high	88.8	Confident	52 Å²	52	25.9 Å²	25.9	32%	0.319	14%	0.136	S	C	.	.	H	α-helix	trans	-57.8	-38.1	172.3	-56	0	0	0	0	110.9	L112 Q113 K119 N120 H231	L112-T116 PolarHBondContact O-N 3.09Å; L112-T116 PolarHBondContact O-OG1 3.29Å; Q113-T116 WeakPolarHBondContact O-CB 3.36Å; Q113-T116 PolarHBondContact O-N 3.17Å; T116-K119 WeakPolarHBondContact O-CB 3.04Å; T116-K119 PolarHBondContact O-N 3.1Å; T116-N120 VanDerWaalsContact O-CG 3.24Å; T116-N120 PolarHBondContact O-N 3.15Å; T116-N120 VanDerWaalsContact O-N 3.11Å; T116-N120 PolarHBondContact O-ND2 3.06Å; T116-H231 PolarHBondContact OG1-NE2 3.04Å
117	Y	91.6	Very high	89.7	Confident	27 Å²	27	24.5 Å²	24.5	11%	0.106	13%	0.128	C	C	.	.	H	α-helix	trans	-64.1	-53	177.1	-178.5	-92.5	0	0	0	111.6	L53 Q113 E114 L115 K119 N120 F121 E707 S714	L53-Y117 HydrophobicContact CD1-CD1 4.01Å; L53-Y117 HydrophobicContact CD1-CE1 3.49Å; L53-Y117 VanDerWaalsContact CD1-CE1 3.49Å; Q113-Y117 WeakPolarHBondContact O-CB 3.29Å; Q113-Y117 PolarHBondContact O-N 3.47Å; E114-Y117 WeakPolarHBondContact O-CB 3.35Å; E114-Y117 PolarHBondContact O-N 3.06Å; L115-Y117 PolarHBondContact O-N 3.33Å; Y117-K119 PolarHBondContact O-N 2.71Å; Y117-N120 PolarHBondContact O-N 2.87Å; Y117-F121 HydrophobicContact CD1-CD2 4.49Å; Y117-F121 AromaticContact CD2-CD2 3.39Å; Y117-F121 HydrophobicContact CD2-CD2 3.39Å; Y117-F121 AromaticContact CD2-CE2 3.66Å; Y117-F121 HydrophobicContact CD2-CE2 3.66Å; Y117-F121 HydrophobicContact CD2-CG 4.33Å; Y117-F121 HydrophobicContact CE1-CB 4.16Å; Y117-F121 HydrophobicContact CE1-CD2 4.37Å; Y117-F121 HydrophobicContact CE1-CG 4.5Å; Y117-F121 HydrophobicContact CE2-CB 4.37Å; Y117-F121 AromaticContact CE2-CD2 3.25Å; Y117-F121 HydrophobicContact CE2-CD2 3.25Å; Y117-F121 AromaticContact CE2-CE2 3.53Å; Y117-F121 HydrophobicContact CE2-CE2 3.53Å; Y117-F121 AromaticContact CE2-CG 3.83Å; Y117-F121 HydrophobicContact CE2-CG 3.83Å; Y117-F121 HydrophobicContact CE2-CZ 4.3Å; Y117-F121 HydrophobicContact CG-CD2 4.01Å; Y117-F121 AromaticContact CZ-CD2 3.76Å; Y117-F121 AromaticContact CZ-CG 3.9Å; Y117-F121 WeakPolarHBondContact O-CD2 3.48Å; Y117-F121 PolarHBondContact O-N 3.02Å; Y117-E707 VanDerWaalsContact CE2-CD 3.47Å; Y117-E707 HydrophobicContact CE2-CG 4.26Å; Y117-E707 WeakPolarHBondContact CE2-OE1 3.14Å; Y117-E707 PolarHBondContact OH-OE1 2.76Å; Y117-S714 WeakPolarHBondContact OH-CB 3.17Å; Y117-S714 PolarHBondContact OH-OG 3.03Å
118	C	92.9	Very high	90.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-53.4	-42.4	176.1	-66.8	0	0	0	0	111.6	L53 F55 E114 L115 N120 S122 F126	L53-C118 HydrophobicContact CB-CB 4.22Å; F55-C118 HydrophobicContact CB-CB 4.3Å; E114-C118 PolarHBondContact O-N 2.91Å; E114-C118 PolarHBondContact O-SG 3.41Å; L115-C118 PolarHBondContact O-N 3.27Å; C118-N120 PolarHBondContact O-N 3.1Å; C118-S122 WeakPolarHBondContact O-CB 3.22Å; C118-S122 PolarHBondContact O-N 3.46Å; C118-F126 HydrophobicContact CB-CB 4.31Å; C118-F126 WeakPolarHBondContact O-CB 3.27Å
119	K	90.8	Very high	90.5	Very high	21 Å²	21	23.9 Å²	23.9	9%	0.091	13%	0.125	C	C	.	.	H	α-helix	trans	-59	-43.6	177	175.3	176.5	-178.9	150.2	0	113.6	L115 T116 Y117 F126 A232 E234 E236 R242	L115-K119 WeakPolarHBondContact O-CB 3.48Å; L115-K119 PolarHBondContact O-N 3.15Å; T116-K119 WeakPolarHBondContact O-CB 3.04Å; T116-K119 PolarHBondContact O-N 3.1Å; Y117-K119 PolarHBondContact O-N 2.71Å; K119-F126 HydrophobicContact CB-CD1 4.46Å; K119-F126 HydrophobicContact CB-CD2 3.7Å; K119-F126 HydrophobicContact CB-CE1 4.4Å; K119-F126 HydrophobicContact CB-CE2 3.63Å; K119-F126 HydrophobicContact CB-CG 4.15Å; K119-F126 HydrophobicContact CB-CZ 4.01Å; K119-F126 HydrophobicContact CD-CE2 4.3Å; K119-F126 HydrophobicContact CD-CZ 4.16Å; K119-F126 HydrophobicContact CG-CD2 4.45Å; K119-F126 HydrophobicContact CG-CE1 4.16Å; K119-F126 HydrophobicContact CG-CE2 4.03Å; K119-F126 HydrophobicContact CG-CZ 3.89Å; K119-A232 PolarHBondContact NZ-O 3.47Å; K119-E234 PolarHBondContact NZ-O 3.39Å; K119-E236 HydrophobicContact CD-CG 4.42Å; K119-R242 PolarHBondContact O-NH1 2.91Å; K119-R242 VanDerWaalsContact O-NH1 3.15Å; K119-R242 PolarHBondContact O-NH2 3.13Å
120	N	88	Confident	90.7	Very high	68 Å²	68	20.4 Å²	20.4	36%	0.364	11%	0.106	S	C	.	.	H	α-helix	trans	-79.8	-33.2	-176.9	-68.7	-22.6	0	0	0	112.8	T116 Y117 C118	T116-N120 VanDerWaalsContact O-CG 3.24Å; T116-N120 PolarHBondContact O-N 3.15Å; T116-N120 VanDerWaalsContact O-N 3.11Å; T116-N120 PolarHBondContact O-ND2 3.06Å; Y117-N120 PolarHBondContact O-N 2.87Å; C118-N120 PolarHBondContact O-N 3.1Å
121	F	88.6	Confident	90.6	Very high	69 Å²	69	20.1 Å²	20.1	30%	0.303	11%	0.105	S	C	.	.	H	α-helix	trans	-114.6	0.9	-168.6	-67.4	-82.6	0	0	0	115.3	L49 Q51 L53 Y117 V709	L49-F121 WeakPolarHBondContact CD1-O 3.41Å; L49-F121 HydrophobicContact CD2-CD1 4.46Å; Q51-F121 WeakPolarHBondContact CG-O 3.47Å; Q51-F121 PolarHBondContact NE2-O 3.05Å; L53-F121 HydrophobicContact CD1-CB 4.19Å; Y117-F121 HydrophobicContact CD1-CD2 4.49Å; Y117-F121 AromaticContact CD2-CD2 3.39Å; Y117-F121 HydrophobicContact CD2-CD2 3.39Å; Y117-F121 AromaticContact CD2-CE2 3.66Å; Y117-F121 HydrophobicContact CD2-CE2 3.66Å; Y117-F121 HydrophobicContact CD2-CG 4.33Å; Y117-F121 HydrophobicContact CE1-CB 4.16Å; Y117-F121 HydrophobicContact CE1-CD2 4.37Å; Y117-F121 HydrophobicContact CE1-CG 4.5Å; Y117-F121 HydrophobicContact CE2-CB 4.37Å; Y117-F121 AromaticContact CE2-CD2 3.25Å; Y117-F121 HydrophobicContact CE2-CD2 3.25Å; Y117-F121 AromaticContact CE2-CE2 3.53Å; Y117-F121 HydrophobicContact CE2-CE2 3.53Å; Y117-F121 AromaticContact CE2-CG 3.83Å; Y117-F121 HydrophobicContact CE2-CG 3.83Å; Y117-F121 HydrophobicContact CE2-CZ 4.3Å; Y117-F121 HydrophobicContact CG-CD2 4.01Å; Y117-F121 AromaticContact CZ-CD2 3.76Å; Y117-F121 AromaticContact CZ-CG 3.9Å; Y117-F121 WeakPolarHBondContact O-CD2 3.48Å; Y117-F121 PolarHBondContact O-N 3.02Å; F121-V709 HydrophobicContact CD1-CG2 3.99Å; F121-V709 HydrophobicContact CE1-CG2 3.98Å
122	S	91	Very high	90.1	Very high	3 Å²	3	20.2 Å²	20.2	2%	0.021	11%	0.106	C	C	.	.			trans	-86.7	122.2	169.4	-175.7	0	0	0	0	111.1	V52 L53 C118 G124 P125 R242	V52-S122 WeakPolarHBondContact CA-OG 3.34Å; L53-S122 PolarHBondContact N-OG 3.42Å; L53-S122 PolarHBondContact O-OG 2.98Å; C118-S122 WeakPolarHBondContact O-CB 3.22Å; C118-S122 PolarHBondContact O-N 3.46Å; S122-G124 PolarHBondContact O-N 3.47Å; S122-G124 PolarHBondContact OG-N 3.36Å; S122-P125 PolarHBondContact OG-O 3.14Å; S122-P125 VanDerWaalsContact OG-O 3.09Å; S122-R242 PolarHBondContact O-NH2 3.22Å
123	G	86.1	Confident	89.2	Confident	21 Å²	21	22.3 Å²	22.3	22%	0.216	12%	0.118	C	C	.	.	S	Bend	trans	-74.1	8.2	172	0	0	0	0	0	114.4	Q51 R338	Q51-G123 PolarHBondContact O-N 3.45Å; G123-R338 PolarHBondContact O-NH1 2.99Å; G123-R338 VanDerWaalsContact O-NH1 3.11Å
124	G	88.8	Confident	88.1	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.01	12%	0.115	C	C	.	.	S	Bend	trans	-145.3	-152.4	-178.3	0	0	0	0	0	112.8	S122 F126 R242	S122-G124 PolarHBondContact O-N 3.47Å; S122-G124 PolarHBondContact OG-N 3.36Å; G124-F126 PolarHBondContact O-N 3.3Å; G124-R242 PolarHBondContact O-NE 2.81Å; G124-R242 VanDerWaalsContact O-NE 3.17Å
125	P	91.9	Very high	86.9	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.116	C	C	.	.			trans	-58.4	140	167.5	26.8	-33.1	0	0	0	109.5	V52 I54 S122 R242 M327 K330 I331	V52-P125 HydrophobicContact CG1-CG 4.45Å; V52-P125 WeakPolarHBondContact CG1-O 3.26Å; I54-P125 HydrophobicContact CD1-CG 4.34Å; S122-P125 PolarHBondContact OG-O 3.14Å; S122-P125 VanDerWaalsContact OG-O 3.09Å; P125-R242 CarbonylContact C-O 3.51Å; P125-R242 VanDerWaalsContact CA-O 3.3Å; P125-R242 WeakPolarHBondContact CA-O 3.4Å; P125-M327 HydrophobicContact CB-SD 4.15Å; P125-M327 HydrophobicContact CG-SD 4.15Å; P125-K330 HydrophobicContact CB-CB 4.28Å; P125-K330 HydrophobicContact CB-CD 4.42Å; P125-K330 HydrophobicContact CG-CB 4.16Å; P125-I331 HydrophobicContact CG-CG1 3.73Å
126	F	93.1	Very high	85.8	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.126	C	C	.	.			trans	-120.3	-14.1	-175.5	75.8	-93.1	0	0	0	113.9	L53 F55 L115 C118 K119 G124 A232 I239 R242	L53-F126 WeakPolarHBondContact O-CA 3.4Å; F55-F126 WeakPolarHBondContact CB-O 3.41Å; F55-F126 PolarHBondContact N-O 3.17Å; L115-F126 HydrophobicContact CD1-CD2 4.3Å; L115-F126 HydrophobicContact CD1-CE2 4.17Å; C118-F126 HydrophobicContact CB-CB 4.31Å; C118-F126 WeakPolarHBondContact O-CB 3.27Å; K119-F126 HydrophobicContact CB-CD1 4.46Å; K119-F126 HydrophobicContact CB-CD2 3.7Å; K119-F126 HydrophobicContact CB-CE1 4.4Å; K119-F126 HydrophobicContact CB-CE2 3.63Å; K119-F126 HydrophobicContact CB-CG 4.15Å; K119-F126 HydrophobicContact CB-CZ 4.01Å; K119-F126 HydrophobicContact CD-CE2 4.3Å; K119-F126 HydrophobicContact CD-CZ 4.16Å; K119-F126 HydrophobicContact CG-CD2 4.45Å; K119-F126 HydrophobicContact CG-CE1 4.16Å; K119-F126 HydrophobicContact CG-CE2 4.03Å; K119-F126 HydrophobicContact CG-CZ 3.89Å; G124-F126 PolarHBondContact O-N 3.3Å; F126-A232 HydrophobicContact CE2-CB 4.33Å; F126-I239 HydrophobicContact CE1-CG1 4.41Å; F126-I239 HydrophobicContact CZ-CD1 4.05Å; F126-I239 HydrophobicContact CZ-CG1 4.3Å; F126-R242 HydrophobicContact CD1-CB 3.76Å; F126-R242 HydrophobicContact CE1-CB 3.9Å; F126-R242 PolarHBondContact N-O 3.5Å
127	F	93.7	Very high	85	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	128.8	-173.2	-178.8	-115.8	0	0	0	111	F55 L115 A129 I228 I229 A232 R242 S243 L244 V245	F55-F127 HydrophobicContact CB-CD2 4.36Å; F55-F127 HydrophobicContact CD1-CD2 4.03Å; F55-F127 HydrophobicContact CD1-CE2 4.05Å; L115-F127 HydrophobicContact CD1-CD2 3.65Å; L115-F127 HydrophobicContact CD1-CE2 4.25Å; L115-F127 HydrophobicContact CD1-CG 4.42Å; F127-A129 HydrophobicContact CE1-CB 3.95Å; F127-A129 HydrophobicContact CE2-CB 4.31Å; F127-A129 HydrophobicContact CZ-CB 3.62Å; F127-I228 HydrophobicContact CE2-CG2 3.57Å; F127-I228 HydrophobicContact CZ-CG2 3.84Å; F127-I229 HydrophobicContact CE1-CG1 4.08Å; F127-I229 HydrophobicContact CZ-CG1 3.94Å; F127-A232 HydrophobicContact CB-CB 4.48Å; F127-A232 HydrophobicContact CD1-CB 3.75Å; F127-A232 HydrophobicContact CD2-CB 4.11Å; F127-A232 HydrophobicContact CE1-CB 3.91Å; F127-A232 HydrophobicContact CE2-CB 4.26Å; F127-A232 HydrophobicContact CG-CB 3.86Å; F127-A232 HydrophobicContact CZ-CB 4.15Å; F127-R242 PolarHBondContact N-O 3.25Å; F127-S243 CarbonylContact O-C 3.59Å; F127-S243 VanDerWaalsContact O-CA 3.27Å; F127-S243 WeakPolarHBondContact O-CA 3.06Å; F127-L244 PolarHBondContact O-N 3.47Å; F127-V245 HydrophobicContact CE1-CG2 4.06Å
128	M	93.4	Very high	84.4	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	128.5	169.5	-163.1	-94.3	-97.1	0	0	109.3	I54 F55 F56 W57 F69 V130 L244 V323 M327	I54-M128 HydrophobicContact CG2-CB 3.9Å; F55-M128 PolarHBondContact O-N 3.45Å; F56-M128 CarbonylContact C-O 3.55Å; F56-M128 WeakPolarHBondContact CA-O 3.33Å; F56-M128 HydrophobicContact CD2-CB 4.24Å; F56-M128 HydrophobicContact CD2-CE 3.46Å; F56-M128 VanDerWaalsContact CD2-CE 3.46Å; F56-M128 HydrophobicContact CD2-CG 4.47Å; F56-M128 HydrophobicContact CD2-SD 3.54Å; F56-M128 VanDerWaalsContact CD2-SD 3.54Å; F56-M128 HydrophobicContact CE2-CE 3.13Å; F56-M128 HydrophobicContact CE2-SD 3.39Å; F56-M128 WeakPolarHBondContact CE2-SD 3.46Å; F56-M128 HydrophobicContact CZ-CE 4.02Å; W57-M128 PolarHBondContact N-O 2.96Å; F69-M128 HydrophobicContact CD2-CE 3.31Å; F69-M128 HydrophobicContact CE2-CE 3.35Å; F69-M128 HydrophobicContact CG-CE 4.01Å; F69-M128 HydrophobicContact CZ-CE 4.05Å; M128-V130 HydrophobicContact SD-CG2 3.74Å; M128-L244 CarbonylContact C-O 3.54Å; M128-L244 VanDerWaalsContact CA-O 3.24Å; M128-L244 WeakPolarHBondContact CA-O 3.43Å; M128-L244 HydrophobicContact CG-CB 4.21Å; M128-L244 HydrophobicContact CG-CD2 4.45Å; M128-V323 HydrophobicContact CE-CG1 4.04Å; M128-M327 HydrophobicContact CB-CE 3.44Å; M128-M327 VanDerWaalsContact CB-CE 3.44Å; M128-M327 HydrophobicContact CG-CE 3.28Å
129	A	90.1	Very high	83.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.2	176.1	0	0	0	0	0	110.8	W57 F127 L244 V245 V246	W57-A129 HydrophobicContact CB-CB 3.91Å; W57-A129 HydrophobicContact CG-CB 4.38Å; W57-A129 CarbonylContact O-C 3.59Å; W57-A129 VanDerWaalsContact O-CA 3.29Å; W57-A129 WeakPolarHBondContact O-CA 3.49Å; F127-A129 HydrophobicContact CE1-CB 3.95Å; F127-A129 HydrophobicContact CE2-CB 4.31Å; F127-A129 HydrophobicContact CZ-CB 3.62Å; A129-L244 PolarHBondContact N-O 3.43Å; A129-V245 HydrophobicContact CB-CG1 4.48Å; A129-V245 HydrophobicContact CB-CG2 4.39Å; A129-V245 CarbonylContact O-C 3.57Å; A129-V245 VanDerWaalsContact O-CA 3.32Å; A129-V245 WeakPolarHBondContact O-CA 3.41Å; A129-V246 PolarHBondContact O-N 3.38Å
130	V	88.8	Confident	83.5	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121.8	167.6	-165.2	0	0	0	0	107.4	F56 W57 C58 P59 L62 M128 V246 F319	F56-V130 HydrophobicContact CE2-CG2 4.09Å; W57-V130 PolarHBondContact O-N 3.33Å; C58-V130 HydrophobicContact CB-CG2 4.45Å; P59-V130 VanDerWaalsContact CD-O 3.31Å; P59-V130 WeakPolarHBondContact CD-O 3.18Å; L62-V130 HydrophobicContact CD1-CB 3.86Å; L62-V130 HydrophobicContact CD1-CG1 3.55Å; L62-V130 WeakPolarHBondContact CD1-O 3.4Å; L62-V130 HydrophobicContact CG-CG1 4.47Å; M128-V130 HydrophobicContact SD-CG2 3.74Å; V130-V246 CarbonylContact C-O 3.49Å; V130-V246 WeakPolarHBondContact CA-O 3.44Å; V130-V246 HydrophobicContact CG1-CB 4.24Å; V130-V246 HydrophobicContact CG1-CG1 4.43Å; V130-V246 HydrophobicContact CG2-CB 4.4Å; V130-F319 HydrophobicContact CG1-CE2 4.1Å; V130-F319 HydrophobicContact CG2-CE2 4.06Å; V130-F319 HydrophobicContact CG2-CZ 4.1Å
131	V	84.7	Confident	83.2	Confident	4 Å²	4	18.6 Å²	18.6	2%	0.024	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.8	-177	-61.8	0	0	0	0	110.2	H225 I229 V245 V246 C247 K248	V131-H225 HydrophobicContact CG1-CB 4.13Å; V131-I229 HydrophobicContact CG1-CD1 4.16Å; V131-V245 HydrophobicContact CG2-CG1 4.04Å; V131-V246 PolarHBondContact N-O 3.23Å; V131-C247 HydrophobicContact CG2-CB 4.14Å; V131-C247 WeakPolarHBondContact CG2-SG 3.41Å; V131-C247 CarbonylContact O-C 3.46Å; V131-C247 WeakPolarHBondContact O-CA 3.47Å; V131-K248 PolarHBondContact O-N 3.32Å
132	C	80	Confident	82.9	Confident	9 Å²	9	19.2 Å²	19.2	6%	0.061	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	167.8	175.2	77.5	0	0	0	0	110.7	L62 H134 C135 K248	L62-C132 HydrophobicContact CD1-CB 4.45Å; L62-C132 HydrophobicContact CD2-CB 4.14Å; C132-H134 PolarHBondContact O-N 3.32Å; C132-C135 PolarHBondContact N-SG 3.46Å; C132-C135 WeakPolarHBondContact O-CB 3.5Å; C132-C135 PolarHBondContact O-N 2.92Å; C132-C135 PolarHBondContact SG-SG 2.85Å; C132-K248 WeakPolarHBondContact CA-O 3.33Å; C132-K248 HydrophobicContact CB-CB 3.9Å; C132-K248 HydrophobicContact CB-CD 4.31Å; C132-K248 HydrophobicContact CB-CG 4.42Å
133	D	70.6	Confident	82.6	Confident	67 Å²	67	22.7 Å²	22.7	36%	0.358	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-14.2	-178.7	-58.5	-38.3	0	0	0	114.1	N136	D133-N136 PolarHBondContact O-ND2 3.13Å; D133-N136 PolarHBondContact O-OD1 3.34Å
134	H	67.5	Low	82.6	Confident	110 Å²	110	21.9 Å²	21.9	51%	0.509	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-2.5	179.9	-56.2	78.1	0	0	0	113.3	C132 N136	C132-H134 PolarHBondContact O-N 3.32Å; H134-N136 PolarHBondContact O-N 2.91Å
135	C	68	Low	82.5	Confident	6 Å²	6	24.2 Å²	24.2	4%	0.041	14%	0.143	C	C	.	.			trans	-74.6	49.9	-177.2	-69.1	0	0	0	0	113.3	C132 T137 H225	C132-C135 PolarHBondContact N-SG 3.46Å; C132-C135 WeakPolarHBondContact O-CB 3.5Å; C132-C135 PolarHBondContact O-N 2.92Å; C132-C135 PolarHBondContact SG-SG 2.85Å; C135-T137 VanDerWaalsContact C-N 3.34Å; C135-T137 PolarHBondContact O-N 2.94Å; C135-H225 PolarHBondContact O-CE1 3.06Å; C135-H225 VanDerWaalsContact O-CE1 3.26Å; C135-H225 PolarHBondContact O-ND1 3.48Å
136	N	70.4	Confident	82.2	Confident	39 Å²	39	28 Å²	28	21%	0.209	16%	0.161	C	C	.	.			trans	-97.9	35.3	-166	-59.9	-8.5	0	0	0	112.7	D133 H134 L138 R205 Y223	D133-N136 PolarHBondContact O-ND2 3.13Å; D133-N136 PolarHBondContact O-OD1 3.34Å; H134-N136 PolarHBondContact O-N 2.91Å; N136-L138 PolarHBondContact O-N 2.68Å; N136-R205 VanDerWaalsContact C-NH2 3.34Å; N136-R205 PolarHBondContact O-NE 2.97Å; N136-R205 PolarHBondContact O-NH2 3.31Å; N136-Y223 HydrophobicContact CB-CD1 4.2Å; N136-Y223 HydrophobicContact CB-CE1 3.74Å; N136-Y223 WeakPolarHBondContact O-CD1 3.19Å; N136-Y223 WeakPolarHBondContact O-CE1 3.14Å
137	T	74.7	Confident	81.8	Confident	20 Å²	20	35.1 Å²	35.1	12%	0.123	19%	0.194	C	C	.	.			trans	-77	114.3	-179.5	-61.1	0	0	0	0	110.3	W99 L103 C135 Y223 L224	W99-T137 HydrophobicContact CE3-CG2 4.07Å; L103-T137 HydrophobicContact CD1-CG2 4.36Å; L103-T137 HydrophobicContact CD2-CG2 3.46Å; L103-T137 VanDerWaalsContact CD2-CG2 3.46Å; L103-T137 HydrophobicContact CG-CG2 4.15Å; C135-T137 VanDerWaalsContact C-N 3.34Å; C135-T137 PolarHBondContact O-N 2.94Å; T137-Y223 CarbonylContact O-C 3.54Å; T137-Y223 WeakPolarHBondContact O-CA 3.36Å; T137-L224 HydrophobicContact CG2-CB 4.47Å; T137-L224 HydrophobicContact CG2-CD2 4.23Å; T137-L224 WeakPolarHBondContact O-CB 3.44Å; T137-L224 PolarHBondContact O-N 3.28Å
138	L	79.5	Confident	81.4	Confident	3 Å²	3	36 Å²	36	2%	0.016	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-82.4	147.7	178.6	-70.8	172.6	0	0	0	111.5	L103 N136 C201 L204 R205 F221 Y223	L103-L138 WeakPolarHBondContact CD2-O 3.24Å; N136-L138 PolarHBondContact O-N 2.68Å; L138-C201 HydrophobicContact CB-CB 4.49Å; L138-C201 PolarHBondContact O-SG 2.8Å; L138-L204 HydrophobicContact CD1-CB 3.65Å; L138-R205 HydrophobicContact CD1-CB 4.01Å; L138-F221 HydrophobicContact CD2-CB 4.4Å; L138-F221 WeakPolarHBondContact CD2-O 3.41Å; L138-Y223 HydrophobicContact CD2-CD1 3.52Å; L138-Y223 HydrophobicContact CD2-CE1 3.53Å; L138-Y223 HydrophobicContact CD2-CG 4.31Å; L138-Y223 HydrophobicContact CG-CD1 4Å; L138-Y223 HydrophobicContact CG-CE1 3.89Å
139	V	80.6	Confident	80.9	Confident	9 Å²	9	36.6 Å²	36.6	6%	0.055	20%	0.203	C	C	.	.			trans	-114.2	135.7	173.7	-172.5	0	0	0	0	109.3	V108 P222 L224 L227	V108-V139 HydrophobicContact CG1-CG1 4.42Å; V108-V139 HydrophobicContact CG2-CG1 4.14Å; V139-P222 PolarHBondContact N-O 2.56Å; V139-L224 HydrophobicContact CG2-CB 3.51Å; V139-L224 HydrophobicContact CG2-CD1 3.44Å; V139-L224 VanDerWaalsContact CG2-CD1 3.44Å; V139-L224 HydrophobicContact CG2-CD2 4.47Å; V139-L224 HydrophobicContact CG2-CG 3.94Å; V139-L227 HydrophobicContact CG1-CD2 4.38Å; V139-L227 HydrophobicContact CG2-CD2 4.39Å
140	L	83.3	Confident	80.6	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.037	22%	0.221	C	C	.	.			trans	-80.8	133.1	173.5	-61	-173.4	0	0	0	110.2	L168 Y169 L183 Y197 L200 L204 F221	L140-L168 HydrophobicContact CD1-CD1 3.97Å; L140-Y169 WeakPolarHBondContact CB-OH 3.42Å; L140-Y169 HydrophobicContact CD1-CE2 4.31Å; L140-L183 HydrophobicContact CB-CD2 4.18Å; L140-Y197 HydrophobicContact CB-CD2 4.48Å; L140-Y197 HydrophobicContact CB-CE2 3.63Å; L140-Y197 HydrophobicContact CD1-CD2 3.44Å; L140-Y197 VanDerWaalsContact CD1-CD2 3.44Å; L140-Y197 HydrophobicContact CD1-CE2 3.43Å; L140-Y197 VanDerWaalsContact CD1-CE2 3.43Å; L140-Y197 HydrophobicContact CD1-CG 4.08Å; L140-Y197 HydrophobicContact CG-CD2 4.06Å; L140-Y197 HydrophobicContact CG-CE1 4.36Å; L140-Y197 HydrophobicContact CG-CE2 3.53Å; L140-Y197 PolarHBondContact N-OH 2.81Å; L140-L200 HydrophobicContact CD1-CD2 3.8Å; L140-L200 HydrophobicContact CD1-CG 4.44Å; L140-L200 HydrophobicContact CD2-CD2 4.08Å; L140-L200 HydrophobicContact CD2-CG 4.23Å; L140-L204 HydrophobicContact CD2-CD1 3.64Å; L140-F221 HydrophobicContact CD2-CD1 4.03Å; L140-F221 HydrophobicContact CD2-CE1 4.02Å
141	P	83.2	Confident	80.2	Confident	22 Å²	22	43.5 Å²	43.5	14%	0.143	24%	0.241	C	C	.	.			trans	-61.3	147	176.2	-28.8	38.2	0	0	0	112.8	V143 L144 Y169 I220 F221	P141-V143 PolarHBondContact O-N 2.82Å; P141-L144 HydrophobicContact CB-CD2 4Å; P141-L144 HydrophobicContact CG-CD2 3.89Å; P141-Y169 WeakPolarHBondContact O-CE1 3.45Å; P141-Y169 PolarHBondContact O-OH 2.82Å; P141-I220 HydrophobicContact CG-CG2 4.08Å; P141-I220 WeakPolarHBondContact CG-O 3.3Å; P141-F221 VanDerWaalsContact CD-CD1 3.45Å; P141-F221 VanDerWaalsContact CD-CE1 3.44Å; P141-F221 HydrophobicContact CG-CD1 4.2Å; P141-F221 HydrophobicContact CG-CE1 4.18Å
142	P	81.1	Confident	80	Confident	82 Å²	82	43.4 Å²	43.4	53%	0.532	24%	0.241	S	C	.	.	S	Bend	trans	-64.8	-27.6	176.3	27.1	-34.6	0	0	0	112.5	L183	P142-L183 WeakPolarHBondContact O-CB 3.39Å; P142-L183 PolarHBondContact O-N 3.17Å
143	V	84.2	Confident	80	Confident	75 Å²	75	45.5 Å²	45.5	46%	0.455	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.6	178	-172.6	0	0	0	0	109.3	P141 C180 Y181 K182	P141-V143 PolarHBondContact O-N 2.82Å; V143-C180 HydrophobicContact CG1-CB 3.9Å; V143-Y181 CarbonylContact C-O 3.51Å; V143-Y181 WeakPolarHBondContact CA-O 3.4Å; V143-K182 HydrophobicContact CG2-CG 4.3Å
144	L	86.5	Confident	80.4	Confident	5 Å²	5	47 Å²	47	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137	172.4	-67.6	175.8	0	0	0	110.3	P141 V148 V149 Y169 C180 Y181 I220 F221	P141-L144 HydrophobicContact CB-CD2 4Å; P141-L144 HydrophobicContact CG-CD2 3.89Å; L144-V148 HydrophobicContact CD2-CG1 4.19Å; L144-V149 HydrophobicContact CB-CG2 4Å; L144-V149 HydrophobicContact CD1-CG2 4.29Å; L144-Y169 HydrophobicContact CB-CE1 4.35Å; L144-Y169 HydrophobicContact CD1-CD1 4.33Å; L144-Y169 HydrophobicContact CD1-CD2 4.46Å; L144-Y169 HydrophobicContact CD1-CE1 3.68Å; L144-Y169 HydrophobicContact CD1-CE2 3.81Å; L144-Y169 WeakPolarHBondContact CD1-OH 3.43Å; L144-Y169 HydrophobicContact CG-CE1 3.73Å; L144-C180 WeakPolarHBondContact O-CA 3.33Å; L144-Y181 PolarHBondContact N-O 3.29Å; L144-Y181 PolarHBondContact O-N 3.38Å; L144-I220 HydrophobicContact CD2-CG2 4.07Å; L144-F221 HydrophobicContact CD2-CE1 4.12Å; L144-F221 HydrophobicContact CD2-CZ 3.91Å
145	A	86.9	Confident	80.8	Confident	50 Å²	50	44.1 Å²	44.1	41%	0.413	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	152	171.1	0	0	0	0	0	110.9	E147 V148 V149	A145-E147 VanDerWaalsContact C-N 3.27Å; A145-E147 PolarHBondContact O-N 3.3Å; A145-V148 HydrophobicContact CB-CG2 4.2Å; A145-V148 WeakPolarHBondContact O-CB 3.34Å; A145-V148 PolarHBondContact O-N 2.88Å; A145-V148 VanDerWaalsContact O-N 3.14Å; A145-V149 PolarHBondContact O-N 3.34Å
146	E	85.7	Confident	81.1	Confident	80 Å²	80	44 Å²	44	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-59.8	-35.7	180	-178.6	167.4	-142	0	0	113.2	V148 V149 S150 R179 Y181	E146-V148 VanDerWaalsContact C-N 3.31Å; E146-V148 PolarHBondContact O-N 2.91Å; E146-V149 PolarHBondContact O-N 3.42Å; E146-S150 WeakPolarHBondContact O-CB 3.3Å; E146-S150 PolarHBondContact O-N 3.11Å; E146-S150 PolarHBondContact O-OG 3.37Å; E146-R179 WeakPolarHBondContact CB-O 3.23Å; E146-R179 WeakPolarHBondContact OE1-CD 3.49Å; E146-R179 IonicContact OE1-NH1 3.66Å; E146-Y181 HydrophobicContact CB-CE2 4.29Å; E146-Y181 HydrophobicContact CG-CE2 4.37Å
147	E	85.6	Confident	81.2	Confident	150 Å²	150	45.7 Å²	45.7	70%	0.701	26%	0.262	S	S	*	.	H	α-helix	trans	-59.5	-42	176.1	-61.3	174.8	-179.5	0	0	111.9	A145 S150 Q151	A145-E147 VanDerWaalsContact C-N 3.27Å; A145-E147 PolarHBondContact O-N 3.3Å; E147-S150 PolarHBondContact O-N 3.38Å; E147-Q151 WeakPolarHBondContact O-CG 3.38Å; E147-Q151 PolarHBondContact O-N 3.22Å
148	V	84.3	Confident	80.6	Confident	17 Å²	17	52.3 Å²	52.3	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-68.5	-42.3	179.9	180	0	0	0	0	110.4	L144 A145 E146 S150 Q151 L152 W216 I220 F221	L144-V148 HydrophobicContact CD2-CG1 4.19Å; A145-V148 HydrophobicContact CB-CG2 4.2Å; A145-V148 WeakPolarHBondContact O-CB 3.34Å; A145-V148 PolarHBondContact O-N 2.88Å; A145-V148 VanDerWaalsContact O-N 3.14Å; E146-V148 VanDerWaalsContact C-N 3.31Å; E146-V148 PolarHBondContact O-N 2.91Å; V148-S150 VanDerWaalsContact C-N 3.32Å; V148-S150 PolarHBondContact O-N 3.28Å; V148-Q151 PolarHBondContact O-N 3.06Å; V148-L152 HydrophobicContact CG1-CD1 4.39Å; V148-L152 WeakPolarHBondContact O-CG 3.31Å; V148-L152 PolarHBondContact O-N 3.41Å; V148-W216 HydrophobicContact CG1-CZ3 4.12Å; V148-I220 HydrophobicContact CB-CD1 4.48Å; V148-I220 HydrophobicContact CG1-CD1 4.02Å; V148-I220 HydrophobicContact CG1-CG2 4.24Å; V148-I220 HydrophobicContact CG2-CD1 3.58Å; V148-F221 HydrophobicContact CG1-CE2 4.39Å; V148-F221 HydrophobicContact CG1-CZ 4.37Å
149	V	83.4	Confident	79.8	Confident	13 Å²	13	56.5 Å²	56.5	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-40.7	176.7	167.6	0	0	0	0	111.3	L144 A145 E146 L152 S153 L165 Y181	L144-V149 HydrophobicContact CB-CG2 4Å; L144-V149 HydrophobicContact CD1-CG2 4.29Å; A145-V149 PolarHBondContact O-N 3.34Å; E146-V149 PolarHBondContact O-N 3.42Å; V149-L152 PolarHBondContact O-N 3.19Å; V149-S153 WeakPolarHBondContact O-CB 3.22Å; V149-S153 PolarHBondContact O-N 3.3Å; V149-L165 HydrophobicContact CB-CD2 4.15Å; V149-L165 HydrophobicContact CG1-CD2 3.44Å; V149-L165 VanDerWaalsContact CG1-CD2 3.44Å; V149-L165 HydrophobicContact CG2-CD2 3.58Å; V149-Y181 HydrophobicContact CB-CD2 4.09Å; V149-Y181 HydrophobicContact CB-CE2 4.02Å; V149-Y181 HydrophobicContact CG1-CD2 4.37Å; V149-Y181 HydrophobicContact CG1-CE2 4.01Å; V149-Y181 HydrophobicContact CG2-CD2 3.53Å; V149-Y181 HydrophobicContact CG2-CE2 3.98Å; V149-Y181 HydrophobicContact CG2-CG 3.93Å
150	S	82.9	Confident	78.8	Confident	56 Å²	56	65 Å²	65	39%	0.392	35%	0.353	S	S	.	.	H	α-helix	trans	-62.2	-47.3	176.9	-56.3	0	0	0	0	110.9	E146 E147 V148 L152 S153 D154	E146-S150 WeakPolarHBondContact O-CB 3.3Å; E146-S150 PolarHBondContact O-N 3.11Å; E146-S150 PolarHBondContact O-OG 3.37Å; E147-S150 PolarHBondContact O-N 3.38Å; V148-S150 VanDerWaalsContact C-N 3.32Å; V148-S150 PolarHBondContact O-N 3.28Å; S150-L152 PolarHBondContact O-N 3.45Å; S150-S153 WeakPolarHBondContact O-CB 2.87Å; S150-S153 PolarHBondContact O-N 3.29Å; S150-S153 VanDerWaalsContact O-N 3.17Å; S150-D154 VanDerWaalsContact O-CG 3.27Å; S150-D154 PolarHBondContact O-N 2.83Å
151	Q	80.3	Confident	77.6	Confident	89 Å²	89	66 Å²	66	42%	0.416	36%	0.361	S	S	.	.	H	α-helix	trans	-60.6	-42	176.3	-71.8	172.1	10.8	0	0	112.9	E147 V148 D154 Y155 W216	E147-Q151 WeakPolarHBondContact O-CG 3.38Å; E147-Q151 PolarHBondContact O-N 3.22Å; V148-Q151 PolarHBondContact O-N 3.06Å; Q151-D154 PolarHBondContact O-N 2.85Å; Q151-Y155 WeakPolarHBondContact O-CB 3.41Å; Q151-Y155 PolarHBondContact O-N 3.19Å; Q151-W216 HydrophobicContact CB-CH2 4.39Å
152	L	80.5	Confident	76.6	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.01	39%	0.386	C	S	.	.	H	α-helix	trans	-65.2	-41.6	175.4	-72.3	177.5	0	0	0	111.6	V148 V149 S150 D154 Y155 F156 F163 L204 W216 F221	V148-L152 HydrophobicContact CG1-CD1 4.39Å; V148-L152 WeakPolarHBondContact O-CG 3.31Å; V148-L152 PolarHBondContact O-N 3.41Å; V149-L152 PolarHBondContact O-N 3.19Å; S150-L152 PolarHBondContact O-N 3.45Å; L152-D154 VanDerWaalsContact C-N 3.34Å; L152-Y155 PolarHBondContact O-N 3.19Å; L152-F156 HydrophobicContact CB-CD2 4.34Å; L152-F156 HydrophobicContact CB-CE2 4.31Å; L152-F156 HydrophobicContact CD2-CE2 4.2Å; L152-F156 WeakPolarHBondContact O-CB 3.34Å; L152-F156 WeakPolarHBondContact O-CD2 3.4Å; L152-F156 PolarHBondContact O-N 2.88Å; L152-F163 HydrophobicContact CB-CE1 4.16Å; L152-F163 HydrophobicContact CB-CZ 4.02Å; L152-F163 HydrophobicContact CD1-CZ 4.12Å; L152-L204 HydrophobicContact CD2-CD2 3.72Å; L152-W216 HydrophobicContact CD2-CH2 4.45Å; L152-F221 HydrophobicContact CD1-CE2 4.3Å; L152-F221 HydrophobicContact CD1-CZ 3.81Å
153	S	80.5	Confident	75.7	Confident	54 Å²	54	67.9 Å²	67.9	38%	0.378	37%	0.369	S	S	.	.	H	α-helix	trans	-61	-44.8	176.6	-176	0	0	0	0	111.2	V149 S150 F156 S157	V149-S153 WeakPolarHBondContact O-CB 3.22Å; V149-S153 PolarHBondContact O-N 3.3Å; S150-S153 WeakPolarHBondContact O-CB 2.87Å; S150-S153 PolarHBondContact O-N 3.29Å; S150-S153 VanDerWaalsContact O-N 3.17Å; S153-F156 PolarHBondContact O-N 3.5Å; S153-S157 WeakPolarHBondContact O-CB 3.26Å; S153-S157 PolarHBondContact O-N 2.94Å; S153-S157 PolarHBondContact O-OG 3.23Å
154	D	79.3	Confident	75	Confident	98 Å²	98	67.5 Å²	67.5	52%	0.524	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-50.8	176.7	-67.5	-19.9	0	0	0	110.3	S150 Q151 L152 F156 S157 E158	S150-D154 VanDerWaalsContact O-CG 3.27Å; S150-D154 PolarHBondContact O-N 2.83Å; Q151-D154 PolarHBondContact O-N 2.85Å; L152-D154 VanDerWaalsContact C-N 3.34Å; D154-F156 PolarHBondContact O-N 2.87Å; D154-S157 PolarHBondContact O-N 3.35Å; D154-S157 PolarHBondContact O-OG 3.15Å; D154-E158 PolarHBondContact O-N 3.14Å; D154-E158 VanDerWaalsContact O-N 3.16Å
155	Y	75.3	Confident	74.5	Confident	49 Å²	49	67.8 Å²	67.8	19%	0.192	37%	0.368	C	S	.	.	H	α-helix	trans	-59.1	-43.8	178.3	178.4	-99.4	0	0	0	113.7	Q151 L152 N159 Y207	Q151-Y155 WeakPolarHBondContact O-CB 3.41Å; Q151-Y155 PolarHBondContact O-N 3.19Å; L152-Y155 PolarHBondContact O-N 3.19Å; Y155-N159 PolarHBondContact O-ND2 2.85Å; Y155-Y207 HydrophobicContact CD1-CD1 4.28Å; Y155-Y207 HydrophobicContact CD1-CD2 4.41Å; Y155-Y207 HydrophobicContact CD1-CE1 4.44Å; Y155-Y207 HydrophobicContact CD1-CG 4.27Å; Y155-Y207 AromaticContact CD2-CD2 3.94Å; Y155-Y207 HydrophobicContact CD2-CD2 3.94Å; Y155-Y207 HydrophobicContact CD2-CE1 4.27Å; Y155-Y207 AromaticContact CD2-CE2 3.49Å; Y155-Y207 HydrophobicContact CD2-CE2 3.49Å; Y155-Y207 VanDerWaalsContact CD2-CE2 3.49Å; Y155-Y207 AromaticContact CD2-CZ 3.72Å; Y155-Y207 HydrophobicContact CE1-CD1 4.13Å; Y155-Y207 AromaticContact CE1-CD2 3.75Å; Y155-Y207 HydrophobicContact CE1-CD2 3.75Å; Y155-Y207 HydrophobicContact CE1-CE2 4.29Å; Y155-Y207 AromaticContact CE1-CG 3.67Å; Y155-Y207 HydrophobicContact CE1-CG 3.67Å; Y155-Y207 AromaticContact CE2-CD2 3.19Å; Y155-Y207 HydrophobicContact CE2-CD2 3.19Å; Y155-Y207 HydrophobicContact CE2-CE1 4.45Å; Y155-Y207 AromaticContact CE2-CE2 3.09Å; Y155-Y207 HydrophobicContact CE2-CE2 3.09Å; Y155-Y207 AromaticContact CE2-CG 3.98Å; Y155-Y207 HydrophobicContact CE2-CG 3.98Å; Y155-Y207 AromaticContact CE2-CZ 3.82Å; Y155-Y207 HydrophobicContact CG-CD2 4.49Å; Y155-Y207 HydrophobicContact CG-CE1 4.27Å; Y155-Y207 HydrophobicContact CG-CE2 4.24Å; Y155-Y207 AromaticContact CZ-CD2 3.06Å; Y155-Y207 AromaticContact CZ-CE2 3.55Å; Y155-Y207 AromaticContact CZ-CG 3.5Å; Y155-Y207 VanDerWaalsContact CZ-CG 3.5Å; Y155-Y207 WeakPolarHBondContact OH-CD2 3.12Å
156	F	74.7	Confident	73.9	Confident	5 Å²	5	70.8 Å²	70.8	2%	0.022	38%	0.377	C	S	.	.	H	α-helix	trans	-75.9	-27.2	-179.6	-73	-56.9	0	0	0	113	L152 S153 D154 N159 S161 F163 L200 R203 L204	L152-F156 HydrophobicContact CB-CD2 4.34Å; L152-F156 HydrophobicContact CB-CE2 4.31Å; L152-F156 HydrophobicContact CD2-CE2 4.2Å; L152-F156 WeakPolarHBondContact O-CB 3.34Å; L152-F156 WeakPolarHBondContact O-CD2 3.4Å; L152-F156 PolarHBondContact O-N 2.88Å; S153-F156 PolarHBondContact O-N 3.5Å; D154-F156 PolarHBondContact O-N 2.87Å; F156-N159 PolarHBondContact O-N 3.44Å; F156-S161 PolarHBondContact O-N 2.93Å; F156-S161 VanDerWaalsContact O-O 3.1Å; F156-S161 PolarHBondContact O-OG 3.25Å; F156-F163 HydrophobicContact CB-CB 3.72Å; F156-F163 HydrophobicContact CB-CG 4.31Å; F156-F163 HydrophobicContact CD2-CB 3.97Å; F156-F163 HydrophobicContact CD2-CD1 4.38Å; F156-F163 AromaticContact CD2-CD2 3.2Å; F156-F163 HydrophobicContact CD2-CD2 3.2Å; F156-F163 AromaticContact CD2-CE2 3.65Å; F156-F163 HydrophobicContact CD2-CE2 3.65Å; F156-F163 AromaticContact CD2-CG 3.61Å; F156-F163 HydrophobicContact CD2-CG 3.61Å; F156-F163 HydrophobicContact CD2-CZ 4.36Å; F156-F163 AromaticContact CE2-CD2 3.53Å; F156-F163 HydrophobicContact CE2-CD2 3.53Å; F156-F163 AromaticContact CE2-CE2 3.54Å; F156-F163 HydrophobicContact CE2-CE2 3.54Å; F156-F163 HydrophobicContact CE2-CG 4.36Å; F156-F163 HydrophobicContact CE2-CZ 4.35Å; F156-F163 HydrophobicContact CG-CB 4.09Å; F156-F163 AromaticContact CG-CD2 4Å; F156-F163 HydrophobicContact CG-CD2 4Å; F156-F163 HydrophobicContact CG-CG 4.24Å; F156-L200 HydrophobicContact CE2-CD1 3.9Å; F156-L200 HydrophobicContact CZ-CD1 3.87Å; F156-R203 HydrophobicContact CE1-CB 3.79Å; F156-R203 HydrophobicContact CE1-CG 4.36Å; F156-R203 HydrophobicContact CZ-CB 4.05Å; F156-L204 HydrophobicContact CZ-CD2 4.32Å
157	S	72.8	Confident	73.5	Confident	74 Å²	74	69.1 Å²	69.1	52%	0.517	37%	0.371	S	S	.	.	H	α-helix	trans	-67.8	-41.4	175.7	76.4	0	0	0	0	112.1	S153 D154 N159 Q160	S153-S157 WeakPolarHBondContact O-CB 3.26Å; S153-S157 PolarHBondContact O-N 2.94Å; S153-S157 PolarHBondContact O-OG 3.23Å; D154-S157 PolarHBondContact O-N 3.35Å; D154-S157 PolarHBondContact O-OG 3.15Å; S157-N159 PolarHBondContact O-N 3.01Å; S157-Q160 PolarHBondContact O-N 3.23Å; S157-Q160 VanDerWaalsContact O-N 3.13Å
158	E	62.9	Low	73.2	Confident	158 Å²	158	62 Å²	62	74%	0.738	34%	0.338	S	S	*	.	H	α-helix	trans	-60	-33.9	175.3	-71.7	-174.2	166.5	0	0	111.8	D154 Q160	D154-E158 PolarHBondContact O-N 3.14Å; D154-E158 VanDerWaalsContact O-N 3.16Å; E158-Q160 VanDerWaalsContact C-N 3.27Å; E158-Q160 PolarHBondContact O-N 3.32Å
159	N	62	Low	73.3	Confident	91 Å²	91	61.3 Å²	61.3	49%	0.487	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	11	180	-72.8	-49.5	0	0	0	114.6	Y155 F156 S157 S161	Y155-N159 PolarHBondContact O-ND2 2.85Å; F156-N159 PolarHBondContact O-N 3.44Å; S157-N159 PolarHBondContact O-N 3.01Å; N159-S161 PolarHBondContact O-N 2.86Å; N159-S161 VanDerWaalsContact O-N 3.1Å
160	Q	59.1	Low	73.4	Confident	189 Å²	189	63.4 Å²	63.4	88%	0.883	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	28.5	-178.5	-59.9	-175.4	-1	0	0	114.2	S157 E158	S157-Q160 PolarHBondContact O-N 3.23Å; S157-Q160 VanDerWaalsContact O-N 3.13Å; E158-Q160 VanDerWaalsContact C-N 3.27Å; E158-Q160 PolarHBondContact O-N 3.32Å
161	S	59.3	Low	73.5	Confident	27 Å²	27	63.6 Å²	63.6	19%	0.189	34%	0.343	C	S	.	.			trans	-114.8	124.9	-178.6	74.1	0	0	0	0	110	F156 N159 F163	F156-S161 PolarHBondContact O-N 2.93Å; F156-S161 VanDerWaalsContact O-O 3.1Å; F156-S161 PolarHBondContact O-OG 3.25Å; N159-S161 PolarHBondContact O-N 2.86Å; N159-S161 VanDerWaalsContact O-N 3.1Å; S161-F163 PolarHBondContact O-N 3.44Å
162	P	60.7	Low	73.6	Confident	103 Å²	103	60.2 Å²	60.2	67%	0.669	33%	0.33	S	S	*	.			trans	-63.7	125.2	176.1	23.9	-30.8	0	0	0	109.5	R203	P162-R203 PolarHBondContact O-NH1 2.94Å
163	F	63.2	Low	73.7	Confident	40 Å²	40	66.4 Å²	66.4	18%	0.175	36%	0.359	C	S	.	.			trans	-95.9	96.2	171.2	-179.8	-115.6	0	0	0	108.4	L152 F156 S161 L165 L200	L152-F163 HydrophobicContact CB-CE1 4.16Å; L152-F163 HydrophobicContact CB-CZ 4.02Å; L152-F163 HydrophobicContact CD1-CZ 4.12Å; F156-F163 HydrophobicContact CB-CB 3.72Å; F156-F163 HydrophobicContact CB-CG 4.31Å; F156-F163 HydrophobicContact CD2-CB 3.97Å; F156-F163 HydrophobicContact CD2-CD1 4.38Å; F156-F163 AromaticContact CD2-CD2 3.2Å; F156-F163 HydrophobicContact CD2-CD2 3.2Å; F156-F163 AromaticContact CD2-CE2 3.65Å; F156-F163 HydrophobicContact CD2-CE2 3.65Å; F156-F163 AromaticContact CD2-CG 3.61Å; F156-F163 HydrophobicContact CD2-CG 3.61Å; F156-F163 HydrophobicContact CD2-CZ 4.36Å; F156-F163 AromaticContact CE2-CD2 3.53Å; F156-F163 HydrophobicContact CE2-CD2 3.53Å; F156-F163 AromaticContact CE2-CE2 3.54Å; F156-F163 HydrophobicContact CE2-CE2 3.54Å; F156-F163 HydrophobicContact CE2-CG 4.36Å; F156-F163 HydrophobicContact CE2-CZ 4.35Å; F156-F163 HydrophobicContact CG-CB 4.09Å; F156-F163 AromaticContact CG-CD2 4Å; F156-F163 HydrophobicContact CG-CD2 4Å; F156-F163 HydrophobicContact CG-CG 4.24Å; S161-F163 PolarHBondContact O-N 3.44Å; F163-L165 HydrophobicContact CD1-CB 4.15Å; F163-L165 HydrophobicContact CE1-CB 3.69Å; F163-L165 HydrophobicContact CE1-CD1 3.9Å; F163-L165 HydrophobicContact CE1-CD2 4.35Å; F163-L165 HydrophobicContact CE1-CG 4.18Å; F163-L165 HydrophobicContact CZ-CB 4.15Å; F163-L165 HydrophobicContact CZ-CD1 3.61Å; F163-L165 HydrophobicContact CZ-CG 4.37Å; F163-L165 PolarHBondContact O-N 3.45Å; F163-L200 HydrophobicContact CD2-CD1 4.25Å; F163-L200 HydrophobicContact CE2-CD1 3.61Å; F163-L200 HydrophobicContact CE2-CD2 4.04Å; F163-L200 HydrophobicContact CE2-CG 4.5Å
164	V	68.8	Low	73.4	Confident	67 Å²	67	66.6 Å²	66.6	41%	0.406	36%	0.356	S	S	.	.			trans	-91.6	84.5	178.2	-171.9	0	0	0	0	108	D166 D167	V164-D166 VanDerWaalsContact C-N 3.32Å; V164-D167 HydrophobicContact CG1-CB 4.11Å
165	L	75.4	Confident	73.1	Confident	12 Å²	12	67.4 Å²	67.4	6%	0.063	38%	0.377	C	S	.	.			trans	-69.9	-33.2	175.2	-171.3	71.9	0	0	0	111.4	V149 F163 D167 L168 Y169 Y181	V149-L165 HydrophobicContact CB-CD2 4.15Å; V149-L165 HydrophobicContact CG1-CD2 3.44Å; V149-L165 VanDerWaalsContact CG1-CD2 3.44Å; V149-L165 HydrophobicContact CG2-CD2 3.58Å; F163-L165 HydrophobicContact CD1-CB 4.15Å; F163-L165 HydrophobicContact CE1-CB 3.69Å; F163-L165 HydrophobicContact CE1-CD1 3.9Å; F163-L165 HydrophobicContact CE1-CD2 4.35Å; F163-L165 HydrophobicContact CE1-CG 4.18Å; F163-L165 HydrophobicContact CZ-CB 4.15Å; F163-L165 HydrophobicContact CZ-CD1 3.61Å; F163-L165 HydrophobicContact CZ-CG 4.37Å; F163-L165 PolarHBondContact O-N 3.45Å; L165-D167 PolarHBondContact O-N 3.43Å; L165-D167 VanDerWaalsContact O-N 3.1Å; L165-L168 PolarHBondContact O-N 2.85Å; L165-Y169 HydrophobicContact CD1-CD2 3.28Å; L165-Y169 HydrophobicContact CD1-CE2 3.84Å; L165-Y169 HydrophobicContact CD1-CG 3.96Å; L165-Y169 HydrophobicContact CG-CD2 3.97Å; L165-Y169 HydrophobicContact CG-CG 4.25Å; L165-Y169 PolarHBondContact O-N 2.87Å; L165-Y181 HydrophobicContact CD2-CD1 3.73Å; L165-Y181 HydrophobicContact CD2-CE1 4.1Å; L165-Y181 HydrophobicContact CD2-CG 4.05Å
166	D	75.6	Confident	73.2	Confident	113 Å²	113	70.7 Å²	70.7	60%	0.604	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.2	-175.1	-65.3	-26	0	0	0	113.9	V164 L168 K184	V164-D166 VanDerWaalsContact C-N 3.32Å; D166-L168 VanDerWaalsContact C-N 3.3Å; D166-K184 PolarHBondContact O-NZ 3.38Å
167	D	77.7	Confident	73.3	Confident	45 Å²	45	72.6 Å²	72.6	24%	0.241	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-29.7	173.9	-80.5	-3.8	0	0	0	111.5	V164 L165 T196	V164-D167 HydrophobicContact CG1-CB 4.11Å; L165-D167 PolarHBondContact O-N 3.43Å; L165-D167 VanDerWaalsContact O-N 3.1Å; D167-T196 HydrophobicContact CB-CG2 4.23Å
168	L	79.5	Confident	73.9	Confident	0 Å²	0	75 Å²	75	0%	0	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-41.5	-173	-66.8	-179.7	0	0	0	113	L140 L165 D166 L183 K184 I189 G193 T196 Y197 L200	L140-L168 HydrophobicContact CD1-CD1 3.97Å; L165-L168 PolarHBondContact O-N 2.85Å; D166-L168 VanDerWaalsContact C-N 3.3Å; L168-L183 HydrophobicContact CB-CD1 4.25Å; L168-L183 WeakPolarHBondContact O-CD1 3.37Å; L168-K184 VanDerWaalsContact O-CB 3.25Å; L168-K184 WeakPolarHBondContact O-CB 3.38Å; L168-K184 WeakPolarHBondContact O-CG 3.21Å; L168-K184 PolarHBondContact O-N 2.67Å; L168-I189 HydrophobicContact CD2-CD1 4.17Å; L168-I189 HydrophobicContact CD2-CG2 4.46Å; L168-G193 WeakPolarHBondContact CD2-O 3.45Å; L168-T196 HydrophobicContact CD1-CG2 3.98Å; L168-T196 HydrophobicContact CD2-CG2 4.47Å; L168-T196 HydrophobicContact CG-CG2 3.97Å; L168-Y197 HydrophobicContact CD2-CD2 4.5Å; L168-L200 HydrophobicContact CD1-CB 4.42Å; L168-L200 HydrophobicContact CD1-CD2 3.85Å
169	Y	86.1	Confident	74.9	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.008	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	154	-177.5	-68.3	-102.2	0	0	0	111	L140 P141 L144 L165 Y181 K182 L183 K184	L140-Y169 WeakPolarHBondContact CB-OH 3.42Å; L140-Y169 HydrophobicContact CD1-CE2 4.31Å; P141-Y169 WeakPolarHBondContact O-CE1 3.45Å; P141-Y169 PolarHBondContact O-OH 2.82Å; L144-Y169 HydrophobicContact CB-CE1 4.35Å; L144-Y169 HydrophobicContact CD1-CD1 4.33Å; L144-Y169 HydrophobicContact CD1-CD2 4.46Å; L144-Y169 HydrophobicContact CD1-CE1 3.68Å; L144-Y169 HydrophobicContact CD1-CE2 3.81Å; L144-Y169 WeakPolarHBondContact CD1-OH 3.43Å; L144-Y169 HydrophobicContact CG-CE1 3.73Å; L165-Y169 HydrophobicContact CD1-CD2 3.28Å; L165-Y169 HydrophobicContact CD1-CE2 3.84Å; L165-Y169 HydrophobicContact CD1-CG 3.96Å; L165-Y169 HydrophobicContact CG-CD2 3.97Å; L165-Y169 HydrophobicContact CG-CG 4.25Å; L165-Y169 PolarHBondContact O-N 2.87Å; Y169-Y181 VanDerWaalsContact CD1-O 3.32Å; Y169-Y181 WeakPolarHBondContact CD1-O 3.18Å; Y169-K182 CarbonylContact C-O 3.56Å; Y169-K182 VanDerWaalsContact CA-O 3.26Å; Y169-K182 WeakPolarHBondContact CA-O 3.25Å; Y169-K182 VanDerWaalsContact CD1-C 3.43Å; Y169-L183 HydrophobicContact CD1-CB 4.02Å; Y169-L183 VanDerWaalsContact CD1-N 3.31Å; Y169-L183 HydrophobicContact CD2-CD1 4.13Å; Y169-L183 HydrophobicContact CE1-CB 3.66Å; Y169-L183 HydrophobicContact CE1-CD1 4.19Å; Y169-L183 HydrophobicContact CE1-CG 4.41Å; Y169-L183 HydrophobicContact CE2-CD1 3.8Å; Y169-L183 HydrophobicContact CG-CD1 4.48Å; Y169-K184 WeakPolarHBondContact O-CE 3.41Å
170	Q	85.9	Confident	76	Confident	58 Å²	58	69.1 Å²	69.1	27%	0.271	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.7	169.3	61	-172	15.3	0	0	109.8	A172 Y181 K182 K184 E575	Q170-A172 PolarHBondContact O-N 3.4Å; Q170-Y181 CarbonylContact O-C 3.6Å; Q170-Y181 WeakPolarHBondContact O-CA 3.38Å; Q170-K182 HydrophobicContact CG-CB 4.27Å; Q170-K182 PolarHBondContact N-O 2.91Å; Q170-K182 PolarHBondContact O-N 2.93Å; Q170-K184 HydrophobicContact CB-CG 4.13Å; Q170-K184 HydrophobicContact CG-CG 4.15Å; Q170-E575 PolarHBondContact NE2-O 3.16Å
171	S	84.5	Confident	77.4	Confident	60 Å²	60	61.3 Å²	61.3	42%	0.42	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	128.4	173.3	-173.6	0	0	0	0	109.5	R179	S171-R179 PolarHBondContact OG-NE 2.87Å; S171-R179 PolarHBondContact OG-NH2 3.2Å
172	A	82.7	Confident	78.6	Confident	17 Å²	17	61.2 Å²	61.2	14%	0.14	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	170.2	175.7	0	0	0	0	0	109.7	Q170 C180 K182	Q170-A172 PolarHBondContact O-N 3.4Å; A172-C180 PolarHBondContact N-O 3.21Å; A172-C180 PolarHBondContact O-N 3.15Å; A172-K182 HydrophobicContact CB-CB 4.46Å; A172-K182 HydrophobicContact CB-CD 3.61Å; A172-K182 HydrophobicContact CB-CG 3.8Å
173	E	81.2	Confident	79.7	Confident	133 Å²	133	57.4 Å²	57.4	62%	0.621	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.4	170.8	-68.4	177.5	-177.1	0	0	108.5	Q178	E173-Q178 CarbonylContact C-O 3.45Å; E173-Q178 WeakPolarHBondContact CA-O 3.5Å
174	D	75.2	Confident	80.6	Confident	58 Å²	58	58.1 Å²	58.1	31%	0.31	33%	0.326	S	S	.	.			trans	-79.3	-179.7	172	75.1	2.1	0	0	0	111.2	V176 G177 Q178	D174-V176 PolarHBondContact O-N 2.89Å; D174-V176 WeakPolarHBondContact OD1-CA 3.39Å; D174-V176 WeakPolarHBondContact OD1-CB 3.27Å; D174-V176 PolarHBondContact OD1-N 3.1Å; D174-G177 PolarHBondContact O-N 3.45Å; D174-G177 PolarHBondContact OD1-N 3.44Å; D174-Q178 PolarHBondContact N-O 3.12Å; D174-Q178 PolarHBondContact OD1-N 2.7Å
175	A	71.6	Confident	81	Confident	115 Å²	115	57.3 Å²	57.3	95%	0.95	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-14.9	-179.6	0	0	0	0	0	114.2
176	V	78.1	Confident	80.6	Confident	117 Å²	117	59 Å²	59	71%	0.709	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-5	179.3	-170.2	0	0	0	0	110.9	D174 Q178	D174-V176 PolarHBondContact O-N 2.89Å; D174-V176 WeakPolarHBondContact OD1-CA 3.39Å; D174-V176 WeakPolarHBondContact OD1-CB 3.27Å; D174-V176 PolarHBondContact OD1-N 3.1Å; V176-Q178 VanDerWaalsContact C-N 3.33Å; V176-Q178 HydrophobicContact CB-CG 4.44Å; V176-Q178 HydrophobicContact CG1-CG 4.46Å
177	G	77.5	Confident	80.2	Confident	45 Å²	45	58.2 Å²	58.2	46%	0.464	32%	0.324	S	S	.	.	S	Bend	trans	79.7	14.4	-174.1	0	0	0	0	0	113.2	D174	D174-G177 PolarHBondContact O-N 3.45Å; D174-G177 PolarHBondContact OD1-N 3.44Å
178	Q	84	Confident	80	Confident	126 Å²	126	59.6 Å²	59.6	59%	0.589	34%	0.338	S	S	*	.			trans	-82.3	146.6	171.6	-62.5	-172.7	-11.7	0	0	110.3	E173 D174 V176 C180	E173-Q178 CarbonylContact C-O 3.45Å; E173-Q178 WeakPolarHBondContact CA-O 3.5Å; D174-Q178 PolarHBondContact N-O 3.12Å; D174-Q178 PolarHBondContact OD1-N 2.7Å; V176-Q178 VanDerWaalsContact C-N 3.33Å; V176-Q178 HydrophobicContact CB-CG 4.44Å; V176-Q178 HydrophobicContact CG1-CG 4.46Å; Q178-C180 PolarHBondContact O-N 2.88Å
179	R	84.8	Confident	79.6	Confident	118 Å²	118	60.8 Å²	60.8	45%	0.445	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	126.7	179.6	-164.2	177.1	-174.5	-174.2	0.7	110.1	E146 S171	E146-R179 WeakPolarHBondContact CB-O 3.23Å; E146-R179 WeakPolarHBondContact OE1-CD 3.49Å; E146-R179 IonicContact OE1-NH1 3.66Å; S171-R179 PolarHBondContact OG-NE 2.87Å; S171-R179 PolarHBondContact OG-NH2 3.2Å
180	C	86.1	Confident	79.1	Confident	7 Å²	7	62 Å²	62	5%	0.047	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	166.2	173.7	68.1	0	0	0	0	110.2	V143 L144 A172 Q178	V143-C180 HydrophobicContact CG1-CB 3.9Å; L144-C180 WeakPolarHBondContact O-CA 3.33Å; A172-C180 PolarHBondContact N-O 3.21Å; A172-C180 PolarHBondContact O-N 3.15Å; Q178-C180 PolarHBondContact O-N 2.88Å
181	Y	86.5	Confident	78.5	Confident	24 Å²	24	67.1 Å²	67.1	9%	0.094	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	116.1	179.9	-68.7	-94	0	0	0	108	V143 L144 E146 V149 L165 Y169 Q170	V143-Y181 CarbonylContact C-O 3.51Å; V143-Y181 WeakPolarHBondContact CA-O 3.4Å; L144-Y181 PolarHBondContact N-O 3.29Å; L144-Y181 PolarHBondContact O-N 3.38Å; E146-Y181 HydrophobicContact CB-CE2 4.29Å; E146-Y181 HydrophobicContact CG-CE2 4.37Å; V149-Y181 HydrophobicContact CB-CD2 4.09Å; V149-Y181 HydrophobicContact CB-CE2 4.02Å; V149-Y181 HydrophobicContact CG1-CD2 4.37Å; V149-Y181 HydrophobicContact CG1-CE2 4.01Å; V149-Y181 HydrophobicContact CG2-CD2 3.53Å; V149-Y181 HydrophobicContact CG2-CE2 3.98Å; V149-Y181 HydrophobicContact CG2-CG 3.93Å; L165-Y181 HydrophobicContact CD2-CD1 3.73Å; L165-Y181 HydrophobicContact CD2-CE1 4.1Å; L165-Y181 HydrophobicContact CD2-CG 4.05Å; Y169-Y181 VanDerWaalsContact CD1-O 3.32Å; Y169-Y181 WeakPolarHBondContact CD1-O 3.18Å; Q170-Y181 CarbonylContact O-C 3.6Å; Q170-Y181 WeakPolarHBondContact O-CA 3.38Å
182	K	84.9	Confident	78.1	Confident	26 Å²	26	72.8 Å²	72.8	11%	0.113	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.2	178.5	-69.4	-178.6	-176.7	176.9	0	109.9	V143 Y169 Q170 A172 K184 E575	V143-K182 HydrophobicContact CG2-CG 4.3Å; Y169-K182 CarbonylContact C-O 3.56Å; Y169-K182 VanDerWaalsContact CA-O 3.26Å; Y169-K182 WeakPolarHBondContact CA-O 3.25Å; Y169-K182 VanDerWaalsContact CD1-C 3.43Å; Q170-K182 HydrophobicContact CG-CB 4.27Å; Q170-K182 PolarHBondContact N-O 2.91Å; Q170-K182 PolarHBondContact O-N 2.93Å; A172-K182 HydrophobicContact CB-CB 4.46Å; A172-K182 HydrophobicContact CB-CD 3.61Å; A172-K182 HydrophobicContact CB-CG 3.8Å; K182-K184 PolarHBondContact O-N 2.89Å; K182-E575 VanDerWaalsContact NZ-CD 3.28Å; K182-E575 IonicContact NZ-OE1 3.77Å; K182-E575 IonicContact NZ-OE2 2.71Å; K182-E575 PolarHBondContact NZ-OE2 3.07Å
183	L	84.9	Confident	77.7	Confident	23 Å²	23	72.1 Å²	72.1	12%	0.12	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	124.2	177.6	-173.7	53.8	0	0	0	108.7	P105 L140 P142 L168 Y169 Y197	P105-L183 HydrophobicContact CB-CD2 3.6Å; P105-L183 HydrophobicContact CB-CG 3.89Å; P105-L183 HydrophobicContact CG-CD1 4.2Å; P105-L183 HydrophobicContact CG-CD2 3.53Å; P105-L183 HydrophobicContact CG-CG 3.68Å; L140-L183 HydrophobicContact CB-CD2 4.18Å; P142-L183 WeakPolarHBondContact O-CB 3.39Å; P142-L183 PolarHBondContact O-N 3.17Å; L168-L183 HydrophobicContact CB-CD1 4.25Å; L168-L183 WeakPolarHBondContact O-CD1 3.37Å; Y169-L183 HydrophobicContact CD1-CB 4.02Å; Y169-L183 VanDerWaalsContact CD1-N 3.31Å; Y169-L183 HydrophobicContact CD2-CD1 4.13Å; Y169-L183 HydrophobicContact CE1-CB 3.66Å; Y169-L183 HydrophobicContact CE1-CD1 4.19Å; Y169-L183 HydrophobicContact CE1-CG 4.41Å; Y169-L183 HydrophobicContact CE2-CD1 3.8Å; Y169-L183 HydrophobicContact CG-CD1 4.48Å; L183-Y197 HydrophobicContact CD2-CE2 4.4Å
184	K	81.8	Confident	77.4	Confident	54 Å²	54	67.8 Å²	67.8	24%	0.235	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-68.2	151.4	179	-67.7	173.5	176.8	176.7	0	109.9	D166 L168 Y169 Q170 K182 S188 I189	D166-K184 PolarHBondContact O-NZ 3.38Å; L168-K184 VanDerWaalsContact O-CB 3.25Å; L168-K184 WeakPolarHBondContact O-CB 3.38Å; L168-K184 WeakPolarHBondContact O-CG 3.21Å; L168-K184 PolarHBondContact O-N 2.67Å; Y169-K184 WeakPolarHBondContact O-CE 3.41Å; Q170-K184 HydrophobicContact CB-CG 4.13Å; Q170-K184 HydrophobicContact CG-CG 4.15Å; K182-K184 PolarHBondContact O-N 2.89Å; K184-S188 WeakPolarHBondContact CB-OG 3.38Å; K184-I189 HydrophobicContact CB-CD1 3.67Å; K184-I189 HydrophobicContact CB-CG1 3.49Å; K184-I189 VanDerWaalsContact CB-CG1 3.49Å; K184-I189 HydrophobicContact CD-CG1 4.26Å; K184-I189 VanDerWaalsContact O-CD1 3.27Å; K184-I189 WeakPolarHBondContact O-CD1 3.14Å
185	T	76.5	Confident	77.5	Confident	51 Å²	51	68.9 Å²	68.9	31%	0.313	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-72.5	153.6	177.8	61.4	0	0	0	0	110.6	D106 D187 S188 I189	D106-T185 WeakPolarHBondContact OD1-CG2 3.48Å; D106-T185 WeakPolarHBondContact OD2-CA 3.23Å; D106-T185 WeakPolarHBondContact OD2-CB 3.36Å; T185-D187 PolarHBondContact O-N 3.14Å; T185-S188 PolarHBondContact N-OG 3.22Å; T185-S188 PolarHBondContact O-N 3.1Å; T185-S188 PolarHBondContact O-OG 2.82Å; T185-S188 PolarHBondContact OG1-OG 3.39Å; T185-I189 WeakPolarHBondContact O-CG1 3.23Å; T185-I189 PolarHBondContact O-N 3.16Å; T185-I189 VanDerWaalsContact O-N 3.17Å
186	F	67	Low	77.9	Confident	46 Å²	46	64.2 Å²	64.2	20%	0.202	33%	0.333	C	S	.	.	H	α-helix	trans	-59.7	-37.5	-178.6	-177.7	-91.5	0	0	0	111.8	Q104 D106 S188 I189 G190 F194	Q104-F186 HydrophobicContact CB-CD2 4.38Å; Q104-F186 HydrophobicContact CG-CD2 3.68Å; Q104-F186 HydrophobicContact CG-CE2 3.99Å; Q104-F186 HydrophobicContact CG-CG 4.22Å; Q104-F186 VanDerWaalsContact NE2-CE2 3.34Å; D106-F186 PolarHBondContact OD2-N 2.86Å; F186-S188 PolarHBondContact O-N 3.09Å; F186-I189 PolarHBondContact O-N 3.46Å; F186-G190 PolarHBondContact O-N 2.95Å; F186-F194 HydrophobicContact CD2-CD2 4.39Å; F186-F194 HydrophobicContact CE2-CB 3.79Å; F186-F194 AromaticContact CE2-CD2 3.83Å; F186-F194 HydrophobicContact CE2-CD2 3.83Å; F186-F194 HydrophobicContact CE2-CG 4.01Å
187	D	68.7	Low	78	Confident	97 Å²	97	58.9 Å²	58.9	52%	0.519	30%	0.3	S	S	.	.	H	α-helix	trans	-61.2	-26.5	178.8	-62.1	-34.7	0	0	0	112.2	T185 R637	T185-D187 PolarHBondContact O-N 3.14Å; D187-R637 IonicContact OD1-NE 3.83Å; D187-R637 IonicContact OD2-CZ 3.27Å; D187-R637 IonicContact OD2-NE 2.72Å; D187-R637 PolarHBondContact OD2-NE 3.41Å; D187-R637 IonicContact OD2-NH2 2.65Å; D187-R637 PolarHBondContact OD2-NH2 3.21Å
188	S	71.7	Confident	78	Confident	74 Å²	74	57.6 Å²	57.6	52%	0.517	29%	0.285	S	S	.	.	H	α-helix	trans	-89.6	-30.8	177.9	70	0	0	0	0	113.9	K184 T185 F186	K184-S188 WeakPolarHBondContact CB-OG 3.38Å; T185-S188 PolarHBondContact N-OG 3.22Å; T185-S188 PolarHBondContact O-N 3.1Å; T185-S188 PolarHBondContact O-OG 2.82Å; T185-S188 PolarHBondContact OG1-OG 3.39Å; F186-S188 PolarHBondContact O-N 3.09Å
189	I	72.9	Confident	77.8	Confident	26 Å²	26	56.8 Å²	56.8	13%	0.133	28%	0.276	C	S	.	.	H	α-helix	trans	-84.8	-36.4	-176.5	-63	171.5	0	0	0	111.5	L168 K184 T185 F186	L168-I189 HydrophobicContact CD2-CD1 4.17Å; L168-I189 HydrophobicContact CD2-CG2 4.46Å; K184-I189 HydrophobicContact CB-CD1 3.67Å; K184-I189 HydrophobicContact CB-CG1 3.49Å; K184-I189 VanDerWaalsContact CB-CG1 3.49Å; K184-I189 HydrophobicContact CD-CG1 4.26Å; K184-I189 VanDerWaalsContact O-CD1 3.27Å; K184-I189 WeakPolarHBondContact O-CD1 3.14Å; T185-I189 WeakPolarHBondContact O-CG1 3.23Å; T185-I189 PolarHBondContact O-N 3.16Å; T185-I189 VanDerWaalsContact O-N 3.17Å; F186-I189 PolarHBondContact O-N 3.46Å
190	G	75.1	Confident	77.6	Confident	28 Å²	28	51.8 Å²	51.8	29%	0.289	26%	0.258	S	S	.	.	H	α-helix	trans	63.6	-166.5	-173.6	0	0	0	0	0	114	F186 R192 F194	F186-G190 PolarHBondContact O-N 2.95Å; G190-R192 VanDerWaalsContact C-N 3.34Å; G190-R192 PolarHBondContact O-N 3.45Å; G190-F194 PolarHBondContact O-N 3.1Å; G190-F194 VanDerWaalsContact O-N 3.16Å
191	Q	73.6	Confident	77.4	Confident	165 Å²	165	51.8 Å²	51.8	77%	0.771	26%	0.258	S	S	*	.	H	α-helix	trans	-61.4	-38.7	-177.7	-72.2	-178.2	-13.4	0	0	113.1	G193 F194 D195	Q191-G193 PolarHBondContact O-N 3.07Å; Q191-F194 WeakPolarHBondContact O-CB 3.3Å; Q191-F194 PolarHBondContact O-N 3.05Å; Q191-F194 VanDerWaalsContact O-N 3.12Å; Q191-D195 PolarHBondContact O-N 3.37Å
192	R	74.7	Confident	77	Confident	178 Å²	178	55.9 Å²	55.9	67%	0.672	28%	0.278	S	S	*	.	H	α-helix	trans	-58.5	-47.2	-176.4	179.2	179.6	171.2	-179	-3.9	112.1	G190 D195 T196	G190-R192 VanDerWaalsContact C-N 3.34Å; G190-R192 PolarHBondContact O-N 3.45Å; R192-D195 PolarHBondContact O-N 3.15Å; R192-T196 PolarHBondContact O-N 3.14Å; R192-T196 PolarHBondContact O-OG1 3.07Å
193	G	75.7	Confident	76.8	Confident	3 Å²	3	59 Å²	59	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-85.1	-13.6	178.2	0	0	0	0	0	113.3	L168 Q191 D195 T196 Y197	L168-G193 WeakPolarHBondContact CD2-O 3.45Å; Q191-G193 PolarHBondContact O-N 3.07Å; G193-D195 VanDerWaalsContact C-N 3.29Å; G193-D195 PolarHBondContact O-N 3.38Å; G193-T196 CarbonylContact O-C 3.59Å; G193-T196 PolarHBondContact O-N 3.14Å; G193-Y197 WeakPolarHBondContact O-CB 3.37Å; G193-Y197 PolarHBondContact O-N 3.37Å
194	F	74.1	Confident	76.6	Confident	43 Å²	43	58.1 Å²	58.1	19%	0.189	29%	0.285	C	S	.	.	H	α-helix	trans	-58.5	-44.7	160.5	-178.3	-98.2	0	0	0	111.5	S100 L103 F186 G190 Q191 T196 Y197 A198	S100-F194 VanDerWaalsContact O-CE2 3.23Å; S100-F194 WeakPolarHBondContact O-CE2 3.5Å; L103-F194 HydrophobicContact CB-CE2 4.48Å; F186-F194 HydrophobicContact CD2-CD2 4.39Å; F186-F194 HydrophobicContact CE2-CB 3.79Å; F186-F194 AromaticContact CE2-CD2 3.83Å; F186-F194 HydrophobicContact CE2-CD2 3.83Å; F186-F194 HydrophobicContact CE2-CG 4.01Å; G190-F194 PolarHBondContact O-N 3.1Å; G190-F194 VanDerWaalsContact O-N 3.16Å; Q191-F194 WeakPolarHBondContact O-CB 3.3Å; Q191-F194 PolarHBondContact O-N 3.05Å; Q191-F194 VanDerWaalsContact O-N 3.12Å; F194-T196 VanDerWaalsContact C-N 3.28Å; F194-T196 PolarHBondContact O-N 3.49Å; F194-Y197 WeakPolarHBondContact O-CB 3.45Å; F194-Y197 PolarHBondContact O-N 2.87Å; F194-A198 PolarHBondContact O-N 2.9Å
195	D	77	Confident	76.4	Confident	81 Å²	81	58.8 Å²	58.8	43%	0.433	29%	0.286	S	S	.	.	H	α-helix	trans	-63.5	-36.6	174.5	-60.9	-28.6	0	0	0	111.5	Q191 R192 G193 R199	Q191-D195 PolarHBondContact O-N 3.37Å; R192-D195 PolarHBondContact O-N 3.15Å; G193-D195 VanDerWaalsContact C-N 3.29Å; G193-D195 PolarHBondContact O-N 3.38Å; D195-R199 WeakPolarHBondContact O-CB 3.35Å; D195-R199 VanDerWaalsContact O-CG 3.27Å; D195-R199 WeakPolarHBondContact O-CG 3.5Å; D195-R199 PolarHBondContact O-N 3.28Å
196	T	79.6	Confident	76.4	Confident	16 Å²	16	58.8 Å²	58.8	10%	0.098	29%	0.291	C	S	.	.	H	α-helix	trans	-65.3	-40.2	174.7	-58.1	0	0	0	0	111.7	D167 L168 R192 G193 F194 R199 L200	D167-T196 HydrophobicContact CB-CG2 4.23Å; L168-T196 HydrophobicContact CD1-CG2 3.98Å; L168-T196 HydrophobicContact CD2-CG2 4.47Å; L168-T196 HydrophobicContact CG-CG2 3.97Å; R192-T196 PolarHBondContact O-N 3.14Å; R192-T196 PolarHBondContact O-OG1 3.07Å; G193-T196 CarbonylContact O-C 3.59Å; G193-T196 PolarHBondContact O-N 3.14Å; F194-T196 VanDerWaalsContact C-N 3.28Å; F194-T196 PolarHBondContact O-N 3.49Å; T196-R199 PolarHBondContact O-N 3.12Å; T196-R199 PolarHBondContact OG1-NH2 3.21Å; T196-L200 WeakPolarHBondContact O-CB 3.27Å; T196-L200 PolarHBondContact O-N 3.35Å
197	Y	81	Confident	76.8	Confident	5 Å²	5	57.4 Å²	57.4	2%	0.02	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-52.6	175	-175.4	-73.4	0	0	0	110.1	L103 P105 L140 L168 L183 G193 F194 R199 L200 C201	L103-Y197 HydrophobicContact CB-CD1 4.22Å; L103-Y197 HydrophobicContact CB-CE1 3.68Å; L103-Y197 HydrophobicContact CD1-CE1 4.22Å; L103-Y197 HydrophobicContact CD2-CE1 3.93Å; L103-Y197 HydrophobicContact CG-CE1 4.16Å; L103-Y197 VanDerWaalsContact O-CZ 3.24Å; L103-Y197 PolarHBondContact O-OH 3.37Å; P105-Y197 HydrophobicContact CG-CD2 4.46Å; P105-Y197 HydrophobicContact CG-CE2 4.15Å; L140-Y197 HydrophobicContact CB-CD2 4.48Å; L140-Y197 HydrophobicContact CB-CE2 3.63Å; L140-Y197 HydrophobicContact CD1-CD2 3.44Å; L140-Y197 VanDerWaalsContact CD1-CD2 3.44Å; L140-Y197 HydrophobicContact CD1-CE2 3.43Å; L140-Y197 VanDerWaalsContact CD1-CE2 3.43Å; L140-Y197 HydrophobicContact CD1-CG 4.08Å; L140-Y197 HydrophobicContact CG-CD2 4.06Å; L140-Y197 HydrophobicContact CG-CE1 4.36Å; L140-Y197 HydrophobicContact CG-CE2 3.53Å; L140-Y197 PolarHBondContact N-OH 2.81Å; L168-Y197 HydrophobicContact CD2-CD2 4.5Å; L183-Y197 HydrophobicContact CD2-CE2 4.4Å; G193-Y197 WeakPolarHBondContact O-CB 3.37Å; G193-Y197 PolarHBondContact O-N 3.37Å; F194-Y197 WeakPolarHBondContact O-CB 3.45Å; F194-Y197 PolarHBondContact O-N 2.87Å; Y197-R199 PolarHBondContact O-N 2.69Å; Y197-L200 PolarHBondContact O-N 3.09Å; Y197-L200 VanDerWaalsContact O-N 3.12Å; Y197-C201 WeakPolarHBondContact CE1-SG 3.35Å; Y197-C201 PolarHBondContact O-N 2.94Å; Y197-C201 PolarHBondContact O-SG 2.74Å
198	A	77.6	Confident	76.9	Confident	18 Å²	18	54.8 Å²	54.8	15%	0.149	27%	0.269	C	S	.	.	H	α-helix	trans	-59.9	-44.4	-179.9	0	0	0	0	0	111.9	F194 L200 C201 Q202	F194-A198 PolarHBondContact O-N 2.9Å; A198-L200 VanDerWaalsContact C-N 3.33Å; A198-L200 PolarHBondContact O-N 3.23Å; A198-C201 PolarHBondContact O-N 3.27Å; A198-Q202 WeakPolarHBondContact O-CG 3.34Å; A198-Q202 PolarHBondContact O-N 3.49Å
199	R	79.6	Confident	76.9	Confident	110 Å²	110	57.3 Å²	57.3	42%	0.415	27%	0.272	S	S	.	.	H	α-helix	trans	-60.1	-41.7	174.4	-77.5	-173.8	-64.7	-99.1	-1.4	112.1	D195 T196 Y197 Q202 R203	D195-R199 WeakPolarHBondContact O-CB 3.35Å; D195-R199 VanDerWaalsContact O-CG 3.27Å; D195-R199 WeakPolarHBondContact O-CG 3.5Å; D195-R199 PolarHBondContact O-N 3.28Å; T196-R199 PolarHBondContact O-N 3.12Å; T196-R199 PolarHBondContact OG1-NH2 3.21Å; Y197-R199 PolarHBondContact O-N 2.69Å; R199-Q202 PolarHBondContact O-N 3.44Å; R199-R203 WeakPolarHBondContact O-CG 3.38Å; R199-R203 PolarHBondContact O-N 2.86Å
200	L	80.8	Confident	76.7	Confident	13 Å²	13	60.6 Å²	60.6	7%	0.068	29%	0.294	C	S	.	.	H	α-helix	trans	-66.3	-46	179.3	179.6	53.8	0	0	0	111.5	L140 F156 F163 L168 T196 Y197 A198 Q202 R203 L204	L140-L200 HydrophobicContact CD1-CD2 3.8Å; L140-L200 HydrophobicContact CD1-CG 4.44Å; L140-L200 HydrophobicContact CD2-CD2 4.08Å; L140-L200 HydrophobicContact CD2-CG 4.23Å; F156-L200 HydrophobicContact CE2-CD1 3.9Å; F156-L200 HydrophobicContact CZ-CD1 3.87Å; F163-L200 HydrophobicContact CD2-CD1 4.25Å; F163-L200 HydrophobicContact CE2-CD1 3.61Å; F163-L200 HydrophobicContact CE2-CD2 4.04Å; F163-L200 HydrophobicContact CE2-CG 4.5Å; L168-L200 HydrophobicContact CD1-CB 4.42Å; L168-L200 HydrophobicContact CD1-CD2 3.85Å; T196-L200 WeakPolarHBondContact O-CB 3.27Å; T196-L200 PolarHBondContact O-N 3.35Å; Y197-L200 PolarHBondContact O-N 3.09Å; Y197-L200 VanDerWaalsContact O-N 3.12Å; A198-L200 VanDerWaalsContact C-N 3.33Å; A198-L200 PolarHBondContact O-N 3.23Å; L200-Q202 VanDerWaalsContact C-N 3.3Å; L200-Q202 PolarHBondContact O-N 3.23Å; L200-R203 PolarHBondContact O-N 3.4Å; L200-R203 VanDerWaalsContact O-N 3.13Å; L200-L204 HydrophobicContact CD1-CD1 4.14Å; L200-L204 HydrophobicContact CD1-CG 4Å; L200-L204 HydrophobicContact CG-CD1 4.02Å; L200-L204 HydrophobicContact CG-CG 4.37Å; L200-L204 WeakPolarHBondContact O-CG 3.48Å; L200-L204 PolarHBondContact O-N 2.85Å
201	C	81.5	Confident	76.4	Confident	6 Å²	6	63.7 Å²	63.7	4%	0.041	30%	0.301	C	S	.	.	H	α-helix	trans	-58.9	-40.8	175.4	-70.4	0	0	0	0	112.3	L138 Y197 A198 L204 R205	L138-C201 HydrophobicContact CB-CB 4.49Å; L138-C201 PolarHBondContact O-SG 2.8Å; Y197-C201 WeakPolarHBondContact CE1-SG 3.35Å; Y197-C201 PolarHBondContact O-N 2.94Å; Y197-C201 PolarHBondContact O-SG 2.74Å; A198-C201 PolarHBondContact O-N 3.27Å; C201-L204 PolarHBondContact O-N 3.22Å; C201-R205 WeakPolarHBondContact O-CB 3.31Å; C201-R205 PolarHBondContact O-N 3.01Å
202	Q	79.2	Confident	75.6	Confident	110 Å²	110	60.4 Å²	60.4	51%	0.514	29%	0.294	S	S	.	.	H	α-helix	trans	-62.2	-41.8	175.1	-73.5	174	-1.5	0	0	112.2	A198 R199 L200 R205 A206	A198-Q202 WeakPolarHBondContact O-CG 3.34Å; A198-Q202 PolarHBondContact O-N 3.49Å; R199-Q202 PolarHBondContact O-N 3.44Å; L200-Q202 VanDerWaalsContact C-N 3.3Å; L200-Q202 PolarHBondContact O-N 3.23Å; Q202-R205 PolarHBondContact O-N 3.45Å; Q202-A206 PolarHBondContact O-N 3.27Å; Q202-A206 VanDerWaalsContact O-N 3.1Å
203	R	79.6	Confident	74.6	Confident	93 Å²	93	59.1 Å²	59.1	35%	0.351	30%	0.301	S	S	.	.	H	α-helix	trans	-67.7	-44	177.7	-73.3	178.4	-176.6	-178.4	2.2	112.6	F156 P162 R199 L200 R205 A206 Y207	F156-R203 HydrophobicContact CE1-CB 3.79Å; F156-R203 HydrophobicContact CE1-CG 4.36Å; F156-R203 HydrophobicContact CZ-CB 4.05Å; P162-R203 PolarHBondContact O-NH1 2.94Å; R199-R203 WeakPolarHBondContact O-CG 3.38Å; R199-R203 PolarHBondContact O-N 2.86Å; L200-R203 PolarHBondContact O-N 3.4Å; L200-R203 VanDerWaalsContact O-N 3.13Å; R203-R205 VanDerWaalsContact C-N 3.25Å; R203-R205 PolarHBondContact O-N 3.43Å; R203-A206 PolarHBondContact O-N 3.31Å; R203-Y207 PolarHBondContact O-N 3.35Å
204	L	80.4	Confident	74	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-34.9	176	-71.7	172.7	0	0	0	111.5	L138 L140 L152 F156 L200 C201 Y207 H208 F221	L138-L204 HydrophobicContact CD1-CB 3.65Å; L140-L204 HydrophobicContact CD2-CD1 3.64Å; L152-L204 HydrophobicContact CD2-CD2 3.72Å; F156-L204 HydrophobicContact CZ-CD2 4.32Å; L200-L204 HydrophobicContact CD1-CD1 4.14Å; L200-L204 HydrophobicContact CD1-CG 4Å; L200-L204 HydrophobicContact CG-CD1 4.02Å; L200-L204 HydrophobicContact CG-CG 4.37Å; L200-L204 WeakPolarHBondContact O-CG 3.48Å; L200-L204 PolarHBondContact O-N 2.85Å; C201-L204 PolarHBondContact O-N 3.22Å; L204-Y207 WeakPolarHBondContact O-CB 3.43Å; L204-Y207 PolarHBondContact O-N 2.91Å; L204-H208 WeakPolarHBondContact O-CB 3.39Å; L204-H208 PolarHBondContact O-N 3.2Å; L204-F221 HydrophobicContact CD1-CD1 3.79Å; L204-F221 HydrophobicContact CD1-CE1 3.93Å; L204-F221 HydrophobicContact CD1-CG 4.16Å; L204-F221 HydrophobicContact CD1-CZ 4.43Å
205	R	77.3	Confident	73.2	Confident	68 Å²	68	60.7 Å²	60.7	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-63.4	-48.5	173.2	-174.8	-172	-65.6	168.8	-0.7	111.3	N136 L138 C201 Q202 R203 Y207 H208 E209	N136-R205 VanDerWaalsContact C-NH2 3.34Å; N136-R205 PolarHBondContact O-NE 2.97Å; N136-R205 PolarHBondContact O-NH2 3.31Å; L138-R205 HydrophobicContact CD1-CB 4.01Å; C201-R205 WeakPolarHBondContact O-CB 3.31Å; C201-R205 PolarHBondContact O-N 3.01Å; Q202-R205 PolarHBondContact O-N 3.45Å; R203-R205 VanDerWaalsContact C-N 3.25Å; R203-R205 PolarHBondContact O-N 3.43Å; R205-Y207 PolarHBondContact O-N 2.91Å; R205-H208 PolarHBondContact O-N 3.35Å; R205-E209 WeakPolarHBondContact O-CG 3.35Å; R205-E209 PolarHBondContact O-N 3.16Å
206	A	77.9	Confident	72.9	Confident	51 Å²	51	60.2 Å²	60.2	42%	0.421	31%	0.308	S	S	.	.	H	α-helix	trans	-57.9	-40.2	175.6	0	0	0	0	0	111.2	Q202 R203 E209 T210	Q202-A206 PolarHBondContact O-N 3.27Å; Q202-A206 VanDerWaalsContact O-N 3.1Å; R203-A206 PolarHBondContact O-N 3.31Å; A206-E209 PolarHBondContact O-N 3.03Å; A206-T210 WeakPolarHBondContact O-CG2 3.26Å; A206-T210 PolarHBondContact O-N 3.4Å; A206-T210 PolarHBondContact O-OG1 2.92Å
207	Y	74.9	Confident	72.5	Confident	17 Å²	17	59.7 Å²	59.7	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-46.8	176.2	-175.5	-146.1	0	0	0	112.4	Y155 R203 L204 R205 E209 T210 E211 W216 L217	Y155-Y207 HydrophobicContact CD1-CD1 4.28Å; Y155-Y207 HydrophobicContact CD1-CD2 4.41Å; Y155-Y207 HydrophobicContact CD1-CE1 4.44Å; Y155-Y207 HydrophobicContact CD1-CG 4.27Å; Y155-Y207 AromaticContact CD2-CD2 3.94Å; Y155-Y207 HydrophobicContact CD2-CD2 3.94Å; Y155-Y207 HydrophobicContact CD2-CE1 4.27Å; Y155-Y207 AromaticContact CD2-CE2 3.49Å; Y155-Y207 HydrophobicContact CD2-CE2 3.49Å; Y155-Y207 VanDerWaalsContact CD2-CE2 3.49Å; Y155-Y207 AromaticContact CD2-CZ 3.72Å; Y155-Y207 HydrophobicContact CE1-CD1 4.13Å; Y155-Y207 AromaticContact CE1-CD2 3.75Å; Y155-Y207 HydrophobicContact CE1-CD2 3.75Å; Y155-Y207 HydrophobicContact CE1-CE2 4.29Å; Y155-Y207 AromaticContact CE1-CG 3.67Å; Y155-Y207 HydrophobicContact CE1-CG 3.67Å; Y155-Y207 AromaticContact CE2-CD2 3.19Å; Y155-Y207 HydrophobicContact CE2-CD2 3.19Å; Y155-Y207 HydrophobicContact CE2-CE1 4.45Å; Y155-Y207 AromaticContact CE2-CE2 3.09Å; Y155-Y207 HydrophobicContact CE2-CE2 3.09Å; Y155-Y207 AromaticContact CE2-CG 3.98Å; Y155-Y207 HydrophobicContact CE2-CG 3.98Å; Y155-Y207 AromaticContact CE2-CZ 3.82Å; Y155-Y207 HydrophobicContact CG-CD2 4.49Å; Y155-Y207 HydrophobicContact CG-CE1 4.27Å; Y155-Y207 HydrophobicContact CG-CE2 4.24Å; Y155-Y207 AromaticContact CZ-CD2 3.06Å; Y155-Y207 AromaticContact CZ-CE2 3.55Å; Y155-Y207 AromaticContact CZ-CG 3.5Å; Y155-Y207 VanDerWaalsContact CZ-CG 3.5Å; Y155-Y207 WeakPolarHBondContact OH-CD2 3.12Å; R203-Y207 PolarHBondContact O-N 3.35Å; L204-Y207 WeakPolarHBondContact O-CB 3.43Å; L204-Y207 PolarHBondContact O-N 2.91Å; R205-Y207 PolarHBondContact O-N 2.91Å; Y207-E209 VanDerWaalsContact C-N 3.25Å; Y207-E209 PolarHBondContact O-N 3.42Å; Y207-T210 WeakPolarHBondContact CA-OG1 3.49Å; Y207-T210 PolarHBondContact O-N 2.88Å; Y207-T210 VanDerWaalsContact O-N 3.1Å; Y207-T210 PolarHBondContact O-OG1 3.15Å; Y207-E211 HydrophobicContact CD2-CB 4.49Å; Y207-E211 HydrophobicContact CD2-CG 4.42Å; Y207-E211 HydrophobicContact CE2-CB 4.07Å; Y207-E211 VanDerWaalsContact CE2-CD 3.46Å; Y207-E211 HydrophobicContact CE2-CG 3.84Å; Y207-E211 WeakPolarHBondContact CE2-OE2 3.43Å; Y207-E211 VanDerWaalsContact CZ-OE2 3.23Å; Y207-E211 PolarHBondContact O-N 2.67Å; Y207-E211 PolarHBondContact OH-OE2 3.38Å; Y207-W216 HydrophobicContact CE1-CZ2 4.43Å; Y207-L217 HydrophobicContact CD1-CD1 3.4Å; Y207-L217 HydrophobicContact CD1-CD2 3.79Å; Y207-L217 HydrophobicContact CD1-CG 4.22Å; Y207-L217 HydrophobicContact CE1-CD1 3.19Å; Y207-L217 HydrophobicContact CE1-CD2 3.67Å; Y207-L217 HydrophobicContact CE1-CG 3.93Å; Y207-L217 HydrophobicContact CE2-CD1 4.46Å; Y207-L217 HydrophobicContact CG-CD1 4.15Å
208	H	70.8	Confident	71.8	Confident	41 Å²	41	60.6 Å²	60.6	19%	0.19	31%	0.312	C	S	.	.	H	α-helix	trans	-60	-32.9	177.1	-169.4	-68.2	0	0	0	112.7	L204 R205 Y223	L204-H208 WeakPolarHBondContact O-CB 3.39Å; L204-H208 PolarHBondContact O-N 3.2Å; R205-H208 PolarHBondContact O-N 3.35Å; H208-Y223 PolarHBondContact ND1-OH 3.2Å
209	E	71.3	Confident	71.6	Confident	127 Å²	127	67.2 Å²	67.2	59%	0.593	34%	0.337	S	S	*	.	H	α-helix	trans	-76.1	-33.7	175.2	-71.6	174.6	-171	0	0	112.6	R205 A206 Y207	R205-E209 WeakPolarHBondContact O-CG 3.35Å; R205-E209 PolarHBondContact O-N 3.16Å; A206-E209 PolarHBondContact O-N 3.03Å; Y207-E209 VanDerWaalsContact C-N 3.25Å; Y207-E209 PolarHBondContact O-N 3.42Å
210	T	69.5	Low	71.6	Confident	96 Å²	96	64.2 Å²	64.2	59%	0.589	33%	0.329	S	S	*	.	H	α-helix	trans	-78.1	-34.4	178.8	53.9	0	0	0	0	114	A206 Y207 P212	A206-T210 WeakPolarHBondContact O-CG2 3.26Å; A206-T210 PolarHBondContact O-N 3.4Å; A206-T210 PolarHBondContact O-OG1 2.92Å; Y207-T210 WeakPolarHBondContact CA-OG1 3.49Å; Y207-T210 PolarHBondContact O-N 2.88Å; Y207-T210 VanDerWaalsContact O-N 3.1Å; Y207-T210 PolarHBondContact O-OG1 3.15Å; T210-P212 VanDerWaalsContact C-CD 3.43Å; T210-P212 VanDerWaalsContact O-CD 3.32Å; T210-P212 WeakPolarHBondContact O-CD 3.36Å
211	E	67.8	Low	71.7	Confident	92 Å²	92	63.9 Å²	63.9	43%	0.43	33%	0.327	S	S	.	.			trans	-120.3	70.5	179.3	-70.9	-165	164.3	0	0	111.6	Y207 N213 G214	Y207-E211 HydrophobicContact CD2-CB 4.49Å; Y207-E211 HydrophobicContact CD2-CG 4.42Å; Y207-E211 HydrophobicContact CE2-CB 4.07Å; Y207-E211 VanDerWaalsContact CE2-CD 3.46Å; Y207-E211 HydrophobicContact CE2-CG 3.84Å; Y207-E211 WeakPolarHBondContact CE2-OE2 3.43Å; Y207-E211 VanDerWaalsContact CZ-OE2 3.23Å; Y207-E211 PolarHBondContact O-N 2.67Å; Y207-E211 PolarHBondContact OH-OE2 3.38Å; E211-N213 PolarHBondContact O-N 3.33Å; E211-G214 PolarHBondContact O-N 3.44Å
212	P	57.2	Low	71.6	Confident	97 Å²	97	65 Å²	65	63%	0.63	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.4	177.7	25.7	-34.4	0	0	0	112.7	T210 G214	T210-P212 VanDerWaalsContact C-CD 3.43Å; T210-P212 VanDerWaalsContact O-CD 3.32Å; T210-P212 WeakPolarHBondContact O-CD 3.36Å; P212-G214 VanDerWaalsContact C-N 3.3Å; P212-G214 PolarHBondContact O-N 3.01Å
213	N	54.3	Low	71.7	Confident	151 Å²	151	61 Å²	61	81%	0.807	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	10.9	177.3	-64.8	-21.3	0	0	0	113.7	E211 P215	E211-N213 PolarHBondContact O-N 3.33Å; N213-P215 WeakPolarHBondContact O-CD 3.34Å
214	G	61.7	Low	71.9	Confident	10 Å²	10	56.9 Å²	56.9	10%	0.103	30%	0.3	C	S	.	.			trans	-92	73.4	169.9	0	0	0	0	0	111.8	E211 P212 W216 L217	E211-G214 PolarHBondContact O-N 3.44Å; P212-G214 VanDerWaalsContact C-N 3.3Å; P212-G214 PolarHBondContact O-N 3.01Å; G214-W216 PolarHBondContact O-N 3.39Å; G214-L217 PolarHBondContact O-N 2.87Å
215	P	59.2	Low	72	Confident	68 Å²	68	57.2 Å²	57.2	44%	0.442	30%	0.301	S	S	.	.	H	α-helix	trans	-65.6	-9.3	-174.8	30.3	-39.2	0	0	0	113.4	N213 S218 K219	N213-P215 WeakPolarHBondContact O-CD 3.34Å; P215-S218 PolarHBondContact O-OG 3.48Å; P215-K219 WeakPolarHBondContact O-CD 3.39Å; P215-K219 VanDerWaalsContact O-CG 3.29Å; P215-K219 WeakPolarHBondContact O-CG 3.5Å
216	W	70.4	Confident	72.2	Confident	72 Å²	72	55.9 Å²	55.9	27%	0.273	30%	0.298	S	S	.	.	H	α-helix	trans	-77	-33.6	175	73.4	-95.8	0	0	0	111.3	V148 Q151 L152 Y207 G214 K219 I220 F221	V148-W216 HydrophobicContact CG1-CZ3 4.12Å; Q151-W216 HydrophobicContact CB-CH2 4.39Å; L152-W216 HydrophobicContact CD2-CH2 4.45Å; Y207-W216 HydrophobicContact CE1-CZ2 4.43Å; G214-W216 PolarHBondContact O-N 3.39Å; W216-K219 PolarHBondContact O-N 3.08Å; W216-I220 HydrophobicContact CE3-CD1 3.53Å; W216-I220 HydrophobicContact CE3-CG1 4.27Å; W216-I220 HydrophobicContact CZ3-CD1 3.87Å; W216-I220 VanDerWaalsContact O-CG1 3.32Å; W216-I220 WeakPolarHBondContact O-CG1 3.39Å; W216-I220 PolarHBondContact O-N 3.47Å; W216-F221 HydrophobicContact CZ3-CE2 4.4Å
217	L	70.4	Confident	72.5	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-47.2	-178	-75.2	161.7	0	0	0	112.3	Y207 G214 K219 I220 F221	Y207-L217 HydrophobicContact CD1-CD1 3.4Å; Y207-L217 HydrophobicContact CD1-CD2 3.79Å; Y207-L217 HydrophobicContact CD1-CG 4.22Å; Y207-L217 HydrophobicContact CE1-CD1 3.19Å; Y207-L217 HydrophobicContact CE1-CD2 3.67Å; Y207-L217 HydrophobicContact CE1-CG 3.93Å; Y207-L217 HydrophobicContact CE2-CD1 4.46Å; Y207-L217 HydrophobicContact CG-CD1 4.15Å; G214-L217 PolarHBondContact O-N 2.87Å; L217-K219 PolarHBondContact O-N 3.36Å; L217-I220 PolarHBondContact O-N 3.28Å; L217-I220 VanDerWaalsContact O-N 3.16Å; L217-F221 HydrophobicContact CD2-CD2 4.15Å; L217-F221 HydrophobicContact CD2-CE2 4.36Å; L217-F221 WeakPolarHBondContact O-CA 3.33Å; L217-F221 PolarHBondContact O-N 3.47Å
218	S	67.3	Low	73	Confident	23 Å²	23	55.1 Å²	55.1	16%	0.161	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-31	178.4	55.9	0	0	0	0	112.6	P215	P215-S218 PolarHBondContact O-OG 3.48Å
219	K	72.2	Confident	73.7	Confident	158 Å²	158	53.3 Å²	53.3	69%	0.687	28%	0.279	S	S	*	.	H	α-helix	trans	-71.2	-33	174.7	-71.6	177.4	-176.1	-179.1	0	112.9	P215 W216 L217	P215-K219 WeakPolarHBondContact O-CD 3.39Å; P215-K219 VanDerWaalsContact O-CG 3.29Å; P215-K219 WeakPolarHBondContact O-CG 3.5Å; W216-K219 PolarHBondContact O-N 3.08Å; L217-K219 PolarHBondContact O-N 3.36Å
220	I	80.6	Confident	74.4	Confident	47 Å²	47	48.7 Å²	48.7	24%	0.241	26%	0.262	C	S	.	.	H	α-helix	trans	-89.8	-42.1	-178.4	-62.7	-174.3	0	0	0	111	P141 L144 V148 W216 L217 P222	P141-I220 HydrophobicContact CG-CG2 4.08Å; P141-I220 WeakPolarHBondContact CG-O 3.3Å; L144-I220 HydrophobicContact CD2-CG2 4.07Å; V148-I220 HydrophobicContact CB-CD1 4.48Å; V148-I220 HydrophobicContact CG1-CD1 4.02Å; V148-I220 HydrophobicContact CG1-CG2 4.24Å; V148-I220 HydrophobicContact CG2-CD1 3.58Å; W216-I220 HydrophobicContact CE3-CD1 3.53Å; W216-I220 HydrophobicContact CE3-CG1 4.27Å; W216-I220 HydrophobicContact CZ3-CD1 3.87Å; W216-I220 VanDerWaalsContact O-CG1 3.32Å; W216-I220 WeakPolarHBondContact O-CG1 3.39Å; W216-I220 PolarHBondContact O-N 3.47Å; L217-I220 PolarHBondContact O-N 3.28Å; L217-I220 VanDerWaalsContact O-N 3.16Å; I220-P222 VanDerWaalsContact C-CD 3.49Å; I220-P222 WeakPolarHBondContact O-CD 3.41Å
221	F	82.2	Confident	75.2	Confident	5 Å²	5	45.9 Å²	45.9	2%	0.022	24%	0.243	C	C	.	.	S	Bend	trans	-115.4	78.6	-177.8	-57.1	-80.2	0	0	0	109.2	L138 L140 P141 L144 V148 L152 L204 W216 L217	L138-F221 HydrophobicContact CD2-CB 4.4Å; L138-F221 WeakPolarHBondContact CD2-O 3.41Å; L140-F221 HydrophobicContact CD2-CD1 4.03Å; L140-F221 HydrophobicContact CD2-CE1 4.02Å; P141-F221 VanDerWaalsContact CD-CD1 3.45Å; P141-F221 VanDerWaalsContact CD-CE1 3.44Å; P141-F221 HydrophobicContact CG-CD1 4.2Å; P141-F221 HydrophobicContact CG-CE1 4.18Å; L144-F221 HydrophobicContact CD2-CE1 4.12Å; L144-F221 HydrophobicContact CD2-CZ 3.91Å; V148-F221 HydrophobicContact CG1-CE2 4.39Å; V148-F221 HydrophobicContact CG1-CZ 4.37Å; L152-F221 HydrophobicContact CD1-CE2 4.3Å; L152-F221 HydrophobicContact CD1-CZ 3.81Å; L204-F221 HydrophobicContact CD1-CD1 3.79Å; L204-F221 HydrophobicContact CD1-CE1 3.93Å; L204-F221 HydrophobicContact CD1-CG 4.16Å; L204-F221 HydrophobicContact CD1-CZ 4.43Å; W216-F221 HydrophobicContact CZ3-CE2 4.4Å; L217-F221 HydrophobicContact CD2-CD2 4.15Å; L217-F221 HydrophobicContact CD2-CE2 4.36Å; L217-F221 WeakPolarHBondContact O-CA 3.33Å; L217-F221 PolarHBondContact O-N 3.47Å
222	P	80.2	Confident	76.2	Confident	31 Å²	31	41.5 Å²	41.5	20%	0.201	22%	0.222	C	C	.	.			trans	-69	155.7	178.9	29.8	-35.4	0	0	0	111	V139 I220 L227	V139-P222 PolarHBondContact N-O 2.56Å; I220-P222 VanDerWaalsContact C-CD 3.49Å; I220-P222 WeakPolarHBondContact O-CD 3.41Å; P222-L227 HydrophobicContact CG-CB 4.38Å; P222-L227 HydrophobicContact CG-CD1 4.46Å
223	Y	81.1	Confident	77.5	Confident	25 Å²	25	37.9 Å²	37.9	10%	0.098	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-67.9	146.4	164.1	-63.7	-62.3	0	0	0	110	N136 T137 L138 H208 H225 E226 L227	N136-Y223 HydrophobicContact CB-CD1 4.2Å; N136-Y223 HydrophobicContact CB-CE1 3.74Å; N136-Y223 WeakPolarHBondContact O-CD1 3.19Å; N136-Y223 WeakPolarHBondContact O-CE1 3.14Å; T137-Y223 CarbonylContact O-C 3.54Å; T137-Y223 WeakPolarHBondContact O-CA 3.36Å; L138-Y223 HydrophobicContact CD2-CD1 3.52Å; L138-Y223 HydrophobicContact CD2-CE1 3.53Å; L138-Y223 HydrophobicContact CD2-CG 4.31Å; L138-Y223 HydrophobicContact CG-CD1 4Å; L138-Y223 HydrophobicContact CG-CE1 3.89Å; H208-Y223 PolarHBondContact ND1-OH 3.2Å; Y223-H225 VanDerWaalsContact C-N 3.26Å; Y223-H225 VanDerWaalsContact CB-CE1 3.49Å; Y223-H225 WeakPolarHBondContact CB-CE1 3.27Å; Y223-H225 AromaticContact CG-CE1 3.98Å; Y223-H225 PolarHBondContact O-N 3.24Å; Y223-E226 HydrophobicContact CD2-CG 4.46Å; Y223-E226 WeakPolarHBondContact CD2-OE2 3.4Å; Y223-E226 PolarHBondContact N-OE2 3.4Å; Y223-E226 WeakPolarHBondContact O-CA 3.26Å; Y223-E226 WeakPolarHBondContact O-CB 3.49Å; Y223-E226 PolarHBondContact O-N 3.27Å; Y223-L227 PolarHBondContact O-N 2.99Å
224	L	83.1	Confident	78.9	Confident	7 Å²	7	36.3 Å²	36.3	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-58.3	-38.9	-177.2	-178.1	55	0	0	0	112.2	W57 A102 T137 V139 L227 I228	W57-L224 HydrophobicContact CH2-CD1 4.15Å; W57-L224 HydrophobicContact CH2-CD2 3.44Å; W57-L224 VanDerWaalsContact CH2-CD2 3.44Å; W57-L224 HydrophobicContact CH2-CG 3.48Å; W57-L224 VanDerWaalsContact CH2-CG 3.48Å; W57-L224 HydrophobicContact CZ2-CB 4.38Å; W57-L224 HydrophobicContact CZ2-CD2 3.77Å; W57-L224 HydrophobicContact CZ2-CG 3.58Å; A102-L224 HydrophobicContact CB-CD2 3.94Å; T137-L224 HydrophobicContact CG2-CB 4.47Å; T137-L224 HydrophobicContact CG2-CD2 4.23Å; T137-L224 WeakPolarHBondContact O-CB 3.44Å; T137-L224 PolarHBondContact O-N 3.28Å; V139-L224 HydrophobicContact CG2-CB 3.51Å; V139-L224 HydrophobicContact CG2-CD1 3.44Å; V139-L224 VanDerWaalsContact CG2-CD1 3.44Å; V139-L224 HydrophobicContact CG2-CD2 4.47Å; V139-L224 HydrophobicContact CG2-CG 3.94Å; L224-L227 PolarHBondContact O-N 3.12Å; L224-I228 HydrophobicContact CD1-CD1 3.94Å; L224-I228 HydrophobicContact CD1-CG1 4.38Å; L224-I228 HydrophobicContact CG-CD1 4.1Å; L224-I228 WeakPolarHBondContact O-CB 3.32Å; L224-I228 WeakPolarHBondContact O-CD1 3.36Å; L224-I228 VanDerWaalsContact O-CG1 3.25Å; L224-I228 WeakPolarHBondContact O-CG1 3.46Å; L224-I228 PolarHBondContact O-N 2.86Å
225	H	82	Confident	79.5	Confident	11 Å²	11	40.1 Å²	40.1	5%	0.051	23%	0.226	C	C	.	.	H	α-helix	trans	-67.8	-36.9	176	72.8	-90	0	0	0	111.8	V131 C135 Y223 I228 I229	V131-H225 HydrophobicContact CG1-CB 4.13Å; C135-H225 PolarHBondContact O-CE1 3.06Å; C135-H225 VanDerWaalsContact O-CE1 3.26Å; C135-H225 PolarHBondContact O-ND1 3.48Å; Y223-H225 VanDerWaalsContact C-N 3.26Å; Y223-H225 VanDerWaalsContact CB-CE1 3.49Å; Y223-H225 WeakPolarHBondContact CB-CE1 3.27Å; Y223-H225 AromaticContact CG-CE1 3.98Å; Y223-H225 PolarHBondContact O-N 3.24Å; H225-I228 PolarHBondContact O-N 2.72Å; H225-I229 WeakPolarHBondContact O-CB 3.41Å; H225-I229 WeakPolarHBondContact O-CD1 3.48Å; H225-I229 WeakPolarHBondContact O-CG1 3.39Å; H225-I229 PolarHBondContact O-N 2.84Å
226	E	81.9	Confident	80.1	Confident	39 Å²	39	39.2 Å²	39.2	18%	0.182	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-44.5	175.7	-64.6	174.9	150.6	0	0	110.9	Y223 I228 I229 A230	Y223-E226 HydrophobicContact CD2-CG 4.46Å; Y223-E226 WeakPolarHBondContact CD2-OE2 3.4Å; Y223-E226 PolarHBondContact N-OE2 3.4Å; Y223-E226 WeakPolarHBondContact O-CA 3.26Å; Y223-E226 WeakPolarHBondContact O-CB 3.49Å; Y223-E226 PolarHBondContact O-N 3.27Å; E226-I228 VanDerWaalsContact C-N 3.32Å; E226-I228 PolarHBondContact O-N 2.9Å; E226-I229 PolarHBondContact O-N 3.1Å; E226-A230 WeakPolarHBondContact O-CB 3.49Å; E226-A230 PolarHBondContact O-N 3.16Å
227	L	83.8	Confident	80.1	Confident	47 Å²	47	45 Å²	45	25%	0.246	24%	0.243	C	C	.	.	H	α-helix	trans	-56.7	-46.9	176.2	179.8	65.9	0	0	0	111	V108 L112 V139 P222 Y223 L224 H231	V108-L227 HydrophobicContact CG1-CD2 3.97Å; L112-L227 HydrophobicContact CD1-CD2 4.33Å; V139-L227 HydrophobicContact CG1-CD2 4.38Å; V139-L227 HydrophobicContact CG2-CD2 4.39Å; P222-L227 HydrophobicContact CG-CB 4.38Å; P222-L227 HydrophobicContact CG-CD1 4.46Å; Y223-L227 PolarHBondContact O-N 2.99Å; L224-L227 PolarHBondContact O-N 3.12Å; L227-H231 VanDerWaalsContact O-CB 3.28Å; L227-H231 WeakPolarHBondContact O-CB 3.33Å; L227-H231 PolarHBondContact O-N 3.49Å
228	I	86.7	Confident	80.2	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-69.1	-43.3	-178.4	-70.2	171	0	0	0	111.7	F55 W57 L112 L115 F127 L224 H225 E226 H231 A232	F55-I228 HydrophobicContact CE1-CG2 4.12Å; W57-I228 HydrophobicContact CD2-CD1 3.59Å; W57-I228 HydrophobicContact CE3-CD1 3.29Å; W57-I228 HydrophobicContact CH2-CD1 3.16Å; W57-I228 HydrophobicContact CZ2-CD1 3.5Å; W57-I228 VanDerWaalsContact CZ2-CD1 3.5Å; W57-I228 HydrophobicContact CZ3-CD1 3.08Å; L112-I228 HydrophobicContact CD2-CG1 4.3Å; L115-I228 HydrophobicContact CD2-CG2 3.95Å; F127-I228 HydrophobicContact CE2-CG2 3.57Å; F127-I228 HydrophobicContact CZ-CG2 3.84Å; L224-I228 HydrophobicContact CD1-CD1 3.94Å; L224-I228 HydrophobicContact CD1-CG1 4.38Å; L224-I228 HydrophobicContact CG-CD1 4.1Å; L224-I228 WeakPolarHBondContact O-CB 3.32Å; L224-I228 WeakPolarHBondContact O-CD1 3.36Å; L224-I228 VanDerWaalsContact O-CG1 3.25Å; L224-I228 WeakPolarHBondContact O-CG1 3.46Å; L224-I228 PolarHBondContact O-N 2.86Å; H225-I228 PolarHBondContact O-N 2.72Å; E226-I228 VanDerWaalsContact C-N 3.32Å; E226-I228 PolarHBondContact O-N 2.9Å; I228-H231 PolarHBondContact O-N 3.32Å; I228-A232 WeakPolarHBondContact O-CB 3.33Å; I228-A232 PolarHBondContact O-N 3.41Å
229	I	85.4	Confident	80.7	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-65.8	-42.4	177.6	-69.1	166.7	0	0	0	110.5	F127 V131 H225 E226 A232 S233 V245 L281	F127-I229 HydrophobicContact CE1-CG1 4.08Å; F127-I229 HydrophobicContact CZ-CG1 3.94Å; V131-I229 HydrophobicContact CG1-CD1 4.16Å; H225-I229 WeakPolarHBondContact O-CB 3.41Å; H225-I229 WeakPolarHBondContact O-CD1 3.48Å; H225-I229 WeakPolarHBondContact O-CG1 3.39Å; H225-I229 PolarHBondContact O-N 2.84Å; E226-I229 PolarHBondContact O-N 3.1Å; I229-A232 PolarHBondContact O-N 3.02Å; I229-S233 WeakPolarHBondContact O-CB 3.34Å; I229-S233 PolarHBondContact O-N 3.4Å; I229-S233 PolarHBondContact O-OG 3.4Å; I229-V245 HydrophobicContact CD1-CG1 4.26Å; I229-L281 HydrophobicContact CD1-CD2 3.87Å; I229-L281 HydrophobicContact CG2-CD2 4.08Å; I229-L281 HydrophobicContact CG2-CG 4.28Å
230	A	85.3	Confident	80.9	Confident	29 Å²	29	44.3 Å²	44.3	24%	0.24	25%	0.245	C	C	.	.	H	α-helix	trans	-58.3	-52.3	174.8	0	0	0	0	0	110.1	E226 A232 S233 E234	E226-A230 WeakPolarHBondContact O-CB 3.49Å; E226-A230 PolarHBondContact O-N 3.16Å; A230-A232 VanDerWaalsContact C-N 3.33Å; A230-A232 PolarHBondContact O-N 3.21Å; A230-S233 WeakPolarHBondContact O-CA 3.41Å; A230-S233 WeakPolarHBondContact O-CB 3.42Å; A230-S233 PolarHBondContact O-N 3.43Å; A230-S233 PolarHBondContact O-OG 3.41Å; A230-E234 WeakPolarHBondContact O-CG 3.01Å; A230-E234 PolarHBondContact O-N 3.37Å; A230-E234 VanDerWaalsContact O-N 3.17Å
231	H	86.9	Confident	80.9	Confident	37 Å²	37	48.1 Å²	48.1	17%	0.171	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-39.5	179.5	-164.3	88.4	0	0	0	112.8	L112 L115 T116 L227 I228 S233 E234	L112-H231 HydrophobicContact CD2-CB 3.88Å; L112-H231 PolarHBondContact O-NE2 2.92Å; L115-H231 HydrophobicContact CD2-CB 4.26Å; T116-H231 PolarHBondContact OG1-NE2 3.04Å; L227-H231 VanDerWaalsContact O-CB 3.28Å; L227-H231 WeakPolarHBondContact O-CB 3.33Å; L227-H231 PolarHBondContact O-N 3.49Å; I228-H231 PolarHBondContact O-N 3.32Å; H231-S233 VanDerWaalsContact C-N 3.29Å; H231-S233 PolarHBondContact O-N 3.3Å; H231-E234 PolarHBondContact O-N 3.24Å
232	A	88	Confident	81.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.5	-43.9	173	0	0	0	0	0	111.1	L115 K119 F126 F127 I228 I229 A230 E234 I239	L115-A232 HydrophobicContact CD1-CB 4.41Å; L115-A232 HydrophobicContact CD2-CB 4.14Å; K119-A232 PolarHBondContact NZ-O 3.47Å; F126-A232 HydrophobicContact CE2-CB 4.33Å; F127-A232 HydrophobicContact CB-CB 4.48Å; F127-A232 HydrophobicContact CD1-CB 3.75Å; F127-A232 HydrophobicContact CD2-CB 4.11Å; F127-A232 HydrophobicContact CE1-CB 3.91Å; F127-A232 HydrophobicContact CE2-CB 4.26Å; F127-A232 HydrophobicContact CG-CB 3.86Å; F127-A232 HydrophobicContact CZ-CB 4.15Å; I228-A232 WeakPolarHBondContact O-CB 3.33Å; I228-A232 PolarHBondContact O-N 3.41Å; I229-A232 PolarHBondContact O-N 3.02Å; A230-A232 VanDerWaalsContact C-N 3.33Å; A230-A232 PolarHBondContact O-N 3.21Å; A232-E234 PolarHBondContact O-N 3.27Å; A232-I239 HydrophobicContact CB-CD1 4.15Å; A232-I239 WeakPolarHBondContact O-CD1 3.48Å
233	S	85.2	Confident	81.7	Confident	21 Å²	21	48.7 Å²	48.7	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-72.1	-17.5	-177.3	75	0	0	0	0	116.2	I229 A230 H231 G235 E236 G280	I229-S233 WeakPolarHBondContact O-CB 3.34Å; I229-S233 PolarHBondContact O-N 3.4Å; I229-S233 PolarHBondContact O-OG 3.4Å; A230-S233 WeakPolarHBondContact O-CA 3.41Å; A230-S233 WeakPolarHBondContact O-CB 3.42Å; A230-S233 PolarHBondContact O-N 3.43Å; A230-S233 PolarHBondContact O-OG 3.41Å; H231-S233 VanDerWaalsContact C-N 3.29Å; H231-S233 PolarHBondContact O-N 3.3Å; S233-G235 PolarHBondContact O-N 3.4Å; S233-E236 PolarHBondContact O-N 3.01Å; S233-G280 VanDerWaalsContact OG-CA 3.29Å; S233-G280 WeakPolarHBondContact OG-CA 3.16Å
234	E	83.5	Confident	82.1	Confident	119 Å²	119	47.5 Å²	47.5	56%	0.556	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	118.6	-172.4	-78.2	178.5	-170.3	0	0	113.8	K119 A230 H231 A232 E236	K119-E234 PolarHBondContact NZ-O 3.39Å; A230-E234 WeakPolarHBondContact O-CG 3.01Å; A230-E234 PolarHBondContact O-N 3.37Å; A230-E234 VanDerWaalsContact O-N 3.17Å; H231-E234 PolarHBondContact O-N 3.24Å; A232-E234 PolarHBondContact O-N 3.27Å; E234-E236 VanDerWaalsContact C-N 3.29Å; E234-E236 PolarHBondContact O-N 3.05Å
235	G	74.4	Confident	82.3	Confident	89 Å²	89	47.1 Å²	47.1	92%	0.918	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	8.6	173.3	0	0	0	0	0	115.9	S233	S233-G235 PolarHBondContact O-N 3.4Å
236	E	71.4	Confident	82.5	Confident	49 Å²	49	46.6 Å²	46.6	23%	0.229	25%	0.251	C	S	.	.			trans	-101.5	119.6	176.3	-81.3	-76.7	179.9	0	0	111.9	K119 S233 E234 I239 R242	K119-E236 HydrophobicContact CD-CG 4.42Å; S233-E236 PolarHBondContact O-N 3.01Å; E234-E236 VanDerWaalsContact C-N 3.29Å; E234-E236 PolarHBondContact O-N 3.05Å; E236-I239 HydrophobicContact CB-CB 3.73Å; E236-R242 IonicContact OE1-NH1 3.88Å; E236-R242 PolarHBondContact OE1-NH1 3.31Å
237	K	70.7	Confident	82.6	Confident	195 Å²	195	45 Å²	45	85%	0.848	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-28	177.5	-67.1	-177.4	-179	177.2	0	113
238	H	72	Confident	82.6	Confident	117 Å²	117	44.7 Å²	44.7	54%	0.542	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.7	37.5	-174.1	-61.6	-69.3	0	0	0	112.2	S240 Q241	H238-S240 PolarHBondContact O-N 3.23Å; H238-Q241 PolarHBondContact O-N 3.14Å; H238-Q241 VanDerWaalsContact O-N 3.11Å
239	I	78.8	Confident	82.1	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.015	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-30.8	-177.7	-174.7	168	0	0	0	113.3	F126 A232 E236 Q241 R242 S243 A283	F126-I239 HydrophobicContact CE1-CG1 4.41Å; F126-I239 HydrophobicContact CZ-CD1 4.05Å; F126-I239 HydrophobicContact CZ-CG1 4.3Å; A232-I239 HydrophobicContact CB-CD1 4.15Å; A232-I239 WeakPolarHBondContact O-CD1 3.48Å; E236-I239 HydrophobicContact CB-CB 3.73Å; I239-Q241 PolarHBondContact O-N 2.96Å; I239-Q241 VanDerWaalsContact O-N 3.13Å; I239-R242 CarbonylContact O-C 3.58Å; I239-R242 PolarHBondContact O-N 3.26Å; I239-S243 WeakPolarHBondContact CG1-OG 3.33Å; I239-S243 WeakPolarHBondContact O-CB 3.37Å; I239-S243 PolarHBondContact O-N 3.16Å; I239-S243 PolarHBondContact O-OG 2.85Å; I239-A283 HydrophobicContact CG2-CB 3.47Å; I239-A283 VanDerWaalsContact CG2-CB 3.47Å; I239-A283 WeakPolarHBondContact CG2-O 3.32Å
240	S	76	Confident	81.2	Confident	51 Å²	51	48.2 Å²	48.2	36%	0.357	26%	0.263	S	S	.	.	H	α-helix	trans	-56.9	-28.7	176.3	58.4	0	0	0	0	113.7	H238 R242 A283 D285 K330	H238-S240 PolarHBondContact O-N 3.23Å; S240-R242 VanDerWaalsContact C-N 3.33Å; S240-A283 WeakPolarHBondContact CB-O 3.46Å; S240-A283 PolarHBondContact N-O 3.27Å; S240-D285 VanDerWaalsContact O-CB 3.3Å; S240-D285 WeakPolarHBondContact O-CB 3.41Å; S240-K330 PolarHBondContact O-NZ 3.21Å
241	Q	81.3	Confident	79.9	Confident	127 Å²	127	47.2 Å²	47.2	59%	0.593	25%	0.254	S	S	*	.	H	α-helix	trans	-77.7	-20.2	176	-66.4	179	-26.1	0	0	112.9	H238 I239 K330	H238-Q241 PolarHBondContact O-N 3.14Å; H238-Q241 VanDerWaalsContact O-N 3.11Å; I239-Q241 PolarHBondContact O-N 2.96Å; I239-Q241 VanDerWaalsContact O-N 3.13Å; Q241-K330 WeakPolarHBondContact O-CD 3.41Å; Q241-K330 WeakPolarHBondContact O-CG 3.47Å
242	R	87.8	Confident	78	Confident	47 Å²	47	47.1 Å²	47.1	18%	0.177	26%	0.26	C	S	.	.	H	α-helix	trans	-117.4	4.6	-174.8	-60.1	-176.7	67.3	-150	2.2	114.3	K119 S122 G124 P125 F126 F127 E236 I239 S240	K119-R242 PolarHBondContact O-NH1 2.91Å; K119-R242 VanDerWaalsContact O-NH1 3.15Å; K119-R242 PolarHBondContact O-NH2 3.13Å; S122-R242 PolarHBondContact O-NH2 3.22Å; G124-R242 PolarHBondContact O-NE 2.81Å; G124-R242 VanDerWaalsContact O-NE 3.17Å; P125-R242 CarbonylContact C-O 3.51Å; P125-R242 VanDerWaalsContact CA-O 3.3Å; P125-R242 WeakPolarHBondContact CA-O 3.4Å; F126-R242 HydrophobicContact CD1-CB 3.76Å; F126-R242 HydrophobicContact CE1-CB 3.9Å; F126-R242 PolarHBondContact N-O 3.5Å; F127-R242 PolarHBondContact N-O 3.25Å; E236-R242 IonicContact OE1-NH1 3.88Å; E236-R242 PolarHBondContact OE1-NH1 3.31Å; I239-R242 CarbonylContact O-C 3.58Å; I239-R242 PolarHBondContact O-N 3.26Å; S240-R242 VanDerWaalsContact C-N 3.33Å
243	S	90.3	Very high	75.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	155.4	179.5	62.5	0	0	0	0	111.1	F127 I239 C284 D285 K330	F127-S243 CarbonylContact O-C 3.59Å; F127-S243 VanDerWaalsContact O-CA 3.27Å; F127-S243 WeakPolarHBondContact O-CA 3.06Å; I239-S243 WeakPolarHBondContact CG1-OG 3.33Å; I239-S243 WeakPolarHBondContact O-CB 3.37Å; I239-S243 PolarHBondContact O-N 3.16Å; I239-S243 PolarHBondContact O-OG 2.85Å; S243-C284 WeakPolarHBondContact OG-CA 3.49Å; S243-D285 WeakPolarHBondContact O-CB 3.33Å; S243-D285 PolarHBondContact OG-N 2.48Å; S243-K330 WeakPolarHBondContact O-CE 3.45Å; S243-K330 PolarHBondContact O-NZ 3.43Å
244	L	89.9	Confident	73.4	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	123.4	167.2	179.4	62.8	0	0	0	109.6	F127 M128 A129 V246 D285 E287 V323 N326 M327	F127-L244 PolarHBondContact O-N 3.47Å; M128-L244 CarbonylContact C-O 3.54Å; M128-L244 VanDerWaalsContact CA-O 3.24Å; M128-L244 WeakPolarHBondContact CA-O 3.43Å; M128-L244 HydrophobicContact CG-CB 4.21Å; M128-L244 HydrophobicContact CG-CD2 4.45Å; A129-L244 PolarHBondContact N-O 3.43Å; L244-V246 HydrophobicContact CD2-CG2 4.2Å; L244-V246 HydrophobicContact CG-CG2 4.07Å; L244-D285 CarbonylContact C-O 3.59Å; L244-D285 WeakPolarHBondContact CA-O 3.2Å; L244-E287 HydrophobicContact CD1-CB 4.38Å; L244-E287 HydrophobicContact CD1-CG 3.85Å; L244-V323 HydrophobicContact CD2-CB 4.5Å; L244-V323 HydrophobicContact CD2-CG1 4.2Å; L244-V323 HydrophobicContact CD2-CG2 4.38Å; L244-N326 WeakPolarHBondContact CD1-ND2 3.44Å; L244-N326 HydrophobicContact CD2-CB 4.42Å; L244-M327 HydrophobicContact CB-CE 3.59Å; L244-M327 HydrophobicContact CB-SD 4.41Å; L244-M327 HydrophobicContact CD2-CE 3.92Å; L244-M327 HydrophobicContact CD2-CG 4.11Å; L244-M327 HydrophobicContact CD2-SD 4.42Å; L244-M327 HydrophobicContact CG-CE 4.37Å
245	V	86.5	Confident	71.2	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.8	173.7	-178.2	0	0	0	0	108.6	F127 A129 V131 I229 L281 C284 D285 V286 E287	F127-V245 HydrophobicContact CE1-CG2 4.06Å; A129-V245 HydrophobicContact CB-CG1 4.48Å; A129-V245 HydrophobicContact CB-CG2 4.39Å; A129-V245 CarbonylContact O-C 3.57Å; A129-V245 VanDerWaalsContact O-CA 3.32Å; A129-V245 WeakPolarHBondContact O-CA 3.41Å; V131-V245 HydrophobicContact CG2-CG1 4.04Å; I229-V245 HydrophobicContact CD1-CG1 4.26Å; V245-L281 HydrophobicContact CG1-CD2 3.92Å; V245-C284 HydrophobicContact CG2-CB 3.73Å; V245-D285 PolarHBondContact N-O 3.05Å; V245-V286 HydrophobicContact CB-CG2 4.31Å; V245-V286 CarbonylContact O-C 3.53Å; V245-V286 VanDerWaalsContact O-CA 3.31Å; V245-V286 WeakPolarHBondContact O-CA 3.47Å; V245-E287 PolarHBondContact O-N 3.39Å
246	V	87.3	Confident	69.3	Low	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.2	179.5	-175	0	0	0	0	109.1	A129 V130 V131 L244 E287 L289 F319 V323	A129-V246 PolarHBondContact O-N 3.38Å; V130-V246 CarbonylContact C-O 3.49Å; V130-V246 WeakPolarHBondContact CA-O 3.44Å; V130-V246 HydrophobicContact CG1-CB 4.24Å; V130-V246 HydrophobicContact CG1-CG1 4.43Å; V130-V246 HydrophobicContact CG2-CB 4.4Å; V131-V246 PolarHBondContact N-O 3.23Å; L244-V246 HydrophobicContact CD2-CG2 4.2Å; L244-V246 HydrophobicContact CG-CG2 4.07Å; V246-E287 CarbonylContact C-O 3.53Å; V246-E287 WeakPolarHBondContact CA-O 3.29Å; V246-L289 HydrophobicContact CG1-CD1 3.61Å; V246-L289 HydrophobicContact CG1-CG 4.1Å; V246-F319 HydrophobicContact CB-CE2 4.36Å; V246-F319 HydrophobicContact CG1-CD2 3.96Å; V246-F319 HydrophobicContact CG1-CE2 3.86Å; V246-F319 HydrophobicContact CG2-CE2 4.48Å; V246-V323 HydrophobicContact CG2-CG2 3.72Å
247	C	83.7	Confident	67.6	Low	5 Å²	5	52.8 Å²	52.8	3%	0.034	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	109.5	179.3	-64.1	0	0	0	0	110.5	V131 E287 I288 L289	V131-C247 HydrophobicContact CG2-CB 4.14Å; V131-C247 WeakPolarHBondContact CG2-SG 3.41Å; V131-C247 CarbonylContact O-C 3.46Å; V131-C247 WeakPolarHBondContact O-CA 3.47Å; C247-E287 PolarHBondContact N-O 3.05Å; C247-I288 HydrophobicContact CB-CG1 4.27Å; C247-L289 PolarHBondContact O-N 2.94Å
248	K	82.9	Confident	65.9	Low	40 Å²	40	46.6 Å²	46.6	17%	0.174	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	114.3	171	-178.6	-176.9	-171.1	167.2	0	110.1	L62 E65 V131 C132 L289 A291 Y315	L62-K248 HydrophobicContact CD2-CB 4.39Å; L62-K248 HydrophobicContact CD2-CD 3.37Å; E65-K248 WeakPolarHBondContact OE1-CD 3.42Å; E65-K248 VanDerWaalsContact OE1-CE 3.27Å; E65-K248 WeakPolarHBondContact OE1-CE 3.41Å; E65-K248 IonicContact OE1-NZ 3.78Å; E65-K248 PolarHBondContact OE1-NZ 3.46Å; E65-K248 IonicContact OE2-NZ 2.84Å; V131-K248 PolarHBondContact O-N 3.32Å; C132-K248 WeakPolarHBondContact CA-O 3.33Å; C132-K248 HydrophobicContact CB-CB 3.9Å; C132-K248 HydrophobicContact CB-CD 4.31Å; C132-K248 HydrophobicContact CB-CG 4.42Å; K248-L289 WeakPolarHBondContact CA-O 3.43Å; K248-A291 HydrophobicContact CD-CB 4.2Å; K248-A291 HydrophobicContact CG-CB 3.63Å; K248-Y315 HydrophobicContact CG-CE2 4.38Å; K248-Y315 WeakPolarHBondContact CG-OH 3.3Å
249	K	76.8	Confident	63.9	Low	56 Å²	56	45.2 Å²	45.2	24%	0.243	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135	178.3	-173.2	171	-178.2	169.6	0	111.6	I288 L289 M290 A291	K249-I288 HydrophobicContact CB-CG2 4.5Å; K249-L289 PolarHBondContact N-O 3.13Å; K249-M290 HydrophobicContact CB-CE 3.98Å; K249-M290 HydrophobicContact CB-SD 3.88Å; K249-M290 HydrophobicContact CD-CE 3.93Å; K249-M290 HydrophobicContact CD-SD 4.15Å; K249-M290 HydrophobicContact CG-CE 3.8Å; K249-M290 HydrophobicContact CG-SD 4.23Å; K249-M290 WeakPolarHBondContact O-CA 3.29Å; K249-A291 PolarHBondContact O-N 3.33Å
250	G	66.1	Low	61.8	Low	27 Å²	27	53 Å²	53	28%	0.278	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	136.7	179.5	0	0	0	0	0	113.9	A291	G250-A291 CarbonylContact C-O 3.6Å; G250-A291 WeakPolarHBondContact CA-O 3.31Å
251	I	59	Low	59.8	Low	8 Å²	8	58.5 Å²	58.5	4%	0.041	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	138.4	165.4	-62.4	-172.5	0	0	0	110	Q255 F256 L259 M290 A291 L293	I251-Q255 HydrophobicContact CG2-CB 3.68Å; I251-F256 HydrophobicContact CB-CD2 3.98Å; I251-F256 HydrophobicContact CB-CE2 3.72Å; I251-F256 HydrophobicContact CD1-CE2 4.14Å; I251-F256 HydrophobicContact CD1-CZ 4.36Å; I251-F256 HydrophobicContact CG1-CE2 4.34Å; I251-F256 HydrophobicContact CG2-CD2 3.74Å; I251-F256 HydrophobicContact CG2-CE2 4Å; I251-L259 HydrophobicContact CD1-CD1 3.87Å; I251-M290 HydrophobicContact CD1-CB 3.35Å; I251-M290 HydrophobicContact CD1-CE 3.67Å; I251-M290 HydrophobicContact CD1-CG 3.78Å; I251-M290 HydrophobicContact CG1-CB 3.81Å; I251-M290 HydrophobicContact CG1-CE 3.19Å; I251-M290 HydrophobicContact CG1-CG 4.29Å; I251-A291 PolarHBondContact N-O 3.38Å; I251-L293 WeakPolarHBondContact O-CG 3.14Å; I251-L293 PolarHBondContact O-N 2.9Å
252	A	46.5	Very low	57.3	Low	36 Å²	36	58.3 Å²	58.3	30%	0.298	32%	0.32	S	S	.	.			trans	-68	128.6	166.9	0	0	0	0	0	111	T254 Q255 L293	A252-T254 PolarHBondContact O-N 2.67Å; A252-Q255 WeakPolarHBondContact O-CB 2.93Å; A252-Q255 PolarHBondContact O-N 3.33Å; A252-L293 HydrophobicContact CB-CD1 4.47Å
253	V	40.3	Very low	54.4	Low	55 Å²	55	65.9 Å²	65.9	33%	0.333	36%	0.358	S	S	.	.	H	α-helix	trans	-51.3	-30.7	-173.3	178	0	0	0	0	113.7	Q255 F256 L296 L303	V253-Q255 VanDerWaalsContact C-N 3.26Å; V253-Q255 PolarHBondContact O-N 2.75Å; V253-F256 PolarHBondContact O-N 3.23Å; V253-F256 VanDerWaalsContact O-N 3.14Å; V253-L296 HydrophobicContact CB-CD1 4.44Å; V253-L296 HydrophobicContact CG2-CD1 4.12Å; V253-L303 HydrophobicContact CG1-CD1 4.09Å
254	T	37.2	Very low	51.3	Low	120 Å²	120	68.8 Å²	68.8	74%	0.736	39%	0.387	S	S	*	.	H	α-helix	trans	-60.8	-29.8	175.3	45.6	0	0	0	0	113.7	A252	A252-T254 PolarHBondContact O-N 2.67Å
255	Q	36.7	Very low	48.2	Very low	110 Å²	110	74.1 Å²	74.1	51%	0.514	42%	0.424	S	S	.	.	H	α-helix	trans	-79.6	-23.9	175.8	-78.1	177.5	-26.4	0	0	113.5	I251 A252 V253 A257 S258 L259	I251-Q255 HydrophobicContact CG2-CB 3.68Å; A252-Q255 WeakPolarHBondContact O-CB 2.93Å; A252-Q255 PolarHBondContact O-N 3.33Å; V253-Q255 VanDerWaalsContact C-N 3.26Å; V253-Q255 PolarHBondContact O-N 2.75Å; Q255-A257 VanDerWaalsContact C-N 3.3Å; Q255-A257 PolarHBondContact O-N 3.33Å; Q255-S258 WeakPolarHBondContact CA-OG 3.02Å; Q255-S258 PolarHBondContact O-N 3.46Å; Q255-S258 PolarHBondContact O-OG 3.34Å; Q255-L259 PolarHBondContact O-N 2.84Å
256	F	34.2	Very low	45.4	Very low	38 Å²	38	80.4 Å²	80.4	17%	0.167	47%	0.466	C	S	.	.	H	α-helix	trans	-65	-36	176.3	-101.3	-77.9	0	0	0	111.9	I251 V253 S258 L259 P292	I251-F256 HydrophobicContact CB-CD2 3.98Å; I251-F256 HydrophobicContact CB-CE2 3.72Å; I251-F256 HydrophobicContact CD1-CE2 4.14Å; I251-F256 HydrophobicContact CD1-CZ 4.36Å; I251-F256 HydrophobicContact CG1-CE2 4.34Å; I251-F256 HydrophobicContact CG2-CD2 3.74Å; I251-F256 HydrophobicContact CG2-CE2 4Å; V253-F256 PolarHBondContact O-N 3.23Å; V253-F256 VanDerWaalsContact O-N 3.14Å; F256-S258 VanDerWaalsContact C-N 3.27Å; F256-S258 PolarHBondContact O-N 2.94Å; F256-L259 PolarHBondContact O-N 3.46Å; F256-P292 HydrophobicContact CE2-CB 4.3Å
257	A	35.9	Very low	42.4	Very low	73 Å²	73	86.3 Å²	86.3	60%	0.603	51%	0.506	S	S	*	.	H	α-helix	trans	-62.3	-34.5	175.3	0	0	0	0	0	112.3	Q255	Q255-A257 VanDerWaalsContact C-N 3.3Å; Q255-A257 PolarHBondContact O-N 3.33Å
258	S	34.6	Very low	39.6	Very low	66 Å²	66	94.2 Å²	94.2	46%	0.462	54%	0.542	S	S	.	.	H	α-helix	trans	-80.9	-28.4	177.5	51.4	0	0	0	0	114.2	Q255 F256 H260 Q261	Q255-S258 WeakPolarHBondContact CA-OG 3.02Å; Q255-S258 PolarHBondContact O-N 3.46Å; Q255-S258 PolarHBondContact O-OG 3.34Å; F256-S258 VanDerWaalsContact C-N 3.27Å; F256-S258 PolarHBondContact O-N 2.94Å; S258-H260 VanDerWaalsContact C-N 3.35Å; S258-H260 PolarHBondContact O-N 2.92Å; S258-Q261 PolarHBondContact O-N 3.09Å
259	L	30.8	Very low	36.8	Very low	87 Å²	87	104.4 Å²	104.4	46%	0.455	58%	0.579	S	S	.	*	H	α-helix	trans	-72.1	-26.6	-178	-86	158.8	0	0	0	113.3	I251 Q255 F256 Q261 N262	I251-L259 HydrophobicContact CD1-CD1 3.87Å; Q255-L259 PolarHBondContact O-N 2.84Å; F256-L259 PolarHBondContact O-N 3.46Å; L259-Q261 PolarHBondContact O-N 2.9Å; L259-N262 PolarHBondContact O-N 3.37Å
260	H	33.9	Very low	34.4	Very low	166 Å²	166	106.9 Å²	106.9	77%	0.769	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-7	170.8	-85.6	-64.6	0	0	0	114	S258	S258-H260 VanDerWaalsContact C-N 3.35Å; S258-H260 PolarHBondContact O-N 2.92Å
261	Q	33.9	Very low	32.6	Very low	168 Å²	168	109.9 Å²	109.9	79%	0.785	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	-12.2	177	-64.4	-172.7	8.4	0	0	114.6	S258 L259	S258-Q261 PolarHBondContact O-N 3.09Å; L259-Q261 PolarHBondContact O-N 2.9Å
262	N	29.2	Very low	31.3	Very low	123 Å²	123	112.9 Å²	112.9	66%	0.658	63%	0.631	S	S	*	*			trans	-130.8	72.3	-173	-83.1	-12.4	0	0	0	112.4	L259 G264	L259-N262 PolarHBondContact O-N 3.37Å; N262-G264 PolarHBondContact O-N 3.19Å
263	E	26.9	Very low	30.8	Very low	206 Å²	206	112.7 Å²	112.7	96%	0.963	63%	0.626	S	S	*	*			trans	-73.9	77.4	157.2	-70.8	-169.8	164.6	0	0	109
264	G	24.8	Very low	30.6	Very low	60 Å²	60	112.3 Å²	112.3	62%	0.619	63%	0.633	S	S	*	*			trans	171.2	72.8	179.6	0	0	0	0	0	115.9	N262	N262-G264 PolarHBondContact O-N 3.19Å
265	S	24.7	Very low	30.5	Very low	112 Å²	112	110.3 Å²	110.3	78%	0.783	63%	0.625	S	S	*	*			trans	171.4	111.3	145.4	41.3	0	0	0	0	110.6
266	P	28.6	Very low	30.5	Very low	133 Å²	133	114.6 Å²	114.6	86%	0.864	65%	0.645	S	S	*	*			trans	-97.9	86.4	173.1	33.7	-24.6	0	0	0	109.2
267	C	24.2	Very low	30.9	Very low	124 Å²	124	117.4 Å²	117.4	84%	0.838	66%	0.658	S	S	*	*			trans	-168.2	62.8	167.1	-136.5	0	0	0	0	113.9
268	E	23.8	Very low	31.5	Very low	170 Å²	170	115.2 Å²	115.2	79%	0.794	64%	0.638	S	S	*	*			trans	-120	117.7	158.1	-77.8	-170.3	166.3	0	0	109.2	L270	E268-L270 PolarHBondContact O-N 3.04Å
269	R	24	Very low	32.3	Very low	255 Å²	255	116.7 Å²	116.7	96%	0.962	65%	0.649	S	S	*	*			trans	-61.1	74.8	177.4	-74.5	178.6	-91.8	-171.8	-7.4	110
270	L	27.7	Very low	33.3	Very low	107 Å²	107	112.7 Å²	112.7	56%	0.56	63%	0.628	S	S	*	*			trans	-89.6	108	172.3	-70.7	168.8	0	0	0	107	E268	E268-L270 PolarHBondContact O-N 3.04Å
271	S	28.8	Very low	34.5	Very low	91 Å²	91	105.6 Å²	105.6	64%	0.636	60%	0.596	S	S	*	*			trans	-49.5	124.3	175.7	48.2	0	0	0	0	109.7
272	P	31.8	Very low	35.7	Very low	70 Å²	70	105.4 Å²	105.4	46%	0.455	60%	0.599	S	S	.	*			trans	-59.7	141.9	170.5	26.4	-30.8	0	0	0	108	G274	P272-G274 PolarHBondContact O-N 3.22Å
273	V	35.3	Very low	37.5	Very low	32 Å²	32	101.3 Å²	101.3	19%	0.194	58%	0.583	C	S	.	*	S	Bend	trans	9	103.3	163.7	-175.4	0	0	0	0	113.7
274	G	36.7	Very low	39.7	Very low	47 Å²	47	92 Å²	92	49%	0.485	54%	0.54	S	S	.	.	S	Bend	trans	56.6	99.2	168.4	0	0	0	0	0	116.5	P272	P272-G274 PolarHBondContact O-N 3.22Å
275	S	35.1	Very low	42.4	Very low	79 Å²	79	91.3 Å²	91.3	55%	0.552	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.8	94.5	147.1	56.4	0	0	0	0	118.5	H277	S275-H277 WeakPolarHBondContact O-CB 3.37Å; S275-H277 PolarHBondContact O-CD2 2.69Å; S275-H277 PolarHBondContact O-N 3.05Å
276	Q	35.8	Very low	45	Very low	200 Å²	200	88.3 Å²	88.3	94%	0.935	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.9	8.9	145.6	-64.6	-168.1	-4.8	0	0	121.5
277	H	41.8	Very low	47.4	Very low	97 Å²	97	82.7 Å²	82.7	45%	0.449	46%	0.461	S	S	.	.			trans	-120.4	-9.2	-165.3	-68.7	-47	0	0	0	115.6	S275 S279	S275-H277 WeakPolarHBondContact O-CB 3.37Å; S275-H277 PolarHBondContact O-CD2 2.69Å; S275-H277 PolarHBondContact O-N 3.05Å; H277-S279 PolarHBondContact O-N 2.68Å; H277-S279 VanDerWaalsContact O-N 3.12Å
278	S	49.3	Very low	50	Low	27 Å²	27	81.2 Å²	81.2	19%	0.189	44%	0.444	C	S	.	.			trans	-89	75.6	176.5	46.7	0	0	0	0	111.2	G280 L281	S278-G280 PolarHBondContact O-N 2.8Å; S278-L281 PolarHBondContact O-N 2.98Å; S278-L281 VanDerWaalsContact OG-CD1 3.25Å; S278-L281 WeakPolarHBondContact OG-CD1 3.38Å
279	S	51.8	Low	52.5	Low	97 Å²	97	73.9 Å²	73.9	68%	0.678	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-30.7	173.1	51.9	0	0	0	0	113.1	H277	H277-S279 PolarHBondContact O-N 2.68Å; H277-S279 VanDerWaalsContact O-N 3.12Å
280	G	51.9	Low	54.9	Low	2 Å²	2	64.2 Å²	64.2	2%	0.021	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-28.7	177.7	0	0	0	0	0	115.7	S233 S278 L282 A283 C284	S233-G280 VanDerWaalsContact OG-CA 3.29Å; S233-G280 WeakPolarHBondContact OG-CA 3.16Å; S278-G280 PolarHBondContact O-N 2.8Å; G280-L282 VanDerWaalsContact C-N 3.29Å; G280-L282 PolarHBondContact O-N 3.31Å; G280-A283 PolarHBondContact O-N 3.35Å; G280-C284 PolarHBondContact O-N 3.1Å; G280-C284 PolarHBondContact O-SG 3.21Å; G280-C284 VanDerWaalsContact O-SG 3.36Å
281	L	57.6	Low	56.9	Low	18 Å²	18	59.2 Å²	59.2	9%	0.094	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-33.7	179.2	-83	-179.5	0	0	0	111.9	I229 V245 S278 A283 C284 V286	I229-L281 HydrophobicContact CD1-CD2 3.87Å; I229-L281 HydrophobicContact CG2-CD2 4.08Å; I229-L281 HydrophobicContact CG2-CG 4.28Å; V245-L281 HydrophobicContact CG1-CD2 3.92Å; S278-L281 PolarHBondContact O-N 2.98Å; S278-L281 VanDerWaalsContact OG-CD1 3.25Å; S278-L281 WeakPolarHBondContact OG-CD1 3.38Å; L281-A283 PolarHBondContact O-N 2.77Å; L281-C284 PolarHBondContact O-N 3.36Å; L281-V286 HydrophobicContact CD2-CG2 4.31Å; L281-V286 WeakPolarHBondContact O-CG2 3.37Å
282	L	60.3	Low	58.6	Low	164 Å²	164	55.8 Å²	55.8	86%	0.859	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-21.7	178.2	-69.1	170.1	0	0	0	112.9	G280	G280-L282 VanDerWaalsContact C-N 3.29Å; G280-L282 PolarHBondContact O-N 3.31Å
283	A	67.6	Low	59.7	Low	37 Å²	37	55.9 Å²	55.9	31%	0.306	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-32.8	179.8	0	0	0	0	0	112	I239 S240 G280 L281	I239-A283 HydrophobicContact CG2-CB 3.47Å; I239-A283 VanDerWaalsContact CG2-CB 3.47Å; I239-A283 WeakPolarHBondContact CG2-O 3.32Å; S240-A283 WeakPolarHBondContact CB-O 3.46Å; S240-A283 PolarHBondContact N-O 3.27Å; G280-A283 PolarHBondContact O-N 3.35Å; L281-A283 PolarHBondContact O-N 2.77Å
284	C	72.9	Confident	60.6	Low	10 Å²	10	58.6 Å²	58.6	7%	0.068	34%	0.341	C	S	.	.	S	Bend	trans	-77.8	159.1	-176.7	-61.2	0	0	0	0	112.6	S243 V245 G280 L281 V286	S243-C284 WeakPolarHBondContact OG-CA 3.49Å; V245-C284 HydrophobicContact CG2-CB 3.73Å; G280-C284 PolarHBondContact O-N 3.1Å; G280-C284 PolarHBondContact O-SG 3.21Å; G280-C284 VanDerWaalsContact O-SG 3.36Å; L281-C284 PolarHBondContact O-N 3.36Å; C284-V286 HydrophobicContact CB-CG2 4.48Å; C284-V286 PolarHBondContact O-N 3.18Å
285	D	80.3	Confident	61	Low	46 Å²	46	63 Å²	63	25%	0.246	35%	0.349	C	S	.	.			trans	-79	116.1	167.1	-175.5	22.2	0	0	0	108.9	S240 S243 L244 V245 N326 K330	S240-D285 VanDerWaalsContact O-CB 3.3Å; S240-D285 WeakPolarHBondContact O-CB 3.41Å; S243-D285 WeakPolarHBondContact O-CB 3.33Å; S243-D285 PolarHBondContact OG-N 2.48Å; L244-D285 CarbonylContact C-O 3.59Å; L244-D285 WeakPolarHBondContact CA-O 3.2Å; V245-D285 PolarHBondContact N-O 3.05Å; D285-N326 PolarHBondContact OD2-ND2 3.05Å; D285-K330 WeakPolarHBondContact OD2-CE 2.96Å; D285-K330 IonicContact OD2-NZ 3.77Å; D285-K330 PolarHBondContact OD2-NZ 2.93Å
286	V	79.6	Confident	61.1	Low	48 Å²	48	62.8 Å²	62.8	29%	0.291	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.7	-172.1	-176.4	0	0	0	0	110.1	V245 L281 C284 I288	V245-V286 HydrophobicContact CB-CG2 4.31Å; V245-V286 CarbonylContact O-C 3.53Å; V245-V286 VanDerWaalsContact O-CA 3.31Å; V245-V286 WeakPolarHBondContact O-CA 3.47Å; L281-V286 HydrophobicContact CD2-CG2 4.31Å; L281-V286 WeakPolarHBondContact O-CG2 3.37Å; C284-V286 HydrophobicContact CB-CG2 4.48Å; C284-V286 PolarHBondContact O-N 3.18Å; V286-I288 HydrophobicContact CG1-CG1 4.29Å
287	E	80.2	Confident	61.3	Low	16 Å²	16	60.9 Å²	60.9	8%	0.075	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118	171.6	-72.4	-167.4	163.8	0	0	110.6	L244 V245 V246 C247 R322 N326	L244-E287 HydrophobicContact CD1-CB 4.38Å; L244-E287 HydrophobicContact CD1-CG 3.85Å; V245-E287 PolarHBondContact O-N 3.39Å; V246-E287 CarbonylContact C-O 3.53Å; V246-E287 WeakPolarHBondContact CA-O 3.29Å; C247-E287 PolarHBondContact N-O 3.05Å; E287-R322 VanDerWaalsContact CD-CG 3.45Å; E287-R322 WeakPolarHBondContact OE1-CG 3.36Å; E287-R322 IonicContact OE1-CZ 3.25Å; E287-R322 IonicContact OE1-NH1 3.89Å; E287-R322 PolarHBondContact OE1-NH1 3.01Å; E287-R322 WeakPolarHBondContact OE2-CB 3.48Å; E287-R322 WeakPolarHBondContact OE2-CG 3.49Å; E287-N326 PolarHBondContact OE1-ND2 3.36Å
288	I	76.8	Confident	61.2	Low	92 Å²	92	61.9 Å²	61.9	47%	0.472	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	117.7	177.5	-57.3	174	0	0	0	108.8	C247 K249 V286 M290	C247-I288 HydrophobicContact CB-CG1 4.27Å; K249-I288 HydrophobicContact CB-CG2 4.5Å; V286-I288 HydrophobicContact CG1-CG1 4.29Å; I288-M290 HydrophobicContact CG2-SD 4.15Å
289	L	77.6	Confident	60.7	Low	16 Å²	16	66.6 Å²	66.6	8%	0.084	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.7	178.2	-65	178.9	0	0	0	110.7	V246 C247 K248 K249 A291 Y315 F319	V246-L289 HydrophobicContact CG1-CD1 3.61Å; V246-L289 HydrophobicContact CG1-CG 4.1Å; C247-L289 PolarHBondContact O-N 2.94Å; K248-L289 WeakPolarHBondContact CA-O 3.43Å; K249-L289 PolarHBondContact N-O 3.13Å; L289-A291 PolarHBondContact O-N 3.46Å; L289-Y315 HydrophobicContact CB-CE2 3.77Å; L289-F319 HydrophobicContact CD1-CB 3.92Å; L289-F319 HydrophobicContact CD1-CD2 3.8Å; L289-F319 HydrophobicContact CD1-CG 4.28Å
290	M	73.5	Confident	60.1	Low	52 Å²	52	67.4 Å²	67.4	26%	0.256	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	116.2	-179.6	-57.4	-52.1	-64.2	0	0	111.4	K249 I251 I288 Y315 R318	K249-M290 HydrophobicContact CB-CE 3.98Å; K249-M290 HydrophobicContact CB-SD 3.88Å; K249-M290 HydrophobicContact CD-CE 3.93Å; K249-M290 HydrophobicContact CD-SD 4.15Å; K249-M290 HydrophobicContact CG-CE 3.8Å; K249-M290 HydrophobicContact CG-SD 4.23Å; K249-M290 WeakPolarHBondContact O-CA 3.29Å; I251-M290 HydrophobicContact CD1-CB 3.35Å; I251-M290 HydrophobicContact CD1-CE 3.67Å; I251-M290 HydrophobicContact CD1-CG 3.78Å; I251-M290 HydrophobicContact CG1-CB 3.81Å; I251-M290 HydrophobicContact CG1-CE 3.19Å; I251-M290 HydrophobicContact CG1-CG 4.29Å; I288-M290 HydrophobicContact CG2-SD 4.15Å; M290-Y315 WeakPolarHBondContact O-CD2 3.28Å; M290-R318 PolarHBondContact O-NH1 3.04Å; M290-R318 PolarHBondContact O-NH2 3.37Å
291	A	70.7	Confident	59.7	Low	2 Å²	2	75.4 Å²	75.4	2%	0.017	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	149.8	179.8	0	0	0	0	0	111.8	K248 K249 G250 I251 L289 Y315	K248-A291 HydrophobicContact CD-CB 4.2Å; K248-A291 HydrophobicContact CG-CB 3.63Å; K249-A291 PolarHBondContact O-N 3.33Å; G250-A291 CarbonylContact C-O 3.6Å; G250-A291 WeakPolarHBondContact CA-O 3.31Å; I251-A291 PolarHBondContact N-O 3.38Å; L289-A291 PolarHBondContact O-N 3.46Å; A291-Y315 HydrophobicContact CB-CD1 4.34Å; A291-Y315 HydrophobicContact CB-CD2 3.63Å; A291-Y315 HydrophobicContact CB-CE1 4.36Å; A291-Y315 HydrophobicContact CB-CE2 3.63Å; A291-Y315 HydrophobicContact CB-CG 3.99Å
292	P	63.5	Low	59.2	Low	20 Å²	20	79 Å²	79	13%	0.13	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	137.1	168.3	26.5	-32.5	0	0	0	110.8	F256	F256-P292 HydrophobicContact CE2-CB 4.3Å
293	L	56	Low	58.5	Low	71 Å²	71	74.7 Å²	74.7	37%	0.372	41%	0.411	S	S	.	.			trans	-65.4	129.4	175.8	-80.4	164.2	0	0	0	111.2	I251 A252 H295	I251-L293 WeakPolarHBondContact O-CG 3.14Å; I251-L293 PolarHBondContact O-N 2.9Å; A252-L293 HydrophobicContact CB-CD1 4.47Å; L293-H295 VanDerWaalsContact C-N 3.33Å; L293-H295 PolarHBondContact O-N 3.34Å
294	P	53.3	Low	57.7	Low	90 Å²	90	75.9 Å²	75.9	58%	0.584	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-24.5	177.2	19.8	-24.8	0	0	0	113.8
295	H	44.9	Very low	56.9	Low	140 Å²	140	81.1 Å²	81.1	65%	0.648	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	15.4	-162.1	-79.1	58.2	0	0	0	116.9	L293 Q297	L293-H295 VanDerWaalsContact C-N 3.33Å; L293-H295 PolarHBondContact O-N 3.34Å; H295-Q297 PolarHBondContact O-N 3.38Å
296	L	38	Very low	55.8	Low	74 Å²	74	83.4 Å²	83.4	39%	0.387	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	60.2	160.5	-78.1	168.3	0	0	0	109.9	V253 L299	V253-L296 HydrophobicContact CB-CD1 4.44Å; V253-L296 HydrophobicContact CG2-CD1 4.12Å; L296-L299 HydrophobicContact CD2-CB 4.3Å
297	Q	39.5	Very low	54.7	Low	159 Å²	159	83.8 Å²	83.8	74%	0.743	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-18.2	163.1	-75.8	-175.3	-10.5	0	0	111.4	H295	H295-Q297 PolarHBondContact O-N 3.38Å
298	T	40.4	Very low	53.7	Low	118 Å²	118	87.7 Å²	87.7	72%	0.724	48%	0.479	S	S	*	.	S	Bend	trans	-101.4	-8.6	-167.4	49.4	0	0	0	0	115.9
299	L	37.9	Very low	53.1	Low	126 Å²	126	89.3 Å²	89.3	66%	0.66	48%	0.484	S	S	*	.	S	Bend	trans	-128.9	0.6	-169.1	-81.4	173.9	0	0	0	118.9	L296	L296-L299 HydrophobicContact CD2-CB 4.3Å
300	N	39.7	Very low	52.6	Low	115 Å²	115	91.8 Å²	91.8	62%	0.615	50%	0.503	S	S	*	.			trans	-171.5	104	163.6	-96.8	-30.4	0	0	0	111.6	S302	N300-S302 WeakPolarHBondContact CB-OG 3.38Å; N300-S302 PolarHBondContact O-N 3.47Å
301	D	43.1	Very low	52.7	Low	170 Å²	170	90.9 Å²	90.9	91%	0.909	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	13.9	167.5	-83.2	-31.7	0	0	0	113.9
302	S	47.6	Very low	53.1	Low	92 Å²	92	93.3 Å²	93.3	64%	0.643	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-2.7	-174.8	48.6	0	0	0	0	114.8	N300	N300-S302 WeakPolarHBondContact CB-OG 3.38Å; N300-S302 PolarHBondContact O-N 3.47Å
303	L	46.4	Very low	54.1	Low	75 Å²	75	96.4 Å²	96.4	39%	0.393	53%	0.53	S	S	.	.	S	Bend	trans	-92.1	112.6	173.3	-84.1	150.2	0	0	0	110.6	V253 T307	V253-L303 HydrophobicContact CG1-CD1 4.09Å; L303-T307 WeakPolarHBondContact CD2-OG1 3.4Å
304	S	49.6	Very low	55.5	Low	62 Å²	62	95.6 Å²	95.6	43%	0.434	53%	0.53	S	S	.	.			trans	-55	140.4	176.5	57.2	0	0	0	0	111.4	T306 T307	S304-T306 PolarHBondContact O-N 3.2Å; S304-T306 PolarHBondContact OG-OG1 2.72Å; S304-T307 PolarHBondContact O-N 2.77Å; S304-T307 PolarHBondContact O-OG1 2.78Å
305	N	56.2	Low	57.1	Low	120 Å²	120	91.3 Å²	91.3	64%	0.642	50%	0.502	S	S	*	.	H	α-helix	trans	-49.3	-29.4	177.2	-73.7	-18.4	0	0	0	113.2	K308 Q309	N305-K308 PolarHBondContact O-N 3.27Å; N305-Q309 WeakPolarHBondContact O-CG 3.39Å; N305-Q309 PolarHBondContact O-N 3.4Å; N305-Q309 VanDerWaalsContact O-N 3.08Å
306	T	57.1	Low	59.3	Low	94 Å²	94	86 Å²	86	58%	0.577	48%	0.478	S	S	*	.	H	α-helix	trans	-62.6	-40	176.7	55.8	0	0	0	0	113.2	S304 S310	S304-T306 PolarHBondContact O-N 3.2Å; S304-T306 PolarHBondContact OG-OG1 2.72Å; T306-S310 PolarHBondContact O-N 2.99Å; T306-S310 PolarHBondContact O-OG 3.04Å
307	T	56.6	Low	61.8	Low	55 Å²	55	90.5 Å²	90.5	34%	0.337	49%	0.49	S	S	.	.	H	α-helix	trans	-70.5	-38.9	179.8	52.3	0	0	0	0	112.1	L303 S304 S310 S311	L303-T307 WeakPolarHBondContact CD2-OG1 3.4Å; S304-T307 PolarHBondContact O-N 2.77Å; S304-T307 PolarHBondContact O-OG1 2.78Å; T307-S310 WeakPolarHBondContact CA-OG 3.43Å; T307-S310 PolarHBondContact O-N 3.26Å; T307-S310 PolarHBondContact O-OG 2.98Å; T307-S311 PolarHBondContact O-N 2.8Å; T307-S311 VanDerWaalsContact O-N 3.09Å
308	K	60	Low	64.2	Low	98 Å²	98	87.1 Å²	87.1	43%	0.426	47%	0.471	S	S	.	.	H	α-helix	trans	-61.8	-48.8	174.4	-67.5	-178.3	-179.3	177.3	0	111	N305 S310 S311 L312	N305-K308 PolarHBondContact O-N 3.27Å; K308-S310 PolarHBondContact O-N 3.2Å; K308-S311 PolarHBondContact O-N 2.83Å; K308-S311 PolarHBondContact O-OG 3.21Å; K308-L312 PolarHBondContact O-N 3.17Å; K308-L312 VanDerWaalsContact O-N 3.15Å
309	Q	63.3	Low	66.7	Low	126 Å²	126	81.5 Å²	81.5	59%	0.589	44%	0.436	S	S	*	.	H	α-helix	trans	-59.9	-46.4	177	-74.2	175.3	-19.1	0	0	112	N305 S311 L312 D313	N305-Q309 WeakPolarHBondContact O-CG 3.39Å; N305-Q309 PolarHBondContact O-N 3.4Å; N305-Q309 VanDerWaalsContact O-N 3.08Å; Q309-S311 PolarHBondContact O-N 3.32Å; Q309-L312 PolarHBondContact O-N 3.02Å; Q309-D313 PolarHBondContact O-N 3.38Å
310	S	67.4	Low	69.4	Low	68 Å²	68	77.7 Å²	77.7	48%	0.476	41%	0.413	S	S	.	.	H	α-helix	trans	-61.8	-31	177.9	63.9	0	0	0	0	113.7	T306 T307 K308 S314	T306-S310 PolarHBondContact O-N 2.99Å; T306-S310 PolarHBondContact O-OG 3.04Å; T307-S310 WeakPolarHBondContact CA-OG 3.43Å; T307-S310 PolarHBondContact O-N 3.26Å; T307-S310 PolarHBondContact O-OG 2.98Å; K308-S310 PolarHBondContact O-N 3.2Å; S310-S314 WeakPolarHBondContact O-CB 3.26Å; S310-S314 PolarHBondContact O-N 2.98Å; S310-S314 VanDerWaalsContact O-N 3.11Å
311	S	75.2	Confident	71.9	Confident	33 Å²	33	79.8 Å²	79.8	23%	0.231	41%	0.414	C	S	.	.	H	α-helix	trans	-73.6	-38.2	178.9	74.5	0	0	0	0	112.3	T307 K308 Q309 Y315	T307-S311 PolarHBondContact O-N 2.8Å; T307-S311 VanDerWaalsContact O-N 3.09Å; K308-S311 PolarHBondContact O-N 2.83Å; K308-S311 PolarHBondContact O-OG 3.21Å; Q309-S311 PolarHBondContact O-N 3.32Å; S311-Y315 PolarHBondContact O-N 3.17Å; S311-Y315 VanDerWaalsContact O-N 3.12Å
312	L	80.1	Confident	74.2	Confident	53 Å²	53	78.4 Å²	78.4	28%	0.277	40%	0.396	S	S	.	.	H	α-helix	trans	-67	-46.6	174.4	-178.5	62.2	0	0	0	110.6	K308 Q309 S314 Y315 L316	K308-L312 PolarHBondContact O-N 3.17Å; K308-L312 VanDerWaalsContact O-N 3.15Å; Q309-L312 PolarHBondContact O-N 3.02Å; L312-S314 VanDerWaalsContact C-N 3.27Å; L312-S314 PolarHBondContact O-N 2.65Å; L312-Y315 HydrophobicContact CD1-CD1 4.33Å; L312-Y315 WeakPolarHBondContact O-CA 3.31Å; L312-Y315 WeakPolarHBondContact O-CB 3.41Å; L312-Y315 PolarHBondContact O-N 2.74Å; L312-L316 HydrophobicContact CD1-CD1 4.31Å; L312-L316 HydrophobicContact CD1-CG 4.24Å; L312-L316 HydrophobicContact CG-CD1 4.02Å; L312-L316 HydrophobicContact CG-CG 4.35Å; L312-L316 WeakPolarHBondContact O-CG 3.47Å; L312-L316 PolarHBondContact O-N 2.92Å
313	D	84	Confident	76.4	Confident	85 Å²	85	74 Å²	74	46%	0.455	37%	0.365	S	S	.	.	H	α-helix	trans	-58.2	-40.3	177	-72.1	-9.6	0	0	0	112	Q309 L316 R317	Q309-D313 PolarHBondContact O-N 3.38Å; D313-L316 PolarHBondContact O-N 3.37Å; D313-R317 WeakPolarHBondContact O-CB 3.12Å; D313-R317 VanDerWaalsContact O-CG 3.26Å; D313-R317 WeakPolarHBondContact O-CG 3.21Å; D313-R317 PolarHBondContact O-N 2.67Å
314	S	84.7	Confident	78.6	Confident	54 Å²	54	70.7 Å²	70.7	38%	0.378	35%	0.348	S	S	.	.	H	α-helix	trans	-65.1	-39.6	175.4	177.3	0	0	0	0	112.5	S310 L312 R318	S310-S314 WeakPolarHBondContact O-CB 3.26Å; S310-S314 PolarHBondContact O-N 2.98Å; S310-S314 VanDerWaalsContact O-N 3.11Å; L312-S314 VanDerWaalsContact C-N 3.27Å; L312-S314 PolarHBondContact O-N 2.65Å; S314-R318 WeakPolarHBondContact O-CG 3.29Å; S314-R318 PolarHBondContact O-N 2.76Å; S314-R318 PolarHBondContact O-NE 3.2Å
315	Y	88.4	Confident	80.7	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-65.1	-48.7	173.2	164.5	-98.9	0	0	0	111.8	E65 K248 L289 M290 A291 S311 L312 R317 R318 F319	E65-Y315 HydrophobicContact CG-CE1 4.09Å; E65-Y315 WeakPolarHBondContact OE1-CE1 3.47Å; E65-Y315 PolarHBondContact OE1-OH 3.36Å; K248-Y315 HydrophobicContact CG-CE2 4.38Å; K248-Y315 WeakPolarHBondContact CG-OH 3.3Å; L289-Y315 HydrophobicContact CB-CE2 3.77Å; M290-Y315 WeakPolarHBondContact O-CD2 3.28Å; A291-Y315 HydrophobicContact CB-CD1 4.34Å; A291-Y315 HydrophobicContact CB-CD2 3.63Å; A291-Y315 HydrophobicContact CB-CE1 4.36Å; A291-Y315 HydrophobicContact CB-CE2 3.63Å; A291-Y315 HydrophobicContact CB-CG 3.99Å; S311-Y315 PolarHBondContact O-N 3.17Å; S311-Y315 VanDerWaalsContact O-N 3.12Å; L312-Y315 HydrophobicContact CD1-CD1 4.33Å; L312-Y315 WeakPolarHBondContact O-CA 3.31Å; L312-Y315 WeakPolarHBondContact O-CB 3.41Å; L312-Y315 PolarHBondContact O-N 2.74Å; Y315-R317 VanDerWaalsContact C-N 3.34Å; Y315-R317 PolarHBondContact O-N 3Å; Y315-R318 WeakPolarHBondContact O-CA 3.42Å; Y315-R318 WeakPolarHBondContact O-CB 3.38Å; Y315-R318 PolarHBondContact O-N 3.18Å; Y315-R318 VanDerWaalsContact O-N 3.08Å; Y315-F319 PolarHBondContact O-N 3.1Å
316	L	89.5	Confident	82.4	Confident	29 Å²	29	65.6 Å²	65.6	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-38.8	-179.4	-71.6	178.2	0	0	0	111.9	D64 E65 L68 L312 D313 R318 F319 Y320	D64-L316 HydrophobicContact CB-CD1 4.13Å; D64-L316 HydrophobicContact CB-CD2 3.91Å; E65-L316 HydrophobicContact CG-CD2 4.33Å; L68-L316 HydrophobicContact CD2-CB 3.97Å; L68-L316 HydrophobicContact CD2-CD2 4.13Å; L68-L316 VanDerWaalsContact CD2-O 3.28Å; L68-L316 WeakPolarHBondContact CD2-O 3.38Å; L312-L316 HydrophobicContact CD1-CD1 4.31Å; L312-L316 HydrophobicContact CD1-CG 4.24Å; L312-L316 HydrophobicContact CG-CD1 4.02Å; L312-L316 HydrophobicContact CG-CG 4.35Å; L312-L316 WeakPolarHBondContact O-CG 3.47Å; L312-L316 PolarHBondContact O-N 2.92Å; D313-L316 PolarHBondContact O-N 3.37Å; L316-R318 PolarHBondContact O-N 3.07Å; L316-F319 WeakPolarHBondContact O-CB 3.34Å; L316-F319 PolarHBondContact O-N 3.03Å; L316-Y320 PolarHBondContact O-N 3.26Å
317	R	91.4	Very high	84.1	Confident	169 Å²	169	61.1 Å²	61.1	64%	0.638	30%	0.296	S	S	*	.	H	α-helix	trans	-60.6	-43.9	171.2	-75.7	176.2	-174.8	-169.5	2.9	112.1	D313 Y315 F319 Y320 Y321	D313-R317 WeakPolarHBondContact O-CB 3.12Å; D313-R317 VanDerWaalsContact O-CG 3.26Å; D313-R317 WeakPolarHBondContact O-CG 3.21Å; D313-R317 PolarHBondContact O-N 2.67Å; Y315-R317 VanDerWaalsContact C-N 3.34Å; Y315-R317 PolarHBondContact O-N 3Å; R317-F319 VanDerWaalsContact C-N 3.35Å; R317-Y320 PolarHBondContact O-N 3.15Å; R317-Y321 HydrophobicContact CB-CE2 4.42Å; R317-Y321 WeakPolarHBondContact O-CD2 3.45Å; R317-Y321 PolarHBondContact O-N 3.14Å
318	R	89.9	Confident	85.8	Confident	87 Å²	87	60.8 Å²	60.8	33%	0.328	29%	0.29	S	S	.	.	H	α-helix	trans	-62.7	-43.1	175.5	-76	-177.5	-71.1	139.9	2.4	111.4	M290 S314 Y315 L316 R322	M290-R318 PolarHBondContact O-NH1 3.04Å; M290-R318 PolarHBondContact O-NH2 3.37Å; S314-R318 WeakPolarHBondContact O-CG 3.29Å; S314-R318 PolarHBondContact O-N 2.76Å; S314-R318 PolarHBondContact O-NE 3.2Å; Y315-R318 WeakPolarHBondContact O-CA 3.42Å; Y315-R318 WeakPolarHBondContact O-CB 3.38Å; Y315-R318 PolarHBondContact O-N 3.18Å; Y315-R318 VanDerWaalsContact O-N 3.08Å; L316-R318 PolarHBondContact O-N 3.07Å; R318-R322 WeakPolarHBondContact O-CB 3.43Å; R318-R322 PolarHBondContact O-N 3.03Å
319	F	92.5	Very high	87.4	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-56	-52.5	173.2	178.2	-85.5	0	0	0	111.2	E65 L68 I73 V130 V246 L289 Y315 L316 R317 Y321 R322 V323	E65-F319 HydrophobicContact CB-CD2 4.42Å; E65-F319 HydrophobicContact CB-CE1 4.1Å; E65-F319 HydrophobicContact CB-CE2 3.94Å; E65-F319 HydrophobicContact CB-CZ 3.76Å; E65-F319 HydrophobicContact CG-CD2 4Å; E65-F319 HydrophobicContact CG-CE2 3.94Å; E65-F319 HydrophobicContact CG-CG 4.37Å; E65-F319 HydrophobicContact CG-CZ 4.25Å; L68-F319 HydrophobicContact CD2-CD1 3.74Å; L68-F319 HydrophobicContact CD2-CE1 4.46Å; L68-F319 HydrophobicContact CG-CD1 4.41Å; I73-F319 HydrophobicContact CD1-CD1 4.27Å; I73-F319 HydrophobicContact CD1-CE1 3.93Å; V130-F319 HydrophobicContact CG1-CE2 4.1Å; V130-F319 HydrophobicContact CG2-CE2 4.06Å; V130-F319 HydrophobicContact CG2-CZ 4.1Å; V246-F319 HydrophobicContact CB-CE2 4.36Å; V246-F319 HydrophobicContact CG1-CD2 3.96Å; V246-F319 HydrophobicContact CG1-CE2 3.86Å; V246-F319 HydrophobicContact CG2-CE2 4.48Å; L289-F319 HydrophobicContact CD1-CB 3.92Å; L289-F319 HydrophobicContact CD1-CD2 3.8Å; L289-F319 HydrophobicContact CD1-CG 4.28Å; Y315-F319 PolarHBondContact O-N 3.1Å; L316-F319 WeakPolarHBondContact O-CB 3.34Å; L316-F319 PolarHBondContact O-N 3.03Å; R317-F319 VanDerWaalsContact C-N 3.35Å; F319-Y321 PolarHBondContact O-N 3.04Å; F319-R322 PolarHBondContact O-N 3.34Å; F319-V323 HydrophobicContact CD1-CG2 4.32Å; F319-V323 HydrophobicContact CD2-CG2 4.1Å; F319-V323 HydrophobicContact CE1-CG2 4.14Å; F319-V323 HydrophobicContact CE2-CG2 3.9Å; F319-V323 HydrophobicContact CG-CG2 4.3Å; F319-V323 HydrophobicContact CZ-CG2 3.91Å; F319-V323 WeakPolarHBondContact O-CB 3.46Å; F319-V323 VanDerWaalsContact O-CG2 3.3Å; F319-V323 WeakPolarHBondContact O-CG2 3.37Å; F319-V323 PolarHBondContact O-N 3.27Å
320	Y	93.8	Very high	88.7	Confident	47 Å²	47	54.6 Å²	54.6	18%	0.184	27%	0.269	C	S	.	.	H	α-helix	trans	-51.9	-57.4	177.5	173.3	-91.5	0	0	0	112	L68 E72 I73 E76 L316 R317 R322 S324	L68-Y320 HydrophobicContact CD1-CD2 4.21Å; E72-Y320 HydrophobicContact CB-CD2 4.02Å; E72-Y320 HydrophobicContact CB-CE2 3.74Å; I73-Y320 HydrophobicContact CD1-CD2 4.34Å; I73-Y320 HydrophobicContact CG1-CD2 3.63Å; I73-Y320 HydrophobicContact CG1-CE2 4Å; E76-Y320 PolarHBondContact OE2-OH 3.02Å; L316-Y320 PolarHBondContact O-N 3.26Å; R317-Y320 PolarHBondContact O-N 3.15Å; Y320-R322 VanDerWaalsContact C-N 3.32Å; Y320-R322 PolarHBondContact O-N 2.73Å; Y320-S324 WeakPolarHBondContact O-CB 3.39Å; Y320-S324 PolarHBondContact O-N 2.92Å
321	Y	92.9	Very high	89.8	Confident	158 Å²	158	51.4 Å²	51.4	62%	0.62	25%	0.247	S	C	*	.	H	α-helix	trans	-64	-39.2	-174.3	-74.3	-60.9	0	0	0	112	R317 F319 A325	R317-Y321 HydrophobicContact CB-CE2 4.42Å; R317-Y321 WeakPolarHBondContact O-CD2 3.45Å; R317-Y321 PolarHBondContact O-N 3.14Å; F319-Y321 PolarHBondContact O-N 3.04Å; Y321-A325 WeakPolarHBondContact O-CB 3.3Å; Y321-A325 PolarHBondContact O-N 2.89Å
322	R	92	Very high	90.5	Very high	141 Å²	141	53.3 Å²	53.3	53%	0.532	25%	0.252	S	S	.	.	H	α-helix	trans	-73.6	-46.5	-176.3	-139.4	67.6	173.1	71.6	-10.4	112	E287 R318 F319 Y320 N326	E287-R322 VanDerWaalsContact CD-CG 3.45Å; E287-R322 WeakPolarHBondContact OE1-CG 3.36Å; E287-R322 IonicContact OE1-CZ 3.25Å; E287-R322 IonicContact OE1-NH1 3.89Å; E287-R322 PolarHBondContact OE1-NH1 3.01Å; E287-R322 WeakPolarHBondContact OE2-CB 3.48Å; E287-R322 WeakPolarHBondContact OE2-CG 3.49Å; R318-R322 WeakPolarHBondContact O-CB 3.43Å; R318-R322 PolarHBondContact O-N 3.03Å; F319-R322 PolarHBondContact O-N 3.34Å; Y320-R322 VanDerWaalsContact C-N 3.32Å; Y320-R322 PolarHBondContact O-N 2.73Å; R322-N326 VanDerWaalsContact O-CB 3.23Å; R322-N326 WeakPolarHBondContact O-CB 3.08Å; R322-N326 PolarHBondContact O-N 3.38Å
323	V	93.1	Very high	90.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.8	-47.4	178.3	175.8	0	0	0	0	111.2	F69 I73 M128 L244 V246 F319 M327	F69-V323 HydrophobicContact CD2-CG1 4.43Å; I73-V323 HydrophobicContact CD1-CB 3.96Å; I73-V323 HydrophobicContact CD1-CG1 3.87Å; I73-V323 HydrophobicContact CG2-CG1 4.4Å; M128-V323 HydrophobicContact CE-CG1 4.04Å; L244-V323 HydrophobicContact CD2-CB 4.5Å; L244-V323 HydrophobicContact CD2-CG1 4.2Å; L244-V323 HydrophobicContact CD2-CG2 4.38Å; V246-V323 HydrophobicContact CG2-CG2 3.72Å; F319-V323 HydrophobicContact CD1-CG2 4.32Å; F319-V323 HydrophobicContact CD2-CG2 4.1Å; F319-V323 HydrophobicContact CE1-CG2 4.14Å; F319-V323 HydrophobicContact CE2-CG2 3.9Å; F319-V323 HydrophobicContact CG-CG2 4.3Å; F319-V323 HydrophobicContact CZ-CG2 3.91Å; F319-V323 WeakPolarHBondContact O-CB 3.46Å; F319-V323 VanDerWaalsContact O-CG2 3.3Å; F319-V323 WeakPolarHBondContact O-CG2 3.37Å; F319-V323 PolarHBondContact O-N 3.27Å; V323-M327 HydrophobicContact CG1-CG 4.41Å; V323-M327 VanDerWaalsContact O-CB 3.27Å; V323-M327 WeakPolarHBondContact O-CB 3.46Å; V323-M327 WeakPolarHBondContact O-CG 3.43Å; V323-M327 PolarHBondContact O-N 2.91Å
324	S	93.3	Very high	90.8	Very high	6 Å²	6	50.9 Å²	50.9	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-50	178.8	174.8	0	0	0	0	111.4	E76 Y320 N326 M327 K328	E76-S324 PolarHBondContact OE2-OG 3.34Å; Y320-S324 WeakPolarHBondContact O-CB 3.39Å; Y320-S324 PolarHBondContact O-N 2.92Å; S324-N326 PolarHBondContact O-N 3.25Å; S324-M327 PolarHBondContact O-N 3.38Å; S324-K328 WeakPolarHBondContact O-CB 3.25Å; S324-K328 VanDerWaalsContact O-CG 3.28Å; S324-K328 WeakPolarHBondContact O-CG 3.04Å; S324-K328 PolarHBondContact O-N 3.5Å
325	A	93	Very high	90.6	Very high	51 Å²	51	48.3 Å²	48.3	42%	0.421	23%	0.233	S	C	.	.	H	α-helix	trans	-62.3	-46.2	-179.2	0	0	0	0	0	112	Y321 K328 C329	Y321-A325 WeakPolarHBondContact O-CB 3.3Å; Y321-A325 PolarHBondContact O-N 2.89Å; A325-K328 PolarHBondContact O-N 2.9Å; A325-C329 WeakPolarHBondContact O-CB 3.47Å; A325-C329 PolarHBondContact O-N 2.99Å; A325-C329 PolarHBondContact O-SG 3.47Å
326	N	92.5	Very high	90	Very high	23 Å²	23	52 Å²	52	12%	0.123	25%	0.253	C	S	.	.	H	α-helix	trans	-66.2	-44.8	-178.8	-162.6	-16.8	0	0	0	111	L244 D285 E287 R322 S324 K328 C329 K330	L244-N326 WeakPolarHBondContact CD1-ND2 3.44Å; L244-N326 HydrophobicContact CD2-CB 4.42Å; D285-N326 PolarHBondContact OD2-ND2 3.05Å; E287-N326 PolarHBondContact OE1-ND2 3.36Å; R322-N326 VanDerWaalsContact O-CB 3.23Å; R322-N326 WeakPolarHBondContact O-CB 3.08Å; R322-N326 PolarHBondContact O-N 3.38Å; S324-N326 PolarHBondContact O-N 3.25Å; N326-K328 PolarHBondContact O-N 3.4Å; N326-C329 PolarHBondContact O-N 2.88Å; N326-K330 WeakPolarHBondContact O-CG 3.27Å; N326-K330 PolarHBondContact O-N 3.46Å; N326-K330 WeakPolarHBondContact OD1-CE 3.38Å; N326-K330 PolarHBondContact OD1-NZ 3.43Å
327	M	93.5	Very high	88.9	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.1	-42.7	176.9	-77.1	-58.4	-168.7	0	0	113	L77 P125 M128 L244 V323 S324 C329 K330 I331	L77-M327 HydrophobicContact CD1-CB 3.77Å; L77-M327 HydrophobicContact CD1-CG 4.2Å; L77-M327 HydrophobicContact CD2-CB 3.74Å; L77-M327 HydrophobicContact CG-CB 4.43Å; P125-M327 HydrophobicContact CB-SD 4.15Å; P125-M327 HydrophobicContact CG-SD 4.15Å; M128-M327 HydrophobicContact CB-CE 3.44Å; M128-M327 VanDerWaalsContact CB-CE 3.44Å; M128-M327 HydrophobicContact CG-CE 3.28Å; L244-M327 HydrophobicContact CB-CE 3.59Å; L244-M327 HydrophobicContact CB-SD 4.41Å; L244-M327 HydrophobicContact CD2-CE 3.92Å; L244-M327 HydrophobicContact CD2-CG 4.11Å; L244-M327 HydrophobicContact CD2-SD 4.42Å; L244-M327 HydrophobicContact CG-CE 4.37Å; V323-M327 HydrophobicContact CG1-CG 4.41Å; V323-M327 VanDerWaalsContact O-CB 3.27Å; V323-M327 WeakPolarHBondContact O-CB 3.46Å; V323-M327 WeakPolarHBondContact O-CG 3.43Å; V323-M327 PolarHBondContact O-N 2.91Å; S324-M327 PolarHBondContact O-N 3.38Å; M327-C329 PolarHBondContact O-N 2.98Å; M327-K330 PolarHBondContact O-N 2.92Å; M327-K330 HydrophobicContact SD-CD 4.47Å; M327-I331 WeakPolarHBondContact O-CB 3.36Å; M327-I331 WeakPolarHBondContact O-CG1 3.28Å; M327-I331 PolarHBondContact O-N 2.94Å
328	K	92.3	Very high	87.5	Confident	49 Å²	49	50.7 Å²	50.7	21%	0.213	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-46.7	173.7	-76.2	-178.8	178.4	-171.1	0	112	E76 L77 S324 A325 N326 K330 I331 Q332	E76-K328 VanDerWaalsContact CG-CE 3.4Å; E76-K328 WeakPolarHBondContact OE1-CE 3.38Å; E76-K328 IonicContact OE1-NZ 3.56Å; E76-K328 PolarHBondContact OE1-NZ 3.01Å; E76-K328 IonicContact OE2-NZ 2.78Å; L77-K328 HydrophobicContact CD2-CG 3.67Å; S324-K328 WeakPolarHBondContact O-CB 3.25Å; S324-K328 VanDerWaalsContact O-CG 3.28Å; S324-K328 WeakPolarHBondContact O-CG 3.04Å; S324-K328 PolarHBondContact O-N 3.5Å; A325-K328 PolarHBondContact O-N 2.9Å; N326-K328 PolarHBondContact O-N 3.4Å; K328-K330 VanDerWaalsContact C-N 3.32Å; K328-K330 PolarHBondContact O-N 3.11Å; K328-I331 PolarHBondContact O-N 3.46Å; K328-Q332 VanDerWaalsContact O-CB 3.32Å; K328-Q332 WeakPolarHBondContact O-CB 3.41Å; K328-Q332 WeakPolarHBondContact O-CG 3.47Å; K328-Q332 PolarHBondContact O-N 2.93Å
329	C	92.1	Very high	85.9	Confident	74 Å²	74	51.8 Å²	51.8	50%	0.5	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-40.9	177.7	-73	0	0	0	0	111.9	A325 N326 M327 A333	A325-C329 WeakPolarHBondContact O-CB 3.47Å; A325-C329 PolarHBondContact O-N 2.99Å; A325-C329 PolarHBondContact O-SG 3.47Å; N326-C329 PolarHBondContact O-N 2.88Å; M327-C329 PolarHBondContact O-N 2.98Å; C329-A333 WeakPolarHBondContact O-CB 3.49Å; C329-A333 PolarHBondContact O-N 2.93Å
330	K	91	Very high	84	Confident	20 Å²	20	57 Å²	57	9%	0.087	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-41.5	176	-69.4	-177.8	-163.9	-56	0	112.4	P125 S240 Q241 S243 D285 N326 M327 K328 A334	P125-K330 HydrophobicContact CB-CB 4.28Å; P125-K330 HydrophobicContact CB-CD 4.42Å; P125-K330 HydrophobicContact CG-CB 4.16Å; S240-K330 PolarHBondContact O-NZ 3.21Å; Q241-K330 WeakPolarHBondContact O-CD 3.41Å; Q241-K330 WeakPolarHBondContact O-CG 3.47Å; S243-K330 WeakPolarHBondContact O-CE 3.45Å; S243-K330 PolarHBondContact O-NZ 3.43Å; D285-K330 WeakPolarHBondContact OD2-CE 2.96Å; D285-K330 IonicContact OD2-NZ 3.77Å; D285-K330 PolarHBondContact OD2-NZ 2.93Å; N326-K330 WeakPolarHBondContact O-CG 3.27Å; N326-K330 PolarHBondContact O-N 3.46Å; N326-K330 WeakPolarHBondContact OD1-CE 3.38Å; N326-K330 PolarHBondContact OD1-NZ 3.43Å; M327-K330 PolarHBondContact O-N 2.92Å; M327-K330 HydrophobicContact SD-CD 4.47Å; K328-K330 VanDerWaalsContact C-N 3.32Å; K328-K330 PolarHBondContact O-N 3.11Å; K330-A334 WeakPolarHBondContact O-CB 3.45Å; K330-A334 PolarHBondContact O-N 3.18Å
331	I	90.3	Very high	82	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59.8	-60.4	174	-71.1	166.4	0	0	0	108.2	L77 T80 P125 M327 K328 A333 A334 L335	L77-I331 HydrophobicContact CB-CD1 4.19Å; L77-I331 HydrophobicContact CD2-CD1 4Å; L77-I331 HydrophobicContact CG-CD1 4.48Å; T80-I331 HydrophobicContact CG2-CG2 4.22Å; P125-I331 HydrophobicContact CG-CG1 3.73Å; M327-I331 WeakPolarHBondContact O-CB 3.36Å; M327-I331 WeakPolarHBondContact O-CG1 3.28Å; M327-I331 PolarHBondContact O-N 2.94Å; K328-I331 PolarHBondContact O-N 3.46Å; I331-A333 VanDerWaalsContact C-N 3.34Å; I331-A333 PolarHBondContact O-N 3.3Å; I331-A334 CarbonylContact O-C 3.55Å; I331-A334 WeakPolarHBondContact O-CA 3.44Å; I331-A334 WeakPolarHBondContact O-CB 3.32Å; I331-A334 PolarHBondContact O-N 3.19Å; I331-L335 HydrophobicContact CG2-CD1 3.56Å; I331-L335 HydrophobicContact CG2-CD2 4.07Å; I331-L335 HydrophobicContact CG2-CG 3.67Å; I331-L335 WeakPolarHBondContact O-CB 3.44Å; I331-L335 WeakPolarHBondContact O-CD2 3.39Å; I331-L335 WeakPolarHBondContact O-CG 3.49Å; I331-L335 PolarHBondContact O-N 3.23Å
332	Q	89.6	Confident	80	Confident	73 Å²	73	58.8 Å²	58.8	34%	0.341	32%	0.319	S	S	.	.	H	α-helix	trans	-52.3	-48.4	179.5	-70.9	172.9	-27.2	0	0	112.1	T80 Y84 K328 A334 L335 D336	T80-Q332 HydrophobicContact CG2-CG 4.49Å; Y84-Q332 HydrophobicContact CE2-CG 4.13Å; K328-Q332 VanDerWaalsContact O-CB 3.32Å; K328-Q332 WeakPolarHBondContact O-CB 3.41Å; K328-Q332 WeakPolarHBondContact O-CG 3.47Å; K328-Q332 PolarHBondContact O-N 2.93Å; Q332-A334 VanDerWaalsContact C-N 3.29Å; Q332-A334 PolarHBondContact O-N 3.18Å; Q332-L335 CarbonylContact O-C 3.58Å; Q332-L335 PolarHBondContact O-N 2.9Å; Q332-D336 VanDerWaalsContact O-CB 3.25Å; Q332-D336 WeakPolarHBondContact O-CB 3.33Å; Q332-D336 PolarHBondContact O-N 2.98Å
333	A	86.8	Confident	78	Confident	58 Å²	58	60.5 Å²	60.5	48%	0.479	34%	0.339	S	S	.	.	H	α-helix	trans	-59.5	-38.7	177.6	0	0	0	0	0	112.9	C329 I331 L337	C329-A333 WeakPolarHBondContact O-CB 3.49Å; C329-A333 PolarHBondContact O-N 2.93Å; I331-A333 VanDerWaalsContact C-N 3.34Å; I331-A333 PolarHBondContact O-N 3.3Å; A333-L337 WeakPolarHBondContact O-CD1 3.49Å; A333-L337 WeakPolarHBondContact O-CG 3.35Å
334	A	84.1	Confident	76.4	Confident	29 Å²	29	64.9 Å²	64.9	24%	0.24	36%	0.359	C	S	.	.	H	α-helix	trans	-75.1	-28.1	175.8	0	0	0	0	0	112.9	K330 I331 Q332 R338	K330-A334 WeakPolarHBondContact O-CB 3.45Å; K330-A334 PolarHBondContact O-N 3.18Å; I331-A334 CarbonylContact O-C 3.55Å; I331-A334 WeakPolarHBondContact O-CA 3.44Å; I331-A334 WeakPolarHBondContact O-CB 3.32Å; I331-A334 PolarHBondContact O-N 3.19Å; Q332-A334 VanDerWaalsContact C-N 3.29Å; Q332-A334 PolarHBondContact O-N 3.18Å; A334-R338 PolarHBondContact O-NH1 3.45Å; A334-R338 VanDerWaalsContact O-NH1 3.14Å
335	L	79.9	Confident	74.8	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-90.9	-36	-175.3	-46.5	-153.6	0	0	0	113.7	V52 Y84 A86 I331 Q332 R338	V52-L335 HydrophobicContact CG2-CD2 4.27Å; Y84-L335 HydrophobicContact CD1-CB 3.66Å; Y84-L335 HydrophobicContact CD1-CD1 4.34Å; Y84-L335 HydrophobicContact CD2-CB 4.26Å; Y84-L335 HydrophobicContact CD2-CD1 3.69Å; Y84-L335 HydrophobicContact CD2-CG 4.4Å; Y84-L335 HydrophobicContact CE1-CB 4.04Å; Y84-L335 HydrophobicContact CG-CB 3.79Å; Y84-L335 HydrophobicContact CG-CD1 3.55Å; Y84-L335 HydrophobicContact CG-CG 4.21Å; A86-L335 HydrophobicContact CB-CD1 4.24Å; I331-L335 HydrophobicContact CG2-CD1 3.56Å; I331-L335 HydrophobicContact CG2-CD2 4.07Å; I331-L335 HydrophobicContact CG2-CG 3.67Å; I331-L335 WeakPolarHBondContact O-CB 3.44Å; I331-L335 WeakPolarHBondContact O-CD2 3.39Å; I331-L335 WeakPolarHBondContact O-CG 3.49Å; I331-L335 PolarHBondContact O-N 3.23Å; Q332-L335 CarbonylContact O-C 3.58Å; Q332-L335 PolarHBondContact O-N 2.9Å; L335-R338 VanDerWaalsContact CB-CZ 3.42Å; L335-R338 VanDerWaalsContact O-CB 3.23Å; L335-R338 WeakPolarHBondContact O-CB 2.9Å; L335-R338 WeakPolarHBondContact O-CG 3.4Å; L335-R338 PolarHBondContact O-N 2.96Å; L335-R338 PolarHBondContact O-NE 2.97Å
336	D	77.7	Confident	73.5	Confident	77 Å²	77	77.1 Å²	77.1	41%	0.412	41%	0.407	S	S	.	.	H	α-helix	trans	-68.6	-33.9	179.1	-70.6	-25.6	0	0	0	112.2	Y84 Q332 R338 H339	Y84-D336 WeakPolarHBondContact CE1-OD1 3.45Å; Y84-D336 VanDerWaalsContact CZ-OD1 3.29Å; Y84-D336 PolarHBondContact OH-OD1 3.19Å; Q332-D336 VanDerWaalsContact O-CB 3.25Å; Q332-D336 WeakPolarHBondContact O-CB 3.33Å; Q332-D336 PolarHBondContact O-N 2.98Å; D336-R338 PolarHBondContact O-N 3.19Å; D336-H339 PolarHBondContact O-N 3.22Å
337	L	65	Low	72.2	Confident	135 Å²	135	80.6 Å²	80.6	71%	0.707	43%	0.425	S	S	*	.	H	α-helix	trans	-55.6	-14.9	172.8	-76.6	170.1	0	0	0	112.7	A333	A333-L337 WeakPolarHBondContact O-CD1 3.49Å; A333-L337 WeakPolarHBondContact O-CG 3.35Å
338	R	62.9	Low	71	Confident	37 Å²	37	83.3 Å²	83.3	14%	0.14	44%	0.439	C	S	.	.	H	α-helix	trans	-93.2	-45.2	-177.3	-49.7	-171	-66.1	-121.8	13.8	112.9	G123 A334 L335 D336 S340 E341	G123-R338 PolarHBondContact O-NH1 2.99Å; G123-R338 VanDerWaalsContact O-NH1 3.11Å; A334-R338 PolarHBondContact O-NH1 3.45Å; A334-R338 VanDerWaalsContact O-NH1 3.14Å; L335-R338 VanDerWaalsContact CB-CZ 3.42Å; L335-R338 VanDerWaalsContact O-CB 3.23Å; L335-R338 WeakPolarHBondContact O-CB 2.9Å; L335-R338 WeakPolarHBondContact O-CG 3.4Å; L335-R338 PolarHBondContact O-N 2.96Å; L335-R338 PolarHBondContact O-NE 2.97Å; D336-R338 PolarHBondContact O-N 3.19Å; R338-S340 PolarHBondContact O-N 3.42Å; R338-E341 PolarHBondContact O-N 3.46Å
339	H	57	Low	70.1	Confident	109 Å²	109	82 Å²	82	51%	0.505	44%	0.435	S	S	.	.	H	α-helix	trans	-65.5	-20.3	-179.4	-75.8	-49.4	0	0	0	113.8	Y84 D336 E341	Y84-H339 AromaticContact CD1-CD2 3.61Å; Y84-H339 AromaticContact CD1-NE2 3.39Å; Y84-H339 WeakPolarHBondContact CD1-NE2 3.43Å; Y84-H339 AromaticContact CE1-CD2 3.84Å; D336-H339 PolarHBondContact O-N 3.22Å; H339-E341 VanDerWaalsContact C-N 3.25Å; H339-E341 PolarHBondContact O-N 3.11Å
340	S	52.3	Low	69.4	Low	110 Å²	110	80.4 Å²	80.4	77%	0.769	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.7	178.7	-172.6	0	0	0	0	113.5	R338	R338-S340 PolarHBondContact O-N 3.42Å
341	E	51.1	Low	68.8	Low	164 Å²	164	80.2 Å²	80.2	77%	0.766	42%	0.424	S	S	*	.	S	Bend	trans	-98.4	-11.4	-179.8	-63.4	-169.9	163.6	0	0	113.5	R338 H339 D343	R338-E341 PolarHBondContact O-N 3.46Å; H339-E341 VanDerWaalsContact C-N 3.25Å; H339-E341 PolarHBondContact O-N 3.11Å; E341-D343 PolarHBondContact O-N 3.5Å
342	D	51.2	Low	68.4	Low	78 Å²	78	83.7 Å²	83.7	42%	0.417	44%	0.439	S	S	.	.			trans	-94.1	50.9	-165	-66.8	-32.9	0	0	0	115.3	E344	D342-E344 PolarHBondContact O-N 3.1Å
343	D	50.4	Low	68.1	Low	178 Å²	178	82 Å²	82	95%	0.952	43%	0.431	S	S	*	.			trans	-76.9	-4.2	160.6	-84.4	-23.1	0	0	0	111.7	E341	E341-D343 PolarHBondContact O-N 3.5Å
344	E	57.9	Low	68.1	Low	92 Å²	92	79.7 Å²	79.7	43%	0.43	41%	0.411	S	S	.	.	S	Bend	trans	-74.9	147.2	176.3	-68.5	-173.9	167.2	0	0	111.9	D342 Q346 V349 K352	D342-E344 PolarHBondContact O-N 3.1Å; E344-Q346 PolarHBondContact O-N 3.13Å; E344-V349 HydrophobicContact CB-CG2 3.81Å; E344-K352 IonicContact OE2-NZ 2.68Å
345	H	61	Low	68.4	Low	147 Å²	147	78.8 Å²	78.8	68%	0.681	40%	0.402	S	S	*	.			trans	-58.5	128.4	172	-69.5	-71.8	0	0	0	110.5	L347 L348 V349	H345-L347 PolarHBondContact O-N 3.3Å; H345-L348 HydrophobicContact CB-CD1 4.07Å; H345-L348 HydrophobicContact CB-CG 4.14Å; H345-L348 WeakPolarHBondContact O-CB 3.06Å; H345-L348 PolarHBondContact O-N 3.4Å; H345-V349 PolarHBondContact O-N 2.86Å
346	Q	64.6	Low	68.8	Low	167 Å²	167	80 Å²	80	78%	0.78	41%	0.409	S	S	*	.	H	α-helix	trans	-47.8	-36.2	-177.9	-170.6	176.4	16.5	0	0	113.9	E344 V349 S350	E344-Q346 PolarHBondContact O-N 3.13Å; Q346-V349 PolarHBondContact O-N 3.1Å; Q346-S350 PolarHBondContact O-N 3.2Å; Q346-S350 PolarHBondContact O-OG 3.5Å; Q346-S350 VanDerWaalsContact O-OG 3.12Å
347	L	65.9	Low	69.4	Low	95 Å²	95	77 Å²	77	50%	0.497	39%	0.393	S	S	.	.	H	α-helix	trans	-65	-42.6	176.4	-73.2	169	0	0	0	113.1	H345 V349 S350 F351 D462	H345-L347 PolarHBondContact O-N 3.3Å; L347-V349 VanDerWaalsContact C-N 3.27Å; L347-V349 PolarHBondContact O-N 3.1Å; L347-S350 PolarHBondContact O-N 3.44Å; L347-F351 VanDerWaalsContact O-CD2 3.28Å; L347-F351 WeakPolarHBondContact O-CD2 3.34Å; L347-F351 PolarHBondContact O-N 3.1Å; L347-F351 VanDerWaalsContact O-N 3.14Å; L347-D462 WeakPolarHBondContact CD1-O 3.26Å
348	L	68.6	Low	70.8	Confident	57 Å²	57	70.7 Å²	70.7	30%	0.298	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-38.8	177.9	-62.9	175.9	0	0	0	110.7	H345 F351 K352 L448 L460	H345-L348 HydrophobicContact CB-CD1 4.07Å; H345-L348 HydrophobicContact CB-CG 4.14Å; H345-L348 WeakPolarHBondContact O-CB 3.06Å; H345-L348 PolarHBondContact O-N 3.4Å; L348-F351 PolarHBondContact O-N 3.08Å; L348-K352 WeakPolarHBondContact O-CB 3.39Å; L348-K352 PolarHBondContact O-N 3.12Å; L348-L448 HydrophobicContact CD2-CD2 3.58Å; L348-L460 HydrophobicContact CD2-CD1 3.71Å
349	V	72.2	Confident	72.2	Confident	22 Å²	22	75.7 Å²	75.7	13%	0.133	38%	0.379	C	S	.	.	H	α-helix	trans	-61.2	-47.7	175.2	-178.8	0	0	0	0	110.5	E344 H345 Q346 L347 F351 K352 E353	E344-V349 HydrophobicContact CB-CG2 3.81Å; H345-V349 PolarHBondContact O-N 2.86Å; Q346-V349 PolarHBondContact O-N 3.1Å; L347-V349 VanDerWaalsContact C-N 3.27Å; L347-V349 PolarHBondContact O-N 3.1Å; V349-F351 PolarHBondContact O-N 2.94Å; V349-K352 WeakPolarHBondContact O-CB 3.38Å; V349-K352 PolarHBondContact O-N 3.33Å; V349-E353 HydrophobicContact CG1-CG 4.43Å; V349-E353 WeakPolarHBondContact CG1-OE1 3.43Å; V349-E353 WeakPolarHBondContact O-CG 3.25Å; V349-E353 PolarHBondContact O-N 3.46Å
350	S	77.1	Confident	73.7	Confident	40 Å²	40	72.4 Å²	72.4	28%	0.28	37%	0.365	S	S	.	.	H	α-helix	trans	-59.9	-41.4	178.5	-57.4	0	0	0	0	113.4	Q346 L347 D354	Q346-S350 PolarHBondContact O-N 3.2Å; Q346-S350 PolarHBondContact O-OG 3.5Å; Q346-S350 VanDerWaalsContact O-OG 3.12Å; L347-S350 PolarHBondContact O-N 3.44Å; S350-D354 WeakPolarHBondContact O-CB 3.32Å; S350-D354 PolarHBondContact O-N 3.02Å
351	F	80.1	Confident	75.6	Confident	16 Å²	16	68.8 Å²	68.8	7%	0.07	34%	0.335	C	S	.	.	H	α-helix	trans	-72.4	-32.5	177.3	-81	-75.8	0	0	0	113.3	L347 L348 V349 D354 S355 L435 E441 L444 L448	L347-F351 VanDerWaalsContact O-CD2 3.28Å; L347-F351 WeakPolarHBondContact O-CD2 3.34Å; L347-F351 PolarHBondContact O-N 3.1Å; L347-F351 VanDerWaalsContact O-N 3.14Å; L348-F351 PolarHBondContact O-N 3.08Å; V349-F351 PolarHBondContact O-N 2.94Å; F351-D354 PolarHBondContact O-N 3.06Å; F351-S355 PolarHBondContact O-N 3.3Å; F351-S355 PolarHBondContact O-OG 3.05Å; F351-L435 HydrophobicContact CD1-CD1 4.01Å; F351-L435 HydrophobicContact CE1-CB 4.17Å; F351-L435 HydrophobicContact CE1-CD1 4.07Å; F351-L435 HydrophobicContact CE1-CD2 4.18Å; F351-L435 HydrophobicContact CE1-CG 4.37Å; F351-L435 HydrophobicContact CG-CD1 4.29Å; F351-L435 HydrophobicContact CZ-CD1 4.39Å; F351-L435 HydrophobicContact CZ-CD2 3.99Å; F351-E441 WeakPolarHBondContact CE1-O 3.37Å; F351-L444 HydrophobicContact CE1-CG 4.48Å; F351-L444 HydrophobicContact CE2-CD2 4.14Å; F351-L444 HydrophobicContact CZ-CD2 3.88Å; F351-L444 HydrophobicContact CZ-CG 4.18Å; F351-L448 HydrophobicContact CB-CB 4.44Å; F351-L448 HydrophobicContact CB-CD1 3.64Å; F351-L448 HydrophobicContact CD1-CD1 3.99Å; F351-L448 HydrophobicContact CD2-CD1 3.35Å; F351-L448 HydrophobicContact CE1-CD1 4.49Å; F351-L448 HydrophobicContact CE2-CD1 3.94Å; F351-L448 HydrophobicContact CG-CD1 3.38Å; F351-L448 HydrophobicContact CZ-CD1 4.48Å
352	K	81.6	Confident	77.6	Confident	74 Å²	74	61.1 Å²	61.1	32%	0.322	30%	0.3	S	S	.	.	H	α-helix	trans	-64.2	-46.8	172.8	177.2	-173.8	-178.7	179.9	0	110.6	E344 L348 V349 S355 I356 Q452	E344-K352 IonicContact OE2-NZ 2.68Å; L348-K352 WeakPolarHBondContact O-CB 3.39Å; L348-K352 PolarHBondContact O-N 3.12Å; V349-K352 WeakPolarHBondContact O-CB 3.38Å; V349-K352 PolarHBondContact O-N 3.33Å; K352-S355 WeakPolarHBondContact O-CB 3.16Å; K352-S355 PolarHBondContact O-N 3.47Å; K352-I356 HydrophobicContact CG-CD1 4.39Å; K352-I356 WeakPolarHBondContact O-CD1 3.49Å; K352-I356 WeakPolarHBondContact O-CG1 3.38Å; K352-I356 PolarHBondContact O-N 3.49Å; K352-I356 VanDerWaalsContact O-N 3.15Å; K352-Q452 VanDerWaalsContact CD-NE2 3.31Å
353	E	82	Confident	79.6	Confident	37 Å²	37	59.9 Å²	59.9	17%	0.173	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-44.3	174.8	-72.3	174	180	0	0	111.8	H48 V349 S355 I356 V357	H48-E353 HydrophobicContact CB-CG 4.03Å; H48-E353 WeakPolarHBondContact CB-OE1 3.26Å; H48-E353 IonicContact CD2-OE1 2.57Å; H48-E353 IonicContact CG-OE1 3.85Å; V349-E353 HydrophobicContact CG1-CG 4.43Å; V349-E353 WeakPolarHBondContact CG1-OE1 3.43Å; V349-E353 WeakPolarHBondContact O-CG 3.25Å; V349-E353 PolarHBondContact O-N 3.46Å; E353-S355 VanDerWaalsContact C-N 3.33Å; E353-S355 PolarHBondContact O-N 3.04Å; E353-I356 WeakPolarHBondContact O-CB 3.39Å; E353-I356 PolarHBondContact O-N 3.36Å; E353-I356 VanDerWaalsContact O-N 3.11Å; E353-V357 WeakPolarHBondContact O-CG2 3.3Å; E353-V357 PolarHBondContact O-N 3.04Å
354	D	87.9	Confident	81.4	Confident	10 Å²	10	54.9 Å²	54.9	5%	0.053	27%	0.266	C	S	.	.	H	α-helix	trans	-55	-49.4	175.1	-176.3	80	0	0	0	111.5	S350 F351 I356 V357 H358 R428 T433 L435	S350-D354 WeakPolarHBondContact O-CB 3.32Å; S350-D354 PolarHBondContact O-N 3.02Å; F351-D354 PolarHBondContact O-N 3.06Å; D354-I356 VanDerWaalsContact C-N 3.26Å; D354-I356 PolarHBondContact O-N 2.9Å; D354-V357 WeakPolarHBondContact O-CA 3.45Å; D354-V357 WeakPolarHBondContact O-CB 3.25Å; D354-V357 PolarHBondContact O-N 3.35Å; D354-H358 PolarHBondContact O-CD2 2.87Å; D354-H358 PolarHBondContact O-N 3.18Å; D354-H358 IonicContact OD1-CD2 3.57Å; D354-H358 IonicContact OD1-NE2 2.94Å; D354-H358 IonicContact OD2-CD2 3.05Å; D354-H358 PolarHBondContact OD2-CD2 3.17Å; D354-H358 IonicContact OD2-NE2 3.68Å; D354-H358 PolarHBondContact OD2-NE2 3.44Å; D354-R428 IonicContact OD2-NH1 2.69Å; D354-R428 PolarHBondContact OD2-NH1 3.19Å; D354-T433 WeakPolarHBondContact OD1-CB 3.24Å; D354-T433 WeakPolarHBondContact OD1-CG2 3.4Å; D354-T433 PolarHBondContact OD1-OG1 2.79Å; D354-L435 HydrophobicContact CB-CD1 4.05Å
355	S	89.4	Confident	83	Confident	9 Å²	9	53 Å²	53	6%	0.063	26%	0.255	C	S	.	.	H	α-helix	trans	-56.4	-39.7	177.2	-52.2	0	0	0	0	112.8	F351 K352 E353 R359 R428	F351-S355 PolarHBondContact O-N 3.3Å; F351-S355 PolarHBondContact O-OG 3.05Å; K352-S355 WeakPolarHBondContact O-CB 3.16Å; K352-S355 PolarHBondContact O-N 3.47Å; E353-S355 VanDerWaalsContact C-N 3.33Å; E353-S355 PolarHBondContact O-N 3.04Å; S355-R359 WeakPolarHBondContact O-CB 3.33Å; S355-R359 PolarHBondContact O-N 2.89Å; S355-R428 PolarHBondContact OG-NH2 2.84Å
356	I	89.4	Confident	84.2	Confident	26 Å²	26	49.3 Å²	49.3	13%	0.133	24%	0.235	C	C	.	.	H	α-helix	trans	-65.9	-41.2	175.2	-66.9	159	0	0	0	111.1	V45 P47 K352 E353 D354 R359 N360	V45-I356 HydrophobicContact CB-CD1 4.44Å; V45-I356 HydrophobicContact CB-CG1 4.4Å; V45-I356 HydrophobicContact CB-CG2 4.43Å; V45-I356 HydrophobicContact CG1-CD1 3.53Å; V45-I356 HydrophobicContact CG1-CG1 4.01Å; V45-I356 HydrophobicContact CG1-CG2 4.4Å; V45-I356 WeakPolarHBondContact O-CG2 3.45Å; P47-I356 HydrophobicContact CB-CG2 4.14Å; K352-I356 HydrophobicContact CG-CD1 4.39Å; K352-I356 WeakPolarHBondContact O-CD1 3.49Å; K352-I356 WeakPolarHBondContact O-CG1 3.38Å; K352-I356 PolarHBondContact O-N 3.49Å; K352-I356 VanDerWaalsContact O-N 3.15Å; E353-I356 WeakPolarHBondContact O-CB 3.39Å; E353-I356 PolarHBondContact O-N 3.36Å; E353-I356 VanDerWaalsContact O-N 3.11Å; D354-I356 VanDerWaalsContact C-N 3.26Å; D354-I356 PolarHBondContact O-N 2.9Å; I356-R359 PolarHBondContact O-N 3.14Å; I356-N360 VanDerWaalsContact CG2-ND2 3.32Å; I356-N360 WeakPolarHBondContact CG2-ND2 3.41Å; I356-N360 WeakPolarHBondContact O-CB 3.29Å; I356-N360 VanDerWaalsContact O-CG 3.24Å; I356-N360 PolarHBondContact O-N 2.92Å; I356-N360 PolarHBondContact O-ND2 3.09Å
357	V	90.4	Very high	85.2	Confident	15 Å²	15	48.7 Å²	48.7	9%	0.091	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-49.1	177	173.1	0	0	0	0	110.9	P47 E353 D354 R359 N360 Y361 L432 T433 V708 V709	P47-V357 HydrophobicContact CB-CG2 4.32Å; E353-V357 WeakPolarHBondContact O-CG2 3.3Å; E353-V357 PolarHBondContact O-N 3.04Å; D354-V357 WeakPolarHBondContact O-CA 3.45Å; D354-V357 WeakPolarHBondContact O-CB 3.25Å; D354-V357 PolarHBondContact O-N 3.35Å; V357-R359 PolarHBondContact O-N 2.56Å; V357-N360 PolarHBondContact O-N 3.14Å; V357-Y361 VanDerWaalsContact O-CB 3.26Å; V357-Y361 WeakPolarHBondContact O-CB 3.21Å; V357-Y361 PolarHBondContact O-N 3.42Å; V357-L432 HydrophobicContact CG1-CD2 4.11Å; V357-T433 HydrophobicContact CB-CG2 4.23Å; V357-T433 HydrophobicContact CG1-CG2 3.72Å; V357-V708 HydrophobicContact CG1-CG1 4.13Å; V357-V709 VanDerWaalsContact CG1-O 3.32Å; V357-V709 WeakPolarHBondContact CG1-O 2.95Å; V357-V709 WeakPolarHBondContact CG2-O 3.34Å
358	H	93.6	Very high	86.2	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-42.8	177.9	-72.1	-87.4	0	0	0	111.8	D354 Y361 A362 V427 R428 F429 T433 A436	D354-H358 PolarHBondContact O-CD2 2.87Å; D354-H358 PolarHBondContact O-N 3.18Å; D354-H358 IonicContact OD1-CD2 3.57Å; D354-H358 IonicContact OD1-NE2 2.94Å; D354-H358 IonicContact OD2-CD2 3.05Å; D354-H358 PolarHBondContact OD2-CD2 3.17Å; D354-H358 IonicContact OD2-NE2 3.68Å; D354-H358 PolarHBondContact OD2-NE2 3.44Å; H358-Y361 PolarHBondContact O-N 3.28Å; H358-A362 PolarHBondContact O-N 3.42Å; H358-V427 WeakPolarHBondContact CB-O 3.05Å; H358-R428 PolarHBondContact CD2-NH1 3.01Å; H358-F429 HydrophobicContact CB-CD2 4.19Å; H358-F429 HydrophobicContact CB-CE2 4.48Å; H358-F429 PolarHBondContact CE1-N 3.35Å; H358-F429 PolarHBondContact CE1-O 3.39Å; H358-F429 AromaticContact ND1-CD2 3.51Å; H358-F429 PolarHBondContact ND1-N 2.69Å; H358-F429 WeakPolarHBondContact O-CE2 3.37Å; H358-T433 PolarHBondContact NE2-OG1 3.44Å; H358-A436 VanDerWaalsContact CE1-CB 3.41Å; H358-A436 WeakPolarHBondContact CE1-CB 3.47Å; H358-A436 WeakPolarHBondContact NE2-CB 3.33Å
359	R	91.6	Very high	87.1	Confident	143 Å²	143	46.3 Å²	46.3	54%	0.54	22%	0.217	S	C	.	.	H	α-helix	trans	-61.5	-47.8	177.1	-175.4	-177.3	-179.9	113.1	0.5	112	S355 I356 V357 Y361 A362 L363	S355-R359 WeakPolarHBondContact O-CB 3.33Å; S355-R359 PolarHBondContact O-N 2.89Å; I356-R359 PolarHBondContact O-N 3.14Å; V357-R359 PolarHBondContact O-N 2.56Å; R359-Y361 VanDerWaalsContact C-N 3.3Å; R359-Y361 PolarHBondContact O-N 3.45Å; R359-A362 WeakPolarHBondContact O-CB 3.48Å; R359-A362 PolarHBondContact O-N 2.95Å; R359-L363 HydrophobicContact CG-CD1 4.34Å; R359-L363 WeakPolarHBondContact O-CG 3.4Å; R359-L363 PolarHBondContact O-N 3.41Å
360	N	90.2	Very high	87.7	Confident	40 Å²	40	47.7 Å²	47.7	21%	0.214	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-37.4	180	-71.8	-18.8	0	0	0	111.4	V45 P47 I356 V357 L363 D364	V45-N360 PolarHBondContact O-ND2 3.37Å; V45-N360 VanDerWaalsContact O-ND2 3.13Å; P47-N360 WeakPolarHBondContact CD-ND2 3.47Å; I356-N360 VanDerWaalsContact CG2-ND2 3.32Å; I356-N360 WeakPolarHBondContact CG2-ND2 3.41Å; I356-N360 WeakPolarHBondContact O-CB 3.29Å; I356-N360 VanDerWaalsContact O-CG 3.24Å; I356-N360 PolarHBondContact O-N 2.92Å; I356-N360 PolarHBondContact O-ND2 3.09Å; V357-N360 PolarHBondContact O-N 3.14Å; N360-L363 PolarHBondContact O-N 3.02Å; N360-D364 PolarHBondContact O-N 2.77Å
361	Y	91.6	Very high	88.1	Confident	34 Å²	34	47 Å²	47	13%	0.133	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-45.4	173.2	-174.8	-98.8	0	0	0	111.7	V357 H358 R359 L363 D364 R365 T406 F429 L432 E706 V708	V357-Y361 VanDerWaalsContact O-CB 3.26Å; V357-Y361 WeakPolarHBondContact O-CB 3.21Å; V357-Y361 PolarHBondContact O-N 3.42Å; H358-Y361 PolarHBondContact O-N 3.28Å; R359-Y361 VanDerWaalsContact C-N 3.3Å; R359-Y361 PolarHBondContact O-N 3.45Å; Y361-L363 VanDerWaalsContact C-N 3.34Å; Y361-L363 PolarHBondContact O-N 2.84Å; Y361-D364 PolarHBondContact O-N 3.07Å; Y361-R365 HydrophobicContact CD1-CG 4.27Å; Y361-R365 HydrophobicContact CE1-CG 3.85Å; Y361-R365 HydrophobicContact CE2-CG 4.36Å; Y361-R365 WeakPolarHBondContact O-CG 3.19Å; Y361-R365 PolarHBondContact O-N 2.96Å; Y361-R365 PolarHBondContact OH-NE 3.15Å; Y361-R365 PolarHBondContact OH-NH2 2.98Å; Y361-T406 HydrophobicContact CE1-CG2 4.32Å; Y361-F429 AromaticContact CD1-CD1 3.77Å; Y361-F429 HydrophobicContact CD1-CD1 3.77Å; Y361-F429 AromaticContact CD1-CD2 3.52Å; Y361-F429 HydrophobicContact CD1-CD2 3.52Å; Y361-F429 AromaticContact CD1-CE1 3.77Å; Y361-F429 HydrophobicContact CD1-CE1 3.77Å; Y361-F429 AromaticContact CD1-CE2 3.54Å; Y361-F429 HydrophobicContact CD1-CE2 3.54Å; Y361-F429 AromaticContact CD1-CG 3.66Å; Y361-F429 HydrophobicContact CD1-CG 3.66Å; Y361-F429 AromaticContact CD1-CZ 3.65Å; Y361-F429 HydrophobicContact CD1-CZ 3.65Å; Y361-F429 AromaticContact CE1-CD1 3.59Å; Y361-F429 HydrophobicContact CE1-CD1 3.59Å; Y361-F429 HydrophobicContact CE1-CD2 4.19Å; Y361-F429 AromaticContact CE1-CE1 3.74Å; Y361-F429 HydrophobicContact CE1-CE1 3.74Å; Y361-F429 HydrophobicContact CE1-CE2 4.33Å; Y361-F429 AromaticContact CE1-CG 3.83Å; Y361-F429 HydrophobicContact CE1-CG 3.83Å; Y361-F429 HydrophobicContact CE1-CZ 4.12Å; Y361-F429 HydrophobicContact CG-CD2 4.44Å; Y361-F429 HydrophobicContact CG-CE2 4.46Å; Y361-L432 HydrophobicContact CD1-CD1 4.09Å; Y361-L432 HydrophobicContact CD1-CD2 3.96Å; Y361-L432 HydrophobicContact CD2-CD1 3.75Å; Y361-L432 HydrophobicContact CD2-CD2 4.33Å; Y361-L432 HydrophobicContact CE1-CD1 4.13Å; Y361-L432 HydrophobicContact CE2-CD1 3.83Å; Y361-L432 HydrophobicContact CG-CD1 3.89Å; Y361-L432 HydrophobicContact CG-CD2 3.73Å; Y361-E706 WeakPolarHBondContact CE2-OE1 3.4Å; Y361-E706 VanDerWaalsContact CZ-OE1 3.23Å; Y361-E706 PolarHBondContact OH-OE1 3.11Å; Y361-V708 HydrophobicContact CD2-CG2 4.44Å; Y361-V708 HydrophobicContact CE2-CG2 4.42Å
362	A	93.1	Very high	88.3	Confident	3 Å²	3	48.3 Å²	48.3	3%	0.025	23%	0.232	C	C	.	.	H	α-helix	trans	-60.3	-42.6	174.1	0	0	0	0	0	112.2	H358 R359 D364 R365 R366 V427 F429	H358-A362 PolarHBondContact O-N 3.42Å; R359-A362 WeakPolarHBondContact O-CB 3.48Å; R359-A362 PolarHBondContact O-N 2.95Å; A362-D364 VanDerWaalsContact C-N 3.28Å; A362-D364 PolarHBondContact O-N 3.1Å; A362-R365 PolarHBondContact O-N 3.33Å; A362-R366 VanDerWaalsContact O-CG 3.26Å; A362-R366 WeakPolarHBondContact O-CG 3.49Å; A362-R366 PolarHBondContact O-N 3.2Å; A362-V427 HydrophobicContact CB-CG1 4.29Å; A362-F429 HydrophobicContact CB-CE2 3.91Å; A362-F429 HydrophobicContact CB-CZ 3.76Å
363	L	92.1	Very high	88.6	Confident	51 Å²	51	45.3 Å²	45.3	27%	0.267	22%	0.219	S	C	.	.	H	α-helix	trans	-63.2	-34.8	177	-71.9	172.4	0	0	0	112.5	R359 N360 Y361	R359-L363 HydrophobicContact CG-CD1 4.34Å; R359-L363 WeakPolarHBondContact O-CG 3.4Å; R359-L363 PolarHBondContact O-N 3.41Å; N360-L363 PolarHBondContact O-N 3.02Å; Y361-L363 VanDerWaalsContact C-N 3.34Å; Y361-L363 PolarHBondContact O-N 2.84Å
364	D	89.7	Confident	88.9	Confident	74 Å²	74	47.1 Å²	47.1	40%	0.396	24%	0.24	S	C	.	.	H	α-helix	trans	-70.6	-47	176.6	-159.9	57.7	0	0	0	111.5	N360 Y361 A362 R366 K367	N360-D364 PolarHBondContact O-N 2.77Å; Y361-D364 PolarHBondContact O-N 3.07Å; A362-D364 VanDerWaalsContact C-N 3.28Å; A362-D364 PolarHBondContact O-N 3.1Å; D364-R366 PolarHBondContact O-N 3.46Å; D364-K367 VanDerWaalsContact O-CB 3.3Å; D364-K367 WeakPolarHBondContact O-CB 3.48Å; D364-K367 PolarHBondContact O-N 3.06Å; D364-K367 IonicContact OD1-NZ 2.79Å; D364-K367 PolarHBondContact OD1-NZ 3.48Å
365	R	89.9	Confident	89.1	Confident	51 Å²	51	53.1 Å²	53.1	19%	0.192	27%	0.273	C	S	.	.	H	α-helix	trans	-65.4	-19.4	176.4	-61.5	-55.4	179.1	-165.8	-2.6	114.2	Y361 A362 K367 D368 T406 C410 E706	Y361-R365 HydrophobicContact CD1-CG 4.27Å; Y361-R365 HydrophobicContact CE1-CG 3.85Å; Y361-R365 HydrophobicContact CE2-CG 4.36Å; Y361-R365 WeakPolarHBondContact O-CG 3.19Å; Y361-R365 PolarHBondContact O-N 2.96Å; Y361-R365 PolarHBondContact OH-NE 3.15Å; Y361-R365 PolarHBondContact OH-NH2 2.98Å; A362-R365 PolarHBondContact O-N 3.33Å; R365-K367 VanDerWaalsContact C-N 3.25Å; R365-K367 PolarHBondContact O-N 3.11Å; R365-D368 WeakPolarHBondContact CD-OD2 3.27Å; R365-D368 VanDerWaalsContact O-CB 3.27Å; R365-D368 WeakPolarHBondContact O-CB 3.38Å; R365-D368 PolarHBondContact O-N 2.91Å; R365-T406 HydrophobicContact CG-CG2 4.27Å; R365-C410 HydrophobicContact CB-CB 4.26Å; R365-E706 IonicContact CZ-OE1 2.67Å; R365-E706 IonicContact NH2-OE1 3.99Å; R365-E706 PolarHBondContact NH2-OE1 2.74Å
366	R	87.6	Confident	89.3	Confident	71 Å²	71	52.9 Å²	52.9	27%	0.268	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-21.4	170.9	-76.7	170.4	-170.3	-174.5	2.7	113.4	A362 D364 C410 S413 E414	A362-R366 VanDerWaalsContact O-CG 3.26Å; A362-R366 WeakPolarHBondContact O-CG 3.49Å; A362-R366 PolarHBondContact O-N 3.2Å; D364-R366 PolarHBondContact O-N 3.46Å; R366-C410 HydrophobicContact CG-CB 4.08Å; R366-C410 PolarHBondContact NE-O 2.83Å; R366-C410 VanDerWaalsContact NE-O 3.1Å; R366-S413 PolarHBondContact NH2-OG 2.86Å; R366-E414 WeakPolarHBondContact CD-OE2 3.29Å
367	K	86.1	Confident	89.5	Confident	154 Å²	154	52.8 Å²	52.8	67%	0.67	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-15.7	174.6	-55.8	171.2	-164.4	155	0	111.7	D364 R365	D364-K367 VanDerWaalsContact O-CB 3.3Å; D364-K367 WeakPolarHBondContact O-CB 3.48Å; D364-K367 PolarHBondContact O-N 3.06Å; D364-K367 IonicContact OD1-NZ 2.79Å; D364-K367 PolarHBondContact OD1-NZ 3.48Å; R365-K367 VanDerWaalsContact C-N 3.25Å; R365-K367 PolarHBondContact O-N 3.11Å
368	D	86.5	Confident	89.6	Confident	50 Å²	50	53.7 Å²	53.7	27%	0.267	28%	0.282	S	S	.	.	S	Bend	trans	-62.8	145.7	175.9	-64	-22.5	0	0	0	110.3	R365 F370 T407	R365-D368 WeakPolarHBondContact CD-OD2 3.27Å; R365-D368 VanDerWaalsContact O-CB 3.27Å; R365-D368 WeakPolarHBondContact O-CB 3.38Å; R365-D368 PolarHBondContact O-N 2.91Å; D368-F370 PolarHBondContact O-N 2.99Å; D368-F370 VanDerWaalsContact O-N 3.14Å; D368-T407 HydrophobicContact CB-CG2 3.99Å
369	I	86	Confident	89.6	Confident	52 Å²	52	57.9 Å²	57.9	27%	0.267	30%	0.302	S	S	.	.			trans	-74.5	111	-173.6	-55.5	-173.8	0	0	0	109.7	I371 L565 R568 L569	I369-I371 HydrophobicContact CG2-CD1 3.56Å; I369-I371 HydrophobicContact CG2-CG1 3.86Å; I369-L565 HydrophobicContact CB-CD1 3.69Å; I369-L565 HydrophobicContact CG2-CD1 3.71Å; I369-R568 HydrophobicContact CD1-CB 3.38Å; I369-L569 HydrophobicContact CD1-CD2 3.71Å; I369-L569 HydrophobicContact CD1-CG 4.02Å; I369-L569 HydrophobicContact CG1-CD2 4.15Å
370	F	86	Confident	89.6	Confident	51 Å²	51	51.1 Å²	51.1	22%	0.224	28%	0.276	C	S	.	.			trans	-100.4	117.5	-179.2	-172.3	-99.2	0	0	0	112	D368 Q373 I377 T407 V408 H411	D368-F370 PolarHBondContact O-N 2.99Å; D368-F370 VanDerWaalsContact O-N 3.14Å; F370-Q373 HydrophobicContact CE1-CB 3.99Å; F370-Q373 HydrophobicContact CE2-CB 4.07Å; F370-Q373 HydrophobicContact CE2-CG 4.28Å; F370-Q373 HydrophobicContact CZ-CB 3.42Å; F370-Q373 VanDerWaalsContact CZ-CB 3.42Å; F370-Q373 HydrophobicContact CZ-CG 4.12Å; F370-I377 HydrophobicContact CD1-CD1 4.46Å; F370-I377 HydrophobicContact CE1-CD1 3.34Å; F370-I377 HydrophobicContact CE1-CG1 4.4Å; F370-I377 HydrophobicContact CZ-CD1 3.65Å; F370-I377 HydrophobicContact CZ-CG1 4.27Å; F370-T407 HydrophobicContact CB-CG2 4.43Å; F370-T407 HydrophobicContact CD2-CG2 3.9Å; F370-V408 HydrophobicContact CE2-CB 4.31Å; F370-V408 HydrophobicContact CE2-CG2 3.64Å; F370-V408 HydrophobicContact CZ-CG2 4.22Å; F370-H411 AromaticContact CD1-CD2 3.62Å; F370-H411 AromaticContact CD1-NE2 3.66Å; F370-H411 AromaticContact CE1-CD2 3.55Å; F370-H411 AromaticContact CE1-NE2 3.84Å; F370-H411 AromaticContact CZ-CD2 3.98Å
371	I	86.1	Confident	89.8	Confident	26 Å²	26	52.7 Å²	52.7	13%	0.133	28%	0.281	C	S	.	.			trans	-140.8	143.6	-175.3	-58.7	169.1	0	0	0	110.6	I369 Q373 L557 N561 I564 L565	I369-I371 HydrophobicContact CG2-CD1 3.56Å; I369-I371 HydrophobicContact CG2-CG1 3.86Å; I371-Q373 PolarHBondContact O-N 3.42Å; I371-L557 WeakPolarHBondContact O-CD1 3.42Å; I371-N561 HydrophobicContact CG2-CB 3.75Å; I371-N561 WeakPolarHBondContact CG2-OD1 3.31Å; I371-I564 HydrophobicContact CD1-CB 4.34Å; I371-I564 HydrophobicContact CD1-CG2 3.77Å; I371-L565 HydrophobicContact CD1-CB 4.19Å; I371-L565 HydrophobicContact CD1-CD1 4.36Å
372	G	83.5	Confident	89.8	Confident	43 Å²	43	54.5 Å²	54.5	44%	0.443	30%	0.296	S	S	.	.	S	Bend	trans	86.3	0.8	161.8	0	0	0	0	0	116.7	N561	G372-N561 VanDerWaalsContact CA-ND2 3.25Å; G372-N561 WeakPolarHBondContact CA-ND2 3.48Å
373	Q	88.4	Confident	89.6	Confident	11 Å²	11	54.4 Å²	54.4	5%	0.051	30%	0.295	C	S	.	.			trans	-112.7	27.8	-172.6	-60.9	-62.4	-14.7	0	0	113.3	F370 I371 D375 L376 I377 P555	F370-Q373 HydrophobicContact CE1-CB 3.99Å; F370-Q373 HydrophobicContact CE2-CB 4.07Å; F370-Q373 HydrophobicContact CE2-CG 4.28Å; F370-Q373 HydrophobicContact CZ-CB 3.42Å; F370-Q373 VanDerWaalsContact CZ-CB 3.42Å; F370-Q373 HydrophobicContact CZ-CG 4.12Å; I371-Q373 PolarHBondContact O-N 3.42Å; Q373-D375 VanDerWaalsContact C-N 3.33Å; Q373-D375 PolarHBondContact O-N 3.29Å; Q373-L376 HydrophobicContact CB-CB 4.46Å; Q373-L376 PolarHBondContact O-N 3.35Å; Q373-I377 WeakPolarHBondContact O-CG1 3.33Å; Q373-I377 PolarHBondContact O-N 3.13Å; Q373-I377 VanDerWaalsContact O-N 3.08Å; Q373-P555 PolarHBondContact NE2-O 3.32Å; Q373-P555 VanDerWaalsContact OE1-CG 3.29Å
374	A	88.7	Confident	89.6	Confident	74 Å²	74	52 Å²	52	61%	0.612	28%	0.283	S	S	*	.	H	α-helix	trans	-62.7	-39.1	-179.1	0	0	0	0	0	112.4	I377 G378	A374-I377 PolarHBondContact O-N 2.85Å; A374-G378 PolarHBondContact O-N 2.89Å
375	D	91.6	Very high	89.5	Confident	137 Å²	137	52.5 Å²	52.5	73%	0.733	28%	0.282	S	S	*	.	H	α-helix	trans	-66.8	-42.9	179.2	-62.7	-20.8	0	0	0	111.6	Q373 I377 G378 Q379	Q373-D375 VanDerWaalsContact C-N 3.33Å; Q373-D375 PolarHBondContact O-N 3.29Å; D375-I377 VanDerWaalsContact C-N 3.33Å; D375-I377 PolarHBondContact O-N 2.87Å; D375-G378 WeakPolarHBondContact O-CA 3.43Å; D375-G378 PolarHBondContact O-N 2.82Å; D375-G378 VanDerWaalsContact O-N 3.14Å; D375-Q379 WeakPolarHBondContact O-CG 3.47Å; D375-Q379 PolarHBondContact O-N 3.26Å
376	L	93	Very high	89.3	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-60.5	-43.5	175.1	178.1	68.4	0	0	0	111.1	Q373 G378 Q379 V380 V408 L552 I554	Q373-L376 HydrophobicContact CB-CB 4.46Å; Q373-L376 PolarHBondContact O-N 3.35Å; L376-G378 VanDerWaalsContact C-N 3.3Å; L376-G378 PolarHBondContact O-N 2.91Å; L376-Q379 WeakPolarHBondContact O-CB 3.44Å; L376-Q379 PolarHBondContact O-N 3.25Å; L376-Q379 VanDerWaalsContact O-N 3.17Å; L376-V380 WeakPolarHBondContact O-CG2 3.26Å; L376-V380 PolarHBondContact O-N 2.81Å; L376-V408 HydrophobicContact CD2-CG1 4.02Å; L376-V408 HydrophobicContact CD2-CG2 4.18Å; L376-L552 HydrophobicContact CD1-CB 3.65Å; L376-L552 HydrophobicContact CD1-CD1 4.09Å; L376-L552 HydrophobicContact CD1-CG 4.48Å; L376-I554 HydrophobicContact CD2-CB 4.44Å; L376-I554 HydrophobicContact CD2-CG1 3.78Å
377	I	93.2	Very high	89.1	Confident	24 Å²	24	50.7 Å²	50.7	12%	0.123	28%	0.282	C	S	.	.	H	α-helix	trans	-60.8	-42.4	174.9	-71.5	172	0	0	0	111	F370 Q373 A374 D375 Q379 V380 K381 W419	F370-I377 HydrophobicContact CD1-CD1 4.46Å; F370-I377 HydrophobicContact CE1-CD1 3.34Å; F370-I377 HydrophobicContact CE1-CG1 4.4Å; F370-I377 HydrophobicContact CZ-CD1 3.65Å; F370-I377 HydrophobicContact CZ-CG1 4.27Å; Q373-I377 WeakPolarHBondContact O-CG1 3.33Å; Q373-I377 PolarHBondContact O-N 3.13Å; Q373-I377 VanDerWaalsContact O-N 3.08Å; A374-I377 PolarHBondContact O-N 2.85Å; D375-I377 VanDerWaalsContact C-N 3.33Å; D375-I377 PolarHBondContact O-N 2.87Å; I377-Q379 VanDerWaalsContact C-N 3.31Å; I377-Q379 PolarHBondContact O-N 2.93Å; I377-V380 PolarHBondContact O-N 2.66Å; I377-K381 WeakPolarHBondContact O-CB 3.43Å; I377-K381 PolarHBondContact O-N 2.63Å; I377-W419 HydrophobicContact CG2-CH2 3.72Å; I377-W419 HydrophobicContact CG2-CZ2 3.35Å
378	G	92.9	Very high	88.8	Confident	33 Å²	33	48 Å²	48	34%	0.34	28%	0.275	S	S	.	.	H	α-helix	trans	-56.7	-45.1	173.6	0	0	0	0	0	111.9	A374 D375 L376 K381 T382	A374-G378 PolarHBondContact O-N 2.89Å; D375-G378 WeakPolarHBondContact O-CA 3.43Å; D375-G378 PolarHBondContact O-N 2.82Å; D375-G378 VanDerWaalsContact O-N 3.14Å; L376-G378 VanDerWaalsContact C-N 3.3Å; L376-G378 PolarHBondContact O-N 2.91Å; G378-K381 WeakPolarHBondContact O-CB 3.47Å; G378-K381 PolarHBondContact O-N 3.42Å; G378-T382 WeakPolarHBondContact O-CG2 3.13Å; G378-T382 PolarHBondContact O-N 2.92Å; G378-T382 PolarHBondContact O-OG1 2.73Å
379	Q	93.5	Very high	88.4	Confident	90 Å²	90	49.8 Å²	49.8	42%	0.421	30%	0.297	S	S	.	.	H	α-helix	trans	-63.1	-46.4	176.9	-68.3	171.4	14.3	0	0	112.1	D375 L376 I377 K381 T382 A383 L552	D375-Q379 WeakPolarHBondContact O-CG 3.47Å; D375-Q379 PolarHBondContact O-N 3.26Å; L376-Q379 WeakPolarHBondContact O-CB 3.44Å; L376-Q379 PolarHBondContact O-N 3.25Å; L376-Q379 VanDerWaalsContact O-N 3.17Å; I377-Q379 VanDerWaalsContact C-N 3.31Å; I377-Q379 PolarHBondContact O-N 2.93Å; Q379-K381 VanDerWaalsContact C-N 3.31Å; Q379-K381 PolarHBondContact O-N 3.08Å; Q379-T382 WeakPolarHBondContact CA-OG1 2.81Å; Q379-T382 PolarHBondContact O-N 2.95Å; Q379-T382 PolarHBondContact O-OG1 3.01Å; Q379-A383 WeakPolarHBondContact O-CB 3.49Å; Q379-A383 PolarHBondContact O-N 3.07Å; Q379-L552 HydrophobicContact CB-CD1 3.9Å; Q379-L552 HydrophobicContact CB-CD2 4.04Å
380	V	93.1	Very high	87.9	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59	-44.1	175.9	175.5	0	0	0	0	110.9	L376 I377 A383 F384 V412 W419 L528 L552	L376-V380 WeakPolarHBondContact O-CG2 3.26Å; L376-V380 PolarHBondContact O-N 2.81Å; I377-V380 PolarHBondContact O-N 2.66Å; V380-A383 PolarHBondContact O-N 2.87Å; V380-F384 HydrophobicContact CG1-CD2 4.17Å; V380-F384 HydrophobicContact CG1-CE2 3.89Å; V380-F384 HydrophobicContact CG1-CZ 4.09Å; V380-F384 PolarHBondContact O-N 3.49Å; V380-V412 HydrophobicContact CG1-CG1 3.83Å; V380-V412 HydrophobicContact CG1-CG2 4.41Å; V380-W419 HydrophobicContact CG1-CZ3 4.21Å; V380-L528 HydrophobicContact CG1-CD1 3.79Å; V380-L552 HydrophobicContact CB-CD1 4.28Å; V380-L552 HydrophobicContact CG2-CD1 3.43Å; V380-L552 VanDerWaalsContact CG2-CD1 3.43Å
381	K	93.4	Very high	87.4	Confident	74 Å²	74	51.3 Å²	51.3	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-59	-50.2	176.8	178.9	-176.9	170	-174.4	0	111	I377 G378 Q379 A383 F384 E385 W419	I377-K381 WeakPolarHBondContact O-CB 3.43Å; I377-K381 PolarHBondContact O-N 2.63Å; G378-K381 WeakPolarHBondContact O-CB 3.47Å; G378-K381 PolarHBondContact O-N 3.42Å; Q379-K381 VanDerWaalsContact C-N 3.31Å; Q379-K381 PolarHBondContact O-N 3.08Å; K381-A383 VanDerWaalsContact C-N 3.28Å; K381-A383 PolarHBondContact O-N 3.45Å; K381-F384 PolarHBondContact O-N 2.9Å; K381-E385 WeakPolarHBondContact CE-OE1 3.07Å; K381-E385 IonicContact NZ-OE1 2.84Å; K381-E385 WeakPolarHBondContact O-CG 3.27Å; K381-E385 PolarHBondContact O-N 2.75Å; K381-W419 HydrophobicContact CB-CD2 3.95Å; K381-W419 HydrophobicContact CB-CE3 3.89Å; K381-W419 HydrophobicContact CB-CH2 4.34Å; K381-W419 HydrophobicContact CB-CZ2 4.41Å; K381-W419 HydrophobicContact CB-CZ3 4.07Å; K381-W419 HydrophobicContact CD-CD2 4.07Å; K381-W419 HydrophobicContact CD-CG 3.91Å; K381-W419 HydrophobicContact CG-CB 4.37Å; K381-W419 HydrophobicContact CG-CD2 3.79Å; K381-W419 HydrophobicContact CG-CE3 4.04Å; K381-W419 HydrophobicContact CG-CG 3.93Å
382	T	91.6	Very high	86.9	Confident	71 Å²	71	56.5 Å²	56.5	44%	0.436	34%	0.336	S	S	.	.	H	α-helix	trans	-61.8	-37.3	178.6	55.6	0	0	0	0	112.3	G378 Q379 E385 N386	G378-T382 WeakPolarHBondContact O-CG2 3.13Å; G378-T382 PolarHBondContact O-N 2.92Å; G378-T382 PolarHBondContact O-OG1 2.73Å; Q379-T382 WeakPolarHBondContact CA-OG1 2.81Å; Q379-T382 PolarHBondContact O-N 2.95Å; Q379-T382 PolarHBondContact O-OG1 3.01Å; T382-E385 PolarHBondContact O-N 3.38Å; T382-N386 VanDerWaalsContact O-CG 3.23Å; T382-N386 PolarHBondContact O-N 3.43Å; T382-N386 VanDerWaalsContact O-N 3.07Å; T382-N386 PolarHBondContact O-ND2 3.48Å
383	A	89.8	Confident	86.9	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-62.5	-48.2	175.5	0	0	0	0	0	110.9	Q379 V380 K381 E385 N386 V387 V395 Y550	Q379-A383 WeakPolarHBondContact O-CB 3.49Å; Q379-A383 PolarHBondContact O-N 3.07Å; V380-A383 PolarHBondContact O-N 2.87Å; K381-A383 VanDerWaalsContact C-N 3.28Å; K381-A383 PolarHBondContact O-N 3.45Å; A383-E385 PolarHBondContact O-N 2.79Å; A383-N386 PolarHBondContact O-N 3.02Å; A383-V387 WeakPolarHBondContact O-CG2 3.36Å; A383-V387 PolarHBondContact O-N 3.01Å; A383-V395 HydrophobicContact CB-CG2 3.74Å; A383-Y550 HydrophobicContact CB-CD1 3.59Å; A383-Y550 HydrophobicContact CB-CD2 4.43Å; A383-Y550 HydrophobicContact CB-CE1 3.82Å; A383-Y550 HydrophobicContact CB-CG 3.97Å
384	F	90.1	Very high	86.7	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.009	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-36.8	178	-70.7	-15.7	0	0	0	113.7	V380 K381 N386 V387 N388 V395 V412 V416 W419 M420 F495 L528	V380-F384 HydrophobicContact CG1-CD2 4.17Å; V380-F384 HydrophobicContact CG1-CE2 3.89Å; V380-F384 HydrophobicContact CG1-CZ 4.09Å; V380-F384 PolarHBondContact O-N 3.49Å; K381-F384 PolarHBondContact O-N 2.9Å; F384-N386 VanDerWaalsContact C-N 3.35Å; F384-V387 PolarHBondContact O-N 3.25Å; F384-N388 WeakPolarHBondContact O-CB 3.39Å; F384-N388 PolarHBondContact O-N 3.46Å; F384-V395 HydrophobicContact CD1-CG2 3.72Å; F384-V395 HydrophobicContact CE1-CB 4.02Å; F384-V395 HydrophobicContact CE1-CG2 3.64Å; F384-V412 HydrophobicContact CE2-CG1 4.1Å; F384-V416 HydrophobicContact CD2-CG2 3.94Å; F384-V416 HydrophobicContact CE2-CG2 3.93Å; F384-W419 HydrophobicContact CD2-CE3 4.38Å; F384-W419 HydrophobicContact CD2-CZ3 4.26Å; F384-M420 HydrophobicContact CB-CE 3.41Å; F384-M420 VanDerWaalsContact CB-CE 3.41Å; F384-M420 HydrophobicContact CB-SD 4.32Å; F384-M420 HydrophobicContact CD2-CE 4.22Å; F384-M420 HydrophobicContact CG-CE 4.32Å; F384-F495 HydrophobicContact CE2-CE1 4.15Å; F384-F495 HydrophobicContact CE2-CZ 4.08Å; F384-F495 HydrophobicContact CZ-CE1 4.01Å; F384-F495 HydrophobicContact CZ-CZ 4.23Å; F384-L528 HydrophobicContact CE1-CB 4.19Å; F384-L528 HydrophobicContact CE1-CD1 4.35Å; F384-L528 HydrophobicContact CZ-CB 3.81Å; F384-L528 HydrophobicContact CZ-CD1 3.77Å; F384-L528 HydrophobicContact CZ-CG 4.44Å
385	E	88.6	Confident	86.8	Confident	83 Å²	83	50.7 Å²	50.7	39%	0.388	29%	0.286	S	S	.	.	H	α-helix	trans	-61.4	-43.5	174.3	-73.8	174.2	166.8	0	0	111.4	K381 T382 A383 N388 A389	K381-E385 WeakPolarHBondContact CE-OE1 3.07Å; K381-E385 IonicContact NZ-OE1 2.84Å; K381-E385 WeakPolarHBondContact O-CG 3.27Å; K381-E385 PolarHBondContact O-N 2.75Å; T382-E385 PolarHBondContact O-N 3.38Å; A383-E385 PolarHBondContact O-N 2.79Å; E385-N388 PolarHBondContact O-N 2.81Å; E385-A389 WeakPolarHBondContact O-CB 3.45Å; E385-A389 PolarHBondContact O-N 3.33Å
386	N	86.3	Confident	86.8	Confident	71 Å²	71	44.2 Å²	44.2	38%	0.38	25%	0.251	S	S	.	.	H	α-helix	trans	-67.3	-38.3	176.3	-69.1	-31	0	0	0	112.4	T382 A383 F384 N388 A389 G390 Q391 Y550	T382-N386 VanDerWaalsContact O-CG 3.23Å; T382-N386 PolarHBondContact O-N 3.43Å; T382-N386 VanDerWaalsContact O-N 3.07Å; T382-N386 PolarHBondContact O-ND2 3.48Å; A383-N386 PolarHBondContact O-N 3.02Å; F384-N386 VanDerWaalsContact C-N 3.35Å; N386-N388 VanDerWaalsContact C-N 3.33Å; N386-N388 PolarHBondContact O-N 3.49Å; N386-A389 PolarHBondContact O-N 2.86Å; N386-G390 PolarHBondContact O-N 2.9Å; N386-Q391 WeakPolarHBondContact O-CB 3.48Å; N386-Q391 PolarHBondContact O-N 2.87Å; N386-Y550 WeakPolarHBondContact CB-OH 3.26Å; N386-Y550 PolarHBondContact ND2-OH 3.44Å
387	V	82.7	Confident	86.9	Confident	14 Å²	14	44 Å²	44	9%	0.085	25%	0.25	C	C	.	.	H	α-helix	trans	-61.2	-45	175.1	173.7	0	0	0	0	110.8	A383 F384 A389 G390 Q391 S393 L521 L526 Y550	A383-V387 WeakPolarHBondContact O-CG2 3.36Å; A383-V387 PolarHBondContact O-N 3.01Å; F384-V387 PolarHBondContact O-N 3.25Å; V387-A389 VanDerWaalsContact C-N 3.29Å; V387-A389 PolarHBondContact O-N 2.99Å; V387-G390 PolarHBondContact O-N 3.19Å; V387-G390 VanDerWaalsContact O-N 3.12Å; V387-Q391 VanDerWaalsContact CA-O 3.23Å; V387-Q391 WeakPolarHBondContact CA-O 3.43Å; V387-Q391 WeakPolarHBondContact CG2-O 3.07Å; V387-S393 VanDerWaalsContact CG2-O 3.26Å; V387-S393 WeakPolarHBondContact CG2-O 3.45Å; V387-L521 HydrophobicContact CG1-CD2 3.89Å; V387-L526 HydrophobicContact CB-CD2 4.21Å; V387-L526 HydrophobicContact CG1-CD2 3.75Å; V387-Y550 HydrophobicContact CG2-CD2 4.44Å; V387-Y550 HydrophobicContact CG2-CE2 3.98Å
388	N	79.8	Confident	86.8	Confident	96 Å²	96	44.8 Å²	44.8	51%	0.513	25%	0.251	S	S	.	.	H	α-helix	trans	-67.4	-29.4	176.3	-161.9	45.2	0	0	0	112.7	F384 E385 N386 G390	F384-N388 WeakPolarHBondContact O-CB 3.39Å; F384-N388 PolarHBondContact O-N 3.46Å; E385-N388 PolarHBondContact O-N 2.81Å; N386-N388 VanDerWaalsContact C-N 3.33Å; N386-N388 PolarHBondContact O-N 3.49Å; N388-G390 PolarHBondContact O-N 3.27Å
389	A	78.8	Confident	86.7	Confident	89 Å²	89	43.2 Å²	43.2	74%	0.736	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-6.5	173.9	0	0	0	0	0	113.9	E385 N386 V387	E385-A389 WeakPolarHBondContact O-CB 3.45Å; E385-A389 PolarHBondContact O-N 3.33Å; N386-A389 PolarHBondContact O-N 2.86Å; V387-A389 VanDerWaalsContact C-N 3.29Å; V387-A389 PolarHBondContact O-N 2.99Å
390	G	75	Confident	86.5	Confident	53 Å²	53	41 Å²	41	55%	0.546	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	123.5	-7.9	172.7	0	0	0	0	0	115.2	N386 V387 N388 R392	N386-G390 PolarHBondContact O-N 2.9Å; V387-G390 PolarHBondContact O-N 3.19Å; V387-G390 VanDerWaalsContact O-N 3.12Å; N388-G390 PolarHBondContact O-N 3.27Å; G390-R392 PolarHBondContact O-N 3.02Å
391	Q	75.7	Confident	86.3	Confident	81 Å²	81	42.1 Å²	42.1	38%	0.379	23%	0.234	S	C	.	.			trans	-77.7	83.6	177	-173.8	172.6	-14.5	0	0	110.3	N386 V387 S393 Y550	N386-Q391 WeakPolarHBondContact O-CB 3.48Å; N386-Q391 PolarHBondContact O-N 2.87Å; V387-Q391 VanDerWaalsContact CA-O 3.23Å; V387-Q391 WeakPolarHBondContact CA-O 3.43Å; V387-Q391 WeakPolarHBondContact CG2-O 3.07Å; Q391-S393 VanDerWaalsContact C-N 3.34Å; Q391-S393 PolarHBondContact O-N 3.02Å; Q391-Y550 HydrophobicContact CG-CE2 4.29Å; Q391-Y550 PolarHBondContact NE2-OH 3.05Å; Q391-Y550 PolarHBondContact OE1-OH 2.9Å
392	R	76.1	Confident	86	Confident	135 Å²	135	39.1 Å²	39.1	51%	0.509	23%	0.225	S	C	.	.			trans	-67.9	87.6	-173.7	-59.9	-163.2	-170.2	-175.9	6	112.3	G390 L521 V545	G390-R392 PolarHBondContact O-N 3.02Å; R392-L521 HydrophobicContact CB-CB 4.47Å; R392-L521 WeakPolarHBondContact CD-O 3.5Å; R392-L521 PolarHBondContact NH1-O 2.94Å; R392-V545 WeakPolarHBondContact O-CG1 3.47Å
393	S	81.9	Confident	85.9	Confident	7 Å²	7	36.3 Å²	36.3	5%	0.049	21%	0.207	C	C	.	.			trans	-135.1	148.6	178.9	-69.3	0	0	0	0	113.6	V387 Q391 L521 V545 T547	V387-S393 VanDerWaalsContact CG2-O 3.26Å; V387-S393 WeakPolarHBondContact CG2-O 3.45Å; Q391-S393 VanDerWaalsContact C-N 3.34Å; Q391-S393 PolarHBondContact O-N 3.02Å; S393-L521 WeakPolarHBondContact O-CD2 3.35Å; S393-V545 WeakPolarHBondContact CA-O 3.22Å; S393-V545 WeakPolarHBondContact CB-O 3.33Å; S393-V545 PolarHBondContact OG-O 2.75Å; S393-T547 PolarHBondContact OG-OG1 3.37Å
394	I	86	Confident	85.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.216	C	C	.	.			trans	-85.6	133.5	177.8	-68.6	166.7	0	0	0	108.9	L396 L517 P518 L521 F527 V545 V546	I394-L396 HydrophobicContact CG2-CD2 3.87Å; I394-L396 HydrophobicContact CG2-CG 4.15Å; I394-L517 HydrophobicContact CB-CD2 4.47Å; I394-L517 HydrophobicContact CD1-CD1 4.29Å; I394-L517 HydrophobicContact CD1-CD2 3.78Å; I394-L517 HydrophobicContact CD1-CG 3.7Å; I394-L517 HydrophobicContact CG2-CD1 4.16Å; I394-L517 HydrophobicContact CG2-CD2 4.11Å; I394-L517 HydrophobicContact CG2-CG 4.47Å; I394-P518 HydrophobicContact CD1-CB 4.09Å; I394-P518 HydrophobicContact CD1-CG 4.35Å; I394-L521 HydrophobicContact CG1-CD1 4.26Å; I394-F527 HydrophobicContact CB-CD1 4.49Å; I394-F527 HydrophobicContact CG1-CB 4.38Å; I394-F527 HydrophobicContact CG1-CD1 4.28Å; I394-F527 HydrophobicContact CG2-CD1 3.59Å; I394-F527 HydrophobicContact CG2-CE1 4.16Å; I394-V545 HydrophobicContact CD1-CB 4.48Å; I394-V545 HydrophobicContact CD1-CG1 4.01Å; I394-V545 HydrophobicContact CG1-CG1 3.93Å; I394-V546 HydrophobicContact CB-CG2 4.15Å
395	V	90.8	Very high	86	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	124.1	175.4	-175.1	0	0	0	0	109	A383 F384 F527 L528 A529 L552	A383-V395 HydrophobicContact CB-CG2 3.74Å; F384-V395 HydrophobicContact CD1-CG2 3.72Å; F384-V395 HydrophobicContact CE1-CB 4.02Å; F384-V395 HydrophobicContact CE1-CG2 3.64Å; V395-F527 PolarHBondContact N-O 3.33Å; V395-F527 VanDerWaalsContact N-O 3.15Å; V395-L528 HydrophobicContact CG1-CD1 4.22Å; V395-L528 HydrophobicContact CG1-CG 4.5Å; V395-L528 WeakPolarHBondContact O-CA 3.47Å; V395-A529 PolarHBondContact O-N 3.48Å; V395-A529 VanDerWaalsContact O-N 3.09Å; V395-L552 HydrophobicContact CG1-CD1 4.21Å
396	L	91.7	Very high	86.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.7	178.5	-65.1	178.7	0	0	0	109.5	I394 L517 A529 L531 L537 V546 Y550 V551 L552	I394-L396 HydrophobicContact CG2-CD2 3.87Å; I394-L396 HydrophobicContact CG2-CG 4.15Å; L396-L517 HydrophobicContact CD1-CD2 4.38Å; L396-L517 HydrophobicContact CD2-CD1 4.19Å; L396-A529 WeakPolarHBondContact CA-O 3.42Å; L396-A529 HydrophobicContact CD2-CB 3.94Å; L396-L531 HydrophobicContact CD1-CD1 4.01Å; L396-L531 HydrophobicContact CD2-CD1 4.16Å; L396-L531 HydrophobicContact CG-CD1 4.48Å; L396-L537 HydrophobicContact CD1-CD1 4.4Å; L396-V546 HydrophobicContact CD1-CG1 3.94Å; L396-V546 HydrophobicContact CD1-CG2 4.32Å; L396-Y550 PolarHBondContact N-O 3.29Å; L396-V551 HydrophobicContact CB-CG2 4.39Å; L396-V551 HydrophobicContact CD1-CG2 4.37Å; L396-V551 CarbonylContact O-C 3.59Å; L396-V551 WeakPolarHBondContact O-CA 3.46Å; L396-L552 PolarHBondContact O-N 3.42Å
397	V	94.1	Very high	86.6	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	117.8	175.5	179.8	0	0	0	0	109.1	L528 A529 T530 L531 L552 I554	V397-L528 HydrophobicContact CG2-CD1 4.15Å; V397-L528 HydrophobicContact CG2-CD2 4.23Å; V397-L528 HydrophobicContact CG2-CG 4.29Å; V397-A529 PolarHBondContact N-O 3.35Å; V397-T530 HydrophobicContact CB-CG2 4.2Å; V397-T530 CarbonylContact O-C 3.56Å; V397-T530 VanDerWaalsContact O-CA 3.22Å; V397-T530 WeakPolarHBondContact O-CA 3.43Å; V397-L531 PolarHBondContact O-N 3.15Å; V397-L552 CarbonylContact C-O 3.6Å; V397-L552 WeakPolarHBondContact CA-O 3.29Å; V397-I554 HydrophobicContact CG1-CD1 3.71Å; V397-I554 HydrophobicContact CG1-CG1 3.56Å
398	R	92	Very high	87.2	Confident	41 Å²	41	32.7 Å²	32.7	16%	0.155	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	144.9	-178.6	-62.1	-170.9	69.7	164.1	4.6	111.3	L531 D533 V535 L537 V551 L552 I554	R398-L531 WeakPolarHBondContact CA-O 3.43Å; R398-L531 HydrophobicContact CG-CB 4.31Å; R398-D533 PolarHBondContact NH2-O 2.82Å; R398-V535 PolarHBondContact NH2-O 3.15Å; R398-L537 VanDerWaalsContact NH1-CD1 3.33Å; R398-V551 HydrophobicContact CG-CG1 3.99Å; R398-L552 PolarHBondContact N-O 3.43Å; R398-I554 WeakPolarHBondContact O-CG1 3.21Å; R398-I554 PolarHBondContact O-N 2.93Å
399	G	90.1	Very high	87.9	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	158.8	168.3	0	0	0	0	0	113	K405 L531 D533	G399-K405 PolarHBondContact O-NZ 3.42Å; G399-L531 PolarHBondContact N-O 2.98Å; G399-D533 VanDerWaalsContact C-CG 3.4Å; G399-D533 VanDerWaalsContact C-OD2 3.29Å; G399-D533 VanDerWaalsContact CA-OD1 3.26Å; G399-D533 WeakPolarHBondContact CA-OD1 3.48Å; G399-D533 PolarHBondContact N-OD1 3.24Å; G399-D533 PolarHBondContact O-N 3.23Å
400	S	88.9	Confident	88.7	Confident	44 Å²	44	23.9 Å²	23.9	31%	0.308	14%	0.136	S	C	.	.			trans	-64.8	169.9	177.6	-69.6	0	0	0	0	112.3	G402 Q403 K405 D533	S400-G402 PolarHBondContact O-N 2.92Å; S400-Q403 WeakPolarHBondContact O-CB 3.34Å; S400-Q403 WeakPolarHBondContact O-CG 3.48Å; S400-Q403 PolarHBondContact O-N 3.4Å; S400-K405 PolarHBondContact O-NZ 3.08Å; S400-D533 WeakPolarHBondContact CA-OD2 3.23Å; S400-D533 WeakPolarHBondContact CB-OD2 3.4Å; S400-D533 PolarHBondContact N-OD2 3.38Å; S400-D533 PolarHBondContact OG-OD2 2.9Å
401	H	88.1	Confident	89.6	Confident	22 Å²	22	23.5 Å²	23.5	10%	0.102	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	135.1	175.9	-64.4	-79.3	0	0	0	111.2	Q403 E534 L620 L623 F722	H401-Q403 VanDerWaalsContact C-N 3.26Å; H401-Q403 PolarHBondContact O-N 3.16Å; H401-E534 IonicContact CD2-OE1 3.69Å; H401-E534 PolarHBondContact CD2-OE1 3.47Å; H401-E534 IonicContact NE2-OE1 2.75Å; H401-E534 PolarHBondContact NE2-OE1 2.93Å; H401-E534 IonicContact NE2-OE2 3.29Å; H401-L620 HydrophobicContact CB-CD1 4.46Å; H401-L623 HydrophobicContact CB-CD1 4.13Å; H401-F722 HydrophobicContact CB-CD1 4.4Å
402	G	88	Confident	90.5	Very high	12 Å²	12	19.7 Å²	19.7	12%	0.124	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	7.9	176.6	0	0	0	0	0	116.3	S400 G404 C592 P593 L594	S400-G402 PolarHBondContact O-N 2.92Å; G402-G404 VanDerWaalsContact C-N 3.27Å; G402-G404 PolarHBondContact O-N 3.09Å; G402-C592 PolarHBondContact O-SG 3.42Å; G402-C592 VanDerWaalsContact O-SG 3.38Å; G402-P593 WeakPolarHBondContact O-CD 2.98Å; G402-L594 VanDerWaalsContact CA-CB 3.47Å; G402-L594 WeakPolarHBondContact O-CB 3.34Å; G402-L594 PolarHBondContact O-N 3.17Å; G402-L594 VanDerWaalsContact O-N 3.11Å
403	Q	89.2	Confident	91.3	Very high	12 Å²	12	13.4 Å²	13.4	6%	0.056	8%	0.079	C	C	.	.	S	Bend	trans	-78.2	-1.6	-179.9	-69.6	-64.3	-18.8	0	0	115.1	S400 H401 I554 S591	S400-Q403 WeakPolarHBondContact O-CB 3.34Å; S400-Q403 WeakPolarHBondContact O-CG 3.48Å; S400-Q403 PolarHBondContact O-N 3.4Å; H401-Q403 VanDerWaalsContact C-N 3.26Å; H401-Q403 PolarHBondContact O-N 3.16Å; Q403-I554 HydrophobicContact CB-CG2 4.36Å; Q403-S591 PolarHBondContact NE2-O 3.01Å; Q403-S591 PolarHBondContact OE1-O 3.17Å
404	G	90.3	Very high	91.8	Very high	20 Å²	20	17.4 Å²	17.4	21%	0.206	10%	0.097	C	C	.	.			trans	88.2	25.2	178.4	0	0	0	0	0	115.4	G402 T406 T407 V408	G402-G404 VanDerWaalsContact C-N 3.27Å; G402-G404 PolarHBondContact O-N 3.09Å; G404-T406 PolarHBondContact O-N 2.79Å; G404-T407 PolarHBondContact O-N 3.07Å; G404-V408 WeakPolarHBondContact O-CG2 3.31Å; G404-V408 PolarHBondContact O-N 2.94Å
405	K	92.8	Very high	92.1	Very high	14 Å²	14	19.7 Å²	19.7	6%	0.061	11%	0.109	C	C	.	.	H	α-helix	trans	-50.9	-53.9	175.4	-71.6	-173.4	-62.7	-74.4	0	113	G399 S400 T407 V408 L409 T530 L531 N532 I554	G399-K405 PolarHBondContact O-NZ 3.42Å; S400-K405 PolarHBondContact O-NZ 3.08Å; K405-T407 VanDerWaalsContact C-N 3.31Å; K405-T407 PolarHBondContact O-N 3.42Å; K405-V408 PolarHBondContact O-N 3.44Å; K405-L409 PolarHBondContact O-N 3.41Å; K405-T530 HydrophobicContact CB-CG2 4.23Å; K405-L531 WeakPolarHBondContact CD-O 3.38Å; K405-N532 WeakPolarHBondContact CE-OD1 3.28Å; K405-N532 PolarHBondContact NZ-OD1 3.38Å; K405-I554 HydrophobicContact CB-CD1 4.11Å; K405-I554 HydrophobicContact CG-CD1 3.49Å; K405-I554 VanDerWaalsContact CG-CD1 3.49Å
406	T	93.6	Very high	92.1	Very high	32 Å²	32	19.7 Å²	19.7	20%	0.196	11%	0.109	C	C	.	.	H	α-helix	trans	-57.4	-45.6	177.9	-51.5	0	0	0	0	110.9	Y361 R365 G404 V408 L409 C410 F429 D497	Y361-T406 HydrophobicContact CE1-CG2 4.32Å; R365-T406 HydrophobicContact CG-CG2 4.27Å; G404-T406 PolarHBondContact O-N 2.79Å; T406-V408 PolarHBondContact O-N 3.22Å; T406-L409 PolarHBondContact O-N 2.86Å; T406-C410 WeakPolarHBondContact O-CB 3.46Å; T406-C410 PolarHBondContact O-N 3.14Å; T406-C410 PolarHBondContact O-SG 3.12Å; T406-F429 HydrophobicContact CG2-CD1 4.2Å; T406-F429 HydrophobicContact CG2-CE1 3.83Å; T406-D497 WeakPolarHBondContact CB-OD2 3.38Å; T406-D497 VanDerWaalsContact CG2-OD2 3.31Å; T406-D497 WeakPolarHBondContact CG2-OD2 3.13Å; T406-D497 PolarHBondContact OG1-OD2 3.31Å
407	T	93.6	Very high	92.1	Very high	25 Å²	25	23.8 Å²	23.8	15%	0.153	13%	0.134	C	C	.	.	H	α-helix	trans	-62.5	-43.7	177.8	-44.2	0	0	0	0	112.2	D368 F370 G404 K405 C410 H411	D368-T407 HydrophobicContact CB-CG2 3.99Å; F370-T407 HydrophobicContact CB-CG2 4.43Å; F370-T407 HydrophobicContact CD2-CG2 3.9Å; G404-T407 PolarHBondContact O-N 3.07Å; K405-T407 VanDerWaalsContact C-N 3.31Å; K405-T407 PolarHBondContact O-N 3.42Å; T407-C410 PolarHBondContact O-N 2.98Å; T407-H411 VanDerWaalsContact O-CB 3.3Å; T407-H411 WeakPolarHBondContact O-CB 3.5Å; T407-H411 PolarHBondContact O-N 3.45Å
408	V	94.2	Very high	92	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-58.3	-50.5	174.2	171.5	0	0	0	0	110.2	F370 L376 G404 K405 T406 C410 H411 V412 I554	F370-V408 HydrophobicContact CE2-CB 4.31Å; F370-V408 HydrophobicContact CE2-CG2 3.64Å; F370-V408 HydrophobicContact CZ-CG2 4.22Å; L376-V408 HydrophobicContact CD2-CG1 4.02Å; L376-V408 HydrophobicContact CD2-CG2 4.18Å; G404-V408 WeakPolarHBondContact O-CG2 3.31Å; G404-V408 PolarHBondContact O-N 2.94Å; K405-V408 PolarHBondContact O-N 3.44Å; T406-V408 PolarHBondContact O-N 3.22Å; V408-C410 PolarHBondContact O-N 3.29Å; V408-H411 PolarHBondContact O-N 3.46Å; V408-V412 HydrophobicContact CG1-CG2 4.16Å; V408-V412 WeakPolarHBondContact O-CB 3.34Å; V408-V412 VanDerWaalsContact O-CG2 3.27Å; V408-V412 WeakPolarHBondContact O-CG2 3.36Å; V408-V412 PolarHBondContact O-N 3.27Å; V408-I554 HydrophobicContact CG2-CD1 4.04Å
409	L	95.3	Very high	91.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-45.5	-179.4	178.6	151	0	0	0	111.5	K405 T406 H411 V412 S413 V427 F429 F495 D497 L528 T530	K405-L409 PolarHBondContact O-N 3.41Å; T406-L409 PolarHBondContact O-N 2.86Å; L409-H411 VanDerWaalsContact C-N 3.33Å; L409-H411 PolarHBondContact O-N 3.01Å; L409-V412 PolarHBondContact O-N 3.06Å; L409-S413 WeakPolarHBondContact O-CB 3.32Å; L409-S413 PolarHBondContact O-N 2.9Å; L409-V427 HydrophobicContact CD2-CG1 3.65Å; L409-F429 HydrophobicContact CD2-CE1 4.27Å; L409-F495 HydrophobicContact CD1-CB 4.27Å; L409-F495 HydrophobicContact CD2-CB 4Å; L409-F495 HydrophobicContact CG-CB 4.08Å; L409-F495 HydrophobicContact CG-CD1 4.32Å; L409-D497 HydrophobicContact CD1-CB 3.9Å; L409-D497 HydrophobicContact CD2-CB 4.4Å; L409-L528 HydrophobicContact CB-CD2 4.49Å; L409-L528 HydrophobicContact CD1-CD2 3.87Å; L409-L528 HydrophobicContact CG-CD2 4.14Å; L409-T530 HydrophobicContact CB-CG2 3.98Å; L409-T530 HydrophobicContact CD1-CG2 3.63Å; L409-T530 HydrophobicContact CG-CG2 4.45Å
410	C	95.3	Very high	91.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-39.7	177.4	-69.4	0	0	0	0	112.3	R365 R366 T406 T407 V408 S413 E414 F429	R365-C410 HydrophobicContact CB-CB 4.26Å; R366-C410 HydrophobicContact CG-CB 4.08Å; R366-C410 PolarHBondContact NE-O 2.83Å; R366-C410 VanDerWaalsContact NE-O 3.1Å; T406-C410 WeakPolarHBondContact O-CB 3.46Å; T406-C410 PolarHBondContact O-N 3.14Å; T406-C410 PolarHBondContact O-SG 3.12Å; T407-C410 PolarHBondContact O-N 2.98Å; V408-C410 PolarHBondContact O-N 3.29Å; C410-S413 PolarHBondContact O-OG 2.89Å; C410-E414 PolarHBondContact O-N 3.15Å; C410-F429 VanDerWaalsContact SG-CZ 3.59Å
411	H	93.7	Very high	91.6	Very high	46 Å²	46	32.7 Å²	32.7	21%	0.213	19%	0.189	C	C	.	.	H	α-helix	trans	-71.7	-43.5	178.2	-171	66.1	0	0	0	112.4	F370 T407 V408 L409 S413 E414 I415	F370-H411 AromaticContact CD1-CD2 3.62Å; F370-H411 AromaticContact CD1-NE2 3.66Å; F370-H411 AromaticContact CE1-CD2 3.55Å; F370-H411 AromaticContact CE1-NE2 3.84Å; F370-H411 AromaticContact CZ-CD2 3.98Å; T407-H411 VanDerWaalsContact O-CB 3.3Å; T407-H411 WeakPolarHBondContact O-CB 3.5Å; T407-H411 PolarHBondContact O-N 3.45Å; V408-H411 PolarHBondContact O-N 3.46Å; L409-H411 VanDerWaalsContact C-N 3.33Å; L409-H411 PolarHBondContact O-N 3.01Å; H411-S413 VanDerWaalsContact C-N 3.3Å; H411-S413 PolarHBondContact O-N 2.99Å; H411-E414 WeakPolarHBondContact O-CB 3.39Å; H411-E414 PolarHBondContact O-N 2.87Å; H411-E414 VanDerWaalsContact O-N 3.09Å; H411-I415 WeakPolarHBondContact CE1-CD1 3.4Å; H411-I415 WeakPolarHBondContact NE2-CD1 3.06Å; H411-I415 PolarHBondContact O-N 2.77Å; H411-I415 VanDerWaalsContact O-N 3.1Å
412	V	94.3	Very high	91.6	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-60.7	-41.8	174.5	173.2	0	0	0	0	110.6	V380 F384 V408 L409 E414 I415 V416 W419 F495 L528	V380-V412 HydrophobicContact CG1-CG1 3.83Å; V380-V412 HydrophobicContact CG1-CG2 4.41Å; F384-V412 HydrophobicContact CE2-CG1 4.1Å; V408-V412 HydrophobicContact CG1-CG2 4.16Å; V408-V412 WeakPolarHBondContact O-CB 3.34Å; V408-V412 VanDerWaalsContact O-CG2 3.27Å; V408-V412 WeakPolarHBondContact O-CG2 3.36Å; V408-V412 PolarHBondContact O-N 3.27Å; L409-V412 PolarHBondContact O-N 3.06Å; V412-E414 PolarHBondContact O-N 2.75Å; V412-E414 VanDerWaalsContact O-N 3.12Å; V412-I415 PolarHBondContact O-N 3.46Å; V412-V416 WeakPolarHBondContact O-CB 3.48Å; V412-V416 PolarHBondContact O-N 3.35Å; V412-W419 HydrophobicContact CG1-CH2 4.01Å; V412-W419 HydrophobicContact CG1-CZ3 3.93Å; V412-W419 HydrophobicContact CG2-CH2 4.35Å; V412-F495 HydrophobicContact CB-CE1 4.36Å; V412-F495 HydrophobicContact CG1-CE1 3.65Å; V412-F495 HydrophobicContact CG1-CZ 4.17Å; V412-L528 HydrophobicContact CG1-CD1 4.27Å
413	S	93.7	Very high	91.5	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-20.8	177.6	76.7	0	0	0	0	113.7	R366 L409 C410 H411	R366-S413 PolarHBondContact NH2-OG 2.86Å; L409-S413 WeakPolarHBondContact O-CB 3.32Å; L409-S413 PolarHBondContact O-N 2.9Å; C410-S413 PolarHBondContact O-OG 2.89Å; H411-S413 VanDerWaalsContact C-N 3.3Å; H411-S413 PolarHBondContact O-N 2.99Å
414	E	91.5	Very high	91.7	Very high	91 Å²	91	33 Å²	33	43%	0.425	20%	0.195	S	C	.	.	H	α-helix	trans	-84.9	-47.3	174.3	-172.2	178.9	179.3	0	0	111.6	R366 C410 H411 V412 T417	R366-E414 WeakPolarHBondContact CD-OE2 3.29Å; C410-E414 PolarHBondContact O-N 3.15Å; H411-E414 WeakPolarHBondContact O-CB 3.39Å; H411-E414 PolarHBondContact O-N 2.87Å; H411-E414 VanDerWaalsContact O-N 3.09Å; V412-E414 PolarHBondContact O-N 2.75Å; V412-E414 VanDerWaalsContact O-N 3.12Å; E414-T417 PolarHBondContact O-OG1 2.78Å
415	I	92.4	Very high	91.8	Very high	47 Å²	47	33.7 Å²	33.7	24%	0.241	20%	0.196	C	C	.	.	H	α-helix	trans	-79.6	-21.4	-172.5	-56.5	178.6	0	0	0	111.7	H411 V412 T417 A418 W419	H411-I415 WeakPolarHBondContact CE1-CD1 3.4Å; H411-I415 WeakPolarHBondContact NE2-CD1 3.06Å; H411-I415 PolarHBondContact O-N 2.77Å; H411-I415 VanDerWaalsContact O-N 3.1Å; V412-I415 PolarHBondContact O-N 3.46Å; I415-T417 PolarHBondContact O-N 2.98Å; I415-T417 VanDerWaalsContact O-N 3.07Å; I415-A418 HydrophobicContact CG2-CB 4.48Å; I415-A418 WeakPolarHBondContact O-CA 3.38Å; I415-A418 VanDerWaalsContact O-CB 3.32Å; I415-A418 WeakPolarHBondContact O-CB 3.39Å; I415-A418 PolarHBondContact O-N 3.12Å; I415-W419 HydrophobicContact CB-CZ2 3.9Å; I415-W419 HydrophobicContact CG2-CD2 4.33Å; I415-W419 VanDerWaalsContact CG2-CE2 3.4Å; I415-W419 HydrophobicContact CG2-CZ2 3.54Å; I415-W419 PolarHBondContact O-N 2.98Å
416	V	92.4	Very high	91.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-53.9	-35.7	-177.7	71.2	0	0	0	0	112.9	F384 V412 A418 W419 M420 V422 V425 F495	F384-V416 HydrophobicContact CD2-CG2 3.94Å; F384-V416 HydrophobicContact CE2-CG2 3.93Å; V412-V416 WeakPolarHBondContact O-CB 3.48Å; V412-V416 PolarHBondContact O-N 3.35Å; V416-A418 PolarHBondContact O-N 3.5Å; V416-W419 HydrophobicContact CB-CE3 4.44Å; V416-W419 HydrophobicContact CG2-CE3 4.37Å; V416-W419 PolarHBondContact O-N 3.48Å; V416-W419 VanDerWaalsContact O-N 3.16Å; V416-M420 PolarHBondContact O-N 2.91Å; V416-M420 VanDerWaalsContact O-N 3.16Å; V416-V422 HydrophobicContact CG1-CG2 4.47Å; V416-V422 HydrophobicContact CG2-CG2 4Å; V416-V425 HydrophobicContact CG1-CG2 3.82Å; V416-F495 HydrophobicContact CB-CZ 4.23Å; V416-F495 HydrophobicContact CG1-CE2 4.17Å; V416-F495 HydrophobicContact CG1-CZ 4.05Å; V416-F495 HydrophobicContact CG2-CZ 4.36Å
417	T	90.7	Very high	92	Very high	86 Å²	86	32.3 Å²	32.3	53%	0.528	19%	0.188	S	C	.	.	H	α-helix	trans	-70.1	-16.7	177.7	57.7	0	0	0	0	113.6	E414 I415 M420 V425	E414-T417 PolarHBondContact O-OG1 2.78Å; I415-T417 PolarHBondContact O-N 2.98Å; I415-T417 VanDerWaalsContact O-N 3.07Å; T417-M420 CarbonylContact C-O 3.6Å; T417-V425 HydrophobicContact CG2-CG2 3.88Å
418	A	91.5	Very high	92.1	Very high	84 Å²	84	31.3 Å²	31.3	69%	0.694	18%	0.181	S	C	*	.	H	α-helix	trans	-89.6	-22.6	173.3	0	0	0	0	0	112.6	I415 V416	I415-A418 HydrophobicContact CG2-CB 4.48Å; I415-A418 WeakPolarHBondContact O-CA 3.38Å; I415-A418 VanDerWaalsContact O-CB 3.32Å; I415-A418 WeakPolarHBondContact O-CB 3.39Å; I415-A418 PolarHBondContact O-N 3.12Å; V416-A418 PolarHBondContact O-N 3.5Å
419	W	88.9	Confident	92.1	Very high	51 Å²	51	31.4 Å²	31.4	19%	0.193	18%	0.182	C	C	.	.	H	α-helix	trans	-80.7	-37.2	175.8	-59.8	-21.3	0	0	0	112.2	I377 V380 K381 F384 V412 I415 V416	I377-W419 HydrophobicContact CG2-CH2 3.72Å; I377-W419 HydrophobicContact CG2-CZ2 3.35Å; V380-W419 HydrophobicContact CG1-CZ3 4.21Å; K381-W419 HydrophobicContact CB-CD2 3.95Å; K381-W419 HydrophobicContact CB-CE3 3.89Å; K381-W419 HydrophobicContact CB-CH2 4.34Å; K381-W419 HydrophobicContact CB-CZ2 4.41Å; K381-W419 HydrophobicContact CB-CZ3 4.07Å; K381-W419 HydrophobicContact CD-CD2 4.07Å; K381-W419 HydrophobicContact CD-CG 3.91Å; K381-W419 HydrophobicContact CG-CB 4.37Å; K381-W419 HydrophobicContact CG-CD2 3.79Å; K381-W419 HydrophobicContact CG-CE3 4.04Å; K381-W419 HydrophobicContact CG-CG 3.93Å; F384-W419 HydrophobicContact CD2-CE3 4.38Å; F384-W419 HydrophobicContact CD2-CZ3 4.26Å; V412-W419 HydrophobicContact CG1-CH2 4.01Å; V412-W419 HydrophobicContact CG1-CZ3 3.93Å; V412-W419 HydrophobicContact CG2-CH2 4.35Å; I415-W419 HydrophobicContact CB-CZ2 3.9Å; I415-W419 HydrophobicContact CG2-CD2 4.33Å; I415-W419 VanDerWaalsContact CG2-CE2 3.4Å; I415-W419 HydrophobicContact CG2-CZ2 3.54Å; I415-W419 PolarHBondContact O-N 2.98Å; V416-W419 HydrophobicContact CB-CE3 4.44Å; V416-W419 HydrophobicContact CG2-CE3 4.37Å; V416-W419 PolarHBondContact O-N 3.48Å; V416-W419 VanDerWaalsContact O-N 3.16Å
420	M	87.1	Confident	91.9	Very high	25 Å²	25	31.8 Å²	31.8	12%	0.123	19%	0.185	C	C	.	.	S	Bend	trans	-151.8	158.2	-175.5	63.9	-166.5	79.2	0	0	111.7	F384 V416 T417 V422 L526	F384-M420 HydrophobicContact CB-CE 3.41Å; F384-M420 VanDerWaalsContact CB-CE 3.41Å; F384-M420 HydrophobicContact CB-SD 4.32Å; F384-M420 HydrophobicContact CD2-CE 4.22Å; F384-M420 HydrophobicContact CG-CE 4.32Å; V416-M420 PolarHBondContact O-N 2.91Å; V416-M420 VanDerWaalsContact O-N 3.16Å; T417-M420 CarbonylContact C-O 3.6Å; M420-V422 VanDerWaalsContact C-N 3.31Å; M420-V422 HydrophobicContact CG-CG2 3.57Å; M420-V422 PolarHBondContact O-N 2.93Å; M420-V422 HydrophobicContact SD-CG2 4.38Å; M420-L526 HydrophobicContact SD-CD1 3.45Å; M420-L526 WeakPolarHBondContact SD-CD1 3.48Å
421	D	86.7	Confident	91.6	Very high	113 Å²	113	34.9 Å²	34.9	60%	0.604	20%	0.196	S	C	*	.			trans	-72.6	82.2	175.4	-89.1	-57.2	0	0	0	110.8	K490	D421-K490 HydrophobicContact CB-CD 4.04Å; D421-K490 HydrophobicContact CB-CG 4.18Å; D421-K490 VanDerWaalsContact O-CB 3.31Å; D421-K490 WeakPolarHBondContact O-CB 3.29Å; D421-K490 WeakPolarHBondContact O-CG 3.37Å; D421-K490 IonicContact OD1-NZ 3.68Å; D421-K490 PolarHBondContact OD1-NZ 2.79Å
422	V	89.7	Confident	91.4	Very high	19 Å²	19	33.1 Å²	33.1	12%	0.115	19%	0.188	C	C	.	.			trans	-83.6	136.1	173.2	-171.9	0	0	0	0	109.8	V416 M420 C424 V425 P491 A493 L526	V416-V422 HydrophobicContact CG1-CG2 4.47Å; V416-V422 HydrophobicContact CG2-CG2 4Å; M420-V422 VanDerWaalsContact C-N 3.31Å; M420-V422 HydrophobicContact CG-CG2 3.57Å; M420-V422 PolarHBondContact O-N 2.93Å; M420-V422 HydrophobicContact SD-CG2 4.38Å; V422-C424 WeakPolarHBondContact CG1-O 3.08Å; V422-V425 HydrophobicContact CG1-CG2 4.01Å; V422-P491 WeakPolarHBondContact CG1-O 3.47Å; V422-A493 HydrophobicContact CG1-CB 3.71Å; V422-L526 HydrophobicContact CG2-CD1 4.45Å
423	G	85.9	Confident	91.1	Very high	23 Å²	23	33.2 Å²	33.2	24%	0.237	19%	0.189	C	C	.	.	S	Bend	trans	-77	-39.8	-179.8	0	0	0	0	0	112.5	P491	G423-P491 PolarHBondContact N-O 3.35Å
424	C	91.5	Very high	90.7	Very high	9 Å²	9	34.5 Å²	34.5	6%	0.061	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	143.4	178.7	-178.1	0	0	0	0	110.5	V422 L450 Q453 F454 V492 A493	V422-C424 WeakPolarHBondContact CG1-O 3.08Å; C424-L450 HydrophobicContact CB-CD2 4.14Å; C424-Q453 PolarHBondContact SG-OE1 3.27Å; C424-F454 HydrophobicContact CB-CE2 3.72Å; C424-F454 HydrophobicContact CB-CZ 3.91Å; C424-V492 HydrophobicContact CB-CG1 4.38Å; C424-V492 HydrophobicContact CB-CG2 4.45Å; C424-V492 WeakPolarHBondContact O-CA 3.27Å; C424-A493 PolarHBondContact O-N 2.85Å
425	V	93.3	Very high	90.5	Very high	36 Å²	36	31.7 Å²	31.7	22%	0.218	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.3	173.7	177	0	0	0	0	108.5	V416 T417 V422 V427 A493 F495	V416-V425 HydrophobicContact CG1-CG2 3.82Å; T417-V425 HydrophobicContact CG2-CG2 3.88Å; V422-V425 HydrophobicContact CG1-CG2 4.01Å; V425-V427 HydrophobicContact CG1-CG2 4.12Å; V425-A493 CarbonylContact C-O 3.55Å; V425-A493 WeakPolarHBondContact CA-O 3.33Å; V425-A493 HydrophobicContact CG2-CB 4.36Å; V425-F495 HydrophobicContact CG1-CD2 3.84Å; V425-F495 HydrophobicContact CG1-CE2 3.74Å
426	I	95.1	Very high	90.4	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.8	174.8	-63.3	-180	0	0	0	108.5	R428 C446 E449 L450 A493 L494 F495	I426-R428 HydrophobicContact CG2-CG 4.15Å; I426-C446 HydrophobicContact CD1-CB 4.49Å; I426-E449 HydrophobicContact CD1-CB 4.47Å; I426-E449 HydrophobicContact CD1-CG 4.43Å; I426-E449 WeakPolarHBondContact CG2-OE2 3.46Å; I426-L450 HydrophobicContact CD1-CD1 4.28Å; I426-L450 HydrophobicContact CD1-CD2 3.51Å; I426-L450 HydrophobicContact CD1-CG 3.6Å; I426-L450 HydrophobicContact CG1-CD2 4.42Å; I426-A493 PolarHBondContact N-O 2.85Å; I426-L494 HydrophobicContact CB-CD1 3.86Å; I426-L494 HydrophobicContact CG2-CD1 3.6Å; I426-L494 WeakPolarHBondContact O-CA 3.48Å; I426-F495 PolarHBondContact O-N 2.86Å
427	V	95.7	Very high	90.1	Very high	15 Å²	15	30 Å²	30	9%	0.091	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.6	178.3	-171.3	0	0	0	0	108.7	H358 A362 L409 V425 F429 F495	H358-V427 WeakPolarHBondContact CB-O 3.05Å; A362-V427 HydrophobicContact CB-CG1 4.29Å; L409-V427 HydrophobicContact CD2-CG1 3.65Å; V425-V427 HydrophobicContact CG1-CG2 4.12Å; V427-F429 HydrophobicContact CB-CE2 4.44Å; V427-F429 HydrophobicContact CG1-CD2 4.45Å; V427-F429 HydrophobicContact CG1-CE1 4.33Å; V427-F429 HydrophobicContact CG1-CE2 3.58Å; V427-F429 HydrophobicContact CG1-CZ 3.51Å; V427-F495 CarbonylContact C-O 3.58Å; V427-F495 WeakPolarHBondContact CA-O 3.3Å; V427-F495 HydrophobicContact CB-CB 4.48Å; V427-F495 HydrophobicContact CG1-CB 4.23Å; V427-F495 HydrophobicContact CG2-CB 4.23Å; V427-F495 HydrophobicContact CG2-CD2 4.37Å
428	R	95.7	Very high	89.9	Confident	3 Å²	3	26.6 Å²	26.6	1%	0.011	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	135.3	178.8	-62.4	-63.4	170.7	175.3	-1.2	111	D354 S355 H358 I426 M442 E449 L494 F495 V496 D497	D354-R428 IonicContact OD2-NH1 2.69Å; D354-R428 PolarHBondContact OD2-NH1 3.19Å; S355-R428 PolarHBondContact OG-NH2 2.84Å; H358-R428 PolarHBondContact CD2-NH1 3.01Å; I426-R428 HydrophobicContact CG2-CG 4.15Å; R428-M442 HydrophobicContact CB-CG 4Å; R428-M442 HydrophobicContact CB-SD 4.16Å; R428-M442 HydrophobicContact CG-CG 4.03Å; R428-M442 HydrophobicContact CG-SD 4.4Å; R428-E449 IonicContact CZ-OE2 3.34Å; R428-E449 IonicContact NE-OE2 3.39Å; R428-E449 IonicContact NH2-OE2 2.68Å; R428-E449 PolarHBondContact NH2-OE2 2.82Å; R428-L494 HydrophobicContact CG-CD1 4.5Å; R428-F495 PolarHBondContact N-O 2.83Å; R428-V496 CarbonylContact O-C 3.56Å; R428-V496 WeakPolarHBondContact O-CA 3.44Å; R428-D497 PolarHBondContact O-N 2.89Å
429	F	94.7	Very high	89.7	Confident	6 Å²	6	22.7 Å²	22.7	3%	0.026	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	117.6	179.3	-58.9	-87.7	0	0	0	109.4	H358 Y361 A362 T406 L409 C410 V427 R431 L432 D497	H358-F429 HydrophobicContact CB-CD2 4.19Å; H358-F429 HydrophobicContact CB-CE2 4.48Å; H358-F429 PolarHBondContact CE1-N 3.35Å; H358-F429 PolarHBondContact CE1-O 3.39Å; H358-F429 AromaticContact ND1-CD2 3.51Å; H358-F429 PolarHBondContact ND1-N 2.69Å; H358-F429 WeakPolarHBondContact O-CE2 3.37Å; Y361-F429 AromaticContact CD1-CD1 3.77Å; Y361-F429 HydrophobicContact CD1-CD1 3.77Å; Y361-F429 AromaticContact CD1-CD2 3.52Å; Y361-F429 HydrophobicContact CD1-CD2 3.52Å; Y361-F429 AromaticContact CD1-CE1 3.77Å; Y361-F429 HydrophobicContact CD1-CE1 3.77Å; Y361-F429 AromaticContact CD1-CE2 3.54Å; Y361-F429 HydrophobicContact CD1-CE2 3.54Å; Y361-F429 AromaticContact CD1-CG 3.66Å; Y361-F429 HydrophobicContact CD1-CG 3.66Å; Y361-F429 AromaticContact CD1-CZ 3.65Å; Y361-F429 HydrophobicContact CD1-CZ 3.65Å; Y361-F429 AromaticContact CE1-CD1 3.59Å; Y361-F429 HydrophobicContact CE1-CD1 3.59Å; Y361-F429 HydrophobicContact CE1-CD2 4.19Å; Y361-F429 AromaticContact CE1-CE1 3.74Å; Y361-F429 HydrophobicContact CE1-CE1 3.74Å; Y361-F429 HydrophobicContact CE1-CE2 4.33Å; Y361-F429 AromaticContact CE1-CG 3.83Å; Y361-F429 HydrophobicContact CE1-CG 3.83Å; Y361-F429 HydrophobicContact CE1-CZ 4.12Å; Y361-F429 HydrophobicContact CG-CD2 4.44Å; Y361-F429 HydrophobicContact CG-CE2 4.46Å; A362-F429 HydrophobicContact CB-CE2 3.91Å; A362-F429 HydrophobicContact CB-CZ 3.76Å; T406-F429 HydrophobicContact CG2-CD1 4.2Å; T406-F429 HydrophobicContact CG2-CE1 3.83Å; L409-F429 HydrophobicContact CD2-CE1 4.27Å; C410-F429 VanDerWaalsContact SG-CZ 3.59Å; V427-F429 HydrophobicContact CB-CE2 4.44Å; V427-F429 HydrophobicContact CG1-CD2 4.45Å; V427-F429 HydrophobicContact CG1-CE1 4.33Å; V427-F429 HydrophobicContact CG1-CE2 3.58Å; V427-F429 HydrophobicContact CG1-CZ 3.51Å; F429-R431 PolarHBondContact O-N 2.87Å; F429-L432 HydrophobicContact CB-CB 3.7Å; F429-L432 HydrophobicContact CB-CD2 4.07Å; F429-L432 HydrophobicContact CB-CG 4.34Å; F429-L432 HydrophobicContact CD2-CD2 3.99Å; F429-L432 HydrophobicContact CG-CD2 4.33Å; F429-L432 WeakPolarHBondContact O-CB 3.45Å; F429-L432 PolarHBondContact O-N 3.45Å; F429-L432 VanDerWaalsContact O-N 3.1Å; F429-D497 HydrophobicContact CD1-CB 3.53Å; F429-D497 HydrophobicContact CE1-CB 4.05Å; F429-D497 HydrophobicContact CG-CB 4.36Å
430	A	91.3	Very high	89.7	Confident	7 Å²	7	21.6 Å²	21.6	6%	0.058	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	126.4	-176.3	0	0	0	0	0	111.4	L432 D497 D498 R501 L502	A430-L432 PolarHBondContact O-N 2.8Å; A430-D497 VanDerWaalsContact CB-O 3.23Å; A430-D497 WeakPolarHBondContact CB-O 3.09Å; A430-D497 PolarHBondContact N-O 3.41Å; A430-D498 HydrophobicContact CB-CB 4.44Å; A430-D498 VanDerWaalsContact CB-O 3.22Å; A430-D498 WeakPolarHBondContact CB-O 3.33Å; A430-R501 HydrophobicContact CB-CB 3.95Å; A430-L502 HydrophobicContact CB-CD2 3.73Å; A430-L502 HydrophobicContact CB-CG 3.91Å
431	R	88.2	Confident	89.7	Confident	65 Å²	65	23.1 Å²	23.1	25%	0.245	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	20.9	-178.7	-56.7	-176.5	58.8	150.8	-1.2	115.1	F429 T433 A436	F429-R431 PolarHBondContact O-N 2.87Å; R431-T433 VanDerWaalsContact C-N 3.28Å; R431-A436 PolarHBondContact N-O 3.45Å
432	L	89.4	Confident	89.9	Confident	9 Å²	9	18 Å²	18	5%	0.047	10%	0.1	C	C	.	.	S	Bend	trans	-63.3	-42.9	169.1	-176.3	76	0	0	0	110.2	V357 Y361 F429 A430 V708 K717	V357-L432 HydrophobicContact CG1-CD2 4.11Å; Y361-L432 HydrophobicContact CD1-CD1 4.09Å; Y361-L432 HydrophobicContact CD1-CD2 3.96Å; Y361-L432 HydrophobicContact CD2-CD1 3.75Å; Y361-L432 HydrophobicContact CD2-CD2 4.33Å; Y361-L432 HydrophobicContact CE1-CD1 4.13Å; Y361-L432 HydrophobicContact CE2-CD1 3.83Å; Y361-L432 HydrophobicContact CG-CD1 3.89Å; Y361-L432 HydrophobicContact CG-CD2 3.73Å; F429-L432 HydrophobicContact CB-CB 3.7Å; F429-L432 HydrophobicContact CB-CD2 4.07Å; F429-L432 HydrophobicContact CB-CG 4.34Å; F429-L432 HydrophobicContact CD2-CD2 3.99Å; F429-L432 HydrophobicContact CG-CD2 4.33Å; F429-L432 WeakPolarHBondContact O-CB 3.45Å; F429-L432 PolarHBondContact O-N 3.45Å; F429-L432 VanDerWaalsContact O-N 3.1Å; A430-L432 PolarHBondContact O-N 2.8Å; L432-V708 HydrophobicContact CD1-CG1 3.97Å; L432-V708 HydrophobicContact CD1-CG2 4.02Å; L432-V708 HydrophobicContact CG-CG1 4.13Å; L432-K717 PolarHBondContact O-NZ 3.48Å
433	T	88.9	Confident	90	Very high	4 Å²	4	17.1 Å²	17.1	3%	0.025	10%	0.095	C	C	.	.	S	Bend	trans	-123.7	162.9	177.1	58.2	0	0	0	0	110.2	D354 V357 H358 R431 L435 A436 S437	D354-T433 WeakPolarHBondContact OD1-CB 3.24Å; D354-T433 WeakPolarHBondContact OD1-CG2 3.4Å; D354-T433 PolarHBondContact OD1-OG1 2.79Å; V357-T433 HydrophobicContact CB-CG2 4.23Å; V357-T433 HydrophobicContact CG1-CG2 3.72Å; H358-T433 PolarHBondContact NE2-OG1 3.44Å; R431-T433 VanDerWaalsContact C-N 3.28Å; T433-L435 VanDerWaalsContact C-N 3.29Å; T433-L435 PolarHBondContact O-N 3.42Å; T433-A436 PolarHBondContact O-N 3.38Å; T433-A436 WeakPolarHBondContact OG1-CB 3.47Å; T433-A436 PolarHBondContact OG1-N 2.84Å; T433-S437 PolarHBondContact O-OG 2.68Å
434	P	84.7	Confident	90.1	Very high	29 Å²	29	16.2 Å²	16.2	19%	0.188	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-55.5	-43.8	173.8	-25.2	34.9	0	0	0	112.6	A436 S437 F655	P434-A436 PolarHBondContact O-N 2.9Å; P434-S437 WeakPolarHBondContact O-CB 3.28Å; P434-S437 PolarHBondContact O-N 2.6Å; P434-S437 PolarHBondContact O-OG 3.38Å; P434-S437 VanDerWaalsContact O-OG 3.09Å; P434-F655 HydrophobicContact CB-CE1 4.04Å; P434-F655 HydrophobicContact CB-CE2 4.25Å; P434-F655 HydrophobicContact CB-CZ 3.88Å; P434-F655 HydrophobicContact CG-CD1 4.04Å; P434-F655 HydrophobicContact CG-CD2 4.27Å; P434-F655 HydrophobicContact CG-CE1 4.08Å; P434-F655 HydrophobicContact CG-CE2 4.29Å; P434-F655 HydrophobicContact CG-CG 4.14Å; P434-F655 HydrophobicContact CG-CZ 4.19Å
435	L	86.9	Confident	90	Very high	33 Å²	33	15.8 Å²	15.8	17%	0.173	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-70.5	-10.5	-179.3	-61.4	176.7	0	0	0	114.2	F351 D354 T433 E441 M442	F351-L435 HydrophobicContact CD1-CD1 4.01Å; F351-L435 HydrophobicContact CE1-CB 4.17Å; F351-L435 HydrophobicContact CE1-CD1 4.07Å; F351-L435 HydrophobicContact CE1-CD2 4.18Å; F351-L435 HydrophobicContact CE1-CG 4.37Å; F351-L435 HydrophobicContact CG-CD1 4.29Å; F351-L435 HydrophobicContact CZ-CD1 4.39Å; F351-L435 HydrophobicContact CZ-CD2 3.99Å; D354-L435 HydrophobicContact CB-CD1 4.05Å; T433-L435 VanDerWaalsContact C-N 3.29Å; T433-L435 PolarHBondContact O-N 3.42Å; L435-E441 CarbonylContact O-C 3.59Å; L435-E441 WeakPolarHBondContact O-CB 3.46Å; L435-M442 PolarHBondContact O-N 3.19Å
436	A	89.5	Confident	89.9	Confident	1 Å²	1	14.1 Å²	14.1	1%	0.008	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-106.7	21.5	171	0	0	0	0	0	112.5	H358 R431 T433 P434 L502	H358-A436 VanDerWaalsContact CE1-CB 3.41Å; H358-A436 WeakPolarHBondContact CE1-CB 3.47Å; H358-A436 WeakPolarHBondContact NE2-CB 3.33Å; R431-A436 PolarHBondContact N-O 3.45Å; T433-A436 PolarHBondContact O-N 3.38Å; T433-A436 WeakPolarHBondContact OG1-CB 3.47Å; T433-A436 PolarHBondContact OG1-N 2.84Å; P434-A436 PolarHBondContact O-N 2.9Å; A436-L502 WeakPolarHBondContact O-CD2 3.27Å
437	S	86.8	Confident	89.6	Confident	9 Å²	9	14 Å²	14	6%	0.063	7%	0.071	C	C	.	.	S	Bend	trans	-90.5	-31.9	-179.7	-65	0	0	0	0	113.7	T433 P434 K503 F655	T433-S437 PolarHBondContact O-OG 2.68Å; P434-S437 WeakPolarHBondContact O-CB 3.28Å; P434-S437 PolarHBondContact O-N 2.6Å; P434-S437 PolarHBondContact O-OG 3.38Å; P434-S437 VanDerWaalsContact O-OG 3.09Å; S437-K503 PolarHBondContact O-N 3.43Å; S437-K503 VanDerWaalsContact O-N 3.15Å; S437-F655 WeakPolarHBondContact OG-CE1 3.2Å
438	T	86.7	Confident	89.2	Confident	16 Å²	16	14.1 Å²	14.1	10%	0.098	7%	0.071	C	C	.	.	B	Isolated β-bridge	trans	-109.1	155.9	174.7	69.2	0	0	0	0	110.3	Q440 E441 M442 K503	T438-Q440 VanDerWaalsContact C-N 3.31Å; T438-Q440 PolarHBondContact O-N 3.47Å; T438-E441 WeakPolarHBondContact CG2-OE2 3.27Å; T438-E441 WeakPolarHBondContact OG1-CB 3.08Å; T438-E441 WeakPolarHBondContact OG1-CG 3.43Å; T438-E441 PolarHBondContact OG1-N 2.88Å; T438-E441 PolarHBondContact OG1-OE2 3.47Å; T438-M442 WeakPolarHBondContact O-CB 3.45Å; T438-M442 PolarHBondContact O-N 2.85Å; T438-M442 VanDerWaalsContact O-N 3.09Å; T438-K503 WeakPolarHBondContact CA-O 3.44Å
439	I	87.6	Confident	88.9	Confident	1 Å²	1	14.8 Å²	14.8	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-64	-42	178.1	-56.3	167	0	0	0	110.5	M442 L443 T469 L502 K503 E504 W516	I439-M442 PolarHBondContact O-N 2.75Å; I439-L443 HydrophobicContact CG2-CD1 3.7Å; I439-L443 HydrophobicContact CG2-CG 4.05Å; I439-L443 WeakPolarHBondContact O-CB 3.45Å; I439-L443 WeakPolarHBondContact O-CG 3.29Å; I439-L443 PolarHBondContact O-N 3.19Å; I439-T469 HydrophobicContact CB-CG2 4.35Å; I439-T469 HydrophobicContact CG2-CG2 3.63Å; I439-L502 HydrophobicContact CG1-CB 3.76Å; I439-L502 HydrophobicContact CG1-CD1 4.31Å; I439-K503 PolarHBondContact N-O 3.25Å; I439-K503 VanDerWaalsContact N-O 3.1Å; I439-E504 HydrophobicContact CD1-CB 4.19Å; I439-E504 HydrophobicContact CD1-CG 3.6Å; I439-W516 HydrophobicContact CD1-CB 3.14Å; I439-W516 HydrophobicContact CD1-CD2 3.96Å; I439-W516 HydrophobicContact CD1-CE3 4.35Å; I439-W516 HydrophobicContact CD1-CG 3.46Å; I439-W516 VanDerWaalsContact CD1-CG 3.46Å; I439-W516 HydrophobicContact CG1-CB 4.26Å; I439-W516 HydrophobicContact CG1-CE3 4.49Å; I439-W516 HydrophobicContact CG1-CG 4.46Å; I439-W516 HydrophobicContact CG2-CD2 3.68Å; I439-W516 HydrophobicContact CG2-CE3 3.69Å; I439-W516 HydrophobicContact CG2-CG 4.24Å; I439-W516 HydrophobicContact CG2-CH2 4.23Å; I439-W516 HydrophobicContact CG2-CZ2 4.22Å; I439-W516 HydrophobicContact CG2-CZ3 3.97Å
440	Q	87.7	Confident	88.7	Confident	28 Å²	28	14.5 Å²	14.5	13%	0.131	7%	0.073	C	C	.	.	H	α-helix	trans	-61.2	-48	-177.6	-65.3	177.3	-5.1	0	0	111.5	T438 L444 A464 Y467 I472	T438-Q440 VanDerWaalsContact C-N 3.31Å; T438-Q440 PolarHBondContact O-N 3.47Å; Q440-L444 WeakPolarHBondContact O-CB 3.42Å; Q440-L444 PolarHBondContact O-N 3.26Å; Q440-A464 HydrophobicContact CB-CB 4.41Å; Q440-Y467 PolarHBondContact NE2-O 2.85Å; Q440-I472 HydrophobicContact CB-CD1 3.74Å; Q440-I472 HydrophobicContact CG-CD1 4.01Å
441	E	88.1	Confident	88.5	Confident	58 Å²	58	14.5 Å²	14.5	27%	0.271	7%	0.073	S	C	.	.	H	α-helix	trans	-67.1	-40.3	178.8	-64.6	161.4	154.2	0	0	111.3	F351 L435 T438 L444 G445 A464	F351-E441 WeakPolarHBondContact CE1-O 3.37Å; L435-E441 CarbonylContact O-C 3.59Å; L435-E441 WeakPolarHBondContact O-CB 3.46Å; T438-E441 WeakPolarHBondContact CG2-OE2 3.27Å; T438-E441 WeakPolarHBondContact OG1-CB 3.08Å; T438-E441 WeakPolarHBondContact OG1-CG 3.43Å; T438-E441 PolarHBondContact OG1-N 2.88Å; T438-E441 PolarHBondContact OG1-OE2 3.47Å; E441-L444 PolarHBondContact O-N 3.41Å; E441-G445 PolarHBondContact O-N 3.01Å; E441-A464 HydrophobicContact CG-CB 4.23Å
442	M	91.5	Very high	88.3	Confident	5 Å²	5	15.7 Å²	15.7	3%	0.025	8%	0.081	C	C	.	.	H	α-helix	trans	-64.2	-46.7	177.8	-176	-125.8	57.7	0	0	111.7	R428 L435 T438 I439 G445 C446 V496 L502	R428-M442 HydrophobicContact CB-CG 4Å; R428-M442 HydrophobicContact CB-SD 4.16Å; R428-M442 HydrophobicContact CG-CG 4.03Å; R428-M442 HydrophobicContact CG-SD 4.4Å; L435-M442 PolarHBondContact O-N 3.19Å; T438-M442 WeakPolarHBondContact O-CB 3.45Å; T438-M442 PolarHBondContact O-N 2.85Å; T438-M442 VanDerWaalsContact O-N 3.09Å; I439-M442 PolarHBondContact O-N 2.75Å; M442-G445 PolarHBondContact O-N 3.11Å; M442-C446 PolarHBondContact O-N 2.7Å; M442-C446 PolarHBondContact O-SG 3.34Å; M442-V496 HydrophobicContact SD-CG1 4.14Å; M442-V496 HydrophobicContact SD-CG2 4.17Å; M442-L502 HydrophobicContact SD-CD1 3.95Å
443	L	90.4	Very high	88.1	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.2	-41.9	178.7	-71.7	175.8	0	0	0	110.9	I439 G445 C446 C447 T469 I472 F473 L476 W516	I439-L443 HydrophobicContact CG2-CD1 3.7Å; I439-L443 HydrophobicContact CG2-CG 4.05Å; I439-L443 WeakPolarHBondContact O-CB 3.45Å; I439-L443 WeakPolarHBondContact O-CG 3.29Å; I439-L443 PolarHBondContact O-N 3.19Å; L443-G445 VanDerWaalsContact C-N 3.3Å; L443-G445 PolarHBondContact O-N 3.28Å; L443-C446 WeakPolarHBondContact O-CB 3.24Å; L443-C446 PolarHBondContact O-N 3.49Å; L443-C446 VanDerWaalsContact O-N 3.16Å; L443-C447 PolarHBondContact O-N 3.35Å; L443-C447 PolarHBondContact O-SG 2.86Å; L443-T469 HydrophobicContact CD1-CG2 4.09Å; L443-I472 HydrophobicContact CB-CG2 3.6Å; L443-F473 HydrophobicContact CD1-CB 4.38Å; L443-F473 HydrophobicContact CD1-CD2 4.49Å; L443-F473 HydrophobicContact CD2-CD2 4.4Å; L443-L476 HydrophobicContact CD2-CD2 3.77Å; L443-W516 HydrophobicContact CD1-CH2 3.85Å; L443-W516 HydrophobicContact CD1-CZ2 3.85Å; L443-W516 HydrophobicContact CD2-CH2 3.78Å; L443-W516 HydrophobicContact CD2-CZ3 4.4Å; L443-W516 HydrophobicContact CG-CH2 4.23Å
444	L	88.3	Confident	88	Confident	4 Å²	4	21.4 Å²	21.4	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-60.4	-43	175.3	178.2	57.8	0	0	0	111.2	F351 Q440 E441 C446 C447 L448 P461 A464 I472	F351-L444 HydrophobicContact CE1-CG 4.48Å; F351-L444 HydrophobicContact CE2-CD2 4.14Å; F351-L444 HydrophobicContact CZ-CD2 3.88Å; F351-L444 HydrophobicContact CZ-CG 4.18Å; Q440-L444 WeakPolarHBondContact O-CB 3.42Å; Q440-L444 PolarHBondContact O-N 3.26Å; E441-L444 PolarHBondContact O-N 3.41Å; L444-C446 VanDerWaalsContact C-N 3.3Å; L444-C446 PolarHBondContact O-N 3.36Å; L444-C447 PolarHBondContact O-N 3.24Å; L444-L448 HydrophobicContact CD1-CD1 4.08Å; L444-L448 HydrophobicContact CD1-CG 4.08Å; L444-L448 HydrophobicContact CG-CD1 3.89Å; L444-L448 HydrophobicContact CG-CG 4.35Å; L444-L448 WeakPolarHBondContact O-CB 3.44Å; L444-L448 VanDerWaalsContact O-CG 3.3Å; L444-L448 WeakPolarHBondContact O-CG 3.38Å; L444-L448 PolarHBondContact O-N 3.25Å; L444-P461 HydrophobicContact CD1-CG 3.35Å; L444-P461 HydrophobicContact CD2-CG 4.19Å; L444-P461 HydrophobicContact CG-CG 4.43Å; L444-A464 HydrophobicContact CD2-CB 3.73Å; L444-I472 HydrophobicContact CB-CG2 4.37Å
445	G	89.7	Confident	88	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-58.1	-41.1	174.1	0	0	0	0	0	112.7	E441 M442 L443 L448 E449	E441-G445 PolarHBondContact O-N 3.01Å; M442-G445 PolarHBondContact O-N 3.11Å; L443-G445 VanDerWaalsContact C-N 3.3Å; L443-G445 PolarHBondContact O-N 3.28Å; G445-L448 PolarHBondContact O-N 3.24Å; G445-E449 WeakPolarHBondContact O-CB 3.42Å; G445-E449 PolarHBondContact O-N 2.98Å
446	C	91.6	Very high	87.8	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.5	-46.6	173.4	-64.6	0	0	0	0	112.4	I426 M442 L443 L444 L448 E449 L450 L476	I426-C446 HydrophobicContact CD1-CB 4.49Å; M442-C446 PolarHBondContact O-N 2.7Å; M442-C446 PolarHBondContact O-SG 3.34Å; L443-C446 WeakPolarHBondContact O-CB 3.24Å; L443-C446 PolarHBondContact O-N 3.49Å; L443-C446 VanDerWaalsContact O-N 3.16Å; L444-C446 VanDerWaalsContact C-N 3.3Å; L444-C446 PolarHBondContact O-N 3.36Å; C446-L448 VanDerWaalsContact C-N 3.34Å; C446-L448 PolarHBondContact O-N 3.02Å; C446-E449 PolarHBondContact O-N 3.32Å; C446-L450 WeakPolarHBondContact O-CG 3.33Å; C446-L450 PolarHBondContact O-N 3.07Å; C446-L450 VanDerWaalsContact O-N 3.08Å; C446-L476 HydrophobicContact CB-CD1 3.95Å
447	C	89.2	Confident	86.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.3	-47.1	177.5	-63.8	0	0	0	0	111.1	L443 L444 E449 L450 C451 M458 L476	L443-C447 PolarHBondContact O-N 3.35Å; L443-C447 PolarHBondContact O-SG 2.86Å; L444-C447 PolarHBondContact O-N 3.24Å; C447-E449 PolarHBondContact O-N 2.93Å; C447-L450 PolarHBondContact O-N 2.86Å; C447-C451 WeakPolarHBondContact O-CB 3.17Å; C447-C451 PolarHBondContact O-N 2.95Å; C447-C451 PolarHBondContact O-SG 3.01Å; C447-M458 HydrophobicContact CB-CE 4.34Å; C447-L476 VanDerWaalsContact SG-CA 3.54Å
448	L	87.1	Confident	85.9	Confident	18 Å²	18	38.2 Å²	38.2	9%	0.094	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-42.7	180	-72.7	171.7	0	0	0	112.2	L348 F351 L444 G445 C446 C451 Q452 L460	L348-L448 HydrophobicContact CD2-CD2 3.58Å; F351-L448 HydrophobicContact CB-CB 4.44Å; F351-L448 HydrophobicContact CB-CD1 3.64Å; F351-L448 HydrophobicContact CD1-CD1 3.99Å; F351-L448 HydrophobicContact CD2-CD1 3.35Å; F351-L448 HydrophobicContact CE1-CD1 4.49Å; F351-L448 HydrophobicContact CE2-CD1 3.94Å; F351-L448 HydrophobicContact CG-CD1 3.38Å; F351-L448 HydrophobicContact CZ-CD1 4.48Å; L444-L448 HydrophobicContact CD1-CD1 4.08Å; L444-L448 HydrophobicContact CD1-CG 4.08Å; L444-L448 HydrophobicContact CG-CD1 3.89Å; L444-L448 HydrophobicContact CG-CG 4.35Å; L444-L448 WeakPolarHBondContact O-CB 3.44Å; L444-L448 VanDerWaalsContact O-CG 3.3Å; L444-L448 WeakPolarHBondContact O-CG 3.38Å; L444-L448 PolarHBondContact O-N 3.25Å; G445-L448 PolarHBondContact O-N 3.24Å; C446-L448 VanDerWaalsContact C-N 3.34Å; C446-L448 PolarHBondContact O-N 3.02Å; L448-C451 PolarHBondContact O-N 3.35Å; L448-Q452 WeakPolarHBondContact O-CB 3.33Å; L448-Q452 PolarHBondContact O-N 3.48Å; L448-L460 HydrophobicContact CD2-CB 4.34Å; L448-L460 HydrophobicContact CD2-CD1 3.52Å; L448-L460 HydrophobicContact CD2-CD2 3.41Å; L448-L460 VanDerWaalsContact CD2-CD2 3.41Å; L448-L460 HydrophobicContact CD2-CG 3.92Å; L448-L460 HydrophobicContact CG-CD2 4.46Å
449	E	89.6	Confident	84.9	Confident	16 Å²	16	45.1 Å²	45.1	8%	0.075	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-45.8	175.9	-177.3	176.2	-174	0	0	111.7	I426 R428 G445 C446 C447 Q452 Q453	I426-E449 HydrophobicContact CD1-CB 4.47Å; I426-E449 HydrophobicContact CD1-CG 4.43Å; I426-E449 WeakPolarHBondContact CG2-OE2 3.46Å; R428-E449 IonicContact CZ-OE2 3.34Å; R428-E449 IonicContact NE-OE2 3.39Å; R428-E449 IonicContact NH2-OE2 2.68Å; R428-E449 PolarHBondContact NH2-OE2 2.82Å; G445-E449 WeakPolarHBondContact O-CB 3.42Å; G445-E449 PolarHBondContact O-N 2.98Å; C446-E449 PolarHBondContact O-N 3.32Å; C447-E449 PolarHBondContact O-N 2.93Å; E449-Q452 PolarHBondContact O-N 2.98Å; E449-Q453 HydrophobicContact CG-CG 4.41Å; E449-Q453 WeakPolarHBondContact O-CB 3.49Å; E449-Q453 VanDerWaalsContact O-CG 3.31Å; E449-Q453 WeakPolarHBondContact O-CG 3.34Å; E449-Q453 PolarHBondContact O-N 3.49Å; E449-Q453 PolarHBondContact OE1-NE2 3.38Å
450	L	89.7	Confident	83.6	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-45.1	176.4	-67.8	177.1	0	0	0	111.8	C424 I426 C446 C447 Q452 Q453 F454 L456 L476 C479 V483 V492	C424-L450 HydrophobicContact CB-CD2 4.14Å; I426-L450 HydrophobicContact CD1-CD1 4.28Å; I426-L450 HydrophobicContact CD1-CD2 3.51Å; I426-L450 HydrophobicContact CD1-CG 3.6Å; I426-L450 HydrophobicContact CG1-CD2 4.42Å; C446-L450 WeakPolarHBondContact O-CG 3.33Å; C446-L450 PolarHBondContact O-N 3.07Å; C446-L450 VanDerWaalsContact O-N 3.08Å; C447-L450 PolarHBondContact O-N 2.86Å; L450-Q452 VanDerWaalsContact C-N 3.27Å; L450-Q452 PolarHBondContact O-N 3.44Å; L450-Q453 PolarHBondContact O-N 2.69Å; L450-F454 HydrophobicContact CD2-CE2 4.33Å; L450-F454 PolarHBondContact O-N 3.23Å; L450-L456 HydrophobicContact CB-CD1 4.49Å; L450-L476 HydrophobicContact CD1-CD1 3.95Å; L450-C479 HydrophobicContact CB-CB 4.32Å; L450-C479 HydrophobicContact CD1-CB 3.9Å; L450-V483 HydrophobicContact CB-CG2 4.39Å; L450-V483 HydrophobicContact CD2-CG2 4.26Å; L450-V492 HydrophobicContact CD1-CG1 4.35Å; L450-V492 HydrophobicContact CD2-CG1 4.02Å; L450-V492 HydrophobicContact CD2-CG2 4.32Å
451	C	86.8	Confident	82.4	Confident	8 Å²	8	47.4 Å²	47.4	5%	0.054	23%	0.229	C	C	.	.	H	α-helix	trans	-56.8	-43.7	177.1	-75.8	0	0	0	0	111.5	C447 L448 K455 L456	C447-C451 WeakPolarHBondContact O-CB 3.17Å; C447-C451 PolarHBondContact O-N 2.95Å; C447-C451 PolarHBondContact O-SG 3.01Å; L448-C451 PolarHBondContact O-N 3.35Å; C451-K455 CarbonylContact O-C 3.53Å; C451-K455 WeakPolarHBondContact O-CA 3.36Å; C451-K455 PolarHBondContact O-N 2.89Å; C451-L456 HydrophobicContact CB-CB 4.29Å; C451-L456 PolarHBondContact O-N 3.44Å
452	Q	83.6	Confident	81.1	Confident	89 Å²	89	49.8 Å²	49.8	42%	0.416	24%	0.244	S	C	.	.	H	α-helix	trans	-69.9	-49.1	179.2	-173.8	-179.1	2.2	0	0	112.2	K352 L448 E449 L450 F454 K455	K352-Q452 VanDerWaalsContact CD-NE2 3.31Å; L448-Q452 WeakPolarHBondContact O-CB 3.33Å; L448-Q452 PolarHBondContact O-N 3.48Å; E449-Q452 PolarHBondContact O-N 2.98Å; L450-Q452 VanDerWaalsContact C-N 3.27Å; L450-Q452 PolarHBondContact O-N 3.44Å; Q452-F454 VanDerWaalsContact C-N 3.32Å; Q452-F454 PolarHBondContact O-N 3.49Å; Q452-K455 PolarHBondContact O-N 2.95Å
453	Q	86.5	Confident	79.6	Confident	91 Å²	91	52.9 Å²	52.9	43%	0.425	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-39.2	-176.8	-74	-175.9	16.1	0	0	112.2	C424 E449 L450	C424-Q453 PolarHBondContact SG-OE1 3.27Å; E449-Q453 HydrophobicContact CG-CG 4.41Å; E449-Q453 WeakPolarHBondContact O-CB 3.49Å; E449-Q453 VanDerWaalsContact O-CG 3.31Å; E449-Q453 WeakPolarHBondContact O-CG 3.34Å; E449-Q453 PolarHBondContact O-N 3.49Å; E449-Q453 PolarHBondContact OE1-NE2 3.38Å; L450-Q453 PolarHBondContact O-N 2.69Å
454	F	87.1	Confident	78.1	Confident	42 Å²	42	53.5 Å²	53.5	18%	0.184	27%	0.265	C	S	.	.	H	α-helix	trans	-104.4	4.2	-176.3	-65.7	-85.2	0	0	0	114	C424 L450 Q452 L456 V483 K486 T487	C424-F454 HydrophobicContact CB-CE2 3.72Å; C424-F454 HydrophobicContact CB-CZ 3.91Å; L450-F454 HydrophobicContact CD2-CE2 4.33Å; L450-F454 PolarHBondContact O-N 3.23Å; Q452-F454 VanDerWaalsContact C-N 3.32Å; Q452-F454 PolarHBondContact O-N 3.49Å; F454-L456 HydrophobicContact CB-CD2 3.72Å; F454-L456 HydrophobicContact CB-CG 4.1Å; F454-L456 PolarHBondContact O-N 2.97Å; F454-V483 HydrophobicContact CB-CG2 4.19Å; F454-V483 HydrophobicContact CD1-CG1 4.26Å; F454-V483 HydrophobicContact CD1-CG2 4.5Å; F454-V483 HydrophobicContact CD2-CB 4.41Å; F454-V483 HydrophobicContact CD2-CG1 4.02Å; F454-V483 HydrophobicContact CD2-CG2 3.53Å; F454-V483 HydrophobicContact CE1-CG1 3.96Å; F454-V483 HydrophobicContact CE2-CG1 3.71Å; F454-V483 HydrophobicContact CE2-CG2 4Å; F454-V483 HydrophobicContact CG-CG1 4.29Å; F454-V483 HydrophobicContact CG-CG2 3.81Å; F454-V483 HydrophobicContact CZ-CG1 3.67Å; F454-K486 HydrophobicContact CB-CD 4.35Å; F454-K486 PolarHBondContact O-NZ 3.45Å; F454-T487 HydrophobicContact CD1-CG2 4.33Å; F454-T487 HydrophobicContact CE1-CG2 3.54Å; F454-T487 HydrophobicContact CZ-CG2 4.18Å
455	K	84.2	Confident	76.8	Confident	177 Å²	177	57.6 Å²	57.6	77%	0.77	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	58.3	-175.6	-58.5	-177.3	-179.4	-174.7	0	111.2	C451 Q452 K486	C451-K455 CarbonylContact O-C 3.53Å; C451-K455 WeakPolarHBondContact O-CA 3.36Å; C451-K455 PolarHBondContact O-N 2.89Å; Q452-K455 PolarHBondContact O-N 2.95Å; K455-K486 PolarHBondContact O-NZ 3.32Å
456	L	83	Confident	75.8	Confident	17 Å²	17	63.5 Å²	63.5	9%	0.089	32%	0.319	C	S	.	.			trans	-79.4	138.6	178.2	-53	-176.8	0	0	0	109.5	L450 C451 F454 M458 C479 Q482 V483 K486	L450-L456 HydrophobicContact CB-CD1 4.49Å; C451-L456 HydrophobicContact CB-CB 4.29Å; C451-L456 PolarHBondContact O-N 3.44Å; F454-L456 HydrophobicContact CB-CD2 3.72Å; F454-L456 HydrophobicContact CB-CG 4.1Å; F454-L456 PolarHBondContact O-N 2.97Å; L456-M458 PolarHBondContact O-N 3.39Å; L456-C479 HydrophobicContact CD1-CB 4Å; L456-Q482 HydrophobicContact CD1-CB 4.26Å; L456-Q482 HydrophobicContact CD2-CB 3.82Å; L456-V483 HydrophobicContact CD1-CG2 4.16Å; L456-K486 HydrophobicContact CD2-CD 4.04Å
457	E	69.2	Low	75	Confident	188 Å²	188	66.8 Å²	66.8	88%	0.879	33%	0.332	S	S	*	.			trans	-84.9	103.8	172.4	-68.3	177.1	-175.9	0	0	107.5
458	M	66.1	Low	74.6	Confident	44 Å²	44	69.3 Å²	69.3	22%	0.217	35%	0.35	C	S	.	.			trans	-142.3	139.9	176.2	-166.1	170.2	75.4	0	0	109.9	C447 L456 L460 W475	C447-M458 HydrophobicContact CB-CE 4.34Å; L456-M458 PolarHBondContact O-N 3.39Å; M458-L460 VanDerWaalsContact C-N 3.32Å; M458-L460 HydrophobicContact CE-CD2 3.54Å; M458-L460 PolarHBondContact O-N 3.47Å; M458-W475 HydrophobicContact SD-CB 4.31Å
459	D	66.1	Low	74.4	Confident	160 Å²	160	69.6 Å²	69.6	86%	0.856	35%	0.352	S	S	*	.			trans	-70.1	91.2	170.4	-68.1	-33.1	0	0	0	108.4
460	L	61.2	Low	74.1	Confident	62 Å²	62	72.9 Å²	72.9	33%	0.325	37%	0.368	S	S	.	.			trans	-67.3	136.7	-176.9	-68.4	172.5	0	0	0	110.5	L348 L448 M458	L348-L460 HydrophobicContact CD2-CD1 3.71Å; L448-L460 HydrophobicContact CD2-CB 4.34Å; L448-L460 HydrophobicContact CD2-CD1 3.52Å; L448-L460 HydrophobicContact CD2-CD2 3.41Å; L448-L460 VanDerWaalsContact CD2-CD2 3.41Å; L448-L460 HydrophobicContact CD2-CG 3.92Å; L448-L460 HydrophobicContact CG-CD2 4.46Å; M458-L460 VanDerWaalsContact C-N 3.32Å; M458-L460 HydrophobicContact CE-CD2 3.54Å; M458-L460 PolarHBondContact O-N 3.47Å
461	P	60.8	Low	73.9	Confident	16 Å²	16	77.1 Å²	77.1	10%	0.104	39%	0.388	C	S	.	.			trans	-69.5	134.2	-179.9	27.6	-34.9	0	0	0	111.8	L444 L463 Y467 W475	L444-P461 HydrophobicContact CD1-CG 3.35Å; L444-P461 HydrophobicContact CD2-CG 4.19Å; L444-P461 HydrophobicContact CG-CG 4.43Å; P461-L463 VanDerWaalsContact C-N 3.27Å; P461-L463 PolarHBondContact O-N 2.95Å; P461-Y467 HydrophobicContact CB-CD2 3.68Å; P461-Y467 HydrophobicContact CB-CE2 3.12Å; P461-Y467 HydrophobicContact CG-CE2 4.39Å; P461-W475 HydrophobicContact CB-CH2 4.11Å; P461-W475 HydrophobicContact CB-CZ3 4.03Å; P461-W475 HydrophobicContact CG-CE3 4.5Å; P461-W475 HydrophobicContact CG-CH2 4.31Å; P461-W475 HydrophobicContact CG-CZ3 3.77Å
462	D	61.2	Low	73.9	Confident	108 Å²	108	76.8 Å²	76.8	58%	0.578	39%	0.385	S	S	*	.	S	Bend	trans	-60.4	-35.6	173.6	-60	-32.2	0	0	0	112.7	L347 K466	L347-D462 WeakPolarHBondContact CD1-O 3.26Å; D462-K466 IonicContact OD2-NZ 3.16Å
463	L	59.7	Low	74.1	Confident	69 Å²	69	72.7 Å²	72.7	36%	0.361	37%	0.366	S	S	.	.			trans	-147.6	131.9	-175.8	-103.1	97.6	0	0	0	110.7	P461 S465 K466 Y467	P461-L463 VanDerWaalsContact C-N 3.27Å; P461-L463 PolarHBondContact O-N 2.95Å; L463-S465 VanDerWaalsContact C-N 3.28Å; L463-S465 WeakPolarHBondContact CD2-OG 3.47Å; L463-S465 PolarHBondContact O-N 3.35Å; L463-K466 HydrophobicContact CB-CD 4.31Å; L463-K466 HydrophobicContact CB-CG 4.21Å; L463-K466 PolarHBondContact O-N 3.42Å; L463-Y467 VanDerWaalsContact O-CD2 3.27Å; L463-Y467 WeakPolarHBondContact O-CD2 3.44Å; L463-Y467 WeakPolarHBondContact O-CE2 3.34Å
464	A	59.3	Low	74.2	Confident	13 Å²	13	71.3 Å²	71.3	11%	0.107	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-56.9	-40	175.5	0	0	0	0	0	112.7	Q440 E441 L444 K466 Y467	Q440-A464 HydrophobicContact CB-CB 4.41Å; E441-A464 HydrophobicContact CG-CB 4.23Å; L444-A464 HydrophobicContact CD2-CB 3.73Å; A464-K466 PolarHBondContact O-N 3.22Å; A464-Y467 PolarHBondContact O-N 3.25Å
465	S	62	Low	74.1	Confident	90 Å²	90	72.3 Å²	72.3	63%	0.629	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-64.2	-14	-174.5	61.1	0	0	0	0	115.1	L463 Y467	L463-S465 VanDerWaalsContact C-N 3.28Å; L463-S465 WeakPolarHBondContact CD2-OG 3.47Å; L463-S465 PolarHBondContact O-N 3.35Å; S465-Y467 VanDerWaalsContact C-N 3.29Å
466	K	67.7	Low	74.4	Confident	125 Å²	125	64 Å²	64	54%	0.543	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-79.1	-14.3	177	-67.1	179.4	-178.5	174	0	112.7	D462 L463 A464	D462-K466 IonicContact OD2-NZ 3.16Å; L463-K466 HydrophobicContact CB-CD 4.31Å; L463-K466 HydrophobicContact CB-CG 4.21Å; L463-K466 PolarHBondContact O-N 3.42Å; A464-K466 PolarHBondContact O-N 3.22Å
467	Y	73.9	Confident	74.7	Confident	69 Å²	69	65.1 Å²	65.1	27%	0.271	33%	0.333	S	S	.	.	S	Bend	trans	-120.7	145.6	-167.9	-57.5	-76.9	0	0	0	111.8	Q440 P461 L463 A464 S465 W475	Q440-Y467 PolarHBondContact NE2-O 2.85Å; P461-Y467 HydrophobicContact CB-CD2 3.68Å; P461-Y467 HydrophobicContact CB-CE2 3.12Å; P461-Y467 HydrophobicContact CG-CE2 4.39Å; L463-Y467 VanDerWaalsContact O-CD2 3.27Å; L463-Y467 WeakPolarHBondContact O-CD2 3.44Å; L463-Y467 WeakPolarHBondContact O-CE2 3.34Å; A464-Y467 PolarHBondContact O-N 3.25Å; S465-Y467 VanDerWaalsContact C-N 3.29Å; Y467-W475 AromaticContact CD1-CH2 3.29Å; Y467-W475 HydrophobicContact CD1-CH2 3.29Å; Y467-W475 AromaticContact CD1-CZ2 3.91Å; Y467-W475 HydrophobicContact CD1-CZ2 3.91Å; Y467-W475 HydrophobicContact CD1-CZ3 4.19Å; Y467-W475 AromaticContact CD2-CH2 3.77Å; Y467-W475 HydrophobicContact CD2-CH2 3.77Å; Y467-W475 HydrophobicContact CD2-CZ3 4.05Å; Y467-W475 AromaticContact CE1-CH2 3.46Å; Y467-W475 HydrophobicContact CE1-CH2 3.46Å; Y467-W475 VanDerWaalsContact CE1-CH2 3.46Å; Y467-W475 AromaticContact CE1-CZ2 3.95Å; Y467-W475 HydrophobicContact CE1-CZ2 3.95Å; Y467-W475 AromaticContact CE2-CH2 3.95Å; Y467-W475 HydrophobicContact CE2-CH2 3.95Å; Y467-W475 AromaticContact CG-CH2 3.42Å; Y467-W475 HydrophobicContact CG-CH2 3.42Å; Y467-W475 VanDerWaalsContact CG-CH2 3.42Å; Y467-W475 HydrophobicContact CG-CZ2 4.43Å; Y467-W475 AromaticContact CG-CZ3 3.87Å; Y467-W475 HydrophobicContact CG-CZ3 3.87Å; Y467-W475 AromaticContact CZ-CH2 3.76Å
468	S	81.7	Confident	75.6	Confident	54 Å²	54	59.2 Å²	59.2	38%	0.378	31%	0.31	S	S	.	.			trans	-72.1	152.7	173	66.8	0	0	0	0	110.9	Q470 Q471 I472	S468-Q470 PolarHBondContact O-N 3.41Å; S468-Q470 VanDerWaalsContact O-N 3.17Å; S468-Q471 PolarHBondContact O-N 2.92Å; S468-Q471 VanDerWaalsContact O-N 3.09Å; S468-Q471 VanDerWaalsContact OG-CD 3.28Å; S468-Q471 VanDerWaalsContact OG-CG 3.23Å; S468-Q471 WeakPolarHBondContact OG-CG 3.41Å; S468-Q471 PolarHBondContact OG-N 3.36Å; S468-Q471 PolarHBondContact OG-OE1 3.16Å; S468-Q471 VanDerWaalsContact OG-OE1 3.05Å; S468-I472 PolarHBondContact O-N 3.49Å; S468-I472 VanDerWaalsContact O-N 3.15Å
469	T	82.8	Confident	76.7	Confident	23 Å²	23	57.2 Å²	57.2	14%	0.141	30%	0.3	C	S	.	.	H	α-helix	trans	-55.4	-34.8	176.2	-48.5	0	0	0	0	112.3	I439 L443 F473 W516	I439-T469 HydrophobicContact CB-CG2 4.35Å; I439-T469 HydrophobicContact CG2-CG2 3.63Å; L443-T469 HydrophobicContact CD1-CG2 4.09Å; T469-F473 WeakPolarHBondContact O-CB 3.4Å; T469-F473 PolarHBondContact O-N 2.84Å; T469-W516 HydrophobicContact CG2-CZ2 4.45Å
470	Q	84.3	Confident	77.9	Confident	86 Å²	86	49.6 Å²	49.6	40%	0.402	26%	0.26	S	S	.	.	H	α-helix	trans	-68.1	-44.2	177.3	-64.6	-64.1	-20	0	0	112.1	S468 I472 F473 D474	S468-Q470 PolarHBondContact O-N 3.41Å; S468-Q470 VanDerWaalsContact O-N 3.17Å; Q470-I472 VanDerWaalsContact C-N 3.33Å; Q470-I472 PolarHBondContact O-N 3.38Å; Q470-F473 WeakPolarHBondContact O-CB 3.27Å; Q470-F473 PolarHBondContact O-N 3.08Å; Q470-F473 VanDerWaalsContact O-N 3.15Å; Q470-D474 VanDerWaalsContact O-CG 3.28Å; Q470-D474 PolarHBondContact O-N 3.24Å
471	Q	85.3	Confident	79.2	Confident	89 Å²	89	49.9 Å²	49.9	42%	0.416	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-42.6	177	-75	164.9	-31.5	0	0	112	S468 F473 D474 W475	S468-Q471 PolarHBondContact O-N 2.92Å; S468-Q471 VanDerWaalsContact O-N 3.09Å; S468-Q471 VanDerWaalsContact OG-CD 3.28Å; S468-Q471 VanDerWaalsContact OG-CG 3.23Å; S468-Q471 WeakPolarHBondContact OG-CG 3.41Å; S468-Q471 PolarHBondContact OG-N 3.36Å; S468-Q471 PolarHBondContact OG-OE1 3.16Å; S468-Q471 VanDerWaalsContact OG-OE1 3.05Å; Q471-F473 VanDerWaalsContact C-N 3.29Å; Q471-F473 PolarHBondContact O-N 2.89Å; Q471-D474 PolarHBondContact O-N 3.23Å; Q471-W475 VanDerWaalsContact O-CG 3.28Å; Q471-W475 PolarHBondContact O-N 2.7Å
472	I	86.3	Confident	80.6	Confident	1 Å²	1	52 Å²	52	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-66.1	-37	177.7	-56.6	171.3	0	0	0	110.5	Q440 L443 L444 S468 Q470 W475 L476	Q440-I472 HydrophobicContact CB-CD1 3.74Å; Q440-I472 HydrophobicContact CG-CD1 4.01Å; L443-I472 HydrophobicContact CB-CG2 3.6Å; L444-I472 HydrophobicContact CB-CG2 4.37Å; S468-I472 PolarHBondContact O-N 3.49Å; S468-I472 VanDerWaalsContact O-N 3.15Å; Q470-I472 VanDerWaalsContact C-N 3.33Å; Q470-I472 PolarHBondContact O-N 3.38Å; I472-W475 HydrophobicContact CB-CE3 4.25Å; I472-W475 HydrophobicContact CG1-CE3 4.09Å; I472-W475 HydrophobicContact CG1-CZ3 3.94Å; I472-W475 HydrophobicContact CG2-CE3 4.42Å; I472-W475 WeakPolarHBondContact O-CB 3.43Å; I472-W475 PolarHBondContact O-N 2.93Å; I472-L476 PolarHBondContact O-N 2.86Å
473	F	87.7	Confident	81.8	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.009	24%	0.242	C	C	.	.	H	α-helix	trans	-67.9	-40.6	175.3	-172.2	-96.5	0	0	0	112.8	L443 T469 Q470 Q471 W475 L476 E477 W516 P518 R520 P522	L443-F473 HydrophobicContact CD1-CB 4.38Å; L443-F473 HydrophobicContact CD1-CD2 4.49Å; L443-F473 HydrophobicContact CD2-CD2 4.4Å; T469-F473 WeakPolarHBondContact O-CB 3.4Å; T469-F473 PolarHBondContact O-N 2.84Å; Q470-F473 WeakPolarHBondContact O-CB 3.27Å; Q470-F473 PolarHBondContact O-N 3.08Å; Q470-F473 VanDerWaalsContact O-N 3.15Å; Q471-F473 VanDerWaalsContact C-N 3.29Å; Q471-F473 PolarHBondContact O-N 2.89Å; F473-W475 PolarHBondContact O-N 2.84Å; F473-L476 HydrophobicContact CD2-CD2 4.39Å; F473-L476 HydrophobicContact CE2-CD2 4.41Å; F473-L476 WeakPolarHBondContact O-CA 3.42Å; F473-L476 WeakPolarHBondContact O-CB 3.25Å; F473-L476 PolarHBondContact O-N 3.27Å; F473-E477 PolarHBondContact O-N 3.34Å; F473-W516 HydrophobicContact CD2-CH2 4.2Å; F473-W516 HydrophobicContact CD2-CZ2 4.04Å; F473-P518 HydrophobicContact CE2-CB 3.66Å; F473-P518 HydrophobicContact CE2-CG 3.84Å; F473-P518 HydrophobicContact CZ-CB 3.65Å; F473-P518 HydrophobicContact CZ-CG 4.31Å; F473-R520 WeakPolarHBondContact CE1-O 3.41Å; F473-R520 VanDerWaalsContact CZ-O 3.26Å; F473-R520 WeakPolarHBondContact CZ-O 3.31Å; F473-P522 HydrophobicContact CZ-CG 4.25Å
474	D	88.4	Confident	83.2	Confident	63 Å²	63	43.8 Å²	43.8	34%	0.337	23%	0.227	S	C	.	.	H	α-helix	trans	-62.2	-33.1	174.5	-66.7	-30.7	0	0	0	111.1	Q470 Q471 T478 R520	Q470-D474 VanDerWaalsContact O-CG 3.28Å; Q470-D474 PolarHBondContact O-N 3.24Å; Q471-D474 PolarHBondContact O-N 3.23Å; D474-T478 PolarHBondContact O-N 3.1Å; D474-T478 PolarHBondContact O-OG1 2.9Å; D474-R520 IonicContact OD1-NH2 3.37Å; D474-R520 PolarHBondContact OD1-NH2 3.19Å
475	W	86.1	Confident	84.6	Confident	63 Å²	63	52.7 Å²	52.7	24%	0.239	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-42.2	170.2	-62.4	-28.4	0	0	0	112.5	M458 P461 Y467 Q471 I472 F473 E477 T478 C479	M458-W475 HydrophobicContact SD-CB 4.31Å; P461-W475 HydrophobicContact CB-CH2 4.11Å; P461-W475 HydrophobicContact CB-CZ3 4.03Å; P461-W475 HydrophobicContact CG-CE3 4.5Å; P461-W475 HydrophobicContact CG-CH2 4.31Å; P461-W475 HydrophobicContact CG-CZ3 3.77Å; Y467-W475 AromaticContact CD1-CH2 3.29Å; Y467-W475 HydrophobicContact CD1-CH2 3.29Å; Y467-W475 AromaticContact CD1-CZ2 3.91Å; Y467-W475 HydrophobicContact CD1-CZ2 3.91Å; Y467-W475 HydrophobicContact CD1-CZ3 4.19Å; Y467-W475 AromaticContact CD2-CH2 3.77Å; Y467-W475 HydrophobicContact CD2-CH2 3.77Å; Y467-W475 HydrophobicContact CD2-CZ3 4.05Å; Y467-W475 AromaticContact CE1-CH2 3.46Å; Y467-W475 HydrophobicContact CE1-CH2 3.46Å; Y467-W475 VanDerWaalsContact CE1-CH2 3.46Å; Y467-W475 AromaticContact CE1-CZ2 3.95Å; Y467-W475 HydrophobicContact CE1-CZ2 3.95Å; Y467-W475 AromaticContact CE2-CH2 3.95Å; Y467-W475 HydrophobicContact CE2-CH2 3.95Å; Y467-W475 AromaticContact CG-CH2 3.42Å; Y467-W475 HydrophobicContact CG-CH2 3.42Å; Y467-W475 VanDerWaalsContact CG-CH2 3.42Å; Y467-W475 HydrophobicContact CG-CZ2 4.43Å; Y467-W475 AromaticContact CG-CZ3 3.87Å; Y467-W475 HydrophobicContact CG-CZ3 3.87Å; Y467-W475 AromaticContact CZ-CH2 3.76Å; Q471-W475 VanDerWaalsContact O-CG 3.28Å; Q471-W475 PolarHBondContact O-N 2.7Å; I472-W475 HydrophobicContact CB-CE3 4.25Å; I472-W475 HydrophobicContact CG1-CE3 4.09Å; I472-W475 HydrophobicContact CG1-CZ3 3.94Å; I472-W475 HydrophobicContact CG2-CE3 4.42Å; I472-W475 WeakPolarHBondContact O-CB 3.43Å; I472-W475 PolarHBondContact O-N 2.93Å; F473-W475 PolarHBondContact O-N 2.84Å; W475-E477 VanDerWaalsContact C-N 3.28Å; W475-E477 PolarHBondContact O-N 3.41Å; W475-T478 CarbonylContact O-C 3.54Å; W475-T478 WeakPolarHBondContact O-CB 3.41Å; W475-T478 PolarHBondContact O-N 3.43Å; W475-T478 VanDerWaalsContact O-N 3.14Å; W475-C479 PolarHBondContact O-N 3.23Å; W475-C479 PolarHBondContact O-SG 3.24Å
476	L	90	Very high	85.9	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-43	174.9	-175.3	64.2	0	0	0	111	L443 C446 C447 L450 I472 F473 T478 C479 C480 L494 M525	L443-L476 HydrophobicContact CD2-CD2 3.77Å; C446-L476 HydrophobicContact CB-CD1 3.95Å; C447-L476 VanDerWaalsContact SG-CA 3.54Å; L450-L476 HydrophobicContact CD1-CD1 3.95Å; I472-L476 PolarHBondContact O-N 2.86Å; F473-L476 HydrophobicContact CD2-CD2 4.39Å; F473-L476 HydrophobicContact CE2-CD2 4.41Å; F473-L476 WeakPolarHBondContact O-CA 3.42Å; F473-L476 WeakPolarHBondContact O-CB 3.25Å; F473-L476 PolarHBondContact O-N 3.27Å; L476-T478 VanDerWaalsContact C-N 3.34Å; L476-T478 PolarHBondContact O-N 3.48Å; L476-C479 WeakPolarHBondContact O-CB 3.48Å; L476-C479 PolarHBondContact O-N 2.89Å; L476-C480 PolarHBondContact O-N 3.33Å; L476-C480 PolarHBondContact O-SG 3.4Å; L476-L494 HydrophobicContact CD2-CD2 4.27Å; L476-M525 HydrophobicContact CD2-CE 3.91Å
477	E	88.8	Confident	86.8	Confident	39 Å²	39	48.6 Å²	48.6	18%	0.182	23%	0.232	C	C	.	.	H	α-helix	trans	-56.7	-47.3	173.3	177.1	163	-150	0	0	110.9	F473 W475 C479 C480 D481 R520 P522	F473-E477 PolarHBondContact O-N 3.34Å; W475-E477 VanDerWaalsContact C-N 3.28Å; W475-E477 PolarHBondContact O-N 3.41Å; E477-C479 PolarHBondContact O-N 3.21Å; E477-C480 PolarHBondContact O-N 3.17Å; E477-D481 PolarHBondContact O-N 3.32Å; E477-R520 IonicContact OE1-NH1 3.87Å; E477-R520 IonicContact OE2-NH1 3.02Å; E477-R520 PolarHBondContact OE2-NH1 3.36Å; E477-P522 HydrophobicContact CB-CB 4.44Å; E477-P522 HydrophobicContact CB-CG 3.87Å; E477-P522 HydrophobicContact CG-CB 3.98Å; E477-P522 HydrophobicContact CG-CG 3.86Å
478	T	89	Confident	87.5	Confident	65 Å²	65	51.3 Å²	51.3	40%	0.399	26%	0.259	S	S	.	.	H	α-helix	trans	-61.6	-42.5	176	-56.6	0	0	0	0	112.3	D474 W475 L476 D481 Q482	D474-T478 PolarHBondContact O-N 3.1Å; D474-T478 PolarHBondContact O-OG1 2.9Å; W475-T478 CarbonylContact O-C 3.54Å; W475-T478 WeakPolarHBondContact O-CB 3.41Å; W475-T478 PolarHBondContact O-N 3.43Å; W475-T478 VanDerWaalsContact O-N 3.14Å; L476-T478 VanDerWaalsContact C-N 3.34Å; L476-T478 PolarHBondContact O-N 3.48Å; T478-D481 PolarHBondContact O-N 2.89Å; T478-Q482 WeakPolarHBondContact O-CG 3.26Å; T478-Q482 PolarHBondContact O-N 3.35Å
479	C	89.2	Confident	87.6	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.007	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-45.9	175.6	-68.7	0	0	0	0	111	L450 L456 W475 L476 E477 D481 Q482 V483	L450-C479 HydrophobicContact CB-CB 4.32Å; L450-C479 HydrophobicContact CD1-CB 3.9Å; L456-C479 HydrophobicContact CD1-CB 4Å; W475-C479 PolarHBondContact O-N 3.23Å; W475-C479 PolarHBondContact O-SG 3.24Å; L476-C479 WeakPolarHBondContact O-CB 3.48Å; L476-C479 PolarHBondContact O-N 2.89Å; E477-C479 PolarHBondContact O-N 3.21Å; C479-D481 VanDerWaalsContact C-N 3.32Å; C479-D481 PolarHBondContact O-N 2.87Å; C479-Q482 PolarHBondContact O-N 2.92Å; C479-V483 VanDerWaalsContact O-CG2 3.22Å; C479-V483 WeakPolarHBondContact O-CG2 3.5Å; C479-V483 PolarHBondContact O-N 2.93Å
480	C	90.1	Very high	88	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.007	27%	0.272	C	S	.	.	H	α-helix	trans	-59.2	-42	177.6	-72	0	0	0	0	112	L476 E477 V483 A484 V492	L476-C480 PolarHBondContact O-N 3.33Å; L476-C480 PolarHBondContact O-SG 3.4Å; E477-C480 PolarHBondContact O-N 3.17Å; C480-V483 PolarHBondContact O-N 3.22Å; C480-A484 WeakPolarHBondContact O-CB 3.34Å; C480-A484 PolarHBondContact O-N 3.27Å; C480-V492 HydrophobicContact CB-CG2 4.45Å
481	D	89.1	Confident	88.3	Confident	67 Å²	67	49.6 Å²	49.6	36%	0.358	26%	0.256	S	S	.	.	H	α-helix	trans	-67	-39.7	177.7	-77.6	-17.5	0	0	0	112.8	E477 T478 C479 A484 Y485 N524	E477-D481 PolarHBondContact O-N 3.32Å; T478-D481 PolarHBondContact O-N 2.89Å; C479-D481 VanDerWaalsContact C-N 3.32Å; C479-D481 PolarHBondContact O-N 2.87Å; D481-A484 PolarHBondContact O-N 3.34Å; D481-Y485 PolarHBondContact O-N 3.44Å; D481-N524 PolarHBondContact OD1-ND2 3.28Å
482	Q	88.9	Confident	88.6	Confident	61 Å²	61	45.5 Å²	45.5	29%	0.285	24%	0.237	S	C	.	.	H	α-helix	trans	-66.5	-38.2	174.4	-68.8	-175.2	23	0	0	112.3	L456 T478 C479 Y485 K486	L456-Q482 HydrophobicContact CD1-CB 4.26Å; L456-Q482 HydrophobicContact CD2-CB 3.82Å; T478-Q482 WeakPolarHBondContact O-CG 3.26Å; T478-Q482 PolarHBondContact O-N 3.35Å; C479-Q482 PolarHBondContact O-N 2.92Å; Q482-Y485 PolarHBondContact O-N 3.2Å; Q482-K486 PolarHBondContact O-N 3.46Å
483	V	88.3	Confident	88.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-44.3	174.5	172.9	0	0	0	0	110.2	L450 F454 L456 C479 C480 Y485 K486 T487 V492	L450-V483 HydrophobicContact CB-CG2 4.39Å; L450-V483 HydrophobicContact CD2-CG2 4.26Å; F454-V483 HydrophobicContact CB-CG2 4.19Å; F454-V483 HydrophobicContact CD1-CG1 4.26Å; F454-V483 HydrophobicContact CD1-CG2 4.5Å; F454-V483 HydrophobicContact CD2-CB 4.41Å; F454-V483 HydrophobicContact CD2-CG1 4.02Å; F454-V483 HydrophobicContact CD2-CG2 3.53Å; F454-V483 HydrophobicContact CE1-CG1 3.96Å; F454-V483 HydrophobicContact CE2-CG1 3.71Å; F454-V483 HydrophobicContact CE2-CG2 4Å; F454-V483 HydrophobicContact CG-CG1 4.29Å; F454-V483 HydrophobicContact CG-CG2 3.81Å; F454-V483 HydrophobicContact CZ-CG1 3.67Å; L456-V483 HydrophobicContact CD1-CG2 4.16Å; C479-V483 VanDerWaalsContact O-CG2 3.22Å; C479-V483 WeakPolarHBondContact O-CG2 3.5Å; C479-V483 PolarHBondContact O-N 2.93Å; C480-V483 PolarHBondContact O-N 3.22Å; V483-Y485 VanDerWaalsContact C-N 3.34Å; V483-Y485 PolarHBondContact O-N 3.17Å; V483-K486 PolarHBondContact O-N 3.11Å; V483-T487 HydrophobicContact CG1-CG2 4.11Å; V483-T487 WeakPolarHBondContact O-CB 3.36Å; V483-T487 VanDerWaalsContact O-CG2 3.3Å; V483-T487 WeakPolarHBondContact O-CG2 3.42Å; V483-T487 PolarHBondContact O-N 2.99Å; V483-T487 PolarHBondContact O-OG1 2.85Å; V483-V492 HydrophobicContact CB-CG2 3.97Å; V483-V492 HydrophobicContact CG1-CG2 3.65Å
484	A	88.3	Confident	89.3	Confident	4 Å²	4	45.5 Å²	45.5	3%	0.033	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-45.1	175.2	0	0	0	0	0	111.3	C480 D481 K486 T487 C488 G489 N524	C480-A484 WeakPolarHBondContact O-CB 3.34Å; C480-A484 PolarHBondContact O-N 3.27Å; D481-A484 PolarHBondContact O-N 3.34Å; A484-K486 VanDerWaalsContact C-N 3.34Å; A484-K486 PolarHBondContact O-N 2.98Å; A484-T487 WeakPolarHBondContact CA-OG1 3.32Å; A484-T487 PolarHBondContact O-N 3.47Å; A484-T487 PolarHBondContact O-OG1 2.9Å; A484-C488 PolarHBondContact O-N 3.03Å; A484-C488 VanDerWaalsContact O-N 3.11Å; A484-G489 PolarHBondContact O-N 2.67Å; A484-N524 HydrophobicContact CB-CB 3.58Å; A484-N524 WeakPolarHBondContact CB-ND2 3.43Å
485	Y	88.2	Confident	89.7	Confident	201 Å²	201	42.5 Å²	42.5	79%	0.788	22%	0.221	S	C	*	.	H	α-helix	trans	-58	-44.5	175.4	-179.3	-98.8	0	0	0	112.3	D481 Q482 V483	D481-Y485 PolarHBondContact O-N 3.44Å; Q482-Y485 PolarHBondContact O-N 3.2Å; V483-Y485 VanDerWaalsContact C-N 3.34Å; V483-Y485 PolarHBondContact O-N 3.17Å
486	K	89.1	Confident	90.1	Very high	106 Å²	106	39.6 Å²	39.6	46%	0.461	21%	0.21	S	C	.	.	H	α-helix	trans	-72.4	-25.1	179	-75.9	-179.3	170.4	175.1	0	114	F454 K455 L456 Q482 V483 A484	F454-K486 HydrophobicContact CB-CD 4.35Å; F454-K486 PolarHBondContact O-NZ 3.45Å; K455-K486 PolarHBondContact O-NZ 3.32Å; L456-K486 HydrophobicContact CD2-CD 4.04Å; Q482-K486 PolarHBondContact O-N 3.46Å; V483-K486 PolarHBondContact O-N 3.11Å; A484-K486 VanDerWaalsContact C-N 3.34Å; A484-K486 PolarHBondContact O-N 2.98Å
487	T	87.7	Confident	90.4	Very high	23 Å²	23	39.8 Å²	39.8	14%	0.141	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	10.2	-177.1	57.9	0	0	0	0	113.5	F454 V483 A484 K490	F454-T487 HydrophobicContact CD1-CG2 4.33Å; F454-T487 HydrophobicContact CE1-CG2 3.54Å; F454-T487 HydrophobicContact CZ-CG2 4.18Å; V483-T487 HydrophobicContact CG1-CG2 4.11Å; V483-T487 WeakPolarHBondContact O-CB 3.36Å; V483-T487 VanDerWaalsContact O-CG2 3.3Å; V483-T487 WeakPolarHBondContact O-CG2 3.42Å; V483-T487 PolarHBondContact O-N 2.99Å; V483-T487 PolarHBondContact O-OG1 2.85Å; A484-T487 WeakPolarHBondContact CA-OG1 3.32Å; A484-T487 PolarHBondContact O-N 3.47Å; A484-T487 PolarHBondContact O-OG1 2.9Å; T487-K490 WeakPolarHBondContact O-CG 3.38Å; T487-K490 PolarHBondContact OG1-N 3.1Å; T487-K490 PolarHBondContact OG1-O 2.82Å
488	C	87.9	Confident	90.5	Very high	125 Å²	125	38.9 Å²	38.9	85%	0.845	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	40.3	-177.5	-55.4	0	0	0	0	113.9	A484	A484-C488 PolarHBondContact O-N 3.03Å; A484-C488 VanDerWaalsContact O-N 3.11Å
489	G	84.7	Confident	90.5	Very high	46 Å²	46	35.9 Å²	35.9	47%	0.474	19%	0.189	S	C	.	.	S	Bend	trans	90	14.5	175.1	0	0	0	0	0	114.9	A484	A484-G489 PolarHBondContact O-N 2.67Å
490	K	89.9	Confident	90.3	Very high	73 Å²	73	38 Å²	38	32%	0.317	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-78.2	131.2	178	-62.1	-176.6	-176.9	-150.8	0	110.6	D421 T487	D421-K490 HydrophobicContact CB-CD 4.04Å; D421-K490 HydrophobicContact CB-CG 4.18Å; D421-K490 VanDerWaalsContact O-CB 3.31Å; D421-K490 WeakPolarHBondContact O-CB 3.29Å; D421-K490 WeakPolarHBondContact O-CG 3.37Å; D421-K490 IonicContact OD1-NZ 3.68Å; D421-K490 PolarHBondContact OD1-NZ 2.79Å; T487-K490 WeakPolarHBondContact O-CG 3.38Å; T487-K490 PolarHBondContact OG1-N 3.1Å; T487-K490 PolarHBondContact OG1-O 2.82Å
491	P	90.8	Very high	90.1	Very high	9 Å²	9	41.3 Å²	41.3	6%	0.058	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-74	159.3	-177.9	30.2	-35.7	0	0	0	112.3	V422 G423 N524 L526	V422-P491 WeakPolarHBondContact CG1-O 3.47Å; G423-P491 PolarHBondContact N-O 3.35Å; P491-N524 CarbonylContact C-O 3.56Å; P491-N524 VanDerWaalsContact CA-O 3.25Å; P491-N524 WeakPolarHBondContact CA-O 3.38Å; P491-L526 HydrophobicContact CB-CG 4.28Å; P491-L526 HydrophobicContact CG-CD1 4.11Å; P491-L526 HydrophobicContact CG-CG 4.31Å
492	V	92.4	Very high	89.9	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.4	169.5	178.7	0	0	0	0	109.1	C424 L450 C480 V483 N524 M525 L526	C424-V492 HydrophobicContact CB-CG1 4.38Å; C424-V492 HydrophobicContact CB-CG2 4.45Å; C424-V492 WeakPolarHBondContact O-CA 3.27Å; L450-V492 HydrophobicContact CD1-CG1 4.35Å; L450-V492 HydrophobicContact CD2-CG1 4.02Å; L450-V492 HydrophobicContact CD2-CG2 4.32Å; C480-V492 HydrophobicContact CB-CG2 4.45Å; V483-V492 HydrophobicContact CB-CG2 3.97Å; V483-V492 HydrophobicContact CG1-CG2 3.65Å; V492-N524 PolarHBondContact N-O 3.27Å; V492-M525 CarbonylContact O-C 3.53Å; V492-M525 VanDerWaalsContact O-CA 3.3Å; V492-M525 WeakPolarHBondContact O-CA 3.39Å; V492-L526 PolarHBondContact O-N 2.99Å
493	A	93	Very high	89.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.1	175.7	0	0	0	0	0	110.9	V422 C424 V425 I426 F495 L526	V422-A493 HydrophobicContact CG1-CB 3.71Å; C424-A493 PolarHBondContact O-N 2.85Å; V425-A493 CarbonylContact C-O 3.55Å; V425-A493 WeakPolarHBondContact CA-O 3.33Å; V425-A493 HydrophobicContact CG2-CB 4.36Å; I426-A493 PolarHBondContact N-O 2.85Å; A493-F495 HydrophobicContact CB-CD2 4.4Å; A493-F495 HydrophobicContact CB-CE2 3.62Å; A493-F495 HydrophobicContact CB-CZ 4.26Å; A493-L526 CarbonylContact C-O 3.54Å; A493-L526 WeakPolarHBondContact CA-O 3.41Å; A493-L526 HydrophobicContact CB-CB 4.11Å; A493-L526 HydrophobicContact CB-CD1 4.42Å
494	L	95.1	Very high	88.3	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.8	176.2	-179.1	59.2	0	0	0	110.3	I426 R428 L476 V496 M525 L526 F527 L528	I426-L494 HydrophobicContact CB-CD1 3.86Å; I426-L494 HydrophobicContact CG2-CD1 3.6Å; I426-L494 WeakPolarHBondContact O-CA 3.48Å; R428-L494 HydrophobicContact CG-CD1 4.5Å; L476-L494 HydrophobicContact CD2-CD2 4.27Å; L494-V496 HydrophobicContact CD1-CG2 4.33Å; L494-V496 HydrophobicContact CD2-CG2 4.36Å; L494-V496 HydrophobicContact CG-CG2 4.01Å; L494-M525 HydrophobicContact CB-CE 3.59Å; L494-M525 HydrophobicContact CD2-CE 3.39Å; L494-M525 HydrophobicContact CG-CE 4.12Å; L494-L526 PolarHBondContact N-O 3.2Å; L494-F527 HydrophobicContact CB-CD2 4.17Å; L494-F527 HydrophobicContact CD2-CD2 3.89Å; L494-F527 HydrophobicContact CD2-CE2 3.67Å; L494-F527 HydrophobicContact CG-CD2 4.15Å; L494-F527 HydrophobicContact CG-CE2 4.12Å; L494-F527 WeakPolarHBondContact O-CA 3.19Å; L494-L528 PolarHBondContact O-N 3.4Å
495	F	96.6	Very high	86.7	Confident	1 Å²	1	46.3 Å²	46.3	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123.6	177.6	-64	-92.4	0	0	0	109.6	F384 L409 V412 V416 V425 I426 V427 R428 A493 L528	F384-F495 HydrophobicContact CE2-CE1 4.15Å; F384-F495 HydrophobicContact CE2-CZ 4.08Å; F384-F495 HydrophobicContact CZ-CE1 4.01Å; F384-F495 HydrophobicContact CZ-CZ 4.23Å; L409-F495 HydrophobicContact CD1-CB 4.27Å; L409-F495 HydrophobicContact CD2-CB 4Å; L409-F495 HydrophobicContact CG-CB 4.08Å; L409-F495 HydrophobicContact CG-CD1 4.32Å; V412-F495 HydrophobicContact CB-CE1 4.36Å; V412-F495 HydrophobicContact CG1-CE1 3.65Å; V412-F495 HydrophobicContact CG1-CZ 4.17Å; V416-F495 HydrophobicContact CB-CZ 4.23Å; V416-F495 HydrophobicContact CG1-CE2 4.17Å; V416-F495 HydrophobicContact CG1-CZ 4.05Å; V416-F495 HydrophobicContact CG2-CZ 4.36Å; V425-F495 HydrophobicContact CG1-CD2 3.84Å; V425-F495 HydrophobicContact CG1-CE2 3.74Å; I426-F495 PolarHBondContact O-N 2.86Å; V427-F495 CarbonylContact C-O 3.58Å; V427-F495 WeakPolarHBondContact CA-O 3.3Å; V427-F495 HydrophobicContact CB-CB 4.48Å; V427-F495 HydrophobicContact CG1-CB 4.23Å; V427-F495 HydrophobicContact CG2-CB 4.23Å; V427-F495 HydrophobicContact CG2-CD2 4.37Å; R428-F495 PolarHBondContact N-O 2.83Å; A493-F495 HydrophobicContact CB-CD2 4.4Å; A493-F495 HydrophobicContact CB-CE2 3.62Å; A493-F495 HydrophobicContact CB-CZ 4.26Å; F495-L528 CarbonylContact C-O 3.54Å; F495-L528 VanDerWaalsContact CA-O 3.31Å; F495-L528 WeakPolarHBondContact CA-O 3.2Å; F495-L528 HydrophobicContact CD1-CB 3.75Å; F495-L528 HydrophobicContact CD1-CD1 4.39Å; F495-L528 HydrophobicContact CD1-CD2 3.98Å; F495-L528 HydrophobicContact CD1-CG 4.24Å; F495-L528 HydrophobicContact CE1-CB 3.92Å; F495-L528 HydrophobicContact CE1-CD1 4.13Å; F495-L528 HydrophobicContact CE1-CG 4.41Å
496	V	95.7	Very high	84.9	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	111.7	-178.9	-173.3	0	0	0	0	110.9	R428 M442 L494 I499 L502 F527 L528 A529 T530	R428-V496 CarbonylContact O-C 3.56Å; R428-V496 WeakPolarHBondContact O-CA 3.44Å; M442-V496 HydrophobicContact SD-CG1 4.14Å; M442-V496 HydrophobicContact SD-CG2 4.17Å; L494-V496 HydrophobicContact CD1-CG2 4.33Å; L494-V496 HydrophobicContact CD2-CG2 4.36Å; L494-V496 HydrophobicContact CG-CG2 4.01Å; V496-I499 HydrophobicContact CG1-CB 3.97Å; V496-I499 HydrophobicContact CG1-CD1 4.3Å; V496-I499 HydrophobicContact CG1-CG1 3.96Å; V496-L502 HydrophobicContact CG1-CD1 4.25Å; V496-F527 HydrophobicContact CB-CZ 4.48Å; V496-F527 HydrophobicContact CG2-CE2 4.06Å; V496-F527 HydrophobicContact CG2-CZ 3.93Å; V496-L528 PolarHBondContact N-O 2.87Å; V496-A529 HydrophobicContact CB-CB 4.34Å; V496-A529 CarbonylContact O-C 3.45Å; V496-A529 WeakPolarHBondContact O-CA 3.36Å; V496-T530 PolarHBondContact O-N 2.92Å
497	D	94.8	Very high	82.9	Confident	8 Å²	8	39.6 Å²	39.6	4%	0.043	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.7	178.6	-161.5	41.6	0	0	0	111.7	T406 L409 R428 F429 A430 I499 T530	T406-D497 WeakPolarHBondContact CB-OD2 3.38Å; T406-D497 VanDerWaalsContact CG2-OD2 3.31Å; T406-D497 WeakPolarHBondContact CG2-OD2 3.13Å; T406-D497 PolarHBondContact OG1-OD2 3.31Å; L409-D497 HydrophobicContact CD1-CB 3.9Å; L409-D497 HydrophobicContact CD2-CB 4.4Å; R428-D497 PolarHBondContact O-N 2.89Å; F429-D497 HydrophobicContact CD1-CB 3.53Å; F429-D497 HydrophobicContact CE1-CB 4.05Å; F429-D497 HydrophobicContact CG-CB 4.36Å; A430-D497 VanDerWaalsContact CB-O 3.23Å; A430-D497 WeakPolarHBondContact CB-O 3.09Å; A430-D497 PolarHBondContact N-O 3.41Å; D497-I499 PolarHBondContact O-N 2.83Å; D497-T530 VanDerWaalsContact CA-OG1 3.29Å; D497-T530 WeakPolarHBondContact CA-OG1 3.43Å; D497-T530 PolarHBondContact OD1-OG1 3.23Å
498	D	91	Very high	80.9	Confident	20 Å²	20	42.3 Å²	42.3	11%	0.107	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	52.2	-177.4	-79.8	-21.4	0	0	0	113.2	A430 H500 R501 T530	A430-D498 HydrophobicContact CB-CB 4.44Å; A430-D498 VanDerWaalsContact CB-O 3.22Å; A430-D498 WeakPolarHBondContact CB-O 3.33Å; D498-H500 PolarHBondContact O-N 2.85Å; D498-H500 IonicContact OD1-CE1 3.74Å; D498-H500 PolarHBondContact OD1-CE1 3.33Å; D498-R501 HydrophobicContact CB-CG 4.01Å; D498-R501 WeakPolarHBondContact O-CB 3.3Å; D498-R501 PolarHBondContact O-N 3.4Å; D498-R501 IonicContact OD2-NH1 3.41Å; D498-T530 PolarHBondContact N-OG1 3.32Å
499	I	89.3	Confident	78.7	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-54.6	-32.3	-173.8	-166	170.5	0	0	0	113.7	V496 D497 R501 L502 F515 W516 L517 F527 A529 T530 L531	V496-I499 HydrophobicContact CG1-CB 3.97Å; V496-I499 HydrophobicContact CG1-CD1 4.3Å; V496-I499 HydrophobicContact CG1-CG1 3.96Å; D497-I499 PolarHBondContact O-N 2.83Å; I499-R501 PolarHBondContact O-N 2.78Å; I499-R501 VanDerWaalsContact O-N 3.1Å; I499-L502 HydrophobicContact CG1-CD1 4.02Å; I499-L502 WeakPolarHBondContact O-CB 3.19Å; I499-L502 PolarHBondContact O-N 2.79Å; I499-F515 HydrophobicContact CG2-CD2 4.14Å; I499-F515 HydrophobicContact CG2-CE2 4.38Å; I499-W516 HydrophobicContact CD1-CE3 4.25Å; I499-W516 HydrophobicContact CD1-CZ3 4.38Å; I499-L517 HydrophobicContact CD1-CD1 3.9Å; I499-F527 HydrophobicContact CD1-CE1 4.15Å; I499-F527 HydrophobicContact CD1-CZ 3.85Å; I499-A529 HydrophobicContact CB-CB 4.07Å; I499-A529 HydrophobicContact CD1-CB 4.04Å; I499-A529 HydrophobicContact CG2-CB 3.89Å; I499-T530 PolarHBondContact N-O 2.87Å; I499-L531 HydrophobicContact CG2-CD2 3.4Å; I499-L531 VanDerWaalsContact CG2-CD2 3.4Å; I499-L531 HydrophobicContact CG2-CG 4.07Å
500	H	85.7	Confident	76.6	Confident	44 Å²	44	43 Å²	43	20%	0.204	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-61.5	-14.2	175.5	67.5	-73.4	0	0	0	115	D498 F515 L531 N532 V535	D498-H500 PolarHBondContact O-N 2.85Å; D498-H500 IonicContact OD1-CE1 3.74Å; D498-H500 PolarHBondContact OD1-CE1 3.33Å; H500-F515 HydrophobicContact CB-CB 4.07Å; H500-F515 HydrophobicContact CB-CG 4.23Å; H500-L531 HydrophobicContact CB-CD2 3.77Å; H500-N532 PolarHBondContact CE1-ND2 3.03Å; H500-N532 PolarHBondContact NE2-ND2 2.89Å; H500-V535 HydrophobicContact CB-CG1 4.49Å; H500-V535 HydrophobicContact CB-CG2 3.89Å
501	R	85.3	Confident	74.6	Confident	71 Å²	71	44.5 Å²	44.5	27%	0.268	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-86.5	-11.9	175.9	-63.6	178.8	65.6	-160.6	-5.1	113.2	A430 D498 I499 L721	A430-R501 HydrophobicContact CB-CB 3.95Å; D498-R501 HydrophobicContact CB-CG 4.01Å; D498-R501 WeakPolarHBondContact O-CB 3.3Å; D498-R501 PolarHBondContact O-N 3.4Å; D498-R501 IonicContact OD2-NH1 3.41Å; I499-R501 PolarHBondContact O-N 2.78Å; I499-R501 VanDerWaalsContact O-N 3.1Å; R501-L721 HydrophobicContact CG-CD1 4.41Å
502	L	85.2	Confident	72.6	Confident	14 Å²	14	53.7 Å²	53.7	7%	0.073	29%	0.292	C	S	.	.	S	Bend	trans	-70.9	134	175.1	-63.9	177.2	0	0	0	109.7	A430 A436 I439 M442 V496 I499	A430-L502 HydrophobicContact CB-CD2 3.73Å; A430-L502 HydrophobicContact CB-CG 3.91Å; A436-L502 WeakPolarHBondContact O-CD2 3.27Å; I439-L502 HydrophobicContact CG1-CB 3.76Å; I439-L502 HydrophobicContact CG1-CD1 4.31Å; M442-L502 HydrophobicContact SD-CD1 3.95Å; V496-L502 HydrophobicContact CG1-CD1 4.25Å; I499-L502 HydrophobicContact CG1-CD1 4.02Å; I499-L502 WeakPolarHBondContact O-CB 3.19Å; I499-L502 PolarHBondContact O-N 2.79Å
503	K	79.8	Confident	70.6	Confident	72 Å²	72	58 Å²	58	31%	0.313	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-89.1	136.4	173.7	-60.5	-171.7	172.9	-162.6	0	110.1	S437 T438 I439 N505	S437-K503 PolarHBondContact O-N 3.43Å; S437-K503 VanDerWaalsContact O-N 3.15Å; T438-K503 WeakPolarHBondContact CA-O 3.44Å; I439-K503 PolarHBondContact N-O 3.25Å; I439-K503 VanDerWaalsContact N-O 3.1Å; K503-N505 VanDerWaalsContact C-N 3.33Å; K503-N505 WeakPolarHBondContact CB-O 3.25Å
504	E	64	Low	69.3	Low	69 Å²	69	61 Å²	61	32%	0.322	34%	0.335	S	S	.	.	S	Bend	trans	-61.2	-44.4	173.4	-79.3	-167.4	156.1	0	0	111.9	I439 W516	I439-E504 HydrophobicContact CD1-CB 4.19Å; I439-E504 HydrophobicContact CD1-CG 3.6Å; E504-W516 HydrophobicContact CG-CB 4.38Å
505	N	54.2	Low	68.2	Low	83 Å²	83	61.8 Å²	61.8	44%	0.444	34%	0.338	S	S	.	.	S	Bend	trans	-131.7	162.1	177.1	-67	-32.5	0	0	0	110.4	K503 S507	K503-N505 VanDerWaalsContact C-N 3.33Å; K503-N505 WeakPolarHBondContact CB-O 3.25Å; N505-S507 PolarHBondContact O-N 2.95Å; N505-S507 VanDerWaalsContact O-N 3.1Å
506	S	50.6	Low	67.5	Low	104 Å²	104	62.7 Å²	62.7	73%	0.727	34%	0.342	S	S	*	.	S	Bend	trans	-66.8	-4	172.5	57.4	0	0	0	0	113.9
507	S	46.9	Very low	66.8	Low	61 Å²	61	63.3 Å²	63.3	43%	0.427	35%	0.345	S	S	.	.			trans	-68.9	139.6	175.3	55.1	0	0	0	0	112	N505	N505-S507 PolarHBondContact O-N 2.95Å; N505-S507 VanDerWaalsContact O-N 3.1Å
508	I	46.9	Very low	66.1	Low	81 Å²	81	62.9 Å²	62.9	42%	0.415	34%	0.343	S	S	.	.	S	Bend	trans	-80.3	-26	-174.6	-64	162.4	0	0	0	111.5	D510 S796	I508-D510 PolarHBondContact O-N 3.46Å; I508-S796 WeakPolarHBondContact CD1-O 3.47Å
509	S	40.1	Very low	65.4	Low	80 Å²	80	64.2 Å²	64.2	56%	0.559	35%	0.352	S	S	*	.			trans	-77.1	107.8	176.9	54.5	0	0	0	0	109.6
510	D	40.3	Very low	65.1	Low	104 Å²	104	69.7 Å²	69.7	56%	0.556	37%	0.373	S	S	*	.				159.6	85.1	128.4	-76.1	-23	0	0	0	110.8	I508 K512 L513	I508-D510 PolarHBondContact O-N 3.46Å; D510-K512 PolarHBondContact O-N 2.86Å; D510-K512 VanDerWaalsContact O-N 3.16Å; D510-L513 HydrophobicContact CB-CD1 3.53Å; D510-L513 HydrophobicContact CB-CG 3.64Å; D510-L513 PolarHBondContact O-N 3.01Å
511	S	48	Very low	65	Low	105 Å²	105	67.9 Å²	67.9	73%	0.734	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-3.6	170.5	54.4	0	0	0	0	114
512	K	48.9	Very low	64.8	Low	203 Å²	203	64.6 Å²	64.6	88%	0.883	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-0.5	-178.7	-84.9	-176.1	177.4	176.1	0	114.8	D510	D510-K512 PolarHBondContact O-N 2.86Å; D510-K512 VanDerWaalsContact O-N 3.16Å
513	L	52	Low	64.5	Low	92 Å²	92	66.7 Å²	66.7	48%	0.482	37%	0.367	S	S	.	.	S	Bend	trans	-73.9	136.9	174.8	-69.8	169.5	0	0	0	109.8	D510 F515	D510-L513 HydrophobicContact CB-CD1 3.53Å; D510-L513 HydrophobicContact CB-CG 3.64Å; D510-L513 PolarHBondContact O-N 3.01Å; L513-F515 PolarHBondContact O-N 3.16Å
514	S	64	Low	64.8	Low	62 Å²	62	65.2 Å²	65.2	43%	0.434	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-49.8	137.3	160.7	45.8	0	0	0	0	109
515	F	74	Confident	66	Low	21 Å²	21	62.1 Å²	62.1	9%	0.092	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-64.2	149.1	169.3	65.9	-84.4	0	0	0	109.2	I499 H500 L513 L531 V535 L537	I499-F515 HydrophobicContact CG2-CD2 4.14Å; I499-F515 HydrophobicContact CG2-CE2 4.38Å; H500-F515 HydrophobicContact CB-CB 4.07Å; H500-F515 HydrophobicContact CB-CG 4.23Å; L513-F515 PolarHBondContact O-N 3.16Å; F515-L531 HydrophobicContact CD2-CD2 4.16Å; F515-L531 HydrophobicContact CE1-CD1 4.49Å; F515-L531 HydrophobicContact CE1-CD2 4.43Å; F515-L531 HydrophobicContact CE2-CD1 4.05Å; F515-L531 HydrophobicContact CE2-CD2 3.96Å; F515-L531 HydrophobicContact CG-CD2 4.5Å; F515-L531 HydrophobicContact CZ-CD1 3.77Å; F515-L531 HydrophobicContact CZ-CD2 4.12Å; F515-V535 HydrophobicContact CD1-CG1 3.49Å; F515-V535 VanDerWaalsContact CD1-CG1 3.49Å; F515-V535 HydrophobicContact CE1-CG1 3.52Å; F515-L537 HydrophobicContact CE1-CD2 3.63Å; F515-L537 HydrophobicContact CZ-CD2 3.4Å
516	W	80.4	Confident	67.8	Low	20 Å²	20	58.4 Å²	58.4	8%	0.076	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-75.8	141.6	-179.1	174.8	90.4	0	0	0	112.1	I439 L443 T469 F473 I499 E504 P518	I439-W516 HydrophobicContact CD1-CB 3.14Å; I439-W516 HydrophobicContact CD1-CD2 3.96Å; I439-W516 HydrophobicContact CD1-CE3 4.35Å; I439-W516 HydrophobicContact CD1-CG 3.46Å; I439-W516 VanDerWaalsContact CD1-CG 3.46Å; I439-W516 HydrophobicContact CG1-CB 4.26Å; I439-W516 HydrophobicContact CG1-CE3 4.49Å; I439-W516 HydrophobicContact CG1-CG 4.46Å; I439-W516 HydrophobicContact CG2-CD2 3.68Å; I439-W516 HydrophobicContact CG2-CE3 3.69Å; I439-W516 HydrophobicContact CG2-CG 4.24Å; I439-W516 HydrophobicContact CG2-CH2 4.23Å; I439-W516 HydrophobicContact CG2-CZ2 4.22Å; I439-W516 HydrophobicContact CG2-CZ3 3.97Å; L443-W516 HydrophobicContact CD1-CH2 3.85Å; L443-W516 HydrophobicContact CD1-CZ2 3.85Å; L443-W516 HydrophobicContact CD2-CH2 3.78Å; L443-W516 HydrophobicContact CD2-CZ3 4.4Å; L443-W516 HydrophobicContact CG-CH2 4.23Å; T469-W516 HydrophobicContact CG2-CZ2 4.45Å; F473-W516 HydrophobicContact CD2-CH2 4.2Å; F473-W516 HydrophobicContact CD2-CZ2 4.04Å; I499-W516 HydrophobicContact CD1-CE3 4.25Å; I499-W516 HydrophobicContact CD1-CZ3 4.38Å; E504-W516 HydrophobicContact CG-CB 4.38Å; W516-P518 HydrophobicContact CH2-CG 3.62Å; W516-P518 HydrophobicContact CZ2-CG 4.11Å; W516-P518 HydrophobicContact CZ3-CG 4.1Å
517	L	81.3	Confident	69.7	Low	13 Å²	13	53.6 Å²	53.6	7%	0.068	29%	0.294	C	S	.	.			trans	-138.4	147.9	167	-161	67	0	0	0	108.8	I394 L396 I499 F527 P543 V546	I394-L517 HydrophobicContact CB-CD2 4.47Å; I394-L517 HydrophobicContact CD1-CD1 4.29Å; I394-L517 HydrophobicContact CD1-CD2 3.78Å; I394-L517 HydrophobicContact CD1-CG 3.7Å; I394-L517 HydrophobicContact CG2-CD1 4.16Å; I394-L517 HydrophobicContact CG2-CD2 4.11Å; I394-L517 HydrophobicContact CG2-CG 4.47Å; L396-L517 HydrophobicContact CD1-CD2 4.38Å; L396-L517 HydrophobicContact CD2-CD1 4.19Å; I499-L517 HydrophobicContact CD1-CD1 3.9Å; L517-F527 HydrophobicContact CD1-CE1 3.86Å; L517-F527 HydrophobicContact CD1-CZ 4.5Å; L517-P543 HydrophobicContact CB-CG 4.14Å; L517-P543 HydrophobicContact CD2-CG 3.79Å; L517-P543 HydrophobicContact CG-CG 4.22Å; L517-V546 HydrophobicContact CD2-CG2 3.27Å
518	P	81	Confident	72	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.274	C	S	.	.			trans	-51.8	126.4	174.6	-30.2	35	0	0	0	112.4	I394 F473 W516 R520 F527 P543	I394-P518 HydrophobicContact CD1-CB 4.09Å; I394-P518 HydrophobicContact CD1-CG 4.35Å; F473-P518 HydrophobicContact CE2-CB 3.66Å; F473-P518 HydrophobicContact CE2-CG 3.84Å; F473-P518 HydrophobicContact CZ-CB 3.65Å; F473-P518 HydrophobicContact CZ-CG 4.31Å; W516-P518 HydrophobicContact CH2-CG 3.62Å; W516-P518 HydrophobicContact CZ2-CG 4.11Å; W516-P518 HydrophobicContact CZ3-CG 4.1Å; P518-R520 PolarHBondContact O-N 3.37Å; P518-F527 HydrophobicContact CG-CD2 4.19Å; P518-F527 HydrophobicContact CG-CE1 4.44Å; P518-F527 HydrophobicContact CG-CE2 3.84Å; P518-F527 HydrophobicContact CG-CZ 3.97Å; P518-P543 WeakPolarHBondContact O-CG 2.99Å
519	P	76.4	Confident	74.2	Confident	47 Å²	47	46.9 Å²	46.9	31%	0.305	25%	0.254	S	S	.	.	S	Bend	trans	-72.3	-19.5	-179	30.1	-36.3	0	0	0	112.6	V545	P519-V545 WeakPolarHBondContact O-CG2 3.4Å
520	R	81.7	Confident	76.7	Confident	117 Å²	117	43.1 Å²	43.1	44%	0.442	23%	0.228	S	C	.	.	S	Bend	trans	-140.8	142.7	178.5	-68.9	-178.2	-78.2	110.3	-0	107.8	F473 D474 E477 P518	F473-R520 WeakPolarHBondContact CE1-O 3.41Å; F473-R520 VanDerWaalsContact CZ-O 3.26Å; F473-R520 WeakPolarHBondContact CZ-O 3.31Å; D474-R520 IonicContact OD1-NH2 3.37Å; D474-R520 PolarHBondContact OD1-NH2 3.19Å; E477-R520 IonicContact OE1-NH1 3.87Å; E477-R520 IonicContact OE2-NH1 3.02Å; E477-R520 PolarHBondContact OE2-NH1 3.36Å; P518-R520 PolarHBondContact O-N 3.37Å
521	L	83.5	Confident	79.2	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.031	20%	0.201	C	C	.	.			trans	-98.6	119	169.8	-168.5	69.5	0	0	0	109.3	V387 R392 S393 I394 M525 F527 V545	V387-L521 HydrophobicContact CG1-CD2 3.89Å; R392-L521 HydrophobicContact CB-CB 4.47Å; R392-L521 WeakPolarHBondContact CD-O 3.5Å; R392-L521 PolarHBondContact NH1-O 2.94Å; S393-L521 WeakPolarHBondContact O-CD2 3.35Å; I394-L521 HydrophobicContact CG1-CD1 4.26Å; L521-M525 HydrophobicContact CD1-CB 4.43Å; L521-M525 HydrophobicContact CD1-CG 4.33Å; L521-M525 HydrophobicContact CD1-SD 4.35Å; L521-F527 HydrophobicContact CD1-CB 3.59Å; L521-V545 HydrophobicContact CB-CG1 3.87Å
522	P	82.6	Confident	81.2	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.013	17%	0.168	C	C	.	.			trans	-56.7	150.6	174.3	-27.1	35.7	0	0	0	112.2	F473 E477 N524 M525	F473-P522 HydrophobicContact CZ-CG 4.25Å; E477-P522 HydrophobicContact CB-CB 4.44Å; E477-P522 HydrophobicContact CB-CG 3.87Å; E477-P522 HydrophobicContact CG-CB 3.98Å; E477-P522 HydrophobicContact CG-CG 3.86Å; P522-N524 VanDerWaalsContact C-N 3.25Å; P522-N524 PolarHBondContact O-N 2.8Å; P522-M525 HydrophobicContact CB-CB 3.91Å; P522-M525 HydrophobicContact CG-CB 4.21Å; P522-M525 HydrophobicContact CG-SD 3.93Å; P522-M525 PolarHBondContact O-N 3.33Å
523	P	78.8	Confident	83	Confident	59 Å²	59	26.7 Å²	26.7	38%	0.383	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-34.2	-177.2	21.9	-30.6	0	0	0	113.5
524	N	85.1	Confident	84.2	Confident	41 Å²	41	28.8 Å²	28.8	22%	0.219	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	33.6	-175.6	-57.4	-55.5	0	0	0	111.9	D481 A484 P491 V492 P522	D481-N524 PolarHBondContact OD1-ND2 3.28Å; A484-N524 HydrophobicContact CB-CB 3.58Å; A484-N524 WeakPolarHBondContact CB-ND2 3.43Å; P491-N524 CarbonylContact C-O 3.56Å; P491-N524 VanDerWaalsContact CA-O 3.25Å; P491-N524 WeakPolarHBondContact CA-O 3.38Å; V492-N524 PolarHBondContact N-O 3.27Å; P522-N524 VanDerWaalsContact C-N 3.25Å; P522-N524 PolarHBondContact O-N 2.8Å
525	M	89.8	Confident	84.9	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.02	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	131.6	-176.5	-169.7	-178	-168.9	0	0	111.8	L476 V492 L494 L521 P522 F527	L476-M525 HydrophobicContact CD2-CE 3.91Å; V492-M525 CarbonylContact O-C 3.53Å; V492-M525 VanDerWaalsContact O-CA 3.3Å; V492-M525 WeakPolarHBondContact O-CA 3.39Å; L494-M525 HydrophobicContact CB-CE 3.59Å; L494-M525 HydrophobicContact CD2-CE 3.39Å; L494-M525 HydrophobicContact CG-CE 4.12Å; L521-M525 HydrophobicContact CD1-CB 4.43Å; L521-M525 HydrophobicContact CD1-CG 4.33Å; L521-M525 HydrophobicContact CD1-SD 4.35Å; P522-M525 HydrophobicContact CB-CB 3.91Å; P522-M525 HydrophobicContact CG-CB 4.21Å; P522-M525 HydrophobicContact CG-SD 3.93Å; P522-M525 PolarHBondContact O-N 3.33Å; M525-F527 HydrophobicContact CE-CD2 3.89Å
526	L	90.8	Very high	85	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.021	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.4	167.1	-58.6	171.4	0	0	0	107.9	V387 M420 V422 P491 V492 A493 L494	V387-L526 HydrophobicContact CB-CD2 4.21Å; V387-L526 HydrophobicContact CG1-CD2 3.75Å; M420-L526 HydrophobicContact SD-CD1 3.45Å; M420-L526 WeakPolarHBondContact SD-CD1 3.48Å; V422-L526 HydrophobicContact CG2-CD1 4.45Å; P491-L526 HydrophobicContact CB-CG 4.28Å; P491-L526 HydrophobicContact CG-CD1 4.11Å; P491-L526 HydrophobicContact CG-CG 4.31Å; V492-L526 PolarHBondContact O-N 2.99Å; A493-L526 CarbonylContact C-O 3.54Å; A493-L526 WeakPolarHBondContact CA-O 3.41Å; A493-L526 HydrophobicContact CB-CB 4.11Å; A493-L526 HydrophobicContact CB-CD1 4.42Å; L494-L526 PolarHBondContact N-O 3.2Å
527	F	91.7	Very high	84.5	Confident	3 Å²	3	29.9 Å²	29.9	1%	0.013	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	124.1	-178.2	-167.8	-82.9	0	0	0	110.2	I394 V395 L494 V496 I499 L517 P518 L521 M525 A529	I394-F527 HydrophobicContact CB-CD1 4.49Å; I394-F527 HydrophobicContact CG1-CB 4.38Å; I394-F527 HydrophobicContact CG1-CD1 4.28Å; I394-F527 HydrophobicContact CG2-CD1 3.59Å; I394-F527 HydrophobicContact CG2-CE1 4.16Å; V395-F527 PolarHBondContact N-O 3.33Å; V395-F527 VanDerWaalsContact N-O 3.15Å; L494-F527 HydrophobicContact CB-CD2 4.17Å; L494-F527 HydrophobicContact CD2-CD2 3.89Å; L494-F527 HydrophobicContact CD2-CE2 3.67Å; L494-F527 HydrophobicContact CG-CD2 4.15Å; L494-F527 HydrophobicContact CG-CE2 4.12Å; L494-F527 WeakPolarHBondContact O-CA 3.19Å; V496-F527 HydrophobicContact CB-CZ 4.48Å; V496-F527 HydrophobicContact CG2-CE2 4.06Å; V496-F527 HydrophobicContact CG2-CZ 3.93Å; I499-F527 HydrophobicContact CD1-CE1 4.15Å; I499-F527 HydrophobicContact CD1-CZ 3.85Å; L517-F527 HydrophobicContact CD1-CE1 3.86Å; L517-F527 HydrophobicContact CD1-CZ 4.5Å; P518-F527 HydrophobicContact CG-CD2 4.19Å; P518-F527 HydrophobicContact CG-CE1 4.44Å; P518-F527 HydrophobicContact CG-CE2 3.84Å; P518-F527 HydrophobicContact CG-CZ 3.97Å; L521-F527 HydrophobicContact CD1-CB 3.59Å; M525-F527 HydrophobicContact CE-CD2 3.89Å; F527-A529 HydrophobicContact CD1-CB 4.43Å; F527-A529 HydrophobicContact CE1-CB 3.69Å; F527-A529 HydrophobicContact CZ-CB 4.44Å
528	L	93.9	Very high	83.7	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.2	171.2	-175.9	152.3	0	0	0	109.6	V380 F384 V395 V397 L409 V412 L494 F495 V496 T530	V380-L528 HydrophobicContact CG1-CD1 3.79Å; F384-L528 HydrophobicContact CE1-CB 4.19Å; F384-L528 HydrophobicContact CE1-CD1 4.35Å; F384-L528 HydrophobicContact CZ-CB 3.81Å; F384-L528 HydrophobicContact CZ-CD1 3.77Å; F384-L528 HydrophobicContact CZ-CG 4.44Å; V395-L528 HydrophobicContact CG1-CD1 4.22Å; V395-L528 HydrophobicContact CG1-CG 4.5Å; V395-L528 WeakPolarHBondContact O-CA 3.47Å; V397-L528 HydrophobicContact CG2-CD1 4.15Å; V397-L528 HydrophobicContact CG2-CD2 4.23Å; V397-L528 HydrophobicContact CG2-CG 4.29Å; L409-L528 HydrophobicContact CB-CD2 4.49Å; L409-L528 HydrophobicContact CD1-CD2 3.87Å; L409-L528 HydrophobicContact CG-CD2 4.14Å; V412-L528 HydrophobicContact CG1-CD1 4.27Å; L494-L528 PolarHBondContact O-N 3.4Å; F495-L528 CarbonylContact C-O 3.54Å; F495-L528 VanDerWaalsContact CA-O 3.31Å; F495-L528 WeakPolarHBondContact CA-O 3.2Å; F495-L528 HydrophobicContact CD1-CB 3.75Å; F495-L528 HydrophobicContact CD1-CD1 4.39Å; F495-L528 HydrophobicContact CD1-CD2 3.98Å; F495-L528 HydrophobicContact CD1-CG 4.24Å; F495-L528 HydrophobicContact CE1-CB 3.92Å; F495-L528 HydrophobicContact CE1-CD1 4.13Å; F495-L528 HydrophobicContact CE1-CG 4.41Å; V496-L528 PolarHBondContact N-O 2.87Å; L528-T530 HydrophobicContact CD2-CG2 4.48Å
529	A	93.2	Very high	82.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.4	172.9	0	0	0	0	0	112.3	V395 L396 V397 V496 I499 F527	V395-A529 PolarHBondContact O-N 3.48Å; V395-A529 VanDerWaalsContact O-N 3.09Å; L396-A529 WeakPolarHBondContact CA-O 3.42Å; L396-A529 HydrophobicContact CD2-CB 3.94Å; V397-A529 PolarHBondContact N-O 3.35Å; V496-A529 HydrophobicContact CB-CB 4.34Å; V496-A529 CarbonylContact O-C 3.45Å; V496-A529 WeakPolarHBondContact O-CA 3.36Å; I499-A529 HydrophobicContact CB-CB 4.07Å; I499-A529 HydrophobicContact CD1-CB 4.04Å; I499-A529 HydrophobicContact CG2-CB 3.89Å; F527-A529 HydrophobicContact CD1-CB 4.43Å; F527-A529 HydrophobicContact CE1-CB 3.69Å; F527-A529 HydrophobicContact CZ-CB 4.44Å
530	T	94.1	Very high	81.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	148.3	174.3	63.7	0	0	0	0	111.8	V397 K405 L409 V496 D497 D498 I499 L528	V397-T530 HydrophobicContact CB-CG2 4.2Å; V397-T530 CarbonylContact O-C 3.56Å; V397-T530 VanDerWaalsContact O-CA 3.22Å; V397-T530 WeakPolarHBondContact O-CA 3.43Å; K405-T530 HydrophobicContact CB-CG2 4.23Å; L409-T530 HydrophobicContact CB-CG2 3.98Å; L409-T530 HydrophobicContact CD1-CG2 3.63Å; L409-T530 HydrophobicContact CG-CG2 4.45Å; V496-T530 PolarHBondContact O-N 2.92Å; D497-T530 VanDerWaalsContact CA-OG1 3.29Å; D497-T530 WeakPolarHBondContact CA-OG1 3.43Å; D497-T530 PolarHBondContact OD1-OG1 3.23Å; D498-T530 PolarHBondContact N-OG1 3.32Å; I499-T530 PolarHBondContact N-O 2.87Å; L528-T530 HydrophobicContact CD2-CG2 4.48Å
531	L	92	Very high	80.9	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147.8	-177.9	-70.7	171.8	0	0	0	111.3	L396 V397 R398 G399 K405 I499 H500 F515 L537	L396-L531 HydrophobicContact CD1-CD1 4.01Å; L396-L531 HydrophobicContact CD2-CD1 4.16Å; L396-L531 HydrophobicContact CG-CD1 4.48Å; V397-L531 PolarHBondContact O-N 3.15Å; R398-L531 WeakPolarHBondContact CA-O 3.43Å; R398-L531 HydrophobicContact CG-CB 4.31Å; G399-L531 PolarHBondContact N-O 2.98Å; K405-L531 WeakPolarHBondContact CD-O 3.38Å; I499-L531 HydrophobicContact CG2-CD2 3.4Å; I499-L531 VanDerWaalsContact CG2-CD2 3.4Å; I499-L531 HydrophobicContact CG2-CG 4.07Å; H500-L531 HydrophobicContact CB-CD2 3.77Å; F515-L531 HydrophobicContact CD2-CD2 4.16Å; F515-L531 HydrophobicContact CE1-CD1 4.49Å; F515-L531 HydrophobicContact CE1-CD2 4.43Å; F515-L531 HydrophobicContact CE2-CD1 4.05Å; F515-L531 HydrophobicContact CE2-CD2 3.96Å; F515-L531 HydrophobicContact CG-CD2 4.5Å; F515-L531 HydrophobicContact CZ-CD1 3.77Å; F515-L531 HydrophobicContact CZ-CD2 4.12Å; L531-L537 HydrophobicContact CD1-CD1 4.46Å; L531-L537 HydrophobicContact CD1-CD2 3.91Å
532	N	89.1	Confident	80	Confident	7 Å²	7	46.3 Å²	46.3	4%	0.037	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	148.4	170.1	-77.7	-38	0	0	0	110.9	K405 H500 E534 V535	K405-N532 WeakPolarHBondContact CE-OD1 3.28Å; K405-N532 PolarHBondContact NZ-OD1 3.38Å; H500-N532 PolarHBondContact CE1-ND2 3.03Å; H500-N532 PolarHBondContact NE2-ND2 2.89Å; N532-E534 PolarHBondContact O-N 3.39Å; N532-V535 HydrophobicContact CB-CG2 4.39Å; N532-V535 WeakPolarHBondContact O-CB 3.31Å; N532-V535 PolarHBondContact O-N 3.17Å; N532-V535 VanDerWaalsContact O-N 3.16Å
533	D	86.6	Confident	79.2	Confident	61 Å²	61	47.6 Å²	47.6	33%	0.326	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-29.3	179.4	-70.8	-17	0	0	0	113.2	R398 G399 S400 V535	R398-D533 PolarHBondContact NH2-O 2.82Å; G399-D533 VanDerWaalsContact C-CG 3.4Å; G399-D533 VanDerWaalsContact C-OD2 3.29Å; G399-D533 VanDerWaalsContact CA-OD1 3.26Å; G399-D533 WeakPolarHBondContact CA-OD1 3.48Å; G399-D533 PolarHBondContact N-OD1 3.24Å; G399-D533 PolarHBondContact O-N 3.23Å; S400-D533 WeakPolarHBondContact CA-OD2 3.23Å; S400-D533 WeakPolarHBondContact CB-OD2 3.4Å; S400-D533 PolarHBondContact N-OD2 3.38Å; S400-D533 PolarHBondContact OG-OD2 2.9Å; D533-V535 PolarHBondContact O-N 3.34Å
534	E	78.5	Confident	78.8	Confident	135 Å²	135	53.1 Å²	53.1	63%	0.631	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.2	178.8	-64.1	175.3	-169.2	0	0	113.4	H401 N532 S536	H401-E534 IonicContact CD2-OE1 3.69Å; H401-E534 PolarHBondContact CD2-OE1 3.47Å; H401-E534 IonicContact NE2-OE1 2.75Å; H401-E534 PolarHBondContact NE2-OE1 2.93Å; H401-E534 IonicContact NE2-OE2 3.29Å; N532-E534 PolarHBondContact O-N 3.39Å; E534-S536 PolarHBondContact O-N 2.83Å
535	V	79.4	Confident	78.2	Confident	27 Å²	27	52.1 Å²	52.1	16%	0.164	26%	0.263	C	S	.	.	S	Bend	trans	-78.8	117.8	179.1	-175.7	0	0	0	0	109.2	R398 H500 F515 N532 D533 L537	R398-V535 PolarHBondContact NH2-O 3.15Å; H500-V535 HydrophobicContact CB-CG1 4.49Å; H500-V535 HydrophobicContact CB-CG2 3.89Å; F515-V535 HydrophobicContact CD1-CG1 3.49Å; F515-V535 VanDerWaalsContact CD1-CG1 3.49Å; F515-V535 HydrophobicContact CE1-CG1 3.52Å; N532-V535 HydrophobicContact CB-CG2 4.39Å; N532-V535 WeakPolarHBondContact O-CB 3.31Å; N532-V535 PolarHBondContact O-N 3.17Å; N532-V535 VanDerWaalsContact O-N 3.16Å; D533-V535 PolarHBondContact O-N 3.34Å; V535-L537 PolarHBondContact O-N 2.65Å
536	S	74.5	Confident	77.6	Confident	80 Å²	80	52.6 Å²	52.6	56%	0.559	27%	0.266	S	S	*	.			trans	-68.7	117.2	174.8	50.7	0	0	0	0	110.7	E534 D538	E534-S536 PolarHBondContact O-N 2.83Å; S536-D538 PolarHBondContact O-N 3.07Å
537	L	70.2	Confident	77	Confident	19 Å²	19	54.1 Å²	54.1	10%	0.099	28%	0.276	C	S	.	.			trans	-91	90.7	166.1	-67.1	-172.6	0	0	0	108	L396 R398 F515 L531 V535 W548 V551	L396-L537 HydrophobicContact CD1-CD1 4.4Å; R398-L537 VanDerWaalsContact NH1-CD1 3.33Å; F515-L537 HydrophobicContact CE1-CD2 3.63Å; F515-L537 HydrophobicContact CZ-CD2 3.4Å; L531-L537 HydrophobicContact CD1-CD1 4.46Å; L531-L537 HydrophobicContact CD1-CD2 3.91Å; V535-L537 PolarHBondContact O-N 2.65Å; L537-W548 HydrophobicContact CB-CH2 4.12Å; L537-W548 HydrophobicContact CB-CZ3 4.05Å; L537-W548 HydrophobicContact CD1-CZ3 4.35Å; L537-V551 HydrophobicContact CD1-CG1 3.83Å; L537-V551 HydrophobicContact CD1-CG2 4.46Å
538	D	65.5	Low	76.4	Confident	91 Å²	91	59.8 Å²	59.8	49%	0.487	30%	0.298	S	S	.	.			trans	-84.6	151.7	167.3	-67	-19.8	0	0	0	109	S536 R540 S541 C542	S536-D538 PolarHBondContact O-N 3.07Å; D538-R540 PolarHBondContact O-N 2.9Å; D538-S541 PolarHBondContact O-N 2.95Å; D538-C542 PolarHBondContact O-N 2.84Å; D538-C542 VanDerWaalsContact O-N 3.14Å
539	E	59.5	Low	75.7	Confident	161 Å²	161	65.8 Å²	65.8	75%	0.752	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-22.6	170.1	-72.7	177.7	173.2	0	0	112.5	W548	E539-W548 HydrophobicContact CG-CZ2 3.81Å
540	R	58.7	Low	75.3	Confident	237 Å²	237	66.5 Å²	66.5	89%	0.894	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-27.1	175.2	-61.9	-179.5	-178.3	179.9	0.8	113.8	D538	D538-R540 PolarHBondContact O-N 2.9Å
541	S	61.8	Low	75.1	Confident	27 Å²	27	67.6 Å²	67.6	19%	0.189	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-30	-177.4	-58.4	0	0	0	0	111.6	D538	D538-S541 PolarHBondContact O-N 2.95Å
542	C	64.8	Low	75.2	Confident	13 Å²	13	68.1 Å²	68.1	9%	0.088	34%	0.342	C	S	.	.	S	Bend	trans	-86.4	132.6	174.2	-95.6	0	0	0	0	110.8	D538 V546	D538-C542 PolarHBondContact O-N 2.84Å; D538-C542 VanDerWaalsContact O-N 3.14Å; C542-V546 HydrophobicContact CB-CB 4.16Å; C542-V546 HydrophobicContact CB-CG2 4.3Å
543	P	66.1	Low	75.3	Confident	29 Å²	29	73.1 Å²	73.1	19%	0.188	37%	0.367	C	S	.	.			trans	-66	156.1	168.8	28	-32.2	0	0	0	110.4	L517 P518 V545 V546	L517-P543 HydrophobicContact CB-CG 4.14Å; L517-P543 HydrophobicContact CD2-CG 3.79Å; L517-P543 HydrophobicContact CG-CG 4.22Å; P518-P543 WeakPolarHBondContact O-CG 2.99Å; P543-V545 PolarHBondContact O-N 3.29Å; P543-V546 HydrophobicContact CG-CG2 4.11Å; P543-V546 PolarHBondContact O-N 3.31Å
544	D	68.7	Low	75.6	Confident	174 Å²	174	70.5 Å²	70.5	93%	0.93	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-14.1	177.1	-66.5	-26.4	0	0	0	114.1
545	V	74.1	Confident	76.1	Confident	20 Å²	20	66.9 Å²	66.9	12%	0.121	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-27	176.6	-176	0	0	0	0	111.9	R392 S393 I394 P519 L521 P543 T547	R392-V545 WeakPolarHBondContact O-CG1 3.47Å; S393-V545 WeakPolarHBondContact CA-O 3.22Å; S393-V545 WeakPolarHBondContact CB-O 3.33Å; S393-V545 PolarHBondContact OG-O 2.75Å; I394-V545 HydrophobicContact CD1-CB 4.48Å; I394-V545 HydrophobicContact CD1-CG1 4.01Å; I394-V545 HydrophobicContact CG1-CG1 3.93Å; P519-V545 WeakPolarHBondContact O-CG2 3.4Å; L521-V545 HydrophobicContact CB-CG1 3.87Å; P543-V545 PolarHBondContact O-N 3.29Å; V545-T547 PolarHBondContact O-N 2.91Å
546	V	75.9	Confident	76.4	Confident	14 Å²	14	69.6 Å²	69.6	9%	0.085	36%	0.36	C	S	.	.			trans	-82.6	113.5	-178.5	-177	0	0	0	0	109.8	I394 L396 L517 C542 P543 V551	I394-V546 HydrophobicContact CB-CG2 4.15Å; L396-V546 HydrophobicContact CD1-CG1 3.94Å; L396-V546 HydrophobicContact CD1-CG2 4.32Å; L517-V546 HydrophobicContact CD2-CG2 3.27Å; C542-V546 HydrophobicContact CB-CB 4.16Å; C542-V546 HydrophobicContact CB-CG2 4.3Å; P543-V546 HydrophobicContact CG-CG2 4.11Å; P543-V546 PolarHBondContact O-N 3.31Å; V546-V551 HydrophobicContact CG1-CG2 3.81Å
547	T	79.5	Confident	77	Confident	37 Å²	37	66.2 Å²	66.2	23%	0.227	34%	0.335	C	S	.	.			trans	-83.7	130.7	167.9	-56.4	0	0	0	0	108.8	S393 V545 D549 Y550	S393-T547 PolarHBondContact OG-OG1 3.37Å; V545-T547 PolarHBondContact O-N 2.91Å; T547-D549 HydrophobicContact CG2-CB 3.99Å; T547-D549 PolarHBondContact O-N 3.17Å; T547-D549 VanDerWaalsContact O-N 3.16Å; T547-Y550 PolarHBondContact O-N 3.21Å
548	W	77.8	Confident	77.8	Confident	121 Å²	121	68 Å²	68	46%	0.458	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-57.1	-29.7	178.9	-67.3	110.5	0	0	0	113.5	L537 E539 Y550 V551	L537-W548 HydrophobicContact CB-CH2 4.12Å; L537-W548 HydrophobicContact CB-CZ3 4.05Å; L537-W548 HydrophobicContact CD1-CZ3 4.35Å; E539-W548 HydrophobicContact CG-CZ2 3.81Å; W548-Y550 PolarHBondContact O-N 3.2Å; W548-V551 HydrophobicContact CE3-CG2 4.03Å; W548-V551 WeakPolarHBondContact O-CB 3.12Å; W548-V551 PolarHBondContact O-N 3.46Å
549	D	80.5	Confident	78.7	Confident	129 Å²	129	67.4 Å²	67.4	69%	0.69	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-62.1	-20.3	173.9	-61.6	-30.9	0	0	0	113.4	T547	T547-D549 HydrophobicContact CG2-CB 3.99Å; T547-D549 PolarHBondContact O-N 3.17Å; T547-D549 VanDerWaalsContact O-N 3.16Å
550	Y	85.1	Confident	80	Confident	15 Å²	15	64.8 Å²	64.8	6%	0.059	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-102.5	8.1	177.4	-58.5	-17.9	0	0	0	113.1	A383 N386 V387 Q391 L396 T547 W548 L552	A383-Y550 HydrophobicContact CB-CD1 3.59Å; A383-Y550 HydrophobicContact CB-CD2 4.43Å; A383-Y550 HydrophobicContact CB-CE1 3.82Å; A383-Y550 HydrophobicContact CB-CG 3.97Å; N386-Y550 WeakPolarHBondContact CB-OH 3.26Å; N386-Y550 PolarHBondContact ND2-OH 3.44Å; V387-Y550 HydrophobicContact CG2-CD2 4.44Å; V387-Y550 HydrophobicContact CG2-CE2 3.98Å; Q391-Y550 HydrophobicContact CG-CE2 4.29Å; Q391-Y550 PolarHBondContact NE2-OH 3.05Å; Q391-Y550 PolarHBondContact OE1-OH 2.9Å; L396-Y550 PolarHBondContact N-O 3.29Å; T547-Y550 PolarHBondContact O-N 3.21Å; W548-Y550 PolarHBondContact O-N 3.2Å; Y550-L552 PolarHBondContact O-N 3.27Å
551	V	89.2	Confident	81.4	Confident	23 Å²	23	55.2 Å²	55.2	14%	0.139	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	92.5	165.9	-176	0	0	0	0	107.6	L396 R398 L537 V546 W548	L396-V551 HydrophobicContact CB-CG2 4.39Å; L396-V551 HydrophobicContact CD1-CG2 4.37Å; L396-V551 CarbonylContact O-C 3.59Å; L396-V551 WeakPolarHBondContact O-CA 3.46Å; R398-V551 HydrophobicContact CG-CG1 3.99Å; L537-V551 HydrophobicContact CD1-CG1 3.83Å; L537-V551 HydrophobicContact CD1-CG2 4.46Å; V546-V551 HydrophobicContact CG1-CG2 3.81Å; W548-V551 HydrophobicContact CE3-CG2 4.03Å; W548-V551 WeakPolarHBondContact O-CB 3.12Å; W548-V551 PolarHBondContact O-N 3.46Å
552	L	92.8	Very high	82.6	Confident	10 Å²	10	54.1 Å²	54.1	5%	0.052	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.2	-175.1	-51.4	-179.4	0	0	0	110.2	L376 Q379 V380 V395 L396 V397 R398 Y550	L376-L552 HydrophobicContact CD1-CB 3.65Å; L376-L552 HydrophobicContact CD1-CD1 4.09Å; L376-L552 HydrophobicContact CD1-CG 4.48Å; Q379-L552 HydrophobicContact CB-CD1 3.9Å; Q379-L552 HydrophobicContact CB-CD2 4.04Å; V380-L552 HydrophobicContact CB-CD1 4.28Å; V380-L552 HydrophobicContact CG2-CD1 3.43Å; V380-L552 VanDerWaalsContact CG2-CD1 3.43Å; V395-L552 HydrophobicContact CG1-CD1 4.21Å; L396-L552 PolarHBondContact O-N 3.42Å; V397-L552 CarbonylContact C-O 3.6Å; V397-L552 WeakPolarHBondContact CA-O 3.29Å; R398-L552 PolarHBondContact N-O 3.43Å; Y550-L552 PolarHBondContact O-N 3.27Å
553	I	92.5	Very high	83.6	Confident	112 Å²	112	59.1 Å²	59.1	57%	0.574	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.3	178.3	-59.5	172.1	0	0	0	108.1	P555	I553-P555 WeakPolarHBondContact O-CD 3.45Å
554	I	92.1	Very high	84.7	Confident	7 Å²	7	60.2 Å²	60.2	4%	0.036	31%	0.312	C	S	.	.			trans	-69.5	113.9	172.7	-60.5	179.4	0	0	0	108	L376 V397 R398 Q403 K405 V408	L376-I554 HydrophobicContact CD2-CB 4.44Å; L376-I554 HydrophobicContact CD2-CG1 3.78Å; V397-I554 HydrophobicContact CG1-CD1 3.71Å; V397-I554 HydrophobicContact CG1-CG1 3.56Å; R398-I554 WeakPolarHBondContact O-CG1 3.21Å; R398-I554 PolarHBondContact O-N 2.93Å; Q403-I554 HydrophobicContact CB-CG2 4.36Å; K405-I554 HydrophobicContact CB-CD1 4.11Å; K405-I554 HydrophobicContact CG-CD1 3.49Å; K405-I554 VanDerWaalsContact CG-CD1 3.49Å; V408-I554 HydrophobicContact CG2-CD1 4.04Å
555	P	89.4	Confident	85.6	Confident	58 Å²	58	52.5 Å²	52.5	38%	0.377	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-67.7	148.5	176.8	29.2	-36.1	0	0	0	110.7	Q373 I553	Q373-P555 PolarHBondContact NE2-O 3.32Å; Q373-P555 VanDerWaalsContact OE1-CG 3.29Å; I553-P555 WeakPolarHBondContact O-CD 3.45Å
556	P	85.9	Confident	86.2	Confident	85 Å²	85	51.7 Å²	51.7	55%	0.552	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-54.7	145.4	171.5	18.5	-28.6	0	0	0	111.7	S558	P556-S558 PolarHBondContact O-N 3.22Å
557	L	87.3	Confident	86.7	Confident	8 Å²	8	55.5 Å²	55.5	4%	0.042	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-66.5	134.4	178	-163.2	65.4	0	0	0	110.3	I371 N561 C562 L565 S591 P593	I371-L557 WeakPolarHBondContact O-CD1 3.42Å; L557-N561 HydrophobicContact CD1-CB 3.54Å; L557-N561 HydrophobicContact CD2-CB 4.16Å; L557-N561 HydrophobicContact CG-CB 3.66Å; L557-C562 HydrophobicContact CD2-CB 4.43Å; L557-L565 HydrophobicContact CD2-CB 4.46Å; L557-L565 HydrophobicContact CD2-CD2 3.92Å; L557-S591 PolarHBondContact N-O 3.3Å; L557-P593 HydrophobicContact CB-CG 4.32Å; L557-P593 HydrophobicContact CD2-CG 4.19Å
558	S	87.6	Confident	87	Confident	57 Å²	57	61.1 Å²	61.1	40%	0.399	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-68.3	151.7	176.8	73.7	0	0	0	0	111	P556 E560 N561 C562	P556-S558 PolarHBondContact O-N 3.22Å; S558-E560 VanDerWaalsContact C-N 3.29Å; S558-E560 PolarHBondContact O-N 2.93Å; S558-N561 PolarHBondContact O-N 3.05Å; S558-N561 WeakPolarHBondContact OG-CB 3.4Å; S558-N561 VanDerWaalsContact OG-CG 3.25Å; S558-N561 PolarHBondContact OG-N 2.8Å; S558-N561 PolarHBondContact OG-ND2 3.19Å; S558-C562 PolarHBondContact O-N 3.44Å; S558-C562 PolarHBondContact O-SG 3.41Å
559	M	84	Confident	87.4	Confident	79 Å²	79	58 Å²	58	39%	0.389	29%	0.292	S	S	.	.	H	α-helix	trans	-42.6	-54.1	174.4	-173.2	54.3	-111.3	0	0	113	N561 C562 R563 G587	M559-N561 PolarHBondContact O-N 2.87Å; M559-C562 WeakPolarHBondContact O-CB 3.42Å; M559-C562 PolarHBondContact O-N 3.06Å; M559-R563 HydrophobicContact CE-CG 3.85Å; M559-R563 PolarHBondContact O-N 3.13Å; M559-G587 WeakPolarHBondContact CE-O 3.1Å; M559-G587 VanDerWaalsContact SD-C 3.54Å
560	E	86.4	Confident	87.4	Confident	106 Å²	106	53.6 Å²	53.6	50%	0.495	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-44	179.6	-175	57.2	-156.9	0	0	112.3	S558 C562 R563 I564	S558-E560 VanDerWaalsContact C-N 3.29Å; S558-E560 PolarHBondContact O-N 2.93Å; E560-C562 VanDerWaalsContact C-N 3.29Å; E560-C562 PolarHBondContact O-N 3.31Å; E560-R563 WeakPolarHBondContact O-CB 3.4Å; E560-R563 PolarHBondContact O-N 3.22Å; E560-I564 HydrophobicContact CG-CD1 4.16Å; E560-I564 WeakPolarHBondContact O-CG1 3.15Å; E560-I564 PolarHBondContact O-N 2.9Å
561	N	88.8	Confident	86.5	Confident	36 Å²	36	57 Å²	57	19%	0.193	29%	0.285	C	S	.	.	H	α-helix	trans	-66.5	-31.7	178.7	-71.6	-25.5	0	0	0	112.3	I371 G372 L557 S558 M559 I564 L565	I371-N561 HydrophobicContact CG2-CB 3.75Å; I371-N561 WeakPolarHBondContact CG2-OD1 3.31Å; G372-N561 VanDerWaalsContact CA-ND2 3.25Å; G372-N561 WeakPolarHBondContact CA-ND2 3.48Å; L557-N561 HydrophobicContact CD1-CB 3.54Å; L557-N561 HydrophobicContact CD2-CB 4.16Å; L557-N561 HydrophobicContact CG-CB 3.66Å; S558-N561 PolarHBondContact O-N 3.05Å; S558-N561 WeakPolarHBondContact OG-CB 3.4Å; S558-N561 VanDerWaalsContact OG-CG 3.25Å; S558-N561 PolarHBondContact OG-N 2.8Å; S558-N561 PolarHBondContact OG-ND2 3.19Å; M559-N561 PolarHBondContact O-N 2.87Å; N561-I564 PolarHBondContact O-N 2.73Å; N561-L565 VanDerWaalsContact O-CB 3.26Å; N561-L565 WeakPolarHBondContact O-CB 3.44Å; N561-L565 PolarHBondContact O-N 2.79Å
562	C	87.1	Confident	85	Confident	3 Å²	3	64 Å²	64	2%	0.02	31%	0.314	C	S	.	.	H	α-helix	trans	-63.4	-41.9	172.8	-64.5	0	0	0	0	111.8	L557 S558 M559 E560 L565 Y566 S590 V596	L557-C562 HydrophobicContact CD2-CB 4.43Å; S558-C562 PolarHBondContact O-N 3.44Å; S558-C562 PolarHBondContact O-SG 3.41Å; M559-C562 WeakPolarHBondContact O-CB 3.42Å; M559-C562 PolarHBondContact O-N 3.06Å; E560-C562 VanDerWaalsContact C-N 3.29Å; E560-C562 PolarHBondContact O-N 3.31Å; C562-L565 PolarHBondContact O-N 3.18Å; C562-Y566 WeakPolarHBondContact O-CB 3.28Å; C562-Y566 PolarHBondContact O-N 3.19Å; C562-S590 PolarHBondContact SG-O 2.9Å; C562-V596 HydrophobicContact CB-CG2 4.1Å
563	R	85.5	Confident	83.1	Confident	119 Å²	119	73.2 Å²	73.2	45%	0.449	35%	0.348	S	S	.	.	H	α-helix	trans	-63.1	-47.6	175.2	-71.2	178.3	172.6	159.6	-1.2	111.4	M559 E560 L565 Y566 E567	M559-R563 HydrophobicContact CE-CG 3.85Å; M559-R563 PolarHBondContact O-N 3.13Å; E560-R563 WeakPolarHBondContact O-CB 3.4Å; E560-R563 PolarHBondContact O-N 3.22Å; R563-L565 VanDerWaalsContact C-N 3.29Å; R563-L565 PolarHBondContact O-N 3.03Å; R563-Y566 PolarHBondContact O-N 3.17Å; R563-E567 WeakPolarHBondContact O-CG 3.14Å; R563-E567 PolarHBondContact O-N 3.22Å
564	I	88.1	Confident	81	Confident	52 Å²	52	71.8 Å²	71.8	27%	0.267	35%	0.347	S	S	.	.	H	α-helix	trans	-60.6	-42.1	177.5	-61.7	167.9	0	0	0	110.6	I371 E560 N561 R568	I371-I564 HydrophobicContact CD1-CB 4.34Å; I371-I564 HydrophobicContact CD1-CG2 3.77Å; E560-I564 HydrophobicContact CG-CD1 4.16Å; E560-I564 WeakPolarHBondContact O-CG1 3.15Å; E560-I564 PolarHBondContact O-N 2.9Å; N561-I564 PolarHBondContact O-N 2.73Å; I564-R568 VanDerWaalsContact O-CG 3.25Å; I564-R568 WeakPolarHBondContact O-CG 3.44Å; I564-R568 PolarHBondContact O-N 3.44Å; I564-R568 VanDerWaalsContact O-N 3.16Å
565	L	88.7	Confident	78.7	Confident	11 Å²	11	75.5 Å²	75.5	6%	0.058	36%	0.364	C	S	.	.	H	α-helix	trans	-62.9	-47.7	177.4	-179.3	63.4	0	0	0	111.2	I369 I371 L557 N561 C562 R563 E567 R568 L569 P593 V596	I369-L565 HydrophobicContact CB-CD1 3.69Å; I369-L565 HydrophobicContact CG2-CD1 3.71Å; I371-L565 HydrophobicContact CD1-CB 4.19Å; I371-L565 HydrophobicContact CD1-CD1 4.36Å; L557-L565 HydrophobicContact CD2-CB 4.46Å; L557-L565 HydrophobicContact CD2-CD2 3.92Å; N561-L565 VanDerWaalsContact O-CB 3.26Å; N561-L565 WeakPolarHBondContact O-CB 3.44Å; N561-L565 PolarHBondContact O-N 2.79Å; C562-L565 PolarHBondContact O-N 3.18Å; R563-L565 VanDerWaalsContact C-N 3.29Å; R563-L565 PolarHBondContact O-N 3.03Å; L565-E567 PolarHBondContact O-N 3.09Å; L565-R568 PolarHBondContact O-N 3.38Å; L565-L569 HydrophobicContact CD1-CD1 3.77Å; L565-L569 HydrophobicContact CD1-CG 4.04Å; L565-L569 HydrophobicContact CD2-CD1 4.4Å; L565-L569 HydrophobicContact CG-CD1 3.75Å; L565-L569 HydrophobicContact CG-CG 4.36Å; L565-L569 WeakPolarHBondContact O-CB 3.48Å; L565-L569 WeakPolarHBondContact O-CG 2.96Å; L565-L569 PolarHBondContact O-N 2.78Å; L565-P593 HydrophobicContact CD2-CB 3.92Å; L565-V596 HydrophobicContact CB-CG1 4.4Å; L565-V596 HydrophobicContact CD2-CB 4.18Å; L565-V596 HydrophobicContact CD2-CG1 4.19Å; L565-V596 HydrophobicContact CG-CG1 4.2Å
566	Y	86.7	Confident	76.3	Confident	4 Å²	4	75.7 Å²	75.7	2%	0.016	37%	0.366	C	S	.	.	H	α-helix	trans	-57.6	-50.8	177.9	-178.5	-91.5	0	0	0	111.7	C562 R563 R568 L569 K570 I586 V596 A600	C562-Y566 WeakPolarHBondContact O-CB 3.28Å; C562-Y566 PolarHBondContact O-N 3.19Å; R563-Y566 PolarHBondContact O-N 3.17Å; Y566-R568 PolarHBondContact O-N 3.49Å; Y566-L569 PolarHBondContact O-N 3.14Å; Y566-L569 VanDerWaalsContact O-N 3.14Å; Y566-K570 HydrophobicContact CE1-CB 4.39Å; Y566-K570 HydrophobicContact CE1-CD 3.95Å; Y566-K570 WeakPolarHBondContact O-CB 3.48Å; Y566-K570 PolarHBondContact O-N 3.19Å; Y566-I586 HydrophobicContact CD1-CD1 3.65Å; Y566-I586 HydrophobicContact CD1-CG2 4.44Å; Y566-I586 HydrophobicContact CD2-CD1 3.77Å; Y566-I586 HydrophobicContact CD2-CG1 4.15Å; Y566-I586 HydrophobicContact CD2-CG2 4.14Å; Y566-I586 HydrophobicContact CE1-CD1 3.27Å; Y566-I586 HydrophobicContact CE2-CD1 3.39Å; Y566-I586 HydrophobicContact CE2-CG1 4.01Å; Y566-I586 HydrophobicContact CG-CD1 3.88Å; Y566-I586 HydrophobicContact CG-CG1 4.47Å; Y566-I586 HydrophobicContact CG-CG2 3.94Å; Y566-V596 HydrophobicContact CD2-CG1 4.18Å; Y566-V596 HydrophobicContact CG-CG1 4.46Å; Y566-A600 HydrophobicContact CD2-CB 3.67Å; Y566-A600 HydrophobicContact CE2-CB 3.77Å; Y566-A600 HydrophobicContact CG-CB 4.48Å
567	E	85.5	Confident	74.2	Confident	93 Å²	93	76.9 Å²	76.9	44%	0.435	38%	0.377	S	S	.	.	H	α-helix	trans	-61.5	-29.9	-179.1	-73.9	-54.1	136.2	0	0	113.1	R563 L565	R563-E567 WeakPolarHBondContact O-CG 3.14Å; R563-E567 PolarHBondContact O-N 3.22Å; L565-E567 PolarHBondContact O-N 3.09Å
568	R	86.9	Confident	72.2	Confident	156 Å²	156	82.2 Å²	82.2	59%	0.589	40%	0.401	S	S	*	.	H	α-helix	trans	-83.9	-28.4	176.7	-64.9	175.9	-179	-172.3	2.8	113.6	I369 I564 L565 Y566	I369-R568 HydrophobicContact CD1-CB 3.38Å; I564-R568 VanDerWaalsContact O-CG 3.25Å; I564-R568 WeakPolarHBondContact O-CG 3.44Å; I564-R568 PolarHBondContact O-N 3.44Å; I564-R568 VanDerWaalsContact O-N 3.16Å; L565-R568 PolarHBondContact O-N 3.38Å; Y566-R568 PolarHBondContact O-N 3.49Å
569	L	86.4	Confident	70.2	Confident	56 Å²	56	80.7 Å²	80.7	29%	0.293	39%	0.391	S	S	.	.	H	α-helix	trans	-82.7	-29.2	177.3	-71.1	175.4	0	0	0	112.6	I369 L565 Y566 D571 Q597 A600	I369-L569 HydrophobicContact CD1-CD2 3.71Å; I369-L569 HydrophobicContact CD1-CG 4.02Å; I369-L569 HydrophobicContact CG1-CD2 4.15Å; L565-L569 HydrophobicContact CD1-CD1 3.77Å; L565-L569 HydrophobicContact CD1-CG 4.04Å; L565-L569 HydrophobicContact CD2-CD1 4.4Å; L565-L569 HydrophobicContact CG-CD1 3.75Å; L565-L569 HydrophobicContact CG-CG 4.36Å; L565-L569 WeakPolarHBondContact O-CB 3.48Å; L565-L569 WeakPolarHBondContact O-CG 2.96Å; L565-L569 PolarHBondContact O-N 2.78Å; Y566-L569 PolarHBondContact O-N 3.14Å; Y566-L569 VanDerWaalsContact O-N 3.14Å; L569-D571 PolarHBondContact O-N 2.92Å; L569-Q597 HydrophobicContact CD1-CB 3.8Å; L569-Q597 HydrophobicContact CD1-CG 4.1Å; L569-A600 HydrophobicContact CB-CB 3.71Å
570	K	79.8	Confident	68.4	Low	35 Å²	35	81.6 Å²	81.6	15%	0.152	41%	0.405	C	S	.	.	S	Bend	trans	-58.7	119.9	176.3	-175.5	-176.8	-177.9	-177.5	0	109.1	Y566 K572 S579	Y566-K570 HydrophobicContact CE1-CB 4.39Å; Y566-K570 HydrophobicContact CE1-CD 3.95Å; Y566-K570 WeakPolarHBondContact O-CB 3.48Å; Y566-K570 PolarHBondContact O-N 3.19Å; K570-K572 PolarHBondContact O-N 3.11Å; K570-S579 PolarHBondContact NZ-OG 3.2Å
571	D	66.2	Low	66.6	Low	86 Å²	86	79 Å²	79	46%	0.46	40%	0.401	S	S	.	.			trans	-66	119.1	174.2	-171.2	-7.6	0	0	0	109	L569 R573 C574	L569-D571 PolarHBondContact O-N 2.92Å; D571-R573 PolarHBondContact O-N 3.38Å; D571-R573 VanDerWaalsContact O-N 3.08Å; D571-R573 WeakPolarHBondContact OD1-CB 3.36Å; D571-R573 WeakPolarHBondContact OD1-CG 3.47Å; D571-R573 PolarHBondContact OD1-N 3.37Å; D571-C574 PolarHBondContact O-N 3.04Å
572	K	57.5	Low	64.8	Low	171 Å²	171	78.2 Å²	78.2	74%	0.743	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-59.7	-18.8	176.1	-64.3	-171.4	177.8	-172.6	0	112.5	K570 C574	K570-K572 PolarHBondContact O-N 3.11Å; K572-C574 VanDerWaalsContact C-N 3.33Å
573	R	52.9	Low	63.1	Low	203 Å²	203	82.7 Å²	82.7	77%	0.766	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-69.4	-30.7	173.3	-62.6	175.5	178.2	-171.3	-0	112.3	D571 E575	D571-R573 PolarHBondContact O-N 3.38Å; D571-R573 VanDerWaalsContact O-N 3.08Å; D571-R573 WeakPolarHBondContact OD1-CB 3.36Å; D571-R573 WeakPolarHBondContact OD1-CG 3.47Å; D571-R573 PolarHBondContact OD1-N 3.37Å; R573-E575 VanDerWaalsContact C-N 3.3Å; R573-E575 PolarHBondContact O-N 3.12Å
574	C	48	Very low	61.6	Low	83 Å²	83	80.5 Å²	80.5	56%	0.561	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-89	39.7	-178.5	-87.6	0	0	0	0	113.6	D571 K572 C576	D571-C574 PolarHBondContact O-N 3.04Å; K572-C574 VanDerWaalsContact C-N 3.33Å; C574-C576 VanDerWaalsContact C-N 3.25Å; C574-C576 PolarHBondContact O-N 3.18Å
575	E	44.2	Very low	60.1	Low	85 Å²	85	84.3 Å²	84.3	40%	0.397	43%	0.434	S	S	.	.			trans	-67	85.9	167.6	-77.3	170.9	-166.7	0	0	110.1	Q170 K182 R573	Q170-E575 PolarHBondContact NE2-O 3.16Å; K182-E575 VanDerWaalsContact NZ-CD 3.28Å; K182-E575 IonicContact NZ-OE1 3.77Å; K182-E575 IonicContact NZ-OE2 2.71Å; K182-E575 PolarHBondContact NZ-OE2 3.07Å; R573-E575 VanDerWaalsContact C-N 3.3Å; R573-E575 PolarHBondContact O-N 3.12Å
576	C	39.4	Very low	58.6	Low	61 Å²	61	84.3 Å²	84.3	41%	0.412	43%	0.433	S	S	.	.			trans	-86.6	131.9	155.6	-71.2	0	0	0	0	108	C574 E578 S579	C574-C576 VanDerWaalsContact C-N 3.25Å; C574-C576 PolarHBondContact O-N 3.18Å; C576-E578 PolarHBondContact O-N 3.09Å; C576-S579 PolarHBondContact O-N 3.22Å; C576-S579 PolarHBondContact O-OG 3.37Å
577	S	41.9	Very low	57.1	Low	111 Å²	111	84.4 Å²	84.4	78%	0.776	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-1.7	174.7	-46.8	0	0	0	0	114	S579	S577-S579 PolarHBondContact O-N 2.86Å
578	E	45.1	Very low	55.8	Low	119 Å²	119	86.1 Å²	86.1	56%	0.556	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-1	169	-65.4	-172.4	165.6	0	0	113.4	C576 S580 A581 K607	C576-E578 PolarHBondContact O-N 3.09Å; E578-S580 VanDerWaalsContact C-N 3.28Å; E578-S580 PolarHBondContact O-N 3.45Å; E578-A581 PolarHBondContact O-N 2.85Å; E578-K607 IonicContact OE1-NZ 3.88Å; E578-K607 PolarHBondContact OE1-NZ 3.23Å; E578-K607 IonicContact OE2-NZ 3.56Å; E578-K607 PolarHBondContact OE2-NZ 3.2Å
579	S	45.5	Very low	54.4	Low	25 Å²	25	79.2 Å²	79.2	18%	0.175	42%	0.423	C	S	.	.	H	α-helix	trans	-58.6	-27.8	-174.6	-64.3	0	0	0	0	115.2	K570 C576 S577 A581 T582 E583	K570-S579 PolarHBondContact NZ-OG 3.2Å; C576-S579 PolarHBondContact O-N 3.22Å; C576-S579 PolarHBondContact O-OG 3.37Å; S577-S579 PolarHBondContact O-N 2.86Å; S579-A581 PolarHBondContact O-N 3.4Å; S579-T582 WeakPolarHBondContact CA-OG1 3.46Å; S579-T582 PolarHBondContact O-N 3.01Å; S579-T582 PolarHBondContact O-OG1 2.91Å; S579-T582 VanDerWaalsContact O-OG1 3.05Å; S579-E583 WeakPolarHBondContact O-CB 3.49Å; S579-E583 WeakPolarHBondContact O-CG 3.32Å; S579-E583 PolarHBondContact O-N 3.15Å
580	S	45.9	Very low	53.3	Low	98 Å²	98	77.2 Å²	77.2	69%	0.685	41%	0.413	S	S	*	.	H	α-helix	trans	-67.7	-34.2	-177	65.1	0	0	0	0	113.4	E578	E578-S580 VanDerWaalsContact C-N 3.28Å; E578-S580 PolarHBondContact O-N 3.45Å
581	A	47.7	Very low	53.2	Low	51 Å²	51	78.5 Å²	78.5	42%	0.421	43%	0.427	S	S	.	.	H	α-helix	trans	-68.5	-51.5	176.2	0	0	0	0	0	109.4	E578 S579 E583 S584 Y585	E578-A581 PolarHBondContact O-N 2.85Å; S579-A581 PolarHBondContact O-N 3.4Å; A581-E583 PolarHBondContact O-N 2.89Å; A581-S584 PolarHBondContact O-N 3.23Å; A581-S584 PolarHBondContact O-OG 3.2Å; A581-Y585 HydrophobicContact CB-CE2 4.38Å; A581-Y585 WeakPolarHBondContact O-CD2 3.22Å; A581-Y585 VanDerWaalsContact O-CE2 3.31Å; A581-Y585 WeakPolarHBondContact O-CE2 3.47Å
582	T	51.1	Low	54.1	Low	20 Å²	20	74.5 Å²	74.5	12%	0.123	41%	0.405	C	S	.	.	H	α-helix	trans	-61.7	-42.1	-176.1	46	0	0	0	0	112.9	S579 S584 Y585 I586 I606	S579-T582 WeakPolarHBondContact CA-OG1 3.46Å; S579-T582 PolarHBondContact O-N 3.01Å; S579-T582 PolarHBondContact O-OG1 2.91Å; S579-T582 VanDerWaalsContact O-OG1 3.05Å; T582-S584 VanDerWaalsContact C-N 3.31Å; T582-S584 PolarHBondContact O-N 3.28Å; T582-Y585 PolarHBondContact O-N 2.78Å; T582-Y585 VanDerWaalsContact O-N 3.15Å; T582-I586 WeakPolarHBondContact O-CD1 3.38Å; T582-I586 WeakPolarHBondContact O-CG1 3.27Å; T582-I586 PolarHBondContact O-N 3.4Å; T582-I606 HydrophobicContact CG2-CD1 3.59Å
583	E	53	Low	55.7	Low	98 Å²	98	67.6 Å²	67.6	46%	0.458	38%	0.378	S	S	.	.	H	α-helix	trans	-57.5	-39.8	-179.4	-80.1	179.4	-152.2	0	0	113.7	S579 A581	S579-E583 WeakPolarHBondContact O-CB 3.49Å; S579-E583 WeakPolarHBondContact O-CG 3.32Å; S579-E583 PolarHBondContact O-N 3.15Å; A581-E583 PolarHBondContact O-N 2.89Å
584	S	53.8	Low	57.5	Low	73 Å²	73	58.2 Å²	58.2	51%	0.51	34%	0.343	S	S	.	.	H	α-helix	trans	-66.5	-39.2	178.4	68.5	0	0	0	0	112.5	A581 T582	A581-S584 PolarHBondContact O-N 3.23Å; A581-S584 PolarHBondContact O-OG 3.2Å; T582-S584 VanDerWaalsContact C-N 3.31Å; T582-S584 PolarHBondContact O-N 3.28Å
585	Y	55.1	Low	59.6	Low	132 Å²	132	54.3 Å²	54.3	52%	0.518	32%	0.317	S	S	.	.	H	α-helix	trans	-81	-28	-178.4	-60.5	-66.6	0	0	0	113.2	A581 T582 G587 D588 L589	A581-Y585 HydrophobicContact CB-CE2 4.38Å; A581-Y585 WeakPolarHBondContact O-CD2 3.22Å; A581-Y585 VanDerWaalsContact O-CE2 3.31Å; A581-Y585 WeakPolarHBondContact O-CE2 3.47Å; T582-Y585 PolarHBondContact O-N 2.78Å; T582-Y585 VanDerWaalsContact O-N 3.15Å; Y585-G587 PolarHBondContact O-N 3.19Å; Y585-G587 VanDerWaalsContact O-N 3.15Å; Y585-D588 PolarHBondContact O-N 3.45Å; Y585-D588 VanDerWaalsContact O-N 3.14Å; Y585-L589 WeakPolarHBondContact O-CB 3.08Å; Y585-L589 WeakPolarHBondContact O-CD1 3.34Å; Y585-L589 VanDerWaalsContact O-CG 3.24Å; Y585-L589 WeakPolarHBondContact O-CG 3.48Å; Y585-L589 PolarHBondContact O-N 2.87Å
586	I	57.7	Low	61.8	Low	10 Å²	10	50.5 Å²	50.5	5%	0.051	30%	0.299	C	S	.	.	H	α-helix	trans	-59.8	-27.3	176.7	-70.1	153.8	0	0	0	110.9	Y566 T582 L589	Y566-I586 HydrophobicContact CD1-CD1 3.65Å; Y566-I586 HydrophobicContact CD1-CG2 4.44Å; Y566-I586 HydrophobicContact CD2-CD1 3.77Å; Y566-I586 HydrophobicContact CD2-CG1 4.15Å; Y566-I586 HydrophobicContact CD2-CG2 4.14Å; Y566-I586 HydrophobicContact CE1-CD1 3.27Å; Y566-I586 HydrophobicContact CE2-CD1 3.39Å; Y566-I586 HydrophobicContact CE2-CG1 4.01Å; Y566-I586 HydrophobicContact CG-CD1 3.88Å; Y566-I586 HydrophobicContact CG-CG1 4.47Å; Y566-I586 HydrophobicContact CG-CG2 3.94Å; T582-I586 WeakPolarHBondContact O-CD1 3.38Å; T582-I586 WeakPolarHBondContact O-CG1 3.27Å; T582-I586 PolarHBondContact O-N 3.4Å; I586-L589 HydrophobicContact CB-CD1 4.43Å; I586-L589 HydrophobicContact CG1-CD1 3.97Å; I586-L589 PolarHBondContact O-N 3.44Å
587	G	55.2	Low	64.3	Low	6 Å²	6	50.5 Å²	50.5	6%	0.062	29%	0.293	C	S	.	.	H	α-helix	trans	-46	-68.3	169.2	0	0	0	0	0	111.4	M559 Y585 L589	M559-G587 WeakPolarHBondContact CE-O 3.1Å; M559-G587 VanDerWaalsContact SD-C 3.54Å; Y585-G587 PolarHBondContact O-N 3.19Å; Y585-G587 VanDerWaalsContact O-N 3.15Å; G587-L589 PolarHBondContact O-N 2.58Å
588	D	58.7	Low	66.6	Low	129 Å²	129	45.2 Å²	45.2	69%	0.69	26%	0.256	S	S	*	.	H	α-helix	trans	-73.3	-6.4	-175.4	-59.7	-29	0	0	0	113.7	Y585 S590	Y585-D588 PolarHBondContact O-N 3.45Å; Y585-D588 VanDerWaalsContact O-N 3.14Å; D588-S590 PolarHBondContact O-N 3.42Å
589	L	57.2	Low	68.7	Low	12 Å²	12	39.7 Å²	39.7	6%	0.063	23%	0.23	C	C	.	.	H	α-helix	trans	-72	-37.2	-155.4	-107.5	160.1	0	0	0	115.1	Y585 I586 G587 L599 K622	Y585-L589 WeakPolarHBondContact O-CB 3.08Å; Y585-L589 WeakPolarHBondContact O-CD1 3.34Å; Y585-L589 VanDerWaalsContact O-CG 3.24Å; Y585-L589 WeakPolarHBondContact O-CG 3.48Å; Y585-L589 PolarHBondContact O-N 2.87Å; I586-L589 HydrophobicContact CB-CD1 4.43Å; I586-L589 HydrophobicContact CG1-CD1 3.97Å; I586-L589 PolarHBondContact O-N 3.44Å; G587-L589 PolarHBondContact O-N 2.58Å; L589-L599 HydrophobicContact CB-CD1 4.47Å; L589-L599 HydrophobicContact CD1-CD1 3.65Å; L589-L599 HydrophobicContact CD2-CD1 3.3Å; L589-L599 HydrophobicContact CG-CD1 3.99Å; L589-K622 VanDerWaalsContact O-CD 3.27Å; L589-K622 WeakPolarHBondContact O-CD 3.47Å; L589-K622 PolarHBondContact O-NZ 3.07Å
590	S	64	Low	70.7	Confident	14 Å²	14	38.7 Å²	38.7	10%	0.098	22%	0.224	C	C	.	.			trans	-180	132.1	178	44.8	0	0	0	0	115.4	C562 D588 C592 A595 V596	C562-S590 PolarHBondContact SG-O 2.9Å; D588-S590 PolarHBondContact O-N 3.42Å; S590-C592 PolarHBondContact O-N 3.3Å; S590-C592 PolarHBondContact OG-O 2.73Å; S590-A595 WeakPolarHBondContact OG-CB 3.01Å; S590-V596 WeakPolarHBondContact OG-CG2 3.32Å
591	S	76.4	Confident	72.7	Confident	62 Å²	62	37.4 Å²	37.4	43%	0.434	21%	0.207	S	C	.	.	S	Bend	trans	-67.8	23.5	157.8	-63.4	0	0	0	0	114.6	Q403 L557	Q403-S591 PolarHBondContact NE2-O 3.01Å; Q403-S591 PolarHBondContact OE1-O 3.17Å; L557-S591 PolarHBondContact N-O 3.3Å
592	C	86.3	Confident	74.6	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.014	20%	0.196	C	C	.	.			trans	-134	113.6	-172.5	-178.6	0	0	0	0	110.7	G402 S590 L594 A595 V596 V619	G402-C592 PolarHBondContact O-SG 3.42Å; G402-C592 VanDerWaalsContact O-SG 3.38Å; S590-C592 PolarHBondContact O-N 3.3Å; S590-C592 PolarHBondContact OG-O 2.73Å; C592-L594 VanDerWaalsContact C-N 3.33Å; C592-L594 PolarHBondContact O-N 3.27Å; C592-A595 HydrophobicContact CB-CB 4.21Å; C592-A595 PolarHBondContact O-N 3.29Å; C592-V596 PolarHBondContact O-N 2.85Å; C592-V619 HydrophobicContact CB-CG1 3.68Å
593	P	90.1	Very high	76.3	Confident	25 Å²	25	38.1 Å²	38.1	16%	0.162	21%	0.205	C	C	.	.	H	α-helix	trans	-52.9	-42.4	179.7	-27.2	32.8	0	0	0	114.6	G402 L557 L565 A595 V596 Q597	G402-P593 WeakPolarHBondContact O-CD 2.98Å; L557-P593 HydrophobicContact CB-CG 4.32Å; L557-P593 HydrophobicContact CD2-CG 4.19Å; L565-P593 HydrophobicContact CD2-CB 3.92Å; P593-A595 VanDerWaalsContact C-N 3.34Å; P593-A595 PolarHBondContact O-N 3.14Å; P593-V596 WeakPolarHBondContact O-CB 3.36Å; P593-V596 PolarHBondContact O-N 3.4Å; P593-Q597 PolarHBondContact O-N 3.22Å
594	L	92.2	Very high	77.8	Confident	7 Å²	7	35.7 Å²	35.7	4%	0.037	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-38.5	-179.2	179.5	62.2	0	0	0	112.4	G402 C592 V596 Q597 M598 L623 H720 F722	G402-L594 VanDerWaalsContact CA-CB 3.47Å; G402-L594 WeakPolarHBondContact O-CB 3.34Å; G402-L594 PolarHBondContact O-N 3.17Å; G402-L594 VanDerWaalsContact O-N 3.11Å; C592-L594 VanDerWaalsContact C-N 3.33Å; C592-L594 PolarHBondContact O-N 3.27Å; L594-V596 VanDerWaalsContact C-N 3.32Å; L594-V596 PolarHBondContact O-N 2.87Å; L594-Q597 PolarHBondContact O-N 3.38Å; L594-M598 HydrophobicContact CD1-CG 4.29Å; L594-M598 HydrophobicContact CD1-SD 4.48Å; L594-M598 HydrophobicContact CG-CG 4.38Å; L594-M598 HydrophobicContact CG-SD 4.05Å; L594-M598 WeakPolarHBondContact O-CB 3.41Å; L594-M598 VanDerWaalsContact O-CG 3.26Å; L594-M598 WeakPolarHBondContact O-CG 3.25Å; L594-M598 PolarHBondContact O-N 3.18Å; L594-L623 HydrophobicContact CB-CD2 4.35Å; L594-L623 HydrophobicContact CD2-CD2 4.2Å; L594-L623 HydrophobicContact CG-CD2 4.21Å; L594-H720 WeakPolarHBondContact CD1-NE2 3.48Å; L594-H720 VanDerWaalsContact CD2-CD2 3.48Å; L594-H720 WeakPolarHBondContact CD2-CD2 3.32Å; L594-H720 WeakPolarHBondContact CD2-NE2 3.32Å; L594-F722 HydrophobicContact CD2-CE1 3.59Å; L594-F722 HydrophobicContact CD2-CZ 3.9Å
595	A	91	Very high	79.4	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-63.7	-41.2	176.8	0	0	0	0	0	111	S590 C592 P593 M598 L599 L623 I626	S590-A595 WeakPolarHBondContact OG-CB 3.01Å; C592-A595 HydrophobicContact CB-CB 4.21Å; C592-A595 PolarHBondContact O-N 3.29Å; P593-A595 VanDerWaalsContact C-N 3.34Å; P593-A595 PolarHBondContact O-N 3.14Å; A595-M598 PolarHBondContact O-N 3.31Å; A595-L599 WeakPolarHBondContact O-CG 2.97Å; A595-L599 PolarHBondContact O-N 2.91Å; A595-L599 VanDerWaalsContact O-N 3.1Å; A595-L623 HydrophobicContact CB-CD2 3.83Å; A595-I626 HydrophobicContact CB-CD1 3.87Å
596	V	90.6	Very high	80.9	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.024	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-45.9	173.4	-179.7	0	0	0	0	110.7	C562 L565 Y566 S590 C592 P593 L594 L599 A600	C562-V596 HydrophobicContact CB-CG2 4.1Å; L565-V596 HydrophobicContact CB-CG1 4.4Å; L565-V596 HydrophobicContact CD2-CB 4.18Å; L565-V596 HydrophobicContact CD2-CG1 4.19Å; L565-V596 HydrophobicContact CG-CG1 4.2Å; Y566-V596 HydrophobicContact CD2-CG1 4.18Å; Y566-V596 HydrophobicContact CG-CG1 4.46Å; S590-V596 WeakPolarHBondContact OG-CG2 3.32Å; C592-V596 PolarHBondContact O-N 2.85Å; P593-V596 WeakPolarHBondContact O-CB 3.36Å; P593-V596 PolarHBondContact O-N 3.4Å; L594-V596 VanDerWaalsContact C-N 3.32Å; L594-V596 PolarHBondContact O-N 2.87Å; V596-L599 PolarHBondContact O-N 3.4Å; V596-A600 WeakPolarHBondContact O-CB 3.32Å; V596-A600 PolarHBondContact O-N 3.4Å
597	Q	91.2	Very high	82.3	Confident	61 Å²	61	33.7 Å²	33.7	29%	0.285	19%	0.187	S	C	.	.	H	α-helix	trans	-61.4	-45.8	177.7	-178.4	179	-0.3	0	0	112.4	L569 P593 L594 L599 A600 E601 C703	L569-Q597 HydrophobicContact CD1-CB 3.8Å; L569-Q597 HydrophobicContact CD1-CG 4.1Å; P593-Q597 PolarHBondContact O-N 3.22Å; L594-Q597 PolarHBondContact O-N 3.38Å; Q597-L599 PolarHBondContact O-N 3.04Å; Q597-A600 PolarHBondContact O-N 2.95Å; Q597-E601 VanDerWaalsContact O-CB 3.28Å; Q597-E601 WeakPolarHBondContact O-CB 3.28Å; Q597-E601 PolarHBondContact O-N 2.78Å; Q597-C703 HydrophobicContact CG-CB 4.36Å
598	M	91.8	Very high	83.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-34.8	177.1	-71.4	170.4	63	0	0	111.9	L594 A595 M602 L623 I626 T627 R630 L704 F722	L594-M598 HydrophobicContact CD1-CG 4.29Å; L594-M598 HydrophobicContact CD1-SD 4.48Å; L594-M598 HydrophobicContact CG-CG 4.38Å; L594-M598 HydrophobicContact CG-SD 4.05Å; L594-M598 WeakPolarHBondContact O-CB 3.41Å; L594-M598 VanDerWaalsContact O-CG 3.26Å; L594-M598 WeakPolarHBondContact O-CG 3.25Å; L594-M598 PolarHBondContact O-N 3.18Å; A595-M598 PolarHBondContact O-N 3.31Å; M598-M602 PolarHBondContact O-N 3.27Å; M598-L623 HydrophobicContact SD-CD2 4.08Å; M598-I626 HydrophobicContact CB-CG2 4.21Å; M598-I626 HydrophobicContact CE-CB 3.81Å; M598-I626 HydrophobicContact CE-CG2 3.55Å; M598-T627 WeakPolarHBondContact CE-OG1 3.48Å; M598-R630 PolarHBondContact O-NH2 3.41Å; M598-L704 HydrophobicContact CE-CD1 4.39Å; M598-L704 HydrophobicContact CE-CD2 3.81Å; M598-L704 HydrophobicContact CE-CG 4.48Å; M598-L704 HydrophobicContact CG-CD2 4.37Å; M598-L704 HydrophobicContact SD-CD2 3.94Å; M598-F722 HydrophobicContact SD-CZ 4.49Å
599	L	88.7	Confident	85.3	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-83.3	-34.5	178.8	-66.2	173.7	0	0	0	112.7	L589 A595 V596 Q597 M602 P603 I606 I626	L589-L599 HydrophobicContact CB-CD1 4.47Å; L589-L599 HydrophobicContact CD1-CD1 3.65Å; L589-L599 HydrophobicContact CD2-CD1 3.3Å; L589-L599 HydrophobicContact CG-CD1 3.99Å; A595-L599 WeakPolarHBondContact O-CG 2.97Å; A595-L599 PolarHBondContact O-N 2.91Å; A595-L599 VanDerWaalsContact O-N 3.1Å; V596-L599 PolarHBondContact O-N 3.4Å; Q597-L599 PolarHBondContact O-N 3.04Å; L599-M602 CarbonylContact O-C 3.47Å; L599-P603 WeakPolarHBondContact O-CA 3.48Å; L599-P603 WeakPolarHBondContact O-CD 3.13Å; L599-P603 WeakPolarHBondContact O-CG 2.78Å; L599-I606 HydrophobicContact CD2-CG1 3.87Å; L599-I626 HydrophobicContact CD1-CD1 4.31Å; L599-I626 HydrophobicContact CD2-CG2 3.96Å; L599-I626 HydrophobicContact CG-CG2 4.4Å
600	A	88	Confident	86.7	Confident	5 Å²	5	34.2 Å²	34.2	4%	0.041	19%	0.186	C	C	.	.	H	α-helix	trans	-66.5	-40.4	175.7	0	0	0	0	0	112.1	Y566 L569 V596 Q597	Y566-A600 HydrophobicContact CD2-CB 3.67Å; Y566-A600 HydrophobicContact CE2-CB 3.77Å; Y566-A600 HydrophobicContact CG-CB 4.48Å; L569-A600 HydrophobicContact CB-CB 3.71Å; V596-A600 WeakPolarHBondContact O-CB 3.32Å; V596-A600 PolarHBondContact O-N 3.4Å; Q597-A600 PolarHBondContact O-N 2.95Å
601	E	88	Confident	87.5	Confident	71 Å²	71	38.5 Å²	38.5	33%	0.332	21%	0.211	S	C	.	.	H	α-helix	trans	-69.3	-41.8	-179.9	-176.3	-171	-142.3	0	0	112.3	Q597 R630 G702 C703	Q597-E601 VanDerWaalsContact O-CB 3.28Å; Q597-E601 WeakPolarHBondContact O-CB 3.28Å; Q597-E601 PolarHBondContact O-N 2.78Å; E601-R630 IonicContact OE2-CZ 3.9Å; E601-R630 IonicContact OE2-NH1 3.9Å; E601-R630 PolarHBondContact OE2-NH1 2.91Å; E601-R630 IonicContact OE2-NH2 2.8Å; E601-R630 PolarHBondContact OE2-NH2 3.12Å; E601-G702 VanDerWaalsContact CD-CA 3.43Å; E601-G702 VanDerWaalsContact OE1-C 3.28Å; E601-G702 WeakPolarHBondContact OE1-CA 3.28Å; E601-G702 WeakPolarHBondContact OE2-CA 3Å; E601-C703 PolarHBondContact OE1-N 2.97Å; E601-C703 PolarHBondContact OE2-N 3.42Å
602	M	87.6	Confident	87.9	Confident	37 Å²	37	41.9 Å²	41.9	18%	0.182	22%	0.224	C	C	.	.			trans	-134.8	80.8	177.1	-66.6	-70.5	147.4	0	0	111.3	M598 L599 A604 T605 R630 M633 Q699	M598-M602 PolarHBondContact O-N 3.27Å; L599-M602 CarbonylContact O-C 3.47Å; M602-A604 PolarHBondContact O-N 2.86Å; M602-A604 VanDerWaalsContact O-N 3.11Å; M602-T605 VanDerWaalsContact O-CB 3.29Å; M602-T605 WeakPolarHBondContact O-CB 3.48Å; M602-T605 PolarHBondContact O-N 3.18Å; M602-T605 PolarHBondContact O-OG1 3.03Å; M602-R630 VanDerWaalsContact CB-CZ 3.42Å; M602-R630 VanDerWaalsContact CG-CZ 3.44Å; M602-R630 VanDerWaalsContact CG-NH1 3.26Å; M602-M633 HydrophobicContact CB-CE 4.21Å; M602-M633 HydrophobicContact CG-CE 4.31Å; M602-Q699 HydrophobicContact CE-CG 3.72Å; M602-Q699 WeakPolarHBondContact CE-O 3.37Å
603	P	85.5	Confident	87.8	Confident	48 Å²	48	44.4 Å²	44.4	31%	0.312	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-59.6	-26.2	179.8	-24.7	34.2	0	0	0	113.4	L599 T605 I606	L599-P603 WeakPolarHBondContact O-CA 3.48Å; L599-P603 WeakPolarHBondContact O-CD 3.13Å; L599-P603 WeakPolarHBondContact O-CG 2.78Å; P603-T605 PolarHBondContact O-N 3.42Å; P603-T605 VanDerWaalsContact O-N 3.07Å; P603-I606 WeakPolarHBondContact O-CB 3.47Å; P603-I606 WeakPolarHBondContact O-CG1 3.2Å; P603-I606 PolarHBondContact O-N 2.81Å; P603-I606 VanDerWaalsContact O-N 3.1Å
604	A	84.1	Confident	87	Confident	48 Å²	48	45 Å²	45	40%	0.397	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-57.9	-21.7	175.8	0	0	0	0	0	113.5	M602 I606 K607 M633	M602-A604 PolarHBondContact O-N 2.86Å; M602-A604 VanDerWaalsContact O-N 3.11Å; A604-I606 PolarHBondContact O-N 3.4Å; A604-K607 WeakPolarHBondContact O-CB 3.39Å; A604-K607 PolarHBondContact O-N 3.43Å; A604-M633 HydrophobicContact CB-SD 3.9Å
605	T	88	Confident	86.4	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-57.1	-30	175.5	-49.2	0	0	0	0	112.2	M602 P603 K607 W608 I626 A629 R630	M602-T605 VanDerWaalsContact O-CB 3.29Å; M602-T605 WeakPolarHBondContact O-CB 3.48Å; M602-T605 PolarHBondContact O-N 3.18Å; M602-T605 PolarHBondContact O-OG1 3.03Å; P603-T605 PolarHBondContact O-N 3.42Å; P603-T605 VanDerWaalsContact O-N 3.07Å; T605-K607 PolarHBondContact O-N 3.32Å; T605-W608 WeakPolarHBondContact O-CB 3.44Å; T605-W608 PolarHBondContact O-N 2.96Å; T605-I626 HydrophobicContact CG2-CG2 4.09Å; T605-A629 HydrophobicContact CG2-CB 3.78Å; T605-R630 HydrophobicContact CG2-CB 4.15Å; T605-R630 VanDerWaalsContact OG1-CD 3.31Å; T605-R630 WeakPolarHBondContact OG1-CD 3.37Å; T605-R630 PolarHBondContact OG1-NE 2.89Å; T605-R630 VanDerWaalsContact OG1-NE 3.15Å
606	I	87.3	Confident	86	Confident	29 Å²	29	53.6 Å²	53.6	15%	0.149	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-58.5	-33.5	-179.4	-65.3	171.1	0	0	0	111.5	T582 L599 P603 A604 W608 L609 M614	T582-I606 HydrophobicContact CG2-CD1 3.59Å; L599-I606 HydrophobicContact CD2-CG1 3.87Å; P603-I606 WeakPolarHBondContact O-CB 3.47Å; P603-I606 WeakPolarHBondContact O-CG1 3.2Å; P603-I606 PolarHBondContact O-N 2.81Å; P603-I606 VanDerWaalsContact O-N 3.1Å; A604-I606 PolarHBondContact O-N 3.4Å; I606-W608 PolarHBondContact O-N 3.12Å; I606-W608 VanDerWaalsContact O-N 3.12Å; I606-L609 PolarHBondContact O-N 3.13Å; I606-M614 HydrophobicContact CG2-CE 3.7Å; I606-M614 WeakPolarHBondContact O-CE 3.09Å
607	K	87	Confident	85.5	Confident	143 Å²	143	58 Å²	58	62%	0.622	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-64.3	-16.6	178.6	-62	179.1	-178.5	175.9	0	113.1	E578 A604 T605	E578-K607 IonicContact OE1-NZ 3.88Å; E578-K607 PolarHBondContact OE1-NZ 3.23Å; E578-K607 IonicContact OE2-NZ 3.56Å; E578-K607 PolarHBondContact OE2-NZ 3.2Å; A604-K607 WeakPolarHBondContact O-CB 3.39Å; A604-K607 PolarHBondContact O-N 3.43Å; T605-K607 PolarHBondContact O-N 3.32Å
608	W	88.4	Confident	85.2	Confident	88 Å²	88	59.2 Å²	59.2	33%	0.333	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-103.7	-1.2	-177.3	-61.7	87.2	0	0	0	113.5	T605 I606 A629 R632 M633 H636	T605-W608 WeakPolarHBondContact O-CB 3.44Å; T605-W608 PolarHBondContact O-N 2.96Å; I606-W608 PolarHBondContact O-N 3.12Å; I606-W608 VanDerWaalsContact O-N 3.12Å; W608-A629 HydrophobicContact CB-CB 3.81Å; W608-R632 HydrophobicContact CD2-CB 4.24Å; W608-R632 HydrophobicContact CE3-CB 3.57Å; W608-R632 HydrophobicContact CZ3-CB 3.95Å; W608-M633 HydrophobicContact CD2-CB 4.32Å; W608-M633 HydrophobicContact CG-CB 4.26Å; W608-M633 HydrophobicContact CZ2-CB 4.48Å; W608-H636 HydrophobicContact CH2-CB 3.57Å; W608-H636 AromaticContact CH2-CG 3.82Å; W608-H636 HydrophobicContact CZ2-CB 3.79Å; W608-H636 AromaticContact CZ2-CG 3.97Å
609	L	88	Confident	84.9	Confident	19 Å²	19	61.3 Å²	61.3	10%	0.099	34%	0.338	C	S	.	.			trans	-97.1	141.2	178.2	-73.9	168.9	0	0	0	110.7	I606 Q613 M614 A625 I626 A629	I606-L609 PolarHBondContact O-N 3.13Å; L609-Q613 HydrophobicContact CD2-CB 4.18Å; L609-M614 HydrophobicContact CB-CE 3.46Å; L609-M614 VanDerWaalsContact CB-CE 3.46Å; L609-M614 HydrophobicContact CB-CG 4.05Å; L609-M614 HydrophobicContact CD1-CG 4.44Å; L609-A625 HydrophobicContact CD2-CB 4.29Å; L609-I626 HydrophobicContact CD1-CG1 4.15Å; L609-A629 HydrophobicContact CD2-CB 3.63Å; L609-A629 HydrophobicContact CG-CB 3.73Å
610	S	86.5	Confident	84.9	Confident	52 Å²	52	63.9 Å²	63.9	36%	0.364	35%	0.352	S	S	.	.			trans	-81.6	158.8	168	61.4	0	0	0	0	111.5	D612 Q613 M614	S610-D612 VanDerWaalsContact C-N 3.25Å; S610-D612 PolarHBondContact O-N 3.49Å; S610-Q613 PolarHBondContact O-N 3.42Å; S610-Q613 WeakPolarHBondContact OG-CB 3.07Å; S610-Q613 VanDerWaalsContact OG-CD 3.26Å; S610-Q613 WeakPolarHBondContact OG-CG 3.46Å; S610-Q613 PolarHBondContact OG-N 2.88Å; S610-Q613 PolarHBondContact OG-OE1 2.78Å; S610-M614 WeakPolarHBondContact O-CG 3.33Å; S610-M614 PolarHBondContact O-N 3.22Å; S610-M614 VanDerWaalsContact O-N 3.13Å
611	V	81.3	Confident	84.9	Confident	104 Å²	104	65.2 Å²	65.2	63%	0.63	36%	0.363	S	S	*	.	H	α-helix	trans	-58.1	-38.9	178.1	-178.9	0	0	0	0	111.5	M614 N615	V611-M614 PolarHBondContact O-N 3.38Å; V611-N615 PolarHBondContact O-N 3.36Å; V611-N615 PolarHBondContact O-ND2 3.33Å
612	D	84.5	Confident	84.9	Confident	132 Å²	132	62.9 Å²	62.9	71%	0.706	35%	0.352	S	S	*	.	H	α-helix	trans	-65.8	-44	178.7	-62.1	-32.3	0	0	0	111.9	S610 M614 N615 E616	S610-D612 VanDerWaalsContact C-N 3.25Å; S610-D612 PolarHBondContact O-N 3.49Å; D612-M614 VanDerWaalsContact C-N 3.26Å; D612-M614 PolarHBondContact O-N 3.19Å; D612-N615 PolarHBondContact O-N 3.41Å; D612-E616 PolarHBondContact O-N 3.5Å
613	Q	83.7	Confident	85.1	Confident	55 Å²	55	61.1 Å²	61.1	26%	0.257	34%	0.343	S	S	.	.	H	α-helix	trans	-63.6	-31.7	177.4	-74	170.4	-43.9	0	0	112.6	L609 S610 E616 A625	L609-Q613 HydrophobicContact CD2-CB 4.18Å; S610-Q613 PolarHBondContact O-N 3.42Å; S610-Q613 WeakPolarHBondContact OG-CB 3.07Å; S610-Q613 VanDerWaalsContact OG-CD 3.26Å; S610-Q613 WeakPolarHBondContact OG-CG 3.46Å; S610-Q613 PolarHBondContact OG-N 2.88Å; S610-Q613 PolarHBondContact OG-OE1 2.78Å; Q613-E616 WeakPolarHBondContact O-CB 3.43Å; Q613-A625 HydrophobicContact CB-CB 3.95Å; Q613-A625 HydrophobicContact CG-CB 3.91Å
614	M	74.6	Confident	85.5	Confident	39 Å²	39	60.5 Å²	60.5	19%	0.192	34%	0.339	C	S	.	.	H	α-helix	trans	-69.2	-37.8	175.9	-67.6	179.3	-170.8	0	0	111.8	I606 L609 S610 V611 D612 E616 K622	I606-M614 HydrophobicContact CG2-CE 3.7Å; I606-M614 WeakPolarHBondContact O-CE 3.09Å; L609-M614 HydrophobicContact CB-CE 3.46Å; L609-M614 VanDerWaalsContact CB-CE 3.46Å; L609-M614 HydrophobicContact CB-CG 4.05Å; L609-M614 HydrophobicContact CD1-CG 4.44Å; S610-M614 WeakPolarHBondContact O-CG 3.33Å; S610-M614 PolarHBondContact O-N 3.22Å; S610-M614 VanDerWaalsContact O-N 3.13Å; V611-M614 PolarHBondContact O-N 3.38Å; D612-M614 VanDerWaalsContact C-N 3.26Å; D612-M614 PolarHBondContact O-N 3.19Å; M614-E616 VanDerWaalsContact C-N 3.3Å; M614-E616 PolarHBondContact O-N 2.82Å; M614-K622 PolarHBondContact O-NZ 2.74Å
615	N	78.7	Confident	85.9	Confident	110 Å²	110	58.7 Å²	58.7	59%	0.588	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	5.6	-178.9	-67.4	-26.3	0	0	0	113.9	V611 D612 A617	V611-N615 PolarHBondContact O-N 3.36Å; V611-N615 PolarHBondContact O-ND2 3.33Å; D612-N615 PolarHBondContact O-N 3.41Å; N615-A617 PolarHBondContact O-N 3.47Å
616	E	82	Confident	86.1	Confident	77 Å²	77	58.9 Å²	58.9	36%	0.36	32%	0.324	S	S	.	.			trans	-58.7	123.2	179.8	-178	54.3	-124.1	0	0	111.3	D612 Q613 M614 N618 A621 K622	D612-E616 PolarHBondContact O-N 3.5Å; Q613-E616 WeakPolarHBondContact O-CB 3.43Å; M614-E616 VanDerWaalsContact C-N 3.3Å; M614-E616 PolarHBondContact O-N 2.82Å; E616-N618 WeakPolarHBondContact OE1-CB 3.46Å; E616-N618 PolarHBondContact OE1-N 3.04Å; E616-A621 HydrophobicContact CG-CB 3.66Å; E616-K622 HydrophobicContact CB-CB 4.24Å; E616-K622 HydrophobicContact CG-CB 4.31Å; E616-K622 WeakPolarHBondContact O-CE 3.49Å; E616-K622 PolarHBondContact O-NZ 3.29Å
617	A	80.2	Confident	86.5	Confident	96 Å²	96	57.5 Å²	57.5	79%	0.793	32%	0.317	S	S	*	.			trans	-78.7	-30.5	-178.1	0	0	0	0	0	112	N615 V619	N615-A617 PolarHBondContact O-N 3.47Å; A617-V619 PolarHBondContact O-N 3.03Å
618	N	86.1	Confident	86.9	Confident	88 Å²	88	52 Å²	52	47%	0.471	30%	0.295	S	S	.	.			trans	-74.9	118.9	179.2	-176.5	-63	0	0	0	110.6	E616 L620 A621 K622	E616-N618 WeakPolarHBondContact OE1-CB 3.46Å; E616-N618 PolarHBondContact OE1-N 3.04Å; N618-L620 VanDerWaalsContact C-N 3.33Å; N618-L620 PolarHBondContact O-N 2.79Å; N618-L620 WeakPolarHBondContact OD1-CB 3.43Å; N618-L620 PolarHBondContact OD1-N 3.24Å; N618-A621 HydrophobicContact CB-CB 3.88Å; N618-A621 PolarHBondContact O-N 3.4Å; N618-A621 PolarHBondContact OD1-N 3.37Å; N618-K622 WeakPolarHBondContact O-CB 3.27Å; N618-K622 PolarHBondContact O-N 3.38Å
619	V	84.8	Confident	87.2	Confident	43 Å²	43	47.9 Å²	47.9	26%	0.261	28%	0.28	S	S	.	.	H	α-helix	trans	-58.6	-42.9	-176.8	177.8	0	0	0	0	112.2	C592 A617 K622 L623	C592-V619 HydrophobicContact CB-CG1 3.68Å; A617-V619 PolarHBondContact O-N 3.03Å; V619-K622 PolarHBondContact O-N 2.83Å; V619-L623 HydrophobicContact CG1-CD1 4.16Å; V619-L623 HydrophobicContact CG1-CG 4.47Å; V619-L623 WeakPolarHBondContact O-CB 3.3Å; V619-L623 WeakPolarHBondContact O-CG 3.5Å; V619-L623 PolarHBondContact O-N 2.93Å
620	L	87.9	Confident	87.5	Confident	57 Å²	57	47 Å²	47	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-68.3	-45.4	-179.7	-179.5	62	0	0	0	111.1	H401 N618 K622 L623 T624 F722	H401-L620 HydrophobicContact CB-CD1 4.46Å; N618-L620 VanDerWaalsContact C-N 3.33Å; N618-L620 PolarHBondContact O-N 2.79Å; N618-L620 WeakPolarHBondContact OD1-CB 3.43Å; N618-L620 PolarHBondContact OD1-N 3.24Å; L620-K622 VanDerWaalsContact C-N 3.3Å; L620-K622 PolarHBondContact O-N 3.12Å; L620-L623 PolarHBondContact O-N 3.5Å; L620-T624 HydrophobicContact CD1-CG2 4.4Å; L620-T624 WeakPolarHBondContact O-CG2 3.25Å; L620-T624 PolarHBondContact O-N 2.91Å; L620-T624 PolarHBondContact O-OG1 2.77Å; L620-F722 HydrophobicContact CD1-CB 3.65Å; L620-F722 HydrophobicContact CD1-CG 4.25Å
621	A	89.6	Confident	88	Confident	34 Å²	34	44.7 Å²	44.7	28%	0.281	26%	0.259	S	S	.	.	H	α-helix	trans	-59.3	-43.5	176.3	0	0	0	0	0	111	E616 N618 T624 A625	E616-A621 HydrophobicContact CG-CB 3.66Å; N618-A621 HydrophobicContact CB-CB 3.88Å; N618-A621 PolarHBondContact O-N 3.4Å; N618-A621 PolarHBondContact OD1-N 3.37Å; A621-T624 WeakPolarHBondContact CA-OG1 3.32Å; A621-T624 PolarHBondContact O-N 2.86Å; A621-T624 PolarHBondContact O-OG1 2.8Å; A621-A625 PolarHBondContact O-N 2.59Å
622	K	87.1	Confident	88.6	Confident	21 Å²	21	44.5 Å²	44.5	9%	0.091	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-50.4	174.3	-172	176.8	-58.7	-144.8	0	112.2	L589 M614 E616 N618 V619 L620 T624 A625 I626	L589-K622 VanDerWaalsContact O-CD 3.27Å; L589-K622 WeakPolarHBondContact O-CD 3.47Å; L589-K622 PolarHBondContact O-NZ 3.07Å; M614-K622 PolarHBondContact O-NZ 2.74Å; E616-K622 HydrophobicContact CB-CB 4.24Å; E616-K622 HydrophobicContact CG-CB 4.31Å; E616-K622 WeakPolarHBondContact O-CE 3.49Å; E616-K622 PolarHBondContact O-NZ 3.29Å; N618-K622 WeakPolarHBondContact O-CB 3.27Å; N618-K622 PolarHBondContact O-N 3.38Å; V619-K622 PolarHBondContact O-N 2.83Å; L620-K622 VanDerWaalsContact C-N 3.3Å; L620-K622 PolarHBondContact O-N 3.12Å; K622-T624 VanDerWaalsContact C-N 3.29Å; K622-T624 PolarHBondContact O-N 3.15Å; K622-A625 WeakPolarHBondContact O-CB 3.33Å; K622-A625 PolarHBondContact O-N 2.71Å; K622-I626 HydrophobicContact CG-CD1 4.03Å; K622-I626 HydrophobicContact CG-CG1 4.42Å; K622-I626 WeakPolarHBondContact O-CG1 3.36Å; K622-I626 PolarHBondContact O-N 2.8Å
623	L	92	Very high	89.1	Confident	1 Å²	1	39 Å²	39	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-56.2	-44.3	177	-75.9	173.5	0	0	0	111.5	H401 L594 A595 M598 V619 L620 A625 I626 T627 F722	H401-L623 HydrophobicContact CB-CD1 4.13Å; L594-L623 HydrophobicContact CB-CD2 4.35Å; L594-L623 HydrophobicContact CD2-CD2 4.2Å; L594-L623 HydrophobicContact CG-CD2 4.21Å; A595-L623 HydrophobicContact CB-CD2 3.83Å; M598-L623 HydrophobicContact SD-CD2 4.08Å; V619-L623 HydrophobicContact CG1-CD1 4.16Å; V619-L623 HydrophobicContact CG1-CG 4.47Å; V619-L623 WeakPolarHBondContact O-CB 3.3Å; V619-L623 WeakPolarHBondContact O-CG 3.5Å; V619-L623 PolarHBondContact O-N 2.93Å; L620-L623 PolarHBondContact O-N 3.5Å; L623-A625 VanDerWaalsContact C-N 3.32Å; L623-A625 PolarHBondContact O-N 3.03Å; L623-I626 PolarHBondContact O-N 3.28Å; L623-T627 WeakPolarHBondContact O-CB 3.02Å; L623-T627 PolarHBondContact O-N 3.5Å; L623-T627 PolarHBondContact O-OG1 2.91Å; L623-F722 HydrophobicContact CB-CD2 4.15Å; L623-F722 HydrophobicContact CB-CE2 3.72Å; L623-F722 HydrophobicContact CB-CZ 4Å; L623-F722 HydrophobicContact CD1-CE1 4.28Å; L623-F722 HydrophobicContact CD1-CZ 4.38Å; L623-F722 HydrophobicContact CD2-CZ 4.33Å; L623-F722 HydrophobicContact CG-CZ 4.48Å
624	T	93.5	Very high	89.6	Confident	35 Å²	35	36.5 Å²	36.5	22%	0.215	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-36	176.8	61.3	0	0	0	0	112.7	L620 A621 K622 D628 F722 V726	L620-T624 HydrophobicContact CD1-CG2 4.4Å; L620-T624 WeakPolarHBondContact O-CG2 3.25Å; L620-T624 PolarHBondContact O-N 2.91Å; L620-T624 PolarHBondContact O-OG1 2.77Å; A621-T624 WeakPolarHBondContact CA-OG1 3.32Å; A621-T624 PolarHBondContact O-N 2.86Å; A621-T624 PolarHBondContact O-OG1 2.8Å; K622-T624 VanDerWaalsContact C-N 3.29Å; K622-T624 PolarHBondContact O-N 3.15Å; T624-D628 WeakPolarHBondContact O-CB 3.44Å; T624-D628 PolarHBondContact O-N 2.89Å; T624-F722 HydrophobicContact CG2-CD2 4.17Å; T624-V726 HydrophobicContact CG2-CG2 3.76Å
625	A	92.4	Very high	90.5	Very high	10 Å²	10	36.2 Å²	36.2	8%	0.083	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-43.3	176	0	0	0	0	0	112.1	L609 Q613 A621 K622 L623 D628 A629	L609-A625 HydrophobicContact CD2-CB 4.29Å; Q613-A625 HydrophobicContact CB-CB 3.95Å; Q613-A625 HydrophobicContact CG-CB 3.91Å; A621-A625 PolarHBondContact O-N 2.59Å; K622-A625 WeakPolarHBondContact O-CB 3.33Å; K622-A625 PolarHBondContact O-N 2.71Å; L623-A625 VanDerWaalsContact C-N 3.32Å; L623-A625 PolarHBondContact O-N 3.03Å; A625-D628 PolarHBondContact O-N 2.98Å; A625-A629 WeakPolarHBondContact O-CB 3.23Å; A625-A629 PolarHBondContact O-N 3.06Å
626	I	92.6	Very high	91.1	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.015	21%	0.209	C	C	.	.	H	α-helix	trans	-64.8	-41.6	176.1	-55.3	167.7	0	0	0	110.2	A595 M598 L599 T605 L609 K622 L623 A629 R630	A595-I626 HydrophobicContact CB-CD1 3.87Å; M598-I626 HydrophobicContact CB-CG2 4.21Å; M598-I626 HydrophobicContact CE-CB 3.81Å; M598-I626 HydrophobicContact CE-CG2 3.55Å; L599-I626 HydrophobicContact CD1-CD1 4.31Å; L599-I626 HydrophobicContact CD2-CG2 3.96Å; L599-I626 HydrophobicContact CG-CG2 4.4Å; T605-I626 HydrophobicContact CG2-CG2 4.09Å; L609-I626 HydrophobicContact CD1-CG1 4.15Å; K622-I626 HydrophobicContact CG-CD1 4.03Å; K622-I626 HydrophobicContact CG-CG1 4.42Å; K622-I626 WeakPolarHBondContact O-CG1 3.36Å; K622-I626 PolarHBondContact O-N 2.8Å; L623-I626 PolarHBondContact O-N 3.28Å; I626-A629 PolarHBondContact O-N 3.29Å; I626-R630 WeakPolarHBondContact O-CB 3.35Å; I626-R630 PolarHBondContact O-N 2.73Å
627	T	95.2	Very high	91.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-47	174.2	-64.7	0	0	0	0	111.5	M598 L623 A629 R630 L631 L704 F722 V723 V726	M598-T627 WeakPolarHBondContact CE-OG1 3.48Å; L623-T627 WeakPolarHBondContact O-CB 3.02Å; L623-T627 PolarHBondContact O-N 3.5Å; L623-T627 PolarHBondContact O-OG1 2.91Å; T627-A629 VanDerWaalsContact C-N 3.3Å; T627-A629 PolarHBondContact O-N 3.03Å; T627-R630 WeakPolarHBondContact O-CB 3.47Å; T627-R630 PolarHBondContact O-N 2.86Å; T627-R630 VanDerWaalsContact O-N 3.13Å; T627-L631 HydrophobicContact CG2-CD1 4.3Å; T627-L631 HydrophobicContact CG2-CG 4.42Å; T627-L631 WeakPolarHBondContact O-CG 3.32Å; T627-L631 PolarHBondContact O-N 2.94Å; T627-L704 HydrophobicContact CG2-CD1 4.14Å; T627-F722 VanDerWaalsContact OG1-CE2 3.27Å; T627-F722 WeakPolarHBondContact OG1-CE2 3.39Å; T627-V723 HydrophobicContact CG2-CG1 4.38Å; T627-V726 HydrophobicContact CG2-CB 4.13Å; T627-V726 HydrophobicContact CG2-CG1 3.95Å; T627-V726 HydrophobicContact CG2-CG2 4.25Å
628	D	95.6	Very high	91.7	Very high	28 Å²	28	33.2 Å²	33.2	15%	0.15	17%	0.168	C	C	.	.	H	α-helix	trans	-60.6	-40.5	177.7	-169.4	68.8	0	0	0	111.9	T624 A625 L631 R632 R730	T624-D628 WeakPolarHBondContact O-CB 3.44Å; T624-D628 PolarHBondContact O-N 2.89Å; A625-D628 PolarHBondContact O-N 2.98Å; D628-L631 PolarHBondContact O-N 3.42Å; D628-R632 WeakPolarHBondContact O-CG 3.38Å; D628-R632 PolarHBondContact O-N 3.21Å; D628-R632 IonicContact OD2-CZ 3.49Å; D628-R632 IonicContact OD2-NE 2.91Å; D628-R632 PolarHBondContact OD2-NE 3.15Å; D628-R632 IonicContact OD2-NH2 2.84Å; D628-R632 PolarHBondContact OD2-NH2 3.5Å; D628-R730 IonicContact OD1-CZ 2.81Å; D628-R730 IonicContact OD1-NH1 2.75Å; D628-R730 PolarHBondContact OD1-NH1 3.1Å; D628-R730 IonicContact OD2-NH1 3.23Å
629	A	94.3	Very high	91.9	Very high	2 Å²	2	29.6 Å²	29.6	2%	0.017	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-43.2	173.2	0	0	0	0	0	112.2	T605 W608 L609 A625 I626 T627 L631 R632 M633	T605-A629 HydrophobicContact CG2-CB 3.78Å; W608-A629 HydrophobicContact CB-CB 3.81Å; L609-A629 HydrophobicContact CD2-CB 3.63Å; L609-A629 HydrophobicContact CG-CB 3.73Å; A625-A629 WeakPolarHBondContact O-CB 3.23Å; A625-A629 PolarHBondContact O-N 3.06Å; I626-A629 PolarHBondContact O-N 3.29Å; T627-A629 VanDerWaalsContact C-N 3.3Å; T627-A629 PolarHBondContact O-N 3.03Å; A629-L631 VanDerWaalsContact C-N 3.32Å; A629-L631 PolarHBondContact O-N 3.09Å; A629-R632 PolarHBondContact O-N 3.46Å; A629-M633 PolarHBondContact O-N 2.9Å
630	R	94.1	Very high	92.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-39.8	175.7	-169.3	74.6	88.9	89.3	-2.1	111.6	M598 E601 M602 T605 I626 T627 M633 A634 C700 L701 L704	M598-R630 PolarHBondContact O-NH2 3.41Å; E601-R630 IonicContact OE2-CZ 3.9Å; E601-R630 IonicContact OE2-NH1 3.9Å; E601-R630 PolarHBondContact OE2-NH1 2.91Å; E601-R630 IonicContact OE2-NH2 2.8Å; E601-R630 PolarHBondContact OE2-NH2 3.12Å; M602-R630 VanDerWaalsContact CB-CZ 3.42Å; M602-R630 VanDerWaalsContact CG-CZ 3.44Å; M602-R630 VanDerWaalsContact CG-NH1 3.26Å; T605-R630 HydrophobicContact CG2-CB 4.15Å; T605-R630 VanDerWaalsContact OG1-CD 3.31Å; T605-R630 WeakPolarHBondContact OG1-CD 3.37Å; T605-R630 PolarHBondContact OG1-NE 2.89Å; T605-R630 VanDerWaalsContact OG1-NE 3.15Å; I626-R630 WeakPolarHBondContact O-CB 3.35Å; I626-R630 PolarHBondContact O-N 2.73Å; T627-R630 WeakPolarHBondContact O-CB 3.47Å; T627-R630 PolarHBondContact O-N 2.86Å; T627-R630 VanDerWaalsContact O-N 3.13Å; R630-M633 VanDerWaalsContact CD-CE 3.46Å; R630-M633 HydrophobicContact CG-CE 4.46Å; R630-M633 WeakPolarHBondContact O-CB 3.5Å; R630-M633 PolarHBondContact O-N 3.46Å; R630-A634 WeakPolarHBondContact O-CB 3.25Å; R630-A634 PolarHBondContact O-N 3.4Å; R630-C700 WeakPolarHBondContact CD-O 3.37Å; R630-C700 WeakPolarHBondContact CG-O 3.45Å; R630-C700 PolarHBondContact NH1-O 3.39Å; R630-L701 PolarHBondContact NH1-O 2.94Å; R630-L704 HydrophobicContact CB-CD1 4.28Å; R630-L704 HydrophobicContact CG-CD1 4.03Å
631	L	96.9	Very high	92.5	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-66.5	-42.3	176.7	-67	179.7	0	0	0	112	T627 D628 A629 M633 A634 E635 L647 L701 V726 Y731	T627-L631 HydrophobicContact CG2-CD1 4.3Å; T627-L631 HydrophobicContact CG2-CG 4.42Å; T627-L631 WeakPolarHBondContact O-CG 3.32Å; T627-L631 PolarHBondContact O-N 2.94Å; D628-L631 PolarHBondContact O-N 3.42Å; A629-L631 VanDerWaalsContact C-N 3.32Å; A629-L631 PolarHBondContact O-N 3.09Å; L631-M633 VanDerWaalsContact C-N 3.32Å; L631-M633 PolarHBondContact O-N 3.5Å; L631-A634 WeakPolarHBondContact O-CB 3.27Å; L631-A634 PolarHBondContact O-N 3.19Å; L631-A634 VanDerWaalsContact O-N 3.17Å; L631-E635 VanDerWaalsContact O-CG 3.27Å; L631-E635 WeakPolarHBondContact O-CG 3.41Å; L631-E635 PolarHBondContact O-N 2.95Å; L631-L647 HydrophobicContact CD2-CD1 3.57Å; L631-L701 HydrophobicContact CD2-CD2 4.06Å; L631-V726 HydrophobicContact CD1-CG1 3.9Å; L631-Y731 HydrophobicContact CD1-CE2 4.2Å
632	R	95.8	Very high	92.7	Very high	100 Å²	100	28.5 Å²	28.5	38%	0.377	15%	0.147	S	C	.	.	H	α-helix	trans	-60.7	-41.5	174.1	-69	172.4	-164.7	-154.7	1.9	112.3	W608 D628 A629 E635 H636	W608-R632 HydrophobicContact CD2-CB 4.24Å; W608-R632 HydrophobicContact CE3-CB 3.57Å; W608-R632 HydrophobicContact CZ3-CB 3.95Å; D628-R632 WeakPolarHBondContact O-CG 3.38Å; D628-R632 PolarHBondContact O-N 3.21Å; D628-R632 IonicContact OD2-CZ 3.49Å; D628-R632 IonicContact OD2-NE 2.91Å; D628-R632 PolarHBondContact OD2-NE 3.15Å; D628-R632 IonicContact OD2-NH2 2.84Å; D628-R632 PolarHBondContact OD2-NH2 3.5Å; A629-R632 PolarHBondContact O-N 3.46Å; R632-E635 PolarHBondContact O-N 3.45Å; R632-H636 PolarHBondContact O-N 2.98Å
633	M	93.7	Very high	93.1	Very high	18 Å²	18	27.5 Å²	27.5	9%	0.089	14%	0.143	C	C	.	.	H	α-helix	trans	-61.1	-45	173.6	-176.4	-174.5	74.5	0	0	111.4	M602 A604 W608 A629 R630 L631 H636 R637 C700	M602-M633 HydrophobicContact CB-CE 4.21Å; M602-M633 HydrophobicContact CG-CE 4.31Å; A604-M633 HydrophobicContact CB-SD 3.9Å; W608-M633 HydrophobicContact CD2-CB 4.32Å; W608-M633 HydrophobicContact CG-CB 4.26Å; W608-M633 HydrophobicContact CZ2-CB 4.48Å; A629-M633 PolarHBondContact O-N 2.9Å; R630-M633 VanDerWaalsContact CD-CE 3.46Å; R630-M633 HydrophobicContact CG-CE 4.46Å; R630-M633 WeakPolarHBondContact O-CB 3.5Å; R630-M633 PolarHBondContact O-N 3.46Å; L631-M633 VanDerWaalsContact C-N 3.32Å; L631-M633 PolarHBondContact O-N 3.5Å; M633-H636 PolarHBondContact O-N 3.06Å; M633-R637 PolarHBondContact O-N 2.95Å; M633-R637 VanDerWaalsContact O-N 3.1Å; M633-C700 HydrophobicContact CE-CB 4.39Å
634	A	93.9	Very high	93.2	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-62	-43.9	177.7	0	0	0	0	0	111.9	R630 L631 H636 R637 C638 C643 L697 C700	R630-A634 WeakPolarHBondContact O-CB 3.25Å; R630-A634 PolarHBondContact O-N 3.4Å; L631-A634 WeakPolarHBondContact O-CB 3.27Å; L631-A634 PolarHBondContact O-N 3.19Å; L631-A634 VanDerWaalsContact O-N 3.17Å; A634-H636 VanDerWaalsContact C-N 3.33Å; A634-H636 PolarHBondContact O-N 3.35Å; A634-R637 PolarHBondContact O-N 3.4Å; A634-R637 VanDerWaalsContact O-N 3.15Å; A634-C638 WeakPolarHBondContact O-CB 3.5Å; A634-C638 PolarHBondContact O-N 3.27Å; A634-C643 PolarHBondContact O-SG 2.66Å; A634-C643 VanDerWaalsContact O-SG 3.41Å; A634-L697 HydrophobicContact CB-CD1 3.86Å; A634-C700 HydrophobicContact CB-CB 3.73Å
635	E	95.1	Very high	93.3	Very high	33 Å²	33	31.7 Å²	31.7	15%	0.154	16%	0.156	C	C	.	.	H	α-helix	trans	-60	-42.3	176	-71.7	167.7	177	0	0	112	L631 R632 R637 G639 P640 C643 R730 Y731	L631-E635 VanDerWaalsContact O-CG 3.27Å; L631-E635 WeakPolarHBondContact O-CG 3.41Å; L631-E635 PolarHBondContact O-N 2.95Å; R632-E635 PolarHBondContact O-N 3.45Å; E635-R637 VanDerWaalsContact C-N 3.3Å; E635-R637 PolarHBondContact O-N 3.42Å; E635-G639 CarbonylContact O-C 3.58Å; E635-G639 VanDerWaalsContact O-C 3.26Å; E635-G639 WeakPolarHBondContact O-CA 3.43Å; E635-G639 PolarHBondContact O-N 3.13Å; E635-P640 HydrophobicContact CB-CB 4.39Å; E635-C643 VanDerWaalsContact CA-SG 3.58Å; E635-C643 HydrophobicContact CG-CB 3.8Å; E635-R730 IonicContact OE1-CZ 3.94Å; E635-R730 IonicContact OE1-NE 3.68Å; E635-R730 PolarHBondContact OE1-NE 2.81Å; E635-R730 IonicContact OE1-NH2 2.67Å; E635-R730 PolarHBondContact OE1-NH2 3.42Å; E635-R730 IonicContact OE2-CZ 3.93Å; E635-R730 IonicContact OE2-NE 3.51Å; E635-R730 IonicContact OE2-NH2 3.11Å; E635-R730 PolarHBondContact OE2-NH2 2.87Å; E635-Y731 VanDerWaalsContact OE1-CE1 3.25Å; E635-Y731 WeakPolarHBondContact OE1-CE1 3.1Å; E635-Y731 VanDerWaalsContact OE1-CZ 3.29Å; E635-Y731 PolarHBondContact OE1-OH 2.88Å
636	H	90.1	Very high	93.5	Very high	151 Å²	151	31.2 Å²	31.2	70%	0.699	15%	0.152	S	C	*	.	H	α-helix	trans	-63.6	-36.4	176.1	-177.1	67.2	0	0	0	112.4	W608 R632 M633 A634	W608-H636 HydrophobicContact CH2-CB 3.57Å; W608-H636 AromaticContact CH2-CG 3.82Å; W608-H636 HydrophobicContact CZ2-CB 3.79Å; W608-H636 AromaticContact CZ2-CG 3.97Å; R632-H636 PolarHBondContact O-N 2.98Å; M633-H636 PolarHBondContact O-N 3.06Å; A634-H636 VanDerWaalsContact C-N 3.33Å; A634-H636 PolarHBondContact O-N 3.35Å
637	R	86.3	Confident	93.7	Very high	55 Å²	55	31.1 Å²	31.1	21%	0.208	15%	0.151	C	C	.	.	H	α-helix	trans	-86.3	-37.4	-174.3	-166.2	176.8	-166.3	-150.3	2.5	114.1	D187 M633 A634 E635	D187-R637 IonicContact OD1-NE 3.83Å; D187-R637 IonicContact OD2-CZ 3.27Å; D187-R637 IonicContact OD2-NE 2.72Å; D187-R637 PolarHBondContact OD2-NE 3.41Å; D187-R637 IonicContact OD2-NH2 2.65Å; D187-R637 PolarHBondContact OD2-NH2 3.21Å; M633-R637 PolarHBondContact O-N 2.95Å; M633-R637 VanDerWaalsContact O-N 3.1Å; A634-R637 PolarHBondContact O-N 3.4Å; A634-R637 VanDerWaalsContact O-N 3.15Å; E635-R637 VanDerWaalsContact C-N 3.3Å; E635-R637 PolarHBondContact O-N 3.42Å
638	C	88.4	Confident	93.7	Very high	14 Å²	14	31.2 Å²	31.2	10%	0.095	15%	0.152	C	C	.	.	H	α-helix	trans	-107.5	-18.9	-172.4	-54.3	0	0	0	0	113	A634 V693 L697	A634-C638 WeakPolarHBondContact O-CB 3.5Å; A634-C638 PolarHBondContact O-N 3.27Å; C638-V693 HydrophobicContact CB-CG1 4.26Å; C638-L697 HydrophobicContact CB-CB 4.46Å; C638-L697 PolarHBondContact SG-N 3.4Å
639	G	90.2	Very high	93.7	Very high	12 Å²	12	30 Å²	30	12%	0.124	15%	0.145	C	C	.	.			trans	105.9	138.2	-173	0	0	0	0	0	112	E635 C643 E675	E635-G639 CarbonylContact O-C 3.58Å; E635-G639 VanDerWaalsContact O-C 3.26Å; E635-G639 WeakPolarHBondContact O-CA 3.43Å; E635-G639 PolarHBondContact O-N 3.13Å; G639-C643 PolarHBondContact O-N 2.69Å; G639-C643 VanDerWaalsContact O-N 3.09Å; G639-C643 PolarHBondContact O-SG 3.11Å; G639-E675 WeakPolarHBondContact CA-OE1 3.39Å
640	P	93.8	Very high	93.8	Very high	77 Å²	77	30 Å²	30	50%	0.5	15%	0.145	S	C	.	.	H	α-helix	trans	-67.7	-37.1	-175.2	26	-34.4	0	0	0	113.3	E635 R644 E675	E635-P640 HydrophobicContact CB-CB 4.39Å; P640-R644 VanDerWaalsContact O-CB 3.3Å; P640-R644 WeakPolarHBondContact O-CB 3.48Å; P640-R644 PolarHBondContact O-N 2.91Å; P640-E675 VanDerWaalsContact CD-OE2 3.24Å; P640-E675 WeakPolarHBondContact CD-OE2 3.17Å; P640-E675 WeakPolarHBondContact CG-OE2 3.34Å
641	S	92.8	Very high	93.8	Very high	34 Å²	34	30.7 Å²	30.7	24%	0.238	15%	0.148	C	C	.	.	H	α-helix	trans	-69.7	-44.9	179.5	-49.3	0	0	0	0	110.3	C643 R644 F645 E675	S641-C643 VanDerWaalsContact C-N 3.35Å; S641-C643 PolarHBondContact O-N 2.92Å; S641-R644 PolarHBondContact O-N 3.4Å; S641-F645 WeakPolarHBondContact O-CD2 3.45Å; S641-F645 PolarHBondContact O-N 2.98Å; S641-E675 VanDerWaalsContact CB-CD 3.48Å; S641-E675 WeakPolarHBondContact CB-OE2 3.37Å; S641-E675 PolarHBondContact N-OE1 3.25Å; S641-E675 PolarHBondContact N-OE2 2.93Å; S641-E675 PolarHBondContact OG-OE2 3.47Å
642	V	92.4	Very high	93.5	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-55.8	-50.7	175.3	171.8	0	0	0	0	111.1	F645 A646 E675 V676 F689 V693	V642-F645 PolarHBondContact O-N 3.06Å; V642-A646 VanDerWaalsContact O-CB 3.27Å; V642-A646 WeakPolarHBondContact O-CB 3.37Å; V642-A646 PolarHBondContact O-N 3.36Å; V642-E675 WeakPolarHBondContact CG2-OE1 3.4Å; V642-E675 PolarHBondContact N-OE1 2.81Å; V642-V676 HydrophobicContact CG2-CG2 3.59Å; V642-F689 HydrophobicContact CG1-CE2 4.1Å; V642-F689 HydrophobicContact CG1-CZ 3.58Å; V642-F689 HydrophobicContact CG2-CE2 3.93Å; V642-F689 HydrophobicContact CG2-CZ 4.15Å; V642-V693 HydrophobicContact CG1-CG1 3.82Å; V642-V693 HydrophobicContact CG2-CG1 4.49Å
643	C	95.5	Very high	93.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.2	-50.1	179	-67	0	0	0	0	110.7	A634 E635 G639 S641 F645 L647	A634-C643 PolarHBondContact O-SG 2.66Å; A634-C643 VanDerWaalsContact O-SG 3.41Å; E635-C643 VanDerWaalsContact CA-SG 3.58Å; E635-C643 HydrophobicContact CG-CB 3.8Å; G639-C643 PolarHBondContact O-N 2.69Å; G639-C643 VanDerWaalsContact O-N 3.09Å; G639-C643 PolarHBondContact O-SG 3.11Å; S641-C643 VanDerWaalsContact C-N 3.35Å; S641-C643 PolarHBondContact O-N 2.92Å; C643-F645 PolarHBondContact O-N 3.2Å; C643-L647 HydrophobicContact CB-CD1 4.38Å; C643-L647 WeakPolarHBondContact O-CB 3.49Å; C643-L647 WeakPolarHBondContact O-CD1 3.43Å; C643-L647 WeakPolarHBondContact O-CG 3.21Å; C643-L647 PolarHBondContact O-N 2.89Å; C643-L647 VanDerWaalsContact O-N 3.08Å
644	R	95.4	Very high	92.8	Very high	81 Å²	81	30.2 Å²	30.2	31%	0.306	15%	0.149	S	C	.	.	H	α-helix	trans	-51.4	-55.1	179.1	175.7	177.5	-179.1	166.3	0.3	112	P640 S641 C648 Y731 H737	P640-R644 VanDerWaalsContact O-CB 3.3Å; P640-R644 WeakPolarHBondContact O-CB 3.48Å; P640-R644 PolarHBondContact O-N 2.91Å; S641-R644 PolarHBondContact O-N 3.4Å; R644-C648 VanDerWaalsContact O-CB 3.3Å; R644-C648 WeakPolarHBondContact O-CB 3.03Å; R644-C648 PolarHBondContact O-N 3.17Å; R644-C648 PolarHBondContact O-SG 3.39Å; R644-Y731 HydrophobicContact CB-CD1 3.8Å; R644-Y731 HydrophobicContact CB-CE1 4.06Å; R644-Y731 HydrophobicContact CB-CG 4.47Å; R644-Y731 HydrophobicContact CG-CD1 3.75Å; R644-Y731 HydrophobicContact CG-CG 4.19Å; R644-H737 PolarHBondContact NH2-CD2 3.1Å; R644-H737 PolarHBondContact NH2-CE1 2.92Å; R644-H737 PolarHBondContact NH2-ND1 3.02Å; R644-H737 PolarHBondContact NH2-NE2 3.14Å
645	F	95	Very high	92.3	Very high	43 Å²	43	33.1 Å²	33.1	19%	0.189	16%	0.161	C	C	.	.	H	α-helix	trans	-72.4	-42.3	-173	-72.4	-71.5	0	0	0	112.8	S641 V642 C643 L647 C648 F649 L666 C669 P671	S641-F645 WeakPolarHBondContact O-CD2 3.45Å; S641-F645 PolarHBondContact O-N 2.98Å; V642-F645 PolarHBondContact O-N 3.06Å; C643-F645 PolarHBondContact O-N 3.2Å; F645-L647 VanDerWaalsContact C-N 3.34Å; F645-L647 PolarHBondContact O-N 3.34Å; F645-C648 PolarHBondContact O-N 2.93Å; F645-F649 HydrophobicContact CB-CD2 4.39Å; F645-F649 HydrophobicContact CB-CE2 3.92Å; F645-F649 HydrophobicContact CB-CZ 4.41Å; F645-F649 HydrophobicContact CD1-CZ 4.29Å; F645-F649 WeakPolarHBondContact O-CB 3.16Å; F645-F649 WeakPolarHBondContact O-CD2 3.32Å; F645-F649 WeakPolarHBondContact O-CG 3.29Å; F645-F649 PolarHBondContact O-N 3.41Å; F645-L666 HydrophobicContact CB-CD2 4.17Å; F645-C669 VanDerWaalsContact CD1-SG 3.54Å; F645-C669 WeakPolarHBondContact CD2-SG 3.48Å; F645-C669 WeakPolarHBondContact CG-SG 3.49Å; F645-P671 HydrophobicContact CE2-CB 3.83Å; F645-P671 HydrophobicContact CE2-CG 4.03Å; F645-P671 HydrophobicContact CZ-CB 4.41Å; F645-P671 HydrophobicContact CZ-CG 4.13Å
646	A	96.1	Very high	92.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.4	-47	178.3	0	0	0	0	0	111.5	V642 F649 I650 L666 W694 L697	V642-A646 VanDerWaalsContact O-CB 3.27Å; V642-A646 WeakPolarHBondContact O-CB 3.37Å; V642-A646 PolarHBondContact O-N 3.36Å; A646-F649 PolarHBondContact O-N 2.97Å; A646-I650 WeakPolarHBondContact O-CG1 3.04Å; A646-I650 PolarHBondContact O-N 2.73Å; A646-I650 VanDerWaalsContact O-N 3.16Å; A646-L666 HydrophobicContact CB-CD1 4.08Å; A646-L666 HydrophobicContact CB-CD2 4Å; A646-W694 HydrophobicContact CB-CZ3 4.37Å; A646-L697 HydrophobicContact CB-CD2 3.69Å
647	L	96.7	Very high	92.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-72.3	-36.4	-177.3	-52.2	173.5	0	0	0	111.6	L631 C643 F645 E651 L701 W718 Y731	L631-L647 HydrophobicContact CD2-CD1 3.57Å; C643-L647 HydrophobicContact CB-CD1 4.38Å; C643-L647 WeakPolarHBondContact O-CB 3.49Å; C643-L647 WeakPolarHBondContact O-CD1 3.43Å; C643-L647 WeakPolarHBondContact O-CG 3.21Å; C643-L647 PolarHBondContact O-N 2.89Å; C643-L647 VanDerWaalsContact O-N 3.08Å; F645-L647 VanDerWaalsContact C-N 3.34Å; F645-L647 PolarHBondContact O-N 3.34Å; L647-E651 WeakPolarHBondContact O-CB 3.19Å; L647-E651 PolarHBondContact O-N 3.41Å; L647-L701 HydrophobicContact CD2-CD1 3.61Å; L647-L701 HydrophobicContact CD2-CD2 3.7Å; L647-L701 HydrophobicContact CD2-CG 4.23Å; L647-W718 HydrophobicContact CB-CH2 4.24Å; L647-W718 HydrophobicContact CB-CZ2 4.1Å; L647-W718 HydrophobicContact CD2-CH2 3.45Å; L647-W718 VanDerWaalsContact CD2-CH2 3.45Å; L647-W718 HydrophobicContact CD2-CZ2 4.15Å; L647-W718 HydrophobicContact CD2-CZ3 4.42Å; L647-W718 HydrophobicContact CG-CH2 4.36Å; L647-Y731 HydrophobicContact CB-CE2 4.37Å; L647-Y731 HydrophobicContact CD1-CD2 4.48Å; L647-Y731 HydrophobicContact CD1-CE2 3.58Å
648	C	95.6	Very high	92.6	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.014	12%	0.118	C	C	.	.	H	α-helix	trans	-62.8	-44.1	172.3	-75.2	0	0	0	0	112.4	R644 F645 E651 C652 Y731 L732 C741	R644-C648 VanDerWaalsContact O-CB 3.3Å; R644-C648 WeakPolarHBondContact O-CB 3.03Å; R644-C648 PolarHBondContact O-N 3.17Å; R644-C648 PolarHBondContact O-SG 3.39Å; F645-C648 PolarHBondContact O-N 2.93Å; C648-E651 PolarHBondContact O-N 3.39Å; C648-C652 WeakPolarHBondContact O-CB 3.4Å; C648-C652 PolarHBondContact O-N 3.3Å; C648-C652 PolarHBondContact O-SG 3.03Å; C648-C652 VanDerWaalsContact O-SG 3.33Å; C648-Y731 WeakPolarHBondContact SG-CB 3.49Å; C648-L732 HydrophobicContact CB-CD2 4.04Å; C648-L732 HydrophobicContact CB-CG 4.44Å; C648-L732 VanDerWaalsContact SG-CD2 3.5Å; C648-C741 VanDerWaalsContact CB-SG 3.55Å
649	F	95.8	Very high	92.8	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.009	12%	0.116	C	C	.	.	H	α-helix	trans	-63.5	-43.6	-179.9	-67.7	-40	0	0	0	111.9	F645 A646 E651 C652 A653 L657 L662 L665 L666 C669 C741	F645-F649 HydrophobicContact CB-CD2 4.39Å; F645-F649 HydrophobicContact CB-CE2 3.92Å; F645-F649 HydrophobicContact CB-CZ 4.41Å; F645-F649 HydrophobicContact CD1-CZ 4.29Å; F645-F649 WeakPolarHBondContact O-CB 3.16Å; F645-F649 WeakPolarHBondContact O-CD2 3.32Å; F645-F649 WeakPolarHBondContact O-CG 3.29Å; F645-F649 PolarHBondContact O-N 3.41Å; A646-F649 PolarHBondContact O-N 2.97Å; F649-E651 VanDerWaalsContact C-N 3.33Å; F649-E651 PolarHBondContact O-N 3.5Å; F649-C652 PolarHBondContact O-N 3.45Å; F649-A653 WeakPolarHBondContact O-CB 3.36Å; F649-A653 PolarHBondContact O-N 2.98Å; F649-A653 VanDerWaalsContact O-N 3.09Å; F649-L657 HydrophobicContact CB-CD1 3.78Å; F649-L657 WeakPolarHBondContact O-CD1 3.31Å; F649-L662 HydrophobicContact CB-CD1 4.42Å; F649-L665 HydrophobicContact CB-CD1 4.06Å; F649-L665 HydrophobicContact CD1-CD1 4.39Å; F649-L665 HydrophobicContact CD2-CB 3.74Å; F649-L665 HydrophobicContact CD2-CD1 4.3Å; F649-L665 HydrophobicContact CE2-CB 3.76Å; F649-L665 HydrophobicContact CG-CB 4.27Å; F649-L665 HydrophobicContact CG-CD1 4.03Å; F649-L665 HydrophobicContact CZ-CB 4.31Å; F649-L666 HydrophobicContact CD2-CD2 4.26Å; F649-L666 HydrophobicContact CE2-CD2 4.21Å; F649-C669 HydrophobicContact CE2-CB 4.37Å; F649-C669 HydrophobicContact CZ-CB 4.49Å; F649-C741 HydrophobicContact CD1-CB 4.35Å; F649-C741 HydrophobicContact CE1-CB 4.42Å
650	I	95.8	Very high	92.8	Very high	2 Å²	2	22 Å²	22	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-61.7	-41.9	176	-66.4	165.5	0	0	0	110.9	A646 L657 L662 W694 L705 W718	A646-I650 WeakPolarHBondContact O-CG1 3.04Å; A646-I650 PolarHBondContact O-N 2.73Å; A646-I650 VanDerWaalsContact O-N 3.16Å; I650-L657 HydrophobicContact CG1-CD1 4.47Å; I650-L662 HydrophobicContact CD1-CD2 4.19Å; I650-L662 HydrophobicContact CG1-CD1 4.22Å; I650-L662 HydrophobicContact CG1-CD2 4.49Å; I650-W694 HydrophobicContact CD1-CH2 3.69Å; I650-W694 HydrophobicContact CD1-CZ3 4.14Å; I650-L705 HydrophobicContact CD1-CD1 4.09Å; I650-L705 HydrophobicContact CG2-CD1 4.35Å; I650-W718 HydrophobicContact CB-CZ2 3.86Å; I650-W718 HydrophobicContact CD1-CZ2 4.47Å; I650-W718 HydrophobicContact CG2-CD2 4.42Å; I650-W718 HydrophobicContact CG2-CH2 4.41Å; I650-W718 HydrophobicContact CG2-CZ2 3.69Å
651	E	94	Very high	92.7	Very high	15 Å²	15	19.1 Å²	19.1	7%	0.07	9%	0.092	C	C	.	.	H	α-helix	trans	-62.6	-50.3	175.7	-167.1	-65.5	156.4	0	0	111.8	L647 C648 F649 A653 I724 I727 R728 L732	L647-E651 WeakPolarHBondContact O-CB 3.19Å; L647-E651 PolarHBondContact O-N 3.41Å; C648-E651 PolarHBondContact O-N 3.39Å; F649-E651 VanDerWaalsContact C-N 3.33Å; F649-E651 PolarHBondContact O-N 3.5Å; E651-A653 PolarHBondContact O-N 3.06Å; E651-I724 HydrophobicContact CG-CG2 4.03Å; E651-I727 HydrophobicContact CB-CG2 4.17Å; E651-I727 HydrophobicContact CG-CG2 4.34Å; E651-R728 HydrophobicContact CG-CG 4.41Å; E651-R728 IonicContact OE1-CZ 2.82Å; E651-R728 IonicContact OE1-NE 3.51Å; E651-R728 PolarHBondContact OE1-NE 2.86Å; E651-R728 IonicContact OE1-NH2 2.74Å; E651-R728 PolarHBondContact OE1-NH2 2.77Å; E651-L732 HydrophobicContact CB-CD1 4.43Å; E651-L732 HydrophobicContact CG-CD1 4.29Å
652	C	91.9	Very high	92.8	Very high	4 Å²	4	17.5 Å²	17.5	3%	0.027	8%	0.081	C	C	.	.	H	α-helix	trans	-70.1	-15.7	-172.8	-71.4	0	0	0	0	112.2	C648 F649 R654 C741 H742 L745	C648-C652 WeakPolarHBondContact O-CB 3.4Å; C648-C652 PolarHBondContact O-N 3.3Å; C648-C652 PolarHBondContact O-SG 3.03Å; C648-C652 VanDerWaalsContact O-SG 3.33Å; F649-C652 PolarHBondContact O-N 3.45Å; C652-R654 PolarHBondContact O-N 2.89Å; C652-C741 HydrophobicContact CB-CB 4.37Å; C652-H742 PolarHBondContact O-CE1 2.86Å; C652-L745 HydrophobicContact CB-CD1 3.62Å
653	A	90.5	Very high	92.7	Very high	14 Å²	14	17.5 Å²	17.5	12%	0.116	8%	0.081	C	C	.	.	S	Bend	trans	-81.3	109.2	173.5	0	0	0	0	0	111.3	F649 E651 F655 G656 L657	F649-A653 WeakPolarHBondContact O-CB 3.36Å; F649-A653 PolarHBondContact O-N 2.98Å; F649-A653 VanDerWaalsContact O-N 3.09Å; E651-A653 PolarHBondContact O-N 3.06Å; A653-F655 PolarHBondContact O-N 2.9Å; A653-G656 WeakPolarHBondContact CB-O 3.29Å; A653-G656 PolarHBondContact O-N 2.97Å; A653-L657 HydrophobicContact CB-CD1 4.2Å; A653-L657 HydrophobicContact CB-CD2 3.63Å; A653-L657 HydrophobicContact CB-CG 3.51Å
654	R	83.9	Confident	92.4	Very high	94 Å²	94	17.8 Å²	17.8	36%	0.355	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-34.4	-173.4	178.3	174	168.5	164.6	-5.8	115.2	C652 S796	C652-R654 PolarHBondContact O-N 2.89Å; R654-S796 PolarHBondContact NH1-OG 3.29Å
655	F	84	Confident	92.1	Very high	62 Å²	62	14.1 Å²	14.1	27%	0.272	7%	0.069	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.2	16.7	-179.9	-63	-66.6	0	0	0	112.6	P434 S437 A653 V715	P434-F655 HydrophobicContact CB-CE1 4.04Å; P434-F655 HydrophobicContact CB-CE2 4.25Å; P434-F655 HydrophobicContact CB-CZ 3.88Å; P434-F655 HydrophobicContact CG-CD1 4.04Å; P434-F655 HydrophobicContact CG-CD2 4.27Å; P434-F655 HydrophobicContact CG-CE1 4.08Å; P434-F655 HydrophobicContact CG-CE2 4.29Å; P434-F655 HydrophobicContact CG-CG 4.14Å; P434-F655 HydrophobicContact CG-CZ 4.19Å; S437-F655 WeakPolarHBondContact OG-CE1 3.2Å; A653-F655 PolarHBondContact O-N 2.9Å; F655-V715 WeakPolarHBondContact O-CG2 3.29Å
656	G	91	Very high	91.9	Very high	13 Å²	13	12.1 Å²	12.1	13%	0.134	6%	0.06	C	C	.	.			trans	85.7	-179.1	-173.9	0	0	0	0	0	113.8	A653 Y716	A653-G656 WeakPolarHBondContact CB-O 3.29Å; A653-G656 PolarHBondContact O-N 2.97Å; G656-Y716 CarbonylContact C-O 3.55Å; G656-Y716 WeakPolarHBondContact CA-O 3.44Å
657	L	93.7	Very high	91.5	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	142	-178.1	-67.9	171.9	0	0	0	111.1	F649 I650 A653 E661 L662 L665 V715 Y716 L745 F749	F649-L657 HydrophobicContact CB-CD1 3.78Å; F649-L657 WeakPolarHBondContact O-CD1 3.31Å; I650-L657 HydrophobicContact CG1-CD1 4.47Å; A653-L657 HydrophobicContact CB-CD1 4.2Å; A653-L657 HydrophobicContact CB-CD2 3.63Å; A653-L657 HydrophobicContact CB-CG 3.51Å; L657-E661 WeakPolarHBondContact CA-OE2 3.38Å; L657-E661 HydrophobicContact CB-CB 4.36Å; L657-E661 HydrophobicContact CD2-CB 4.15Å; L657-L662 HydrophobicContact CB-CB 4.45Å; L657-L662 HydrophobicContact CD1-CD1 4.15Å; L657-L665 HydrophobicContact CD1-CD1 3.72Å; L657-L665 HydrophobicContact CD2-CD1 4.26Å; L657-V715 CarbonylContact O-C 3.59Å; L657-V715 WeakPolarHBondContact O-CA 3.3Å; L657-Y716 PolarHBondContact N-O 2.57Å; L657-Y716 VanDerWaalsContact N-O 3.14Å; L657-Y716 PolarHBondContact O-N 3.19Å; L657-L745 HydrophobicContact CD1-CD2 4.45Å; L657-L745 HydrophobicContact CD2-CD2 3.85Å; L657-F749 HydrophobicContact CD2-CZ 4.5Å
658	T	92.4	Very high	90.8	Very high	4 Å²	4	13.8 Å²	13.8	3%	0.025	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	160.9	168.2	75.9	0	0	0	0	110.9	E87 G660 E661 L662 R713 S714 V715	E87-T658 PolarHBondContact OE1-OG1 2.94Å; E87-T658 PolarHBondContact OE2-OG1 2.96Å; T658-G660 VanDerWaalsContact C-N 3.26Å; T658-G660 PolarHBondContact O-N 2.94Å; T658-E661 PolarHBondContact N-OE2 3.07Å; T658-E661 PolarHBondContact O-N 3.21Å; T658-E661 VanDerWaalsContact OG1-CG 3.27Å; T658-E661 WeakPolarHBondContact OG1-CG 3.44Å; T658-E661 PolarHBondContact OG1-N 3.45Å; T658-L662 WeakPolarHBondContact O-CB 3.33Å; T658-L662 PolarHBondContact O-N 2.97Å; T658-R713 HydrophobicContact CG2-CB 4.05Å; T658-S714 WeakPolarHBondContact CA-O 3.29Å; T658-V715 HydrophobicContact CG2-CG1 3.95Å
659	L	92.5	Very high	90.4	Very high	10 Å²	10	14.2 Å²	14.2	5%	0.052	7%	0.071	C	C	.	.	H	α-helix	trans	-55.4	-44.2	174.5	177.3	61.4	0	0	0	111.4	T89 V91 L662 L663 L691 W694 Y716	T89-L659 HydrophobicContact CG2-CD2 4.43Å; T89-L659 HydrophobicContact CG2-CG 4.43Å; V91-L659 HydrophobicContact CG2-CD2 3.86Å; L659-L662 PolarHBondContact O-N 3.19Å; L659-L663 HydrophobicContact CD1-CD1 3.97Å; L659-L663 HydrophobicContact CD1-CD2 4.43Å; L659-L663 HydrophobicContact CD1-CG 3.94Å; L659-L663 HydrophobicContact CG-CD1 4.04Å; L659-L663 HydrophobicContact CG-CG 4.37Å; L659-L663 WeakPolarHBondContact O-CB 3.48Å; L659-L663 VanDerWaalsContact O-CG 3.29Å; L659-L663 WeakPolarHBondContact O-CG 3.41Å; L659-L663 PolarHBondContact O-N 3.06Å; L659-L691 HydrophobicContact CD1-CD1 4.1Å; L659-L691 HydrophobicContact CD2-CD1 4.28Å; L659-W694 VanDerWaalsContact CD1-CD1 3.46Å; L659-W694 HydrophobicContact CD1-CG 4.45Å; L659-Y716 HydrophobicContact CB-CE2 3.96Å; L659-Y716 HydrophobicContact CD1-CE2 4.15Å
660	G	90.1	Very high	89.8	Confident	3 Å²	3	19.1 Å²	19.1	3%	0.031	9%	0.094	C	C	.	.	H	α-helix	trans	-60.9	-46.8	178.2	0	0	0	0	0	112.1	T658 L662 L663 D664	T658-G660 VanDerWaalsContact C-N 3.26Å; T658-G660 PolarHBondContact O-N 2.94Å; G660-L662 PolarHBondContact O-N 2.77Å; G660-L663 PolarHBondContact O-N 3.5Å; G660-D664 WeakPolarHBondContact O-CB 3.21Å; G660-D664 PolarHBondContact O-N 3.44Å
661	E	92.1	Very high	89.3	Confident	17 Å²	17	22 Å²	22	8%	0.079	11%	0.113	C	C	.	.	H	α-helix	trans	-60.7	-44	177.7	-71.1	170.4	164.7	0	0	112.2	L657 T658 D664 L665 L748 F749	L657-E661 WeakPolarHBondContact CA-OE2 3.38Å; L657-E661 HydrophobicContact CB-CB 4.36Å; L657-E661 HydrophobicContact CD2-CB 4.15Å; T658-E661 PolarHBondContact N-OE2 3.07Å; T658-E661 PolarHBondContact O-N 3.21Å; T658-E661 VanDerWaalsContact OG1-CG 3.27Å; T658-E661 WeakPolarHBondContact OG1-CG 3.44Å; T658-E661 PolarHBondContact OG1-N 3.45Å; E661-D664 PolarHBondContact O-N 2.81Å; E661-L665 VanDerWaalsContact O-CG 3.28Å; E661-L665 WeakPolarHBondContact O-CG 3.32Å; E661-L665 PolarHBondContact O-N 3.29Å; E661-L748 HydrophobicContact CB-CD2 3.87Å; E661-L748 HydrophobicContact CG-CD2 4.03Å; E661-F749 WeakPolarHBondContact OE1-CE1 3.45Å
662	L	93.7	Very high	88.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.8	-45.7	179.8	-178.3	62.3	0	0	0	111.9	F649 I650 L657 T658 L659 G660 D664 L665 L666 W694 Y716	F649-L662 HydrophobicContact CB-CD1 4.42Å; I650-L662 HydrophobicContact CD1-CD2 4.19Å; I650-L662 HydrophobicContact CG1-CD1 4.22Å; I650-L662 HydrophobicContact CG1-CD2 4.49Å; L657-L662 HydrophobicContact CB-CB 4.45Å; L657-L662 HydrophobicContact CD1-CD1 4.15Å; T658-L662 WeakPolarHBondContact O-CB 3.33Å; T658-L662 PolarHBondContact O-N 2.97Å; L659-L662 PolarHBondContact O-N 3.19Å; G660-L662 PolarHBondContact O-N 2.77Å; L662-D664 VanDerWaalsContact C-N 3.33Å; L662-D664 PolarHBondContact O-N 2.76Å; L662-L665 PolarHBondContact O-N 3.18Å; L662-L666 HydrophobicContact CD1-CD1 4.22Å; L662-L666 HydrophobicContact CD1-CG 4.37Å; L662-L666 HydrophobicContact CG-CD1 4.14Å; L662-L666 WeakPolarHBondContact O-CB 3.5Å; L662-L666 WeakPolarHBondContact O-CG 3.39Å; L662-L666 PolarHBondContact O-N 2.67Å; L662-W694 HydrophobicContact CD2-CD2 3.77Å; L662-W694 HydrophobicContact CD2-CE3 3.66Å; L662-W694 HydrophobicContact CD2-CH2 3.37Å; L662-W694 HydrophobicContact CD2-CZ2 3.45Å; L662-W694 VanDerWaalsContact CD2-CZ2 3.45Å; L662-W694 HydrophobicContact CD2-CZ3 3.48Å; L662-W694 VanDerWaalsContact CD2-CZ3 3.48Å; L662-Y716 HydrophobicContact CD2-CD2 4.24Å
663	L	90.6	Very high	88.4	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-64.2	-39.2	177.6	-68.9	-179.3	0	0	0	111.5	L659 G660 L666 T667 F689 L691 W694	L659-L663 HydrophobicContact CD1-CD1 3.97Å; L659-L663 HydrophobicContact CD1-CD2 4.43Å; L659-L663 HydrophobicContact CD1-CG 3.94Å; L659-L663 HydrophobicContact CG-CD1 4.04Å; L659-L663 HydrophobicContact CG-CG 4.37Å; L659-L663 WeakPolarHBondContact O-CB 3.48Å; L659-L663 VanDerWaalsContact O-CG 3.29Å; L659-L663 WeakPolarHBondContact O-CG 3.41Å; L659-L663 PolarHBondContact O-N 3.06Å; G660-L663 PolarHBondContact O-N 3.5Å; L663-L666 PolarHBondContact O-N 2.79Å; L663-T667 WeakPolarHBondContact O-CB 3.38Å; L663-T667 PolarHBondContact O-N 3.46Å; L663-T667 PolarHBondContact O-OG1 2.79Å; L663-F689 HydrophobicContact CD2-CD1 3.83Å; L663-L691 HydrophobicContact CD1-CD1 4.39Å; L663-W694 HydrophobicContact CD2-CB 4.26Å
664	D	88.7	Confident	87.9	Confident	7 Å²	7	24.1 Å²	24.1	4%	0.037	12%	0.122	C	C	.	.	H	α-helix	trans	-62.8	-49.4	175.5	-69.9	-24.1	0	0	0	110.4	G660 E661 L662 L666 T667 F668 L748 R774	G660-D664 WeakPolarHBondContact O-CB 3.21Å; G660-D664 PolarHBondContact O-N 3.44Å; E661-D664 PolarHBondContact O-N 2.81Å; L662-D664 VanDerWaalsContact C-N 3.33Å; L662-D664 PolarHBondContact O-N 2.76Å; D664-L666 VanDerWaalsContact C-N 3.33Å; D664-L666 PolarHBondContact O-N 2.91Å; D664-T667 VanDerWaalsContact O-CB 3.31Å; D664-T667 WeakPolarHBondContact O-CB 3.27Å; D664-T667 PolarHBondContact O-N 3.47Å; D664-T667 VanDerWaalsContact O-N 3.07Å; D664-F668 WeakPolarHBondContact O-CD2 3.29Å; D664-F668 PolarHBondContact O-N 3.43Å; D664-F668 VanDerWaalsContact O-N 3.15Å; D664-L748 HydrophobicContact CB-CD1 3.66Å; D664-R774 IonicContact OD2-CZ 3Å; D664-R774 VanDerWaalsContact OD2-CZ 3.25Å; D664-R774 IonicContact OD2-NH1 2.81Å; D664-R774 PolarHBondContact OD2-NH1 3.47Å; D664-R774 IonicContact OD2-NH2 2.91Å; D664-R774 PolarHBondContact OD2-NH2 2.83Å
665	L	90.9	Very high	88	Confident	3 Å²	3	21.2 Å²	21.2	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-58.2	-43.5	177.6	-72.8	165.4	0	0	0	112.8	F649 L657 E661 L662 T667 F668 C669 S744 L745 L748	F649-L665 HydrophobicContact CB-CD1 4.06Å; F649-L665 HydrophobicContact CD1-CD1 4.39Å; F649-L665 HydrophobicContact CD2-CB 3.74Å; F649-L665 HydrophobicContact CD2-CD1 4.3Å; F649-L665 HydrophobicContact CE2-CB 3.76Å; F649-L665 HydrophobicContact CG-CB 4.27Å; F649-L665 HydrophobicContact CG-CD1 4.03Å; F649-L665 HydrophobicContact CZ-CB 4.31Å; L657-L665 HydrophobicContact CD1-CD1 3.72Å; L657-L665 HydrophobicContact CD2-CD1 4.26Å; E661-L665 VanDerWaalsContact O-CG 3.28Å; E661-L665 WeakPolarHBondContact O-CG 3.32Å; E661-L665 PolarHBondContact O-N 3.29Å; L662-L665 PolarHBondContact O-N 3.18Å; L665-T667 VanDerWaalsContact C-N 3.3Å; L665-T667 PolarHBondContact O-N 2.98Å; L665-F668 PolarHBondContact O-N 3.31Å; L665-C669 WeakPolarHBondContact O-CB 3.24Å; L665-C669 PolarHBondContact O-N 3.2Å; L665-C669 VanDerWaalsContact O-N 3.15Å; L665-S744 WeakPolarHBondContact CD2-O 3.33Å; L665-L745 HydrophobicContact CD1-CD2 3.61Å; L665-L745 HydrophobicContact CD2-CD2 4.41Å; L665-L748 HydrophobicContact CD1-CD2 3.99Å; L665-L748 HydrophobicContact CD2-CB 3.84Å; L665-L748 HydrophobicContact CD2-CD2 4.09Å; L665-L748 HydrophobicContact CD2-CG 4.41Å; L665-L748 HydrophobicContact CG-CB 4.44Å; L665-L748 HydrophobicContact CG-CD1 4.49Å; L665-L748 HydrophobicContact CG-CD2 3.85Å; L665-L748 HydrophobicContact CG-CG 4.49Å
666	L	90.5	Very high	87.8	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-68.5	-31.1	177.6	-70.4	174.8	0	0	0	112.2	F645 A646 F649 L662 L663 D664 C669 F689	F645-L666 HydrophobicContact CB-CD2 4.17Å; A646-L666 HydrophobicContact CB-CD1 4.08Å; A646-L666 HydrophobicContact CB-CD2 4Å; F649-L666 HydrophobicContact CD2-CD2 4.26Å; F649-L666 HydrophobicContact CE2-CD2 4.21Å; L662-L666 HydrophobicContact CD1-CD1 4.22Å; L662-L666 HydrophobicContact CD1-CG 4.37Å; L662-L666 HydrophobicContact CG-CD1 4.14Å; L662-L666 WeakPolarHBondContact O-CB 3.5Å; L662-L666 WeakPolarHBondContact O-CG 3.39Å; L662-L666 PolarHBondContact O-N 2.67Å; L663-L666 PolarHBondContact O-N 2.79Å; D664-L666 VanDerWaalsContact C-N 3.33Å; D664-L666 PolarHBondContact O-N 2.91Å; L666-C669 PolarHBondContact O-N 2.78Å; L666-F689 HydrophobicContact CB-CB 3.79Å; L666-F689 HydrophobicContact CB-CD1 4.05Å; L666-F689 HydrophobicContact CB-CD2 3.6Å; L666-F689 HydrophobicContact CB-CE2 4.18Å; L666-F689 HydrophobicContact CB-CG 3.51Å; L666-F689 HydrophobicContact CD1-CD1 3.83Å; L666-F689 HydrophobicContact CD1-CD2 4.41Å; L666-F689 HydrophobicContact CD1-CE1 3.76Å; L666-F689 HydrophobicContact CD1-CE2 4.33Å; L666-F689 HydrophobicContact CD1-CG 4.16Å; L666-F689 HydrophobicContact CD1-CZ 4.02Å; L666-F689 HydrophobicContact CG-CG 4.47Å
667	T	86.1	Confident	87.2	Confident	5 Å²	5	18.9 Å²	18.9	3%	0.031	10%	0.1	C	C	.	.	H	α-helix	trans	-63.5	-42.6	176.1	-62	0	0	0	0	111.8	L663 D664 L665 C669 M673 F687 Q688 F689 I758	L663-T667 WeakPolarHBondContact O-CB 3.38Å; L663-T667 PolarHBondContact O-N 3.46Å; L663-T667 PolarHBondContact O-OG1 2.79Å; D664-T667 VanDerWaalsContact O-CB 3.31Å; D664-T667 WeakPolarHBondContact O-CB 3.27Å; D664-T667 PolarHBondContact O-N 3.47Å; D664-T667 VanDerWaalsContact O-N 3.07Å; L665-T667 VanDerWaalsContact C-N 3.3Å; L665-T667 PolarHBondContact O-N 2.98Å; T667-C669 VanDerWaalsContact C-N 3.3Å; T667-M673 HydrophobicContact CG2-CE 3.72Å; T667-M673 WeakPolarHBondContact O-CE 3.36Å; T667-F687 HydrophobicContact CG2-CD1 4.43Å; T667-Q688 HydrophobicContact CG2-CG 4.44Å; T667-Q688 VanDerWaalsContact OG1-CG 3.25Å; T667-Q688 WeakPolarHBondContact OG1-CG 3.19Å; T667-F689 PolarHBondContact OG1-N 3.28Å; T667-I758 WeakPolarHBondContact O-CD1 3.43Å
668	F	84	Confident	86.4	Confident	30 Å²	30	23.6 Å²	23.6	13%	0.132	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	2.3	-179.8	-64	-76.3	0	0	0	113.4	D664 L665 E670 L753 P754 V771	D664-F668 WeakPolarHBondContact O-CD2 3.29Å; D664-F668 PolarHBondContact O-N 3.43Å; D664-F668 VanDerWaalsContact O-N 3.15Å; L665-F668 PolarHBondContact O-N 3.31Å; F668-E670 PolarHBondContact O-N 3.49Å; F668-L753 HydrophobicContact CB-CD2 4.05Å; F668-L753 HydrophobicContact CD1-CB 4.3Å; F668-L753 HydrophobicContact CD2-CB 3.86Å; F668-L753 HydrophobicContact CD2-CD1 3.57Å; F668-L753 HydrophobicContact CD2-CD2 4.06Å; F668-L753 HydrophobicContact CD2-CG 4.03Å; F668-L753 HydrophobicContact CE1-CB 4.44Å; F668-L753 HydrophobicContact CE2-CB 4.05Å; F668-L753 HydrophobicContact CE2-CD1 3.77Å; F668-L753 HydrophobicContact CE2-CG 4.44Å; F668-L753 HydrophobicContact CG-CB 4.02Å; F668-L753 HydrophobicContact CG-CD1 4.43Å; F668-L753 HydrophobicContact CG-CD2 4.19Å; F668-L753 HydrophobicContact CG-CG 4.43Å; F668-L753 HydrophobicContact CZ-CB 4.32Å; F668-P754 WeakPolarHBondContact CD1-O 3.43Å; F668-P754 WeakPolarHBondContact CE1-O 3.5Å; F668-V771 HydrophobicContact CE2-CG2 3.63Å; F668-V771 HydrophobicContact CZ-CG2 3.77Å
669	C	86.3	Confident	85.3	Confident	12 Å²	12	28.3 Å²	28.3	8%	0.081	16%	0.162	C	C	.	.			trans	-88	94.5	174.9	-173.7	0	0	0	0	110.2	F645 F649 L665 L666 T667 G672 M673	F645-C669 VanDerWaalsContact CD1-SG 3.54Å; F645-C669 WeakPolarHBondContact CD2-SG 3.48Å; F645-C669 WeakPolarHBondContact CG-SG 3.49Å; F649-C669 HydrophobicContact CE2-CB 4.37Å; F649-C669 HydrophobicContact CZ-CB 4.49Å; L665-C669 WeakPolarHBondContact O-CB 3.24Å; L665-C669 PolarHBondContact O-N 3.2Å; L665-C669 VanDerWaalsContact O-N 3.15Å; L666-C669 PolarHBondContact O-N 2.78Å; T667-C669 VanDerWaalsContact C-N 3.3Å; C669-G672 PolarHBondContact O-N 2.85Å; C669-M673 WeakPolarHBondContact O-CB 3.49Å; C669-M673 PolarHBondContact O-N 3.28Å
670	E	83.2	Confident	84	Confident	105 Å²	105	31.3 Å²	31.3	49%	0.491	17%	0.172	S	C	.	.	H	α-helix	trans	-48.3	-51.8	-176.8	172	-179.7	-172.3	0	0	113.9	F668 G672 M673 L674 I758	F668-E670 PolarHBondContact O-N 3.49Å; E670-G672 PolarHBondContact O-N 2.9Å; E670-M673 PolarHBondContact O-N 3.26Å; E670-L674 HydrophobicContact CG-CD1 3.64Å; E670-L674 HydrophobicContact CG-CG 4.14Å; E670-L674 WeakPolarHBondContact O-CB 3.45Å; E670-L674 VanDerWaalsContact O-CG 3.3Å; E670-L674 WeakPolarHBondContact O-CG 3.42Å; E670-L674 PolarHBondContact O-N 2.85Å; E670-I758 HydrophobicContact CB-CG1 4.18Å; E670-I758 HydrophobicContact CB-CG2 4.14Å; E670-I758 HydrophobicContact CG-CG2 4.13Å
671	P	85.5	Confident	82.5	Confident	63 Å²	63	33.1 Å²	33.1	41%	0.409	19%	0.19	S	C	.	.	H	α-helix	trans	-65.8	-39.2	-176.2	-19.2	31.6	0	0	0	113.1	F645 M673 E675	F645-P671 HydrophobicContact CE2-CB 3.83Å; F645-P671 HydrophobicContact CE2-CG 4.03Å; F645-P671 HydrophobicContact CZ-CB 4.41Å; F645-P671 HydrophobicContact CZ-CG 4.13Å; P671-M673 VanDerWaalsContact C-N 3.32Å; P671-E675 WeakPolarHBondContact O-CB 3.35Å; P671-E675 PolarHBondContact O-N 2.96Å
672	G	83.2	Confident	80.8	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-38.9	175.9	0	0	0	0	0	111.5	C669 E670 V676	C669-G672 PolarHBondContact O-N 2.85Å; E670-G672 PolarHBondContact O-N 2.9Å; G672-V676 WeakPolarHBondContact O-CG2 3.07Å; G672-V676 PolarHBondContact O-N 2.82Å
673	M	83	Confident	79	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-71.9	-44.3	-179.1	-159.2	67.3	129.9	0	0	113	W96 T667 C669 E670 P671 E675 V676 I677 F687 F689 I758	W96-M673 HydrophobicContact CH2-CE 3.49Å; W96-M673 VanDerWaalsContact CH2-CE 3.49Å; W96-M673 HydrophobicContact CH2-CG 3.82Å; W96-M673 HydrophobicContact CH2-SD 3.19Å; W96-M673 WeakPolarHBondContact CH2-SD 3Å; W96-M673 HydrophobicContact CZ2-CE 3.47Å; W96-M673 VanDerWaalsContact CZ2-CE 3.47Å; W96-M673 HydrophobicContact CZ2-SD 3.84Å; W96-M673 HydrophobicContact CZ3-SD 3.98Å; T667-M673 HydrophobicContact CG2-CE 3.72Å; T667-M673 WeakPolarHBondContact O-CE 3.36Å; C669-M673 WeakPolarHBondContact O-CB 3.49Å; C669-M673 PolarHBondContact O-N 3.28Å; E670-M673 PolarHBondContact O-N 3.26Å; P671-M673 VanDerWaalsContact C-N 3.32Å; M673-E675 VanDerWaalsContact C-N 3.27Å; M673-E675 PolarHBondContact O-N 2.82Å; M673-V676 PolarHBondContact O-N 2.92Å; M673-V676 VanDerWaalsContact O-N 3.17Å; M673-I677 HydrophobicContact CG-CD1 3.98Å; M673-I677 VanDerWaalsContact O-CG1 3.27Å; M673-I677 WeakPolarHBondContact O-CG1 3.27Å; M673-I677 PolarHBondContact O-N 3Å; M673-F687 HydrophobicContact CE-CD1 3.73Å; M673-F687 HydrophobicContact CE-CE1 3.3Å; M673-F687 HydrophobicContact CE-CZ 3.8Å; M673-F687 HydrophobicContact CG-CE1 3.85Å; M673-F687 HydrophobicContact CG-CZ 3.59Å; M673-F687 HydrophobicContact SD-CE1 4.47Å; M673-F689 HydrophobicContact SD-CB 4.39Å; M673-F689 HydrophobicContact SD-CD2 4.13Å; M673-I758 HydrophobicContact CB-CG2 4.35Å
674	L	81.5	Confident	77.6	Confident	76 Å²	76	44.9 Å²	44.9	40%	0.398	26%	0.257	S	S	.	.	H	α-helix	trans	-59.9	-38.9	176.4	-72	175.5	0	0	0	111.6	E670 V676 I677 S678	E670-L674 HydrophobicContact CG-CD1 3.64Å; E670-L674 HydrophobicContact CG-CG 4.14Å; E670-L674 WeakPolarHBondContact O-CB 3.45Å; E670-L674 VanDerWaalsContact O-CG 3.3Å; E670-L674 WeakPolarHBondContact O-CG 3.42Å; E670-L674 PolarHBondContact O-N 2.85Å; L674-V676 VanDerWaalsContact C-N 3.35Å; L674-V676 PolarHBondContact O-N 3.44Å; L674-I677 PolarHBondContact O-N 3.24Å; L674-S678 VanDerWaalsContact O-CB 3.3Å; L674-S678 WeakPolarHBondContact O-CB 3.46Å; L674-S678 PolarHBondContact O-N 2.71Å; L674-S678 PolarHBondContact O-OG 3.42Å
675	E	85.1	Confident	76.4	Confident	32 Å²	32	48.1 Å²	48.1	15%	0.15	27%	0.272	C	S	.	.	H	α-helix	trans	-58.9	-45.2	174.9	-175.7	173.4	90.1	0	0	111.6	G639 P640 S641 V642 P671 M673 S678 T679	G639-E675 WeakPolarHBondContact CA-OE1 3.39Å; P640-E675 VanDerWaalsContact CD-OE2 3.24Å; P640-E675 WeakPolarHBondContact CD-OE2 3.17Å; P640-E675 WeakPolarHBondContact CG-OE2 3.34Å; S641-E675 VanDerWaalsContact CB-CD 3.48Å; S641-E675 WeakPolarHBondContact CB-OE2 3.37Å; S641-E675 PolarHBondContact N-OE1 3.25Å; S641-E675 PolarHBondContact N-OE2 2.93Å; S641-E675 PolarHBondContact OG-OE2 3.47Å; V642-E675 WeakPolarHBondContact CG2-OE1 3.4Å; V642-E675 PolarHBondContact N-OE1 2.81Å; P671-E675 WeakPolarHBondContact O-CB 3.35Å; P671-E675 PolarHBondContact O-N 2.96Å; M673-E675 VanDerWaalsContact C-N 3.27Å; M673-E675 PolarHBondContact O-N 2.82Å; E675-S678 PolarHBondContact O-OG 2.76Å; E675-T679 PolarHBondContact O-N 3.29Å; E675-T679 PolarHBondContact O-OG1 3.45Å
676	V	80.9	Confident	75	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-67.6	-45.5	177.7	179.4	0	0	0	0	111.8	W96 V642 G672 M673 L674 S678 T679 R680 F689 P690 V693	W96-V676 HydrophobicContact CE3-CG1 3.66Å; W96-V676 HydrophobicContact CZ3-CB 4Å; W96-V676 HydrophobicContact CZ3-CG1 3.48Å; W96-V676 VanDerWaalsContact CZ3-CG1 3.48Å; V642-V676 HydrophobicContact CG2-CG2 3.59Å; G672-V676 WeakPolarHBondContact O-CG2 3.07Å; G672-V676 PolarHBondContact O-N 2.82Å; M673-V676 PolarHBondContact O-N 2.92Å; M673-V676 VanDerWaalsContact O-N 3.17Å; L674-V676 VanDerWaalsContact C-N 3.35Å; L674-V676 PolarHBondContact O-N 3.44Å; V676-S678 VanDerWaalsContact C-N 3.35Å; V676-S678 PolarHBondContact O-N 3.45Å; V676-T679 PolarHBondContact O-N 2.82Å; V676-R680 PolarHBondContact O-N 3.04Å; V676-F689 HydrophobicContact CG2-CD2 4.46Å; V676-F689 HydrophobicContact CG2-CE2 3.72Å; V676-F689 HydrophobicContact CG2-CZ 4.3Å; V676-P690 HydrophobicContact CG1-CG 3.59Å; V676-V693 HydrophobicContact CG1-CG2 4.32Å; V676-V693 HydrophobicContact CG2-CG2 4.48Å
677	I	77.6	Confident	74.2	Confident	21 Å²	21	48.9 Å²	48.9	11%	0.108	28%	0.276	C	S	.	.	H	α-helix	trans	-59.9	-47	179.9	-67.2	164.8	0	0	0	110.4	W96 M673 L674 T679 R680 G681 F687 V759	W96-I677 HydrophobicContact CH2-CD1 4.26Å; W96-I677 HydrophobicContact CH2-CG1 3.77Å; W96-I677 HydrophobicContact CZ3-CG1 3.77Å; M673-I677 HydrophobicContact CG-CD1 3.98Å; M673-I677 VanDerWaalsContact O-CG1 3.27Å; M673-I677 WeakPolarHBondContact O-CG1 3.27Å; M673-I677 PolarHBondContact O-N 3Å; L674-I677 PolarHBondContact O-N 3.24Å; I677-T679 PolarHBondContact O-N 3.25Å; I677-T679 VanDerWaalsContact O-N 3.17Å; I677-R680 PolarHBondContact O-N 3.36Å; I677-G681 PolarHBondContact O-N 3.13Å; I677-G681 VanDerWaalsContact O-N 3.13Å; I677-F687 HydrophobicContact CD1-CE2 3.65Å; I677-F687 HydrophobicContact CD1-CZ 3.7Å; I677-F687 HydrophobicContact CG1-CE2 4.49Å; I677-V759 HydrophobicContact CD1-CG2 4.09Å
678	S	75.7	Confident	73.8	Confident	98 Å²	98	48.9 Å²	48.9	69%	0.685	28%	0.275	S	S	*	.	H	α-helix	trans	-59.8	-29.2	-179.5	71.5	0	0	0	0	113.2	L674 E675 V676	L674-S678 VanDerWaalsContact O-CB 3.3Å; L674-S678 WeakPolarHBondContact O-CB 3.46Å; L674-S678 PolarHBondContact O-N 2.71Å; L674-S678 PolarHBondContact O-OG 3.42Å; E675-S678 PolarHBondContact O-OG 2.76Å; V676-S678 VanDerWaalsContact C-N 3.35Å; V676-S678 PolarHBondContact O-N 3.45Å
679	T	69.5	Low	73.9	Confident	104 Å²	104	47.5 Å²	47.5	64%	0.638	27%	0.269	S	S	*	.	H	α-helix	trans	-86.2	-27.6	-177.6	-54.1	0	0	0	0	112.7	E675 V676 I677	E675-T679 PolarHBondContact O-N 3.29Å; E675-T679 PolarHBondContact O-OG1 3.45Å; V676-T679 PolarHBondContact O-N 2.82Å; I677-T679 PolarHBondContact O-N 3.25Å; I677-T679 VanDerWaalsContact O-N 3.17Å
680	R	65.5	Low	73.8	Confident	73 Å²	73	46.9 Å²	46.9	28%	0.275	27%	0.265	S	S	.	.	H	α-helix	trans	-125.9	0.1	-162.8	-56.4	-163.3	-177.4	-163.3	8.4	116.2	Y97 I101 V676 I677 S692	Y97-R680 HydrophobicContact CE1-CB 4.46Å; Y97-R680 HydrophobicContact CE1-CG 4.48Å; Y97-R680 PolarHBondContact OH-NH1 3.44Å; I101-R680 VanDerWaalsContact CD1-NH1 3.32Å; V676-R680 PolarHBondContact O-N 3.04Å; I677-R680 PolarHBondContact O-N 3.36Å; R680-S692 PolarHBondContact NH1-OG 3.07Å
681	G	59.9	Low	74	Confident	40 Å²	40	42 Å²	42	41%	0.412	24%	0.242	S	C	.	.			trans	90.1	170.5	169.5	0	0	0	0	0	115.5	I677	I677-G681 PolarHBondContact O-N 3.13Å; I677-G681 VanDerWaalsContact O-N 3.13Å
682	N	56.2	Low	74	Confident	104 Å²	104	39 Å²	39	56%	0.556	22%	0.223	S	C	*	.	S	Bend	trans	-103.2	5.3	-158.7	-70.5	-10	0	0	0	116.4	Q684 L763	N682-Q684 PolarHBondContact O-N 3.44Å; N682-L763 HydrophobicContact CB-CD2 4.36Å
683	V	55.7	Low	74.3	Confident	124 Å²	124	39 Å²	39	75%	0.752	22%	0.223	S	C	*	.			trans	-88.1	95.5	-174.6	-172.9	0	0	0	0	109.9
684	Q	60.9	Low	74.7	Confident	38 Å²	38	39.1 Å²	39.1	18%	0.178	22%	0.223	C	C	.	.			trans	-134.6	137.6	-173.8	-57.5	-177.8	2.8	0	0	112.4	N682 A766	N682-Q684 PolarHBondContact O-N 3.44Å; Q684-A766 HydrophobicContact CB-CB 4.28Å; Q684-A766 WeakPolarHBondContact O-CB 3.43Å
685	E	62.6	Low	75.2	Confident	74 Å²	74	35.7 Å²	35.7	35%	0.346	21%	0.206	S	C	.	.	S	Bend	trans	-103.1	-31	173.2	-67.7	171.8	-172.8	0	0	111.9	S63 A766 K767	S63-E685 WeakPolarHBondContact CB-OE1 3.3Å; S63-E685 WeakPolarHBondContact CB-OE2 3.49Å; E685-A766 CarbonylContact O-C 3.59Å; E685-A766 VanDerWaalsContact O-CA 3.3Å; E685-A766 WeakPolarHBondContact O-CA 3.49Å; E685-K767 PolarHBondContact O-N 3.15Å
686	I	61.7	Low	75.4	Confident	15 Å²	15	35 Å²	35	8%	0.077	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	129.2	-178.8	-59	161.6	0	0	0	109.6	R66 Y70 W96 K767 R769	R66-I686 HydrophobicContact CG-CD1 4.36Å; Y70-I686 VanDerWaalsContact CB-CD1 3.49Å; Y70-I686 HydrophobicContact CD2-CD1 3.21Å; Y70-I686 HydrophobicContact CE2-CD1 4.04Å; Y70-I686 HydrophobicContact CG-CD1 3.53Å; W96-I686 PolarHBondContact NE1-O 3.25Å; I686-K767 CarbonylContact C-O 3.55Å; I686-K767 WeakPolarHBondContact CA-O 3.5Å; I686-R769 HydrophobicContact CG2-CB 3.89Å
687	F	73.4	Confident	76	Confident	6 Å²	6	34.7 Å²	34.7	3%	0.026	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.8	-175.2	-162.4	-94.3	0	0	0	111.4	W96 T667 M673 I677 I758 V759 K767 L768 R769	W96-F687 HydrophobicContact CH2-CE2 4.18Å; W96-F687 HydrophobicContact CH2-CZ 4.35Å; W96-F687 HydrophobicContact CZ2-CD2 4Å; W96-F687 HydrophobicContact CZ2-CE2 4.03Å; W96-F687 HydrophobicContact CZ2-CG 4.29Å; W96-F687 HydrophobicContact CZ2-CZ 4.37Å; T667-F687 HydrophobicContact CG2-CD1 4.43Å; M673-F687 HydrophobicContact CE-CD1 3.73Å; M673-F687 HydrophobicContact CE-CE1 3.3Å; M673-F687 HydrophobicContact CE-CZ 3.8Å; M673-F687 HydrophobicContact CG-CE1 3.85Å; M673-F687 HydrophobicContact CG-CZ 3.59Å; M673-F687 HydrophobicContact SD-CE1 4.47Å; I677-F687 HydrophobicContact CD1-CE2 3.65Å; I677-F687 HydrophobicContact CD1-CZ 3.7Å; I677-F687 HydrophobicContact CG1-CE2 4.49Å; F687-I758 HydrophobicContact CZ-CG2 4.42Å; F687-V759 HydrophobicContact CE2-CG2 3.82Å; F687-V759 HydrophobicContact CZ-CG2 3.75Å; F687-K767 PolarHBondContact N-O 2.68Å; F687-L768 HydrophobicContact CB-CD2 4.04Å; F687-L768 HydrophobicContact CD1-CD2 3.67Å; F687-L768 HydrophobicContact CG-CD2 4.28Å; F687-R769 PolarHBondContact O-N 3.37Å
688	Q	78.7	Confident	76.9	Confident	5 Å²	5	35.8 Å²	35.8	2%	0.023	20%	0.204	C	C	.	.	S	Bend	trans	-168.6	148.5	177.9	-169.1	-172.1	5.7	0	0	110.9	E95 W96 T667 R769	E95-Q688 PolarHBondContact OE1-OE1 3.5Å; W96-Q688 WeakPolarHBondContact CZ2-O 3.45Å; W96-Q688 PolarHBondContact NE1-O 2.98Å; T667-Q688 HydrophobicContact CG2-CG 4.44Å; T667-Q688 VanDerWaalsContact OG1-CG 3.25Å; T667-Q688 WeakPolarHBondContact OG1-CG 3.19Å; Q688-R769 HydrophobicContact CB-CB 4.34Å; Q688-R769 VanDerWaalsContact CD-NH1 3.29Å
689	F	85.3	Confident	77.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.			trans	-57.1	127.3	177.3	-171.7	-90.4	0	0	0	111.4	V642 L663 L666 T667 M673 V676 L691 V693 W694	V642-F689 HydrophobicContact CG1-CE2 4.1Å; V642-F689 HydrophobicContact CG1-CZ 3.58Å; V642-F689 HydrophobicContact CG2-CE2 3.93Å; V642-F689 HydrophobicContact CG2-CZ 4.15Å; L663-F689 HydrophobicContact CD2-CD1 3.83Å; L666-F689 HydrophobicContact CB-CB 3.79Å; L666-F689 HydrophobicContact CB-CD1 4.05Å; L666-F689 HydrophobicContact CB-CD2 3.6Å; L666-F689 HydrophobicContact CB-CE2 4.18Å; L666-F689 HydrophobicContact CB-CG 3.51Å; L666-F689 HydrophobicContact CD1-CD1 3.83Å; L666-F689 HydrophobicContact CD1-CD2 4.41Å; L666-F689 HydrophobicContact CD1-CE1 3.76Å; L666-F689 HydrophobicContact CD1-CE2 4.33Å; L666-F689 HydrophobicContact CD1-CG 4.16Å; L666-F689 HydrophobicContact CD1-CZ 4.02Å; L666-F689 HydrophobicContact CG-CG 4.47Å; T667-F689 PolarHBondContact OG1-N 3.28Å; M673-F689 HydrophobicContact SD-CB 4.39Å; M673-F689 HydrophobicContact SD-CD2 4.13Å; V676-F689 HydrophobicContact CG2-CD2 4.46Å; V676-F689 HydrophobicContact CG2-CE2 3.72Å; V676-F689 HydrophobicContact CG2-CZ 4.3Å; F689-L691 PolarHBondContact O-N 2.87Å; F689-V693 HydrophobicContact CE1-CB 3.98Å; F689-V693 HydrophobicContact CE1-CG1 4.25Å; F689-V693 HydrophobicContact CZ-CB 3.87Å; F689-V693 HydrophobicContact CZ-CG1 3.71Å; F689-W694 HydrophobicContact CE1-CB 4.19Å
690	P	84.9	Confident	78.7	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.154	C	C	.	.			trans	-78.8	126.3	-169	29.9	-35.4	0	0	0	112.6	E95 W96 Y97 V676 S692 V693	E95-P690 HydrophobicContact CB-CB 4.47Å; E95-P690 WeakPolarHBondContact O-CB 3.34Å; W96-P690 HydrophobicContact CB-CB 4.07Å; W96-P690 HydrophobicContact CD2-CB 4.09Å; W96-P690 HydrophobicContact CD2-CG 4.03Å; W96-P690 HydrophobicContact CE3-CB 4.2Å; W96-P690 HydrophobicContact CE3-CG 3.64Å; W96-P690 HydrophobicContact CG-CB 4Å; W96-P690 HydrophobicContact CG-CG 4.43Å; W96-P690 HydrophobicContact CZ3-CG 4.29Å; Y97-P690 HydrophobicContact CE2-CB 3.73Å; Y97-P690 WeakPolarHBondContact OH-CB 3.43Å; Y97-P690 WeakPolarHBondContact OH-CG 3.43Å; V676-P690 HydrophobicContact CG1-CG 3.59Å; P690-S692 PolarHBondContact O-N 3.06Å; P690-V693 HydrophobicContact CG-CB 4.43Å; P690-V693 HydrophobicContact CG-CG2 3.83Å; P690-V693 PolarHBondContact O-N 3Å
691	L	87.4	Confident	80.1	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-49.8	-37.9	-179.4	-179.3	66	0	0	0	113.8	V91 E95 L659 L663 F689 V693 W694 L695	V91-L691 HydrophobicContact CB-CD2 4.41Å; V91-L691 HydrophobicContact CG1-CD2 3.38Å; E95-L691 WeakPolarHBondContact OE2-CB 3.22Å; E95-L691 PolarHBondContact OE2-N 3.37Å; E95-L691 VanDerWaalsContact OE2-N 3.13Å; L659-L691 HydrophobicContact CD1-CD1 4.1Å; L659-L691 HydrophobicContact CD2-CD1 4.28Å; L663-L691 HydrophobicContact CD1-CD1 4.39Å; F689-L691 PolarHBondContact O-N 2.87Å; L691-V693 VanDerWaalsContact C-N 3.26Å; L691-V693 PolarHBondContact O-N 3.41Å; L691-W694 CarbonylContact O-C 3.52Å; L691-W694 WeakPolarHBondContact O-CB 3.37Å; L691-W694 PolarHBondContact O-N 3.31Å; L691-W694 VanDerWaalsContact O-N 3.08Å; L691-L695 HydrophobicContact CD1-CD1 4.47Å; L691-L695 HydrophobicContact CD1-CD2 4.23Å; L691-L695 HydrophobicContact CD1-CG 4.07Å; L691-L695 HydrophobicContact CD2-CD1 4.18Å; L691-L695 HydrophobicContact CG-CD1 3.92Å; L691-L695 HydrophobicContact CG-CG 3.95Å; L691-L695 WeakPolarHBondContact O-CG 3.47Å; L691-L695 PolarHBondContact O-N 3.4Å
692	S	86.1	Confident	81.7	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.007	13%	0.129	C	C	.	.	H	α-helix	trans	-61.9	-31.2	-177.3	82.2	0	0	0	0	113.9	Y97 M107 R680 P690 K696	Y97-S692 WeakPolarHBondContact CE2-OG 3.32Å; Y97-S692 PolarHBondContact OH-OG 3.45Å; M107-S692 VanDerWaalsContact CE-CB 3.43Å; R680-S692 PolarHBondContact NH1-OG 3.07Å; P690-S692 PolarHBondContact O-N 3.06Å; S692-K696 WeakPolarHBondContact O-CG 3.49Å; S692-K696 PolarHBondContact O-N 2.99Å; S692-K696 VanDerWaalsContact O-N 3.1Å
693	V	88.3	Confident	83.4	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-71.3	-42.7	176.3	179.9	0	0	0	0	109.3	Y97 C638 V642 V676 F689 P690 L691 K696 L697	Y97-V693 WeakPolarHBondContact OH-CG2 3.48Å; C638-V693 HydrophobicContact CB-CG1 4.26Å; V642-V693 HydrophobicContact CG1-CG1 3.82Å; V642-V693 HydrophobicContact CG2-CG1 4.49Å; V676-V693 HydrophobicContact CG1-CG2 4.32Å; V676-V693 HydrophobicContact CG2-CG2 4.48Å; F689-V693 HydrophobicContact CE1-CB 3.98Å; F689-V693 HydrophobicContact CE1-CG1 4.25Å; F689-V693 HydrophobicContact CZ-CB 3.87Å; F689-V693 HydrophobicContact CZ-CG1 3.71Å; P690-V693 HydrophobicContact CG-CB 4.43Å; P690-V693 HydrophobicContact CG-CG2 3.83Å; P690-V693 PolarHBondContact O-N 3Å; L691-V693 VanDerWaalsContact C-N 3.26Å; L691-V693 PolarHBondContact O-N 3.41Å; V693-K696 PolarHBondContact O-N 3.38Å; V693-L697 PolarHBondContact O-N 2.87Å
694	W	92.1	Very high	85.3	Confident	1 Å²	1	14.4 Å²	14.4	0%	0.004	7%	0.073	C	C	.	.	H	α-helix	trans	-60.7	-45.6	174	170.4	-115.7	0	0	0	111.8	A646 I650 L659 L662 L663 F689 L691 K696 L697 K698 L705 Y716	A646-W694 HydrophobicContact CB-CZ3 4.37Å; I650-W694 HydrophobicContact CD1-CH2 3.69Å; I650-W694 HydrophobicContact CD1-CZ3 4.14Å; L659-W694 VanDerWaalsContact CD1-CD1 3.46Å; L659-W694 HydrophobicContact CD1-CG 4.45Å; L662-W694 HydrophobicContact CD2-CD2 3.77Å; L662-W694 HydrophobicContact CD2-CE3 3.66Å; L662-W694 HydrophobicContact CD2-CH2 3.37Å; L662-W694 HydrophobicContact CD2-CZ2 3.45Å; L662-W694 VanDerWaalsContact CD2-CZ2 3.45Å; L662-W694 HydrophobicContact CD2-CZ3 3.48Å; L662-W694 VanDerWaalsContact CD2-CZ3 3.48Å; L663-W694 HydrophobicContact CD2-CB 4.26Å; F689-W694 HydrophobicContact CE1-CB 4.19Å; L691-W694 CarbonylContact O-C 3.52Å; L691-W694 WeakPolarHBondContact O-CB 3.37Å; L691-W694 PolarHBondContact O-N 3.31Å; L691-W694 VanDerWaalsContact O-N 3.08Å; W694-K696 VanDerWaalsContact C-N 3.32Å; W694-K696 PolarHBondContact O-N 3.2Å; W694-L697 HydrophobicContact CE3-CB 4.32Å; W694-L697 HydrophobicContact CE3-CD2 4.06Å; W694-L697 HydrophobicContact CE3-CG 4.37Å; W694-L697 HydrophobicContact CZ3-CD2 3.95Å; W694-L697 HydrophobicContact CZ3-CG 4.21Å; W694-L697 CarbonylContact O-C 3.6Å; W694-L697 WeakPolarHBondContact O-CA 3.37Å; W694-L697 WeakPolarHBondContact O-CB 3.49Å; W694-L697 PolarHBondContact O-N 3.32Å; W694-K698 HydrophobicContact CZ2-CB 4.36Å; W694-K698 WeakPolarHBondContact O-CB 3.49Å; W694-K698 PolarHBondContact O-N 3.02Å; W694-L705 HydrophobicContact CH2-CD2 3.85Å; W694-L705 HydrophobicContact CZ2-CD2 4Å; W694-Y716 HydrophobicContact CZ2-CD1 4.16Å; W694-Y716 AromaticContact CZ2-CD2 3.75Å; W694-Y716 HydrophobicContact CZ2-CD2 3.75Å; W694-Y716 HydrophobicContact CZ2-CE1 4.2Å; W694-Y716 AromaticContact CZ2-CE2 3.76Å; W694-Y716 HydrophobicContact CZ2-CE2 3.76Å; W694-Y716 AromaticContact CZ2-CG 3.97Å; W694-Y716 HydrophobicContact CZ2-CG 3.97Å; W694-Y716 AromaticContact NE1-CE2 3.83Å; W694-Y716 AromaticContact NE1-CZ 3.96Å
695	L	91.7	Very high	87	Confident	5 Å²	5	13.4 Å²	13.4	3%	0.026	7%	0.069	C	C	.	.	H	α-helix	trans	-62.9	-37.8	179.1	-66.1	-179.9	0	0	0	112.3	L110 F111 E114 L691 L697 K698 Q699	L110-L695 HydrophobicContact CB-CB 4.41Å; L110-L695 HydrophobicContact CB-CD1 4.39Å; L110-L695 HydrophobicContact CD1-CB 4.31Å; F111-L695 HydrophobicContact CD1-CD1 3.7Å; F111-L695 HydrophobicContact CE1-CD1 3.84Å; E114-L695 HydrophobicContact CB-CD1 4.36Å; E114-L695 HydrophobicContact CG-CD2 4.32Å; L691-L695 HydrophobicContact CD1-CD1 4.47Å; L691-L695 HydrophobicContact CD1-CD2 4.23Å; L691-L695 HydrophobicContact CD1-CG 4.07Å; L691-L695 HydrophobicContact CD2-CD1 4.18Å; L691-L695 HydrophobicContact CG-CD1 3.92Å; L691-L695 HydrophobicContact CG-CG 3.95Å; L691-L695 WeakPolarHBondContact O-CG 3.47Å; L691-L695 PolarHBondContact O-N 3.4Å; L695-L697 VanDerWaalsContact C-N 3.34Å; L695-K698 HydrophobicContact CD2-CD 4.44Å; L695-K698 PolarHBondContact O-N 3.1Å; L695-Q699 WeakPolarHBondContact O-CB 3.46Å; L695-Q699 PolarHBondContact O-N 3.13Å
696	K	89.8	Confident	88.4	Confident	17 Å²	17	10.6 Å²	10.6	7%	0.074	6%	0.056	C	C	.	.	H	α-helix	trans	-62.2	-42	171.7	-73.5	-179.2	-174.5	-163.8	0	111.4	M107 S692 V693 W694 Q699 C700	M107-K696 HydrophobicContact SD-CD 4.12Å; M107-K696 WeakPolarHBondContact SD-CE 3.5Å; M107-K696 HydrophobicContact SD-CG 3.79Å; S692-K696 WeakPolarHBondContact O-CG 3.49Å; S692-K696 PolarHBondContact O-N 2.99Å; S692-K696 VanDerWaalsContact O-N 3.1Å; V693-K696 PolarHBondContact O-N 3.38Å; W694-K696 VanDerWaalsContact C-N 3.32Å; W694-K696 PolarHBondContact O-N 3.2Å; K696-Q699 PolarHBondContact O-N 3.32Å; K696-C700 PolarHBondContact O-N 3.32Å; K696-C700 PolarHBondContact O-SG 3.39Å
697	L	94.1	Very high	89.8	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-66.2	-47.3	176.5	-179.9	55.6	0	0	0	111.4	A634 C638 A646 V693 W694 L695 Q699 C700 L701	A634-L697 HydrophobicContact CB-CD1 3.86Å; C638-L697 HydrophobicContact CB-CB 4.46Å; C638-L697 PolarHBondContact SG-N 3.4Å; A646-L697 HydrophobicContact CB-CD2 3.69Å; V693-L697 PolarHBondContact O-N 2.87Å; W694-L697 HydrophobicContact CE3-CB 4.32Å; W694-L697 HydrophobicContact CE3-CD2 4.06Å; W694-L697 HydrophobicContact CE3-CG 4.37Å; W694-L697 HydrophobicContact CZ3-CD2 3.95Å; W694-L697 HydrophobicContact CZ3-CG 4.21Å; W694-L697 CarbonylContact O-C 3.6Å; W694-L697 WeakPolarHBondContact O-CA 3.37Å; W694-L697 WeakPolarHBondContact O-CB 3.49Å; W694-L697 PolarHBondContact O-N 3.32Å; L695-L697 VanDerWaalsContact C-N 3.34Å; L697-Q699 VanDerWaalsContact C-N 3.29Å; L697-Q699 PolarHBondContact O-N 3.16Å; L697-C700 CarbonylContact O-C 3.55Å; L697-C700 WeakPolarHBondContact O-CA 2.8Å; L697-C700 WeakPolarHBondContact O-CB 3.15Å; L697-C700 PolarHBondContact O-N 3.36Å; L697-L701 HydrophobicContact CD1-CD1 4.37Å; L697-L701 HydrophobicContact CD1-CG 4.22Å; L697-L701 HydrophobicContact CG-CD1 4.18Å; L697-L701 HydrophobicContact CG-CG 4.49Å; L697-L701 WeakPolarHBondContact O-CG 3.3Å; L697-L701 PolarHBondContact O-N 3.12Å
698	K	95	Very high	90.6	Very high	43 Å²	43	12.9 Å²	12.9	19%	0.187	7%	0.067	C	C	.	.	H	α-helix	trans	-53	-46.5	174.2	-177.6	177.5	179.6	175.3	0	110.8	E114 W694 L695 C700 L701 G702 L705 E707 Y716	E114-K698 IonicContact OE2-NZ 3.58Å; W694-K698 HydrophobicContact CZ2-CB 4.36Å; W694-K698 WeakPolarHBondContact O-CB 3.49Å; W694-K698 PolarHBondContact O-N 3.02Å; L695-K698 HydrophobicContact CD2-CD 4.44Å; L695-K698 PolarHBondContact O-N 3.1Å; K698-C700 PolarHBondContact O-N 3.28Å; K698-L701 PolarHBondContact O-N 3.24Å; K698-G702 PolarHBondContact O-N 3.39Å; K698-L705 HydrophobicContact CG-CD2 4.25Å; K698-E707 WeakPolarHBondContact CE-OE2 3.38Å; K698-E707 IonicContact NZ-OE1 3.21Å; K698-E707 IonicContact NZ-OE2 2.83Å; K698-E707 PolarHBondContact NZ-OE2 3.29Å; K698-Y716 HydrophobicContact CD-CE1 4.28Å; K698-Y716 PolarHBondContact NZ-OH 2.59Å; K698-Y716 VanDerWaalsContact NZ-OH 3.16Å
699	Q	91.4	Very high	91	Very high	59 Å²	59	13.4 Å²	13.4	28%	0.276	7%	0.07	S	C	.	.	H	α-helix	trans	-61.6	-43.1	174.3	-173.7	-175.8	50	0	0	112.2	L110 M602 L695 K696 L697 L701 G702	L110-Q699 HydrophobicContact CD2-CB 4.08Å; L110-Q699 HydrophobicContact CD2-CG 4.29Å; M602-Q699 HydrophobicContact CE-CG 3.72Å; M602-Q699 WeakPolarHBondContact CE-O 3.37Å; L695-Q699 WeakPolarHBondContact O-CB 3.46Å; L695-Q699 PolarHBondContact O-N 3.13Å; K696-Q699 PolarHBondContact O-N 3.32Å; L697-Q699 VanDerWaalsContact C-N 3.29Å; L697-Q699 PolarHBondContact O-N 3.16Å; Q699-L701 VanDerWaalsContact C-N 3.3Å; Q699-L701 PolarHBondContact O-N 3.02Å; Q699-G702 PolarHBondContact O-N 3.04Å
700	C	92.7	Very high	90.8	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-65	-33.4	177.9	-65.7	0	0	0	0	112.6	R630 M633 A634 K696 L697 K698	R630-C700 WeakPolarHBondContact CD-O 3.37Å; R630-C700 WeakPolarHBondContact CG-O 3.45Å; R630-C700 PolarHBondContact NH1-O 3.39Å; M633-C700 HydrophobicContact CE-CB 4.39Å; A634-C700 HydrophobicContact CB-CB 3.73Å; K696-C700 PolarHBondContact O-N 3.32Å; K696-C700 PolarHBondContact O-SG 3.39Å; L697-C700 CarbonylContact O-C 3.55Å; L697-C700 WeakPolarHBondContact O-CA 2.8Å; L697-C700 WeakPolarHBondContact O-CB 3.15Å; L697-C700 PolarHBondContact O-N 3.36Å; K698-C700 PolarHBondContact O-N 3.28Å
701	L	95.4	Very high	90.5	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-74.2	-42.5	178.1	-64.3	169.9	0	0	0	111.3	R630 L631 L647 L697 K698 Q699 C703 L704 L705 W718	R630-L701 PolarHBondContact NH1-O 2.94Å; L631-L701 HydrophobicContact CD2-CD2 4.06Å; L647-L701 HydrophobicContact CD2-CD1 3.61Å; L647-L701 HydrophobicContact CD2-CD2 3.7Å; L647-L701 HydrophobicContact CD2-CG 4.23Å; L697-L701 HydrophobicContact CD1-CD1 4.37Å; L697-L701 HydrophobicContact CD1-CG 4.22Å; L697-L701 HydrophobicContact CG-CD1 4.18Å; L697-L701 HydrophobicContact CG-CG 4.49Å; L697-L701 WeakPolarHBondContact O-CG 3.3Å; L697-L701 PolarHBondContact O-N 3.12Å; K698-L701 PolarHBondContact O-N 3.24Å; Q699-L701 VanDerWaalsContact C-N 3.3Å; Q699-L701 PolarHBondContact O-N 3.02Å; L701-C703 PolarHBondContact O-N 3.16Å; L701-L704 VanDerWaalsContact O-CB 3.29Å; L701-L704 WeakPolarHBondContact O-CB 3.35Å; L701-L704 WeakPolarHBondContact O-CG 3.22Å; L701-L704 PolarHBondContact O-N 2.72Å; L701-L704 VanDerWaalsContact O-N 3.14Å; L701-L705 HydrophobicContact CB-CB 3.89Å; L701-L705 HydrophobicContact CD1-CB 4.19Å; L701-L705 HydrophobicContact CD1-CD1 4.37Å; L701-L705 HydrophobicContact CD1-CD2 4.07Å; L701-L705 HydrophobicContact CD1-CG 4.46Å; L701-W718 HydrophobicContact CD1-CH2 4.36Å; L701-W718 HydrophobicContact CD1-CZ3 4.45Å; L701-W718 HydrophobicContact CD2-CZ3 4.39Å
702	G	92.4	Very high	90.2	Very high	16 Å²	16	18.9 Å²	18.9	17%	0.165	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	56.5	-129.1	175.6	0	0	0	0	0	112.3	E601 K698 Q699 L704 L705	E601-G702 VanDerWaalsContact CD-CA 3.43Å; E601-G702 VanDerWaalsContact OE1-C 3.28Å; E601-G702 WeakPolarHBondContact OE1-CA 3.28Å; E601-G702 WeakPolarHBondContact OE2-CA 3Å; K698-G702 PolarHBondContact O-N 3.39Å; Q699-G702 PolarHBondContact O-N 3.04Å; G702-L704 PolarHBondContact O-N 2.68Å; G702-L705 PolarHBondContact O-N 3.28Å
703	C	92.7	Very high	90.3	Very high	17 Å²	17	23 Å²	23	12%	0.115	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-63	-13.5	-178.9	70.4	0	0	0	0	115.1	Q597 E601 L701 L705 S719	Q597-C703 HydrophobicContact CG-CB 4.36Å; E601-C703 PolarHBondContact OE1-N 2.97Å; E601-C703 PolarHBondContact OE2-N 3.42Å; L701-C703 PolarHBondContact O-N 3.16Å; C703-L705 VanDerWaalsContact C-N 3.29Å; C703-S719 WeakPolarHBondContact O-CB 3.37Å; C703-S719 PolarHBondContact O-OG 3.42Å
704	L	95.1	Very high	90.4	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-70.2	-28.2	174.8	-60.1	175.8	0	0	0	112.6	M598 T627 R630 L701 G702 S719 V723	M598-L704 HydrophobicContact CE-CD1 4.39Å; M598-L704 HydrophobicContact CE-CD2 3.81Å; M598-L704 HydrophobicContact CE-CG 4.48Å; M598-L704 HydrophobicContact CG-CD2 4.37Å; M598-L704 HydrophobicContact SD-CD2 3.94Å; T627-L704 HydrophobicContact CG2-CD1 4.14Å; R630-L704 HydrophobicContact CB-CD1 4.28Å; R630-L704 HydrophobicContact CG-CD1 4.03Å; L701-L704 VanDerWaalsContact O-CB 3.29Å; L701-L704 WeakPolarHBondContact O-CB 3.35Å; L701-L704 WeakPolarHBondContact O-CG 3.22Å; L701-L704 PolarHBondContact O-N 2.72Å; L701-L704 VanDerWaalsContact O-N 3.14Å; G702-L704 PolarHBondContact O-N 2.68Å; L704-S719 PolarHBondContact O-N 3.47Å; L704-S719 PolarHBondContact O-OG 2.97Å; L704-V723 HydrophobicContact CD2-CG2 3.75Å
705	L	96.3	Very high	90.5	Very high	18 Å²	18	23.7 Å²	23.7	9%	0.094	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	136.8	176.9	-170.7	72.9	0	0	0	109.6	I650 W694 K698 L701 G702 C703 Y716 K717 W718 S719	I650-L705 HydrophobicContact CD1-CD1 4.09Å; I650-L705 HydrophobicContact CG2-CD1 4.35Å; W694-L705 HydrophobicContact CH2-CD2 3.85Å; W694-L705 HydrophobicContact CZ2-CD2 4Å; K698-L705 HydrophobicContact CG-CD2 4.25Å; L701-L705 HydrophobicContact CB-CB 3.89Å; L701-L705 HydrophobicContact CD1-CB 4.19Å; L701-L705 HydrophobicContact CD1-CD1 4.37Å; L701-L705 HydrophobicContact CD1-CD2 4.07Å; L701-L705 HydrophobicContact CD1-CG 4.46Å; G702-L705 PolarHBondContact O-N 3.28Å; C703-L705 VanDerWaalsContact C-N 3.29Å; L705-Y716 HydrophobicContact CD2-CD1 3.75Å; L705-Y716 HydrophobicContact CD2-CE1 4.35Å; L705-Y716 HydrophobicContact CD2-CG 4.36Å; L705-Y716 HydrophobicContact CG-CD1 4.27Å; L705-K717 WeakPolarHBondContact CD1-O 3.31Å; L705-W718 HydrophobicContact CD1-CE3 4.37Å; L705-W718 HydrophobicContact CD1-CH2 4.17Å; L705-W718 HydrophobicContact CD1-CZ3 3.95Å; L705-S719 VanDerWaalsContact C-OG 3.29Å; L705-S719 PolarHBondContact O-OG 3.05Å
706	E	92	Very high	90.7	Very high	15 Å²	15	23.5 Å²	23.5	7%	0.07	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.8	177.5	-157.1	177	-145.2	0	0	110.3	Y361 R365 V708 Y716 K717 S719	Y361-E706 WeakPolarHBondContact CE2-OE1 3.4Å; Y361-E706 VanDerWaalsContact CZ-OE1 3.23Å; Y361-E706 PolarHBondContact OH-OE1 3.11Å; R365-E706 IonicContact CZ-OE1 2.67Å; R365-E706 IonicContact NH2-OE1 3.99Å; R365-E706 PolarHBondContact NH2-OE1 2.74Å; E706-V708 HydrophobicContact CG-CG2 3.79Å; E706-Y716 WeakPolarHBondContact O-CA 3.23Å; E706-K717 HydrophobicContact CB-CG 4.01Å; E706-K717 PolarHBondContact N-O 2.8Å; E706-K717 PolarHBondContact O-N 3.47Å; E706-K717 WeakPolarHBondContact OE2-CE 3.33Å; E706-K717 IonicContact OE2-NZ 3.31Å; E706-S719 WeakPolarHBondContact CB-OG 3.37Å; E706-S719 PolarHBondContact N-OG 3.28Å
707	E	91.8	Very high	90.8	Very high	59 Å²	59	23.9 Å²	23.9	28%	0.276	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	114.7	175.1	-173.3	162.7	-147.6	0	0	108.3	Y117 K698 V715 Y716	Y117-E707 VanDerWaalsContact CE2-CD 3.47Å; Y117-E707 HydrophobicContact CE2-CG 4.26Å; Y117-E707 WeakPolarHBondContact CE2-OE1 3.14Å; Y117-E707 PolarHBondContact OH-OE1 2.76Å; K698-E707 WeakPolarHBondContact CE-OE2 3.38Å; K698-E707 IonicContact NZ-OE1 3.21Å; K698-E707 IonicContact NZ-OE2 2.83Å; K698-E707 PolarHBondContact NZ-OE2 3.29Å; E707-V715 WeakPolarHBondContact CA-O 3.35Å; E707-Y716 HydrophobicContact CB-CD1 4.18Å; E707-Y716 HydrophobicContact CB-CE1 4.08Å; E707-Y716 HydrophobicContact CG-CD1 4.22Å; E707-Y716 HydrophobicContact CG-CE1 3.82Å; E707-Y716 WeakPolarHBondContact OE1-CE1 3.44Å; E707-Y716 PolarHBondContact OE1-OH 3Å
708	V	89	Confident	90.8	Very high	10 Å²	10	25 Å²	25	6%	0.061	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	146.2	-175.2	179.2	0	0	0	0	109.8	V357 Y361 L432 E706 S714 V715 K717	V357-V708 HydrophobicContact CG1-CG1 4.13Å; Y361-V708 HydrophobicContact CD2-CG2 4.44Å; Y361-V708 HydrophobicContact CE2-CG2 4.42Å; L432-V708 HydrophobicContact CD1-CG1 3.97Å; L432-V708 HydrophobicContact CD1-CG2 4.02Å; L432-V708 HydrophobicContact CG-CG1 4.13Å; E706-V708 HydrophobicContact CG-CG2 3.79Å; V708-S714 WeakPolarHBondContact O-CA 3.38Å; V708-V715 PolarHBondContact N-O 3.39Å; V708-V715 VanDerWaalsContact O-CG2 3.26Å; V708-V715 WeakPolarHBondContact O-CG2 3.34Å; V708-V715 PolarHBondContact O-N 3.35Å; V708-K717 VanDerWaalsContact CG2-CE 3.41Å
709	V	87	Confident	90.7	Very high	15 Å²	15	24.1 Å²	24.1	9%	0.091	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.2	173.1	-176.2	0	0	0	0	109.6	P47 L49 F121 V357 R713	P47-V709 HydrophobicContact CB-CG1 4.46Å; P47-V709 HydrophobicContact CG-CB 4.49Å; P47-V709 HydrophobicContact CG-CG1 4.29Å; P47-V709 HydrophobicContact CG-CG2 4.47Å; L49-V709 HydrophobicContact CD2-CG1 3.9Å; L49-V709 HydrophobicContact CD2-CG2 4.16Å; F121-V709 HydrophobicContact CD1-CG2 3.99Å; F121-V709 HydrophobicContact CE1-CG2 3.98Å; V357-V709 VanDerWaalsContact CG1-O 3.32Å; V357-V709 WeakPolarHBondContact CG1-O 2.95Å; V357-V709 WeakPolarHBondContact CG2-O 3.34Å; V709-R713 CarbonylContact C-O 3.56Å; V709-R713 VanDerWaalsContact CA-O 3.27Å; V709-R713 WeakPolarHBondContact CA-O 3.28Å
710	C	81.4	Confident	90.6	Very high	10 Å²	10	24.1 Å²	24.1	7%	0.068	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	130.8	172.8	-63.6	0	0	0	0	108.9	G712 R713 V715	C710-G712 PolarHBondContact O-N 3.45Å; C710-G712 VanDerWaalsContact O-N 3.14Å; C710-R713 PolarHBondContact N-O 3.45Å; C710-R713 PolarHBondContact O-N 3.08Å; C710-V715 HydrophobicContact CB-CG2 3.96Å
711	D	78.1	Confident	90.3	Very high	102 Å²	102	27.2 Å²	27.2	55%	0.545	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	42.8	-178.3	-54.5	-27.4	0	0	0	112.6	R713	D711-R713 PolarHBondContact O-N 3.35Å
712	G	81.8	Confident	90	Very high	4 Å²	4	27.9 Å²	27.9	4%	0.041	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	8.8	-178	0	0	0	0	0	116.3	H48 L49 S50 C710	H48-G712 WeakPolarHBondContact O-CA 3.4Å; L49-G712 CarbonylContact C-O 3.11Å; L49-G712 WeakPolarHBondContact CA-O 3.45Å; S50-G712 PolarHBondContact N-O 2.96Å; C710-G712 PolarHBondContact O-N 3.45Å; C710-G712 VanDerWaalsContact O-N 3.14Å
713	R	87.7	Confident	90.1	Very high	88 Å²	88	27.2 Å²	27.2	33%	0.332	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	144.7	178.7	-58.8	179.2	-171.4	144.9	6.8	110.9	Q51 T658 V709 C710 D711	Q51-R713 HydrophobicContact CB-CG 4.37Å; T658-R713 HydrophobicContact CG2-CB 4.05Å; V709-R713 CarbonylContact C-O 3.56Å; V709-R713 VanDerWaalsContact CA-O 3.27Å; V709-R713 WeakPolarHBondContact CA-O 3.28Å; C710-R713 PolarHBondContact N-O 3.45Å; C710-R713 PolarHBondContact O-N 3.08Å; D711-R713 PolarHBondContact O-N 3.35Å
714	S	91.1	Very high	90	Very high	5 Å²	5	28.3 Å²	28.3	4%	0.035	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	125.4	177.8	-61.1	0	0	0	0	110.7	Q51 Y117 T658 V708	Q51-S714 PolarHBondContact NE2-OG 3.01Å; Y117-S714 WeakPolarHBondContact OH-CB 3.17Å; Y117-S714 PolarHBondContact OH-OG 3.03Å; T658-S714 WeakPolarHBondContact CA-O 3.29Å; V708-S714 WeakPolarHBondContact O-CA 3.38Å
715	V	93.3	Very high	89.8	Confident	12 Å²	12	29.5 Å²	29.5	7%	0.073	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.4	-176.1	-65.9	0	0	0	0	111.2	F655 L657 T658 E707 V708 C710	F655-V715 WeakPolarHBondContact O-CG2 3.29Å; L657-V715 CarbonylContact O-C 3.59Å; L657-V715 WeakPolarHBondContact O-CA 3.3Å; T658-V715 HydrophobicContact CG2-CG1 3.95Å; E707-V715 WeakPolarHBondContact CA-O 3.35Å; V708-V715 PolarHBondContact N-O 3.39Å; V708-V715 VanDerWaalsContact O-CG2 3.26Å; V708-V715 WeakPolarHBondContact O-CG2 3.34Å; V708-V715 PolarHBondContact O-N 3.35Å; C710-V715 HydrophobicContact CB-CG2 3.96Å
716	Y	95.7	Very high	89.7	Confident	1 Å²	1	29.1 Å²	29.1	0%	0.004	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	128.2	172.8	-66.1	-59.6	0	0	0	110.8	G656 L657 L659 L662 W694 K698 L705 E706 E707	G656-Y716 CarbonylContact C-O 3.55Å; G656-Y716 WeakPolarHBondContact CA-O 3.44Å; L657-Y716 PolarHBondContact N-O 2.57Å; L657-Y716 VanDerWaalsContact N-O 3.14Å; L657-Y716 PolarHBondContact O-N 3.19Å; L659-Y716 HydrophobicContact CB-CE2 3.96Å; L659-Y716 HydrophobicContact CD1-CE2 4.15Å; L662-Y716 HydrophobicContact CD2-CD2 4.24Å; W694-Y716 HydrophobicContact CZ2-CD1 4.16Å; W694-Y716 AromaticContact CZ2-CD2 3.75Å; W694-Y716 HydrophobicContact CZ2-CD2 3.75Å; W694-Y716 HydrophobicContact CZ2-CE1 4.2Å; W694-Y716 AromaticContact CZ2-CE2 3.76Å; W694-Y716 HydrophobicContact CZ2-CE2 3.76Å; W694-Y716 AromaticContact CZ2-CG 3.97Å; W694-Y716 HydrophobicContact CZ2-CG 3.97Å; W694-Y716 AromaticContact NE1-CE2 3.83Å; W694-Y716 AromaticContact NE1-CZ 3.96Å; K698-Y716 HydrophobicContact CD-CE1 4.28Å; K698-Y716 PolarHBondContact NZ-OH 2.59Å; K698-Y716 VanDerWaalsContact NZ-OH 3.16Å; L705-Y716 HydrophobicContact CD2-CD1 3.75Å; L705-Y716 HydrophobicContact CD2-CE1 4.35Å; L705-Y716 HydrophobicContact CD2-CG 4.36Å; L705-Y716 HydrophobicContact CG-CD1 4.27Å; E706-Y716 WeakPolarHBondContact O-CA 3.23Å; E707-Y716 HydrophobicContact CB-CD1 4.18Å; E707-Y716 HydrophobicContact CB-CE1 4.08Å; E707-Y716 HydrophobicContact CG-CD1 4.22Å; E707-Y716 HydrophobicContact CG-CE1 3.82Å; E707-Y716 WeakPolarHBondContact OE1-CE1 3.44Å; E707-Y716 PolarHBondContact OE1-OH 3Å
717	K	93.3	Very high	89.9	Confident	25 Å²	25	28.4 Å²	28.4	11%	0.109	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	172	177.1	65.8	-173	-176.2	-174.9	0	111.4	L432 L705 E706 V708	L432-K717 PolarHBondContact O-NZ 3.48Å; L705-K717 WeakPolarHBondContact CD1-O 3.31Å; E706-K717 HydrophobicContact CB-CG 4.01Å; E706-K717 PolarHBondContact N-O 2.8Å; E706-K717 PolarHBondContact O-N 3.47Å; E706-K717 WeakPolarHBondContact OE2-CE 3.33Å; E706-K717 IonicContact OE2-NZ 3.31Å; V708-K717 VanDerWaalsContact CG2-CE 3.41Å
718	W	94.3	Very high	90	Very high	25 Å²	25	30.1 Å²	30.1	10%	0.095	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	126.7	178.2	-59.8	112.9	0	0	0	111.7	L647 I650 L701 L705 H720 V723 I724 I727	L647-W718 HydrophobicContact CB-CH2 4.24Å; L647-W718 HydrophobicContact CB-CZ2 4.1Å; L647-W718 HydrophobicContact CD2-CH2 3.45Å; L647-W718 VanDerWaalsContact CD2-CH2 3.45Å; L647-W718 HydrophobicContact CD2-CZ2 4.15Å; L647-W718 HydrophobicContact CD2-CZ3 4.42Å; L647-W718 HydrophobicContact CG-CH2 4.36Å; I650-W718 HydrophobicContact CB-CZ2 3.86Å; I650-W718 HydrophobicContact CD1-CZ2 4.47Å; I650-W718 HydrophobicContact CG2-CD2 4.42Å; I650-W718 HydrophobicContact CG2-CH2 4.41Å; I650-W718 HydrophobicContact CG2-CZ2 3.69Å; L701-W718 HydrophobicContact CD1-CH2 4.36Å; L701-W718 HydrophobicContact CD1-CZ3 4.45Å; L701-W718 HydrophobicContact CD2-CZ3 4.39Å; L705-W718 HydrophobicContact CD1-CE3 4.37Å; L705-W718 HydrophobicContact CD1-CH2 4.17Å; L705-W718 HydrophobicContact CD1-CZ3 3.95Å; W718-H720 VanDerWaalsContact C-N 3.26Å; W718-H720 PolarHBondContact O-N 3.35Å; W718-V723 HydrophobicContact CD2-CG1 4.06Å; W718-V723 HydrophobicContact CE3-CG1 3.56Å; W718-V723 HydrophobicContact CZ3-CG1 4.17Å; W718-I724 HydrophobicContact CB-CD1 4.48Å; W718-I724 HydrophobicContact CB-CG1 3.96Å; W718-I724 HydrophobicContact CG-CG1 3.99Å; W718-I727 HydrophobicContact CD2-CD1 3.51Å; W718-I727 HydrophobicContact CE3-CD1 3.81Å; W718-I727 HydrophobicContact CG-CD1 4.32Å; W718-I727 HydrophobicContact CH2-CD1 3.58Å; W718-I727 HydrophobicContact CZ2-CD1 3.17Å; W718-I727 HydrophobicContact CZ3-CD1 3.85Å
719	S	91.3	Very high	90.2	Very high	24 Å²	24	39 Å²	39	17%	0.168	19%	0.185	C	C	.	.	S	Bend	trans	-64.2	-30.7	178.5	-48.5	0	0	0	0	112.7	C703 L704 L705 E706	C703-S719 WeakPolarHBondContact O-CB 3.37Å; C703-S719 PolarHBondContact O-OG 3.42Å; L704-S719 PolarHBondContact O-N 3.47Å; L704-S719 PolarHBondContact O-OG 2.97Å; L705-S719 VanDerWaalsContact C-OG 3.29Å; L705-S719 PolarHBondContact O-OG 3.05Å; E706-S719 WeakPolarHBondContact CB-OG 3.37Å; E706-S719 PolarHBondContact N-OG 3.28Å
720	H	89.7	Confident	90.5	Very high	59 Å²	59	41.8 Å²	41.8	27%	0.273	19%	0.194	S	C	.	.	S	Bend	trans	-136.6	144.6	-172.7	-55.3	-65.8	0	0	0	113	L594 W718 F722 V723	L594-H720 WeakPolarHBondContact CD1-NE2 3.48Å; L594-H720 VanDerWaalsContact CD2-CD2 3.48Å; L594-H720 WeakPolarHBondContact CD2-CD2 3.32Å; L594-H720 WeakPolarHBondContact CD2-NE2 3.32Å; W718-H720 VanDerWaalsContact C-N 3.26Å; W718-H720 PolarHBondContact O-N 3.35Å; H720-F722 HydrophobicContact CB-CD1 3.63Å; H720-F722 HydrophobicContact CB-CE1 3.44Å; H720-F722 VanDerWaalsContact CB-CE1 3.44Å; H720-F722 HydrophobicContact CB-CZ 4.45Å; H720-F722 AromaticContact CG-CE1 3.86Å; H720-F722 PolarHBondContact O-N 2.89Å; H720-V723 HydrophobicContact CB-CG2 4.08Å; H720-V723 WeakPolarHBondContact O-CB 3.35Å; H720-V723 PolarHBondContact O-N 2.89Å
721	L	85.8	Confident	91.1	Very high	64 Å²	64	41.9 Å²	41.9	34%	0.335	19%	0.193	S	C	.	.	H	α-helix	trans	-65.2	-37.3	-177.3	-68.1	177.3	0	0	0	113.7	R501 V723 I724 G725	R501-L721 HydrophobicContact CG-CD1 4.41Å; L721-V723 PolarHBondContact O-N 3.06Å; L721-I724 HydrophobicContact CD2-CD1 4.07Å; L721-I724 WeakPolarHBondContact O-CB 3.38Å; L721-I724 PolarHBondContact O-N 3.46Å; L721-I724 VanDerWaalsContact O-N 3.12Å; L721-G725 PolarHBondContact O-N 3.47Å
722	F	90.2	Very high	91.7	Very high	15 Å²	15	37.8 Å²	37.8	7%	0.066	17%	0.171	C	C	.	.	H	α-helix	trans	-63.6	-28	-179.6	77.8	-88.5	0	0	0	112	H401 L594 M598 L620 L623 T624 T627 H720 I724 G725 V726	H401-F722 HydrophobicContact CB-CD1 4.4Å; L594-F722 HydrophobicContact CD2-CE1 3.59Å; L594-F722 HydrophobicContact CD2-CZ 3.9Å; M598-F722 HydrophobicContact SD-CZ 4.49Å; L620-F722 HydrophobicContact CD1-CB 3.65Å; L620-F722 HydrophobicContact CD1-CG 4.25Å; L623-F722 HydrophobicContact CB-CD2 4.15Å; L623-F722 HydrophobicContact CB-CE2 3.72Å; L623-F722 HydrophobicContact CB-CZ 4Å; L623-F722 HydrophobicContact CD1-CE1 4.28Å; L623-F722 HydrophobicContact CD1-CZ 4.38Å; L623-F722 HydrophobicContact CD2-CZ 4.33Å; L623-F722 HydrophobicContact CG-CZ 4.48Å; T624-F722 HydrophobicContact CG2-CD2 4.17Å; T627-F722 VanDerWaalsContact OG1-CE2 3.27Å; T627-F722 WeakPolarHBondContact OG1-CE2 3.39Å; H720-F722 HydrophobicContact CB-CD1 3.63Å; H720-F722 HydrophobicContact CB-CE1 3.44Å; H720-F722 VanDerWaalsContact CB-CE1 3.44Å; H720-F722 HydrophobicContact CB-CZ 4.45Å; H720-F722 AromaticContact CG-CE1 3.86Å; H720-F722 PolarHBondContact O-N 2.89Å; F722-I724 VanDerWaalsContact C-N 3.33Å; F722-I724 PolarHBondContact O-N 2.87Å; F722-G725 PolarHBondContact O-N 3.09Å; F722-G725 VanDerWaalsContact O-N 3.15Å; F722-V726 WeakPolarHBondContact O-CG2 3.31Å; F722-V726 PolarHBondContact O-N 3.33Å
723	V	93.9	Very high	92	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.012	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-41.1	176.4	-178.2	0	0	0	0	110.5	T627 L704 W718 H720 L721 G725 V726 I727	T627-V723 HydrophobicContact CG2-CG1 4.38Å; L704-V723 HydrophobicContact CD2-CG2 3.75Å; W718-V723 HydrophobicContact CD2-CG1 4.06Å; W718-V723 HydrophobicContact CE3-CG1 3.56Å; W718-V723 HydrophobicContact CZ3-CG1 4.17Å; H720-V723 HydrophobicContact CB-CG2 4.08Å; H720-V723 WeakPolarHBondContact O-CB 3.35Å; H720-V723 PolarHBondContact O-N 2.89Å; L721-V723 PolarHBondContact O-N 3.06Å; V723-G725 VanDerWaalsContact C-N 3.28Å; V723-G725 PolarHBondContact O-N 3.02Å; V723-V726 PolarHBondContact O-N 2.93Å; V723-V726 VanDerWaalsContact O-N 3.14Å; V723-I727 HydrophobicContact CG1-CD1 3.78Å; V723-I727 HydrophobicContact CG1-CG1 4.36Å; V723-I727 WeakPolarHBondContact O-CG1 3.41Å; V723-I727 PolarHBondContact O-N 2.85Å
724	I	91.1	Very high	92.2	Very high	40 Å²	40	40.5 Å²	40.5	21%	0.205	20%	0.199	C	C	.	.	H	α-helix	trans	-57.5	-44.4	173.8	-59.1	172.3	0	0	0	110.2	E651 W718 L721 F722 V726 I727 R728	E651-I724 HydrophobicContact CG-CG2 4.03Å; W718-I724 HydrophobicContact CB-CD1 4.48Å; W718-I724 HydrophobicContact CB-CG1 3.96Å; W718-I724 HydrophobicContact CG-CG1 3.99Å; L721-I724 HydrophobicContact CD2-CD1 4.07Å; L721-I724 WeakPolarHBondContact O-CB 3.38Å; L721-I724 PolarHBondContact O-N 3.46Å; L721-I724 VanDerWaalsContact O-N 3.12Å; F722-I724 VanDerWaalsContact C-N 3.33Å; F722-I724 PolarHBondContact O-N 2.87Å; I724-V726 VanDerWaalsContact C-N 3.35Å; I724-V726 PolarHBondContact O-N 2.98Å; I724-I727 PolarHBondContact O-N 2.75Å; I724-R728 HydrophobicContact CG2-CG 4.3Å; I724-R728 WeakPolarHBondContact O-CB 3.25Å; I724-R728 WeakPolarHBondContact O-CG 3.39Å; I724-R728 PolarHBondContact O-N 2.78Å
725	G	90.7	Very high	92.1	Very high	26 Å²	26	44.4 Å²	44.4	27%	0.268	22%	0.223	S	C	.	.	H	α-helix	trans	-59.5	-42.5	176.5	0	0	0	0	0	113	L721 F722 V723 R729	L721-G725 PolarHBondContact O-N 3.47Å; F722-G725 PolarHBondContact O-N 3.09Å; F722-G725 VanDerWaalsContact O-N 3.15Å; V723-G725 VanDerWaalsContact C-N 3.28Å; V723-G725 PolarHBondContact O-N 3.02Å; G725-R729 WeakPolarHBondContact O-CB 3.5Å; G725-R729 VanDerWaalsContact O-CG 3.23Å; G725-R729 WeakPolarHBondContact O-CG 3.39Å; G725-R729 PolarHBondContact O-N 3.2Å; G725-R729 VanDerWaalsContact O-N 3.14Å
726	V	95	Very high	92.1	Very high	10 Å²	10	48.7 Å²	48.7	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-47.4	176.9	179.1	0	0	0	0	111.1	T624 T627 L631 F722 V723 I724 R728 R729 R730	T624-V726 HydrophobicContact CG2-CG2 3.76Å; T627-V726 HydrophobicContact CG2-CB 4.13Å; T627-V726 HydrophobicContact CG2-CG1 3.95Å; T627-V726 HydrophobicContact CG2-CG2 4.25Å; L631-V726 HydrophobicContact CD1-CG1 3.9Å; F722-V726 WeakPolarHBondContact O-CG2 3.31Å; F722-V726 PolarHBondContact O-N 3.33Å; V723-V726 PolarHBondContact O-N 2.93Å; V723-V726 VanDerWaalsContact O-N 3.14Å; I724-V726 VanDerWaalsContact C-N 3.35Å; I724-V726 PolarHBondContact O-N 2.98Å; V726-R728 PolarHBondContact O-N 3.29Å; V726-R729 PolarHBondContact O-N 2.81Å; V726-R730 WeakPolarHBondContact O-CB 3.13Å; V726-R730 PolarHBondContact O-N 3.26Å
727	I	95.1	Very high	91.8	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-46.6	179.5	-69.8	168.3	0	0	0	110.9	E651 W718 V723 I724 R729 R730 Y731	E651-I727 HydrophobicContact CB-CG2 4.17Å; E651-I727 HydrophobicContact CG-CG2 4.34Å; W718-I727 HydrophobicContact CD2-CD1 3.51Å; W718-I727 HydrophobicContact CE3-CD1 3.81Å; W718-I727 HydrophobicContact CG-CD1 4.32Å; W718-I727 HydrophobicContact CH2-CD1 3.58Å; W718-I727 HydrophobicContact CZ2-CD1 3.17Å; W718-I727 HydrophobicContact CZ3-CD1 3.85Å; V723-I727 HydrophobicContact CG1-CD1 3.78Å; V723-I727 HydrophobicContact CG1-CG1 4.36Å; V723-I727 WeakPolarHBondContact O-CG1 3.41Å; V723-I727 PolarHBondContact O-N 2.85Å; I724-I727 PolarHBondContact O-N 2.75Å; I727-R729 PolarHBondContact O-N 3.28Å; I727-R730 PolarHBondContact O-N 2.99Å; I727-Y731 HydrophobicContact CG2-CD2 4.11Å; I727-Y731 PolarHBondContact O-N 3.19Å
728	R	93.9	Very high	91.7	Very high	96 Å²	96	52.1 Å²	52.1	36%	0.362	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-44.5	179.7	-75	179.9	177	-172.2	-1.9	111.9	E651 I724 V726 R730 L732 C733	E651-R728 HydrophobicContact CG-CG 4.41Å; E651-R728 IonicContact OE1-CZ 2.82Å; E651-R728 IonicContact OE1-NE 3.51Å; E651-R728 PolarHBondContact OE1-NE 2.86Å; E651-R728 IonicContact OE1-NH2 2.74Å; E651-R728 PolarHBondContact OE1-NH2 2.77Å; I724-R728 HydrophobicContact CG2-CG 4.3Å; I724-R728 WeakPolarHBondContact O-CB 3.25Å; I724-R728 WeakPolarHBondContact O-CG 3.39Å; I724-R728 PolarHBondContact O-N 2.78Å; V726-R728 PolarHBondContact O-N 3.29Å; R728-R730 VanDerWaalsContact C-N 3.33Å; R728-R730 PolarHBondContact O-N 2.91Å; R728-L732 HydrophobicContact CG-CD1 4.22Å; R728-L732 CarbonylContact O-C 3.2Å; R728-L732 WeakPolarHBondContact O-CA 3.42Å; R728-L732 PolarHBondContact O-N 3.33Å; R728-C733 PolarHBondContact O-N 2.92Å
729	R	93.4	Very high	91.5	Very high	196 Å²	196	56.4 Å²	56.4	74%	0.74	28%	0.279	S	S	*	.	H	α-helix	trans	-63.7	-37.8	176.6	-70.8	173.6	-164.9	174.8	5.5	112.3	G725 V726 I727	G725-R729 WeakPolarHBondContact O-CB 3.5Å; G725-R729 VanDerWaalsContact O-CG 3.23Å; G725-R729 WeakPolarHBondContact O-CG 3.39Å; G725-R729 PolarHBondContact O-N 3.2Å; G725-R729 VanDerWaalsContact O-N 3.14Å; V726-R729 PolarHBondContact O-N 2.81Å; I727-R729 PolarHBondContact O-N 3.28Å
730	R	93.9	Very high	91.5	Very high	74 Å²	74	58.8 Å²	58.8	28%	0.279	29%	0.289	S	S	.	.	H	α-helix	trans	-80.3	-41.8	-175.6	-167.8	174.6	-177.4	82.6	9.2	113.4	D628 E635 V726 I727 R728	D628-R730 IonicContact OD1-CZ 2.81Å; D628-R730 IonicContact OD1-NH1 2.75Å; D628-R730 PolarHBondContact OD1-NH1 3.1Å; D628-R730 IonicContact OD2-NH1 3.23Å; E635-R730 IonicContact OE1-CZ 3.94Å; E635-R730 IonicContact OE1-NE 3.68Å; E635-R730 PolarHBondContact OE1-NE 2.81Å; E635-R730 IonicContact OE1-NH2 2.67Å; E635-R730 PolarHBondContact OE1-NH2 3.42Å; E635-R730 IonicContact OE2-CZ 3.93Å; E635-R730 IonicContact OE2-NE 3.51Å; E635-R730 IonicContact OE2-NH2 3.11Å; E635-R730 PolarHBondContact OE2-NH2 2.87Å; V726-R730 WeakPolarHBondContact O-CB 3.13Å; V726-R730 PolarHBondContact O-N 3.26Å; I727-R730 PolarHBondContact O-N 2.99Å; R728-R730 VanDerWaalsContact C-N 3.33Å; R728-R730 PolarHBondContact O-N 2.91Å
731	Y	94	Very high	91.5	Very high	12 Å²	12	56.2 Å²	56.2	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-121.7	-28.9	-167.6	-54.7	-60.6	0	0	0	115	L631 E635 R644 L647 C648 I727	L631-Y731 HydrophobicContact CD1-CE2 4.2Å; E635-Y731 VanDerWaalsContact OE1-CE1 3.25Å; E635-Y731 WeakPolarHBondContact OE1-CE1 3.1Å; E635-Y731 VanDerWaalsContact OE1-CZ 3.29Å; E635-Y731 PolarHBondContact OE1-OH 2.88Å; R644-Y731 HydrophobicContact CB-CD1 3.8Å; R644-Y731 HydrophobicContact CB-CE1 4.06Å; R644-Y731 HydrophobicContact CB-CG 4.47Å; R644-Y731 HydrophobicContact CG-CD1 3.75Å; R644-Y731 HydrophobicContact CG-CG 4.19Å; L647-Y731 HydrophobicContact CB-CE2 4.37Å; L647-Y731 HydrophobicContact CD1-CD2 4.48Å; L647-Y731 HydrophobicContact CD1-CE2 3.58Å; C648-Y731 WeakPolarHBondContact SG-CB 3.49Å; I727-Y731 HydrophobicContact CG2-CD2 4.11Å; I727-Y731 PolarHBondContact O-N 3.19Å
732	L	91.2	Very high	91.8	Very high	16 Å²	16	54 Å²	54	8%	0.084	27%	0.266	C	S	.	.			trans	-108.5	42.3	-178.7	-60.4	169.7	0	0	0	111.9	C648 E651 R728 T734 H737	C648-L732 HydrophobicContact CB-CD2 4.04Å; C648-L732 HydrophobicContact CB-CG 4.44Å; C648-L732 VanDerWaalsContact SG-CD2 3.5Å; E651-L732 HydrophobicContact CB-CD1 4.43Å; E651-L732 HydrophobicContact CG-CD1 4.29Å; R728-L732 HydrophobicContact CG-CD1 4.22Å; R728-L732 CarbonylContact O-C 3.2Å; R728-L732 WeakPolarHBondContact O-CA 3.42Å; R728-L732 PolarHBondContact O-N 3.33Å; L732-T734 PolarHBondContact O-N 3.06Å; L732-H737 HydrophobicContact CD2-CB 4.24Å
733	C	88.5	Confident	91.8	Very high	88 Å²	88	59.2 Å²	59.2	60%	0.595	29%	0.292	S	S	*	.			trans	-71.7	-11.2	-175.5	58.3	0	0	0	0	115.1	R728 H737	R728-C733 PolarHBondContact O-N 2.92Å; C733-H737 VanDerWaalsContact SG-CE1 3.59Å
734	T	90.2	Very high	91.6	Very high	60 Å²	60	61.2 Å²	61.2	37%	0.368	31%	0.306	S	S	.	.	S	Bend	trans	-128.1	150	178.8	74.4	0	0	0	0	110.6	L732 Q736 H737 L738	L732-T734 PolarHBondContact O-N 3.06Å; T734-Q736 PolarHBondContact O-N 3.33Å; T734-Q736 PolarHBondContact OG1-N 3.29Å; T734-H737 PolarHBondContact O-N 3.21Å; T734-H737 VanDerWaalsContact O-N 3.16Å; T734-H737 PolarHBondContact OG1-CD2 3Å; T734-H737 PolarHBondContact OG1-CE1 3.03Å; T734-H737 PolarHBondContact OG1-N 3.22Å; T734-H737 VanDerWaalsContact OG1-N 3.13Å; T734-H737 PolarHBondContact OG1-ND1 3.5Å; T734-H737 VanDerWaalsContact OG1-ND1 3.11Å; T734-L738 PolarHBondContact O-N 3.34Å
735	V	90.3	Very high	91.5	Very high	88 Å²	88	59.4 Å²	59.4	53%	0.533	30%	0.297	S	S	.	.	H	α-helix	trans	-57.8	-29.8	172.7	178.7	0	0	0	0	111.2	K739	V735-K739 HydrophobicContact CG1-CD 4.17Å; V735-K739 HydrophobicContact CG1-CG 4.4Å; V735-K739 WeakPolarHBondContact O-CB 3.25Å; V735-K739 VanDerWaalsContact O-CG 3.29Å; V735-K739 WeakPolarHBondContact O-CG 3.39Å; V735-K739 PolarHBondContact O-N 3Å
736	Q	91.8	Very high	91.4	Very high	102 Å²	102	59.5 Å²	59.5	48%	0.477	29%	0.293	S	S	.	.	H	α-helix	trans	-67.1	-46.6	177.3	-170.6	59	36.3	0	0	111.6	T734 L738 K739 D740	T734-Q736 PolarHBondContact O-N 3.33Å; T734-Q736 PolarHBondContact OG1-N 3.29Å; Q736-L738 VanDerWaalsContact C-N 3.27Å; Q736-L738 PolarHBondContact O-N 2.96Å; Q736-K739 WeakPolarHBondContact O-CB 3.28Å; Q736-K739 PolarHBondContact O-N 3.02Å; Q736-K739 VanDerWaalsContact O-N 3.1Å; Q736-D740 PolarHBondContact NE2-OD1 2.68Å; Q736-D740 PolarHBondContact O-N 2.64Å
737	H	90.8	Very high	91	Very high	49 Å²	49	59.8 Å²	59.8	23%	0.227	30%	0.296	C	S	.	.	H	α-helix	trans	-57.4	-42.4	177.2	-59.8	151.8	0	0	0	111.8	R644 L732 C733 T734 D740 C741	R644-H737 PolarHBondContact NH2-CD2 3.1Å; R644-H737 PolarHBondContact NH2-CE1 2.92Å; R644-H737 PolarHBondContact NH2-ND1 3.02Å; R644-H737 PolarHBondContact NH2-NE2 3.14Å; L732-H737 HydrophobicContact CD2-CB 4.24Å; C733-H737 VanDerWaalsContact SG-CE1 3.59Å; T734-H737 PolarHBondContact O-N 3.21Å; T734-H737 VanDerWaalsContact O-N 3.16Å; T734-H737 PolarHBondContact OG1-CD2 3Å; T734-H737 PolarHBondContact OG1-CE1 3.03Å; T734-H737 PolarHBondContact OG1-N 3.22Å; T734-H737 VanDerWaalsContact OG1-N 3.13Å; T734-H737 PolarHBondContact OG1-ND1 3.5Å; T734-H737 VanDerWaalsContact OG1-ND1 3.11Å; H737-D740 PolarHBondContact O-N 3.21Å; H737-C741 PolarHBondContact O-N 2.94Å; H737-C741 VanDerWaalsContact O-N 3.1Å; H737-C741 PolarHBondContact O-SG 2.83Å; H737-C741 VanDerWaalsContact O-SG 3.4Å
738	L	90	Very high	90.6	Very high	49 Å²	49	59.8 Å²	59.8	26%	0.257	30%	0.296	S	S	.	.	H	α-helix	trans	-65.7	-41.9	176.7	-178.5	140.1	0	0	0	112	T734 Q736 C741 H742	T734-L738 PolarHBondContact O-N 3.34Å; Q736-L738 VanDerWaalsContact C-N 3.27Å; Q736-L738 PolarHBondContact O-N 2.96Å; L738-C741 PolarHBondContact O-N 3.45Å; L738-H742 VanDerWaalsContact CD2-CD2 3.46Å; L738-H742 WeakPolarHBondContact CD2-CD2 3.27Å; L738-H742 PolarHBondContact O-CD2 2.78Å; L738-H742 PolarHBondContact O-N 3.34Å
739	K	91.6	Very high	90.1	Very high	114 Å²	114	57.4 Å²	57.4	50%	0.496	29%	0.288	S	S	.	.	H	α-helix	trans	-61	-45.6	174.3	-77.7	173	177.9	174.4	0	111.9	V735 Q736 C741 H742 M743	V735-K739 HydrophobicContact CG1-CD 4.17Å; V735-K739 HydrophobicContact CG1-CG 4.4Å; V735-K739 WeakPolarHBondContact O-CB 3.25Å; V735-K739 VanDerWaalsContact O-CG 3.29Å; V735-K739 WeakPolarHBondContact O-CG 3.39Å; V735-K739 PolarHBondContact O-N 3Å; Q736-K739 WeakPolarHBondContact O-CB 3.28Å; Q736-K739 PolarHBondContact O-N 3.02Å; Q736-K739 VanDerWaalsContact O-N 3.1Å; K739-C741 PolarHBondContact O-N 3.16Å; K739-H742 PolarHBondContact O-N 3.36Å; K739-M743 WeakPolarHBondContact O-CB 3.32Å; K739-M743 VanDerWaalsContact O-CG 3.25Å; K739-M743 WeakPolarHBondContact O-CG 3.48Å; K739-M743 PolarHBondContact O-N 2.94Å
740	D	90.2	Very high	89.5	Confident	74 Å²	74	50.7 Å²	50.7	40%	0.396	27%	0.267	S	S	.	.	H	α-helix	trans	-61.1	-46.4	-179.2	-63	-25.4	0	0	0	110.6	Q736 H737 H742 M743 S744	Q736-D740 PolarHBondContact NE2-OD1 2.68Å; Q736-D740 PolarHBondContact O-N 2.64Å; H737-D740 PolarHBondContact O-N 3.21Å; D740-H742 PolarHBondContact O-N 3.44Å; D740-M743 PolarHBondContact O-N 3.37Å; D740-S744 PolarHBondContact O-N 3.36Å; D740-S744 PolarHBondContact O-OG 2.83Å
741	C	91	Very high	88.7	Confident	6 Å²	6	50.5 Å²	50.5	4%	0.041	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-44.3	175.7	-70.7	0	0	0	0	112.5	C648 F649 C652 H737 L738 K739 M743 S744 L745	C648-C741 VanDerWaalsContact CB-SG 3.55Å; F649-C741 HydrophobicContact CD1-CB 4.35Å; F649-C741 HydrophobicContact CE1-CB 4.42Å; C652-C741 HydrophobicContact CB-CB 4.37Å; H737-C741 PolarHBondContact O-N 2.94Å; H737-C741 VanDerWaalsContact O-N 3.1Å; H737-C741 PolarHBondContact O-SG 2.83Å; H737-C741 VanDerWaalsContact O-SG 3.4Å; L738-C741 PolarHBondContact O-N 3.45Å; K739-C741 PolarHBondContact O-N 3.16Å; C741-M743 VanDerWaalsContact C-N 3.34Å; C741-M743 PolarHBondContact O-N 2.95Å; C741-S744 PolarHBondContact O-N 2.81Å; C741-L745 WeakPolarHBondContact O-CG 3.37Å; C741-L745 PolarHBondContact O-N 2.95Å
742	H	90.6	Very high	87.9	Confident	16 Å²	16	54.1 Å²	54.1	7%	0.074	30%	0.295	C	S	.	.	H	α-helix	trans	-66	-35.1	175.4	-76.5	-51.6	0	0	0	112.9	C652 L738 K739 D740 L745 V746	C652-H742 PolarHBondContact O-CE1 2.86Å; L738-H742 VanDerWaalsContact CD2-CD2 3.46Å; L738-H742 WeakPolarHBondContact CD2-CD2 3.27Å; L738-H742 PolarHBondContact O-CD2 2.78Å; L738-H742 PolarHBondContact O-N 3.34Å; K739-H742 PolarHBondContact O-N 3.36Å; D740-H742 PolarHBondContact O-N 3.44Å; H742-L745 PolarHBondContact O-N 3.03Å; H742-V746 WeakPolarHBondContact O-CB 3.18Å; H742-V746 VanDerWaalsContact O-CG2 3.25Å; H742-V746 WeakPolarHBondContact O-CG2 3.17Å; H742-V746 PolarHBondContact O-N 3.41Å
743	M	90.6	Very high	86.9	Confident	126 Å²	126	54.8 Å²	54.8	62%	0.621	30%	0.298	S	S	*	.	H	α-helix	trans	-64.4	-41	175.2	-75.2	-60.7	-59.5	0	0	111.4	K739 D740 C741 V746 A747	K739-M743 WeakPolarHBondContact O-CB 3.32Å; K739-M743 VanDerWaalsContact O-CG 3.25Å; K739-M743 WeakPolarHBondContact O-CG 3.48Å; K739-M743 PolarHBondContact O-N 2.94Å; D740-M743 PolarHBondContact O-N 3.37Å; C741-M743 VanDerWaalsContact C-N 3.34Å; C741-M743 PolarHBondContact O-N 2.95Å; M743-V746 PolarHBondContact O-N 3.39Å; M743-A747 WeakPolarHBondContact O-CB 3.06Å; M743-A747 PolarHBondContact O-N 3.4Å
744	S	89.9	Confident	85.7	Confident	44 Å²	44	54.3 Å²	54.3	31%	0.308	29%	0.294	S	S	.	.	H	α-helix	trans	-62.7	-42.7	173.2	-58.7	0	0	0	0	112.3	L665 D740 C741 A747 L748	L665-S744 WeakPolarHBondContact CD2-O 3.33Å; D740-S744 PolarHBondContact O-N 3.36Å; D740-S744 PolarHBondContact O-OG 2.83Å; C741-S744 PolarHBondContact O-N 2.81Å; S744-A747 WeakPolarHBondContact O-CB 3.42Å; S744-A747 PolarHBondContact O-N 3.31Å; S744-L748 PolarHBondContact O-N 3.34Å
745	L	89.8	Confident	84.1	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-61.8	-47.4	175.2	-73.3	168.6	0	0	0	111.6	C652 L657 L665 C741 H742 A747 L748 F749 I794	C652-L745 HydrophobicContact CB-CD1 3.62Å; L657-L745 HydrophobicContact CD1-CD2 4.45Å; L657-L745 HydrophobicContact CD2-CD2 3.85Å; L665-L745 HydrophobicContact CD1-CD2 3.61Å; L665-L745 HydrophobicContact CD2-CD2 4.41Å; C741-L745 WeakPolarHBondContact O-CG 3.37Å; C741-L745 PolarHBondContact O-N 2.95Å; H742-L745 PolarHBondContact O-N 3.03Å; L745-A747 VanDerWaalsContact C-N 3.26Å; L745-A747 PolarHBondContact O-N 3.06Å; L745-L748 WeakPolarHBondContact O-CB 3.46Å; L745-L748 PolarHBondContact O-N 2.9Å; L745-F749 HydrophobicContact CB-CE2 4.45Å; L745-F749 HydrophobicContact CD2-CE2 4.2Å; L745-F749 WeakPolarHBondContact O-CD2 3.32Å; L745-F749 PolarHBondContact O-N 3.43Å; L745-I794 HydrophobicContact CB-CG2 4.4Å
746	V	87.6	Confident	82.2	Confident	28 Å²	28	53.2 Å²	53.2	17%	0.17	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-40.9	175.1	170.3	0	0	0	0	110.6	H742 M743 N750 I794	H742-V746 WeakPolarHBondContact O-CB 3.18Å; H742-V746 VanDerWaalsContact O-CG2 3.25Å; H742-V746 WeakPolarHBondContact O-CG2 3.17Å; H742-V746 PolarHBondContact O-N 3.41Å; M743-V746 PolarHBondContact O-N 3.39Å; V746-N750 VanDerWaalsContact CG1-ND2 3.32Å; V746-N750 WeakPolarHBondContact CG1-ND2 3.48Å; V746-N750 VanDerWaalsContact O-CB 3.29Å; V746-N750 WeakPolarHBondContact O-CB 3.09Å; V746-N750 PolarHBondContact O-N 3.17Å; V746-N750 PolarHBondContact O-ND2 2.96Å; V746-I794 HydrophobicContact CG2-CB 4.19Å; V746-I794 HydrophobicContact CG2-CD1 3.89Å; V746-I794 HydrophobicContact CG2-CG2 4.06Å
747	A	86.8	Confident	80.1	Confident	16 Å²	16	57.2 Å²	57.2	13%	0.132	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-43.4	178.3	0	0	0	0	0	112	M743 S744 L745 N751 T752 L753	M743-A747 WeakPolarHBondContact O-CB 3.06Å; M743-A747 PolarHBondContact O-N 3.4Å; S744-A747 WeakPolarHBondContact O-CB 3.42Å; S744-A747 PolarHBondContact O-N 3.31Å; L745-A747 VanDerWaalsContact C-N 3.26Å; L745-A747 PolarHBondContact O-N 3.06Å; A747-N751 PolarHBondContact O-N 2.83Å; A747-T752 WeakPolarHBondContact CA-OG1 3.45Å; A747-T752 PolarHBondContact O-N 3.46Å; A747-T752 PolarHBondContact O-OG1 3.08Å; A747-L753 HydrophobicContact CB-CD2 4Å; A747-L753 HydrophobicContact CB-CG 4.42Å; A747-L753 PolarHBondContact O-N 3.17Å
748	L	86.6	Confident	78.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-57.8	-56.7	174.1	176.2	79.7	0	0	0	111.4	E661 D664 L665 S744 L745 N750 N751 L753	E661-L748 HydrophobicContact CB-CD2 3.87Å; E661-L748 HydrophobicContact CG-CD2 4.03Å; D664-L748 HydrophobicContact CB-CD1 3.66Å; L665-L748 HydrophobicContact CD1-CD2 3.99Å; L665-L748 HydrophobicContact CD2-CB 3.84Å; L665-L748 HydrophobicContact CD2-CD2 4.09Å; L665-L748 HydrophobicContact CD2-CG 4.41Å; L665-L748 HydrophobicContact CG-CB 4.44Å; L665-L748 HydrophobicContact CG-CD1 4.49Å; L665-L748 HydrophobicContact CG-CD2 3.85Å; L665-L748 HydrophobicContact CG-CG 4.49Å; S744-L748 PolarHBondContact O-N 3.34Å; L745-L748 WeakPolarHBondContact O-CB 3.46Å; L745-L748 PolarHBondContact O-N 2.9Å; L748-N750 VanDerWaalsContact C-N 3.25Å; L748-N750 PolarHBondContact O-N 3.27Å; L748-N751 PolarHBondContact O-N 3.47Å; L748-L753 HydrophobicContact CB-CD1 4.05Å; L748-L753 HydrophobicContact CB-CD2 4.39Å; L748-L753 HydrophobicContact CB-CG 4.35Å; L748-L753 HydrophobicContact CD1-CD1 3.52Å; L748-L753 HydrophobicContact CG-CD1 4.38Å
749	F	82.7	Confident	76.2	Confident	45 Å²	45	54.9 Å²	54.9	20%	0.197	30%	0.304	C	S	.	.	H	α-helix	trans	-69.5	-21.6	-174.7	-69	-64.7	0	0	0	113.7	L657 E661 L745 N751 L776 I794	L657-F749 HydrophobicContact CD2-CZ 4.5Å; E661-F749 WeakPolarHBondContact OE1-CE1 3.45Å; L745-F749 HydrophobicContact CB-CE2 4.45Å; L745-F749 HydrophobicContact CD2-CE2 4.2Å; L745-F749 WeakPolarHBondContact O-CD2 3.32Å; L745-F749 PolarHBondContact O-N 3.43Å; F749-N751 VanDerWaalsContact C-N 3.35Å; F749-L776 HydrophobicContact CB-CD1 3.91Å; F749-L776 HydrophobicContact CB-CG 4.26Å; F749-I794 HydrophobicContact CB-CD1 4.17Å; F749-I794 HydrophobicContact CD2-CD1 3.59Å; F749-I794 HydrophobicContact CD2-CG1 4.48Å; F749-I794 HydrophobicContact CE2-CD1 4.42Å; F749-I794 HydrophobicContact CG-CD1 4.22Å
750	N	82.5	Confident	74.3	Confident	55 Å²	55	56.1 Å²	56.1	29%	0.294	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-0.6	172.1	-71.2	-28.3	0	0	0	113.4	V746 L748 T752 C790	V746-N750 VanDerWaalsContact CG1-ND2 3.32Å; V746-N750 WeakPolarHBondContact CG1-ND2 3.48Å; V746-N750 VanDerWaalsContact O-CB 3.29Å; V746-N750 WeakPolarHBondContact O-CB 3.09Å; V746-N750 PolarHBondContact O-N 3.17Å; V746-N750 PolarHBondContact O-ND2 2.96Å; L748-N750 VanDerWaalsContact C-N 3.25Å; L748-N750 PolarHBondContact O-N 3.27Å; N750-T752 HydrophobicContact CB-CG2 4.01Å; N750-T752 PolarHBondContact O-N 2.84Å; N750-C790 WeakPolarHBondContact OD1-CB 3.45Å; N750-C790 PolarHBondContact OD1-SG 3.04Å
751	N	75.6	Confident	72.2	Confident	71 Å²	71	58 Å²	58	38%	0.38	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	38	-169.3	-51.4	-64.7	0	0	0	112.8	A747 L748 F749 R774	A747-N751 PolarHBondContact O-N 2.83Å; L748-N751 PolarHBondContact O-N 3.47Å; F749-N751 VanDerWaalsContact C-N 3.35Å; N751-R774 PolarHBondContact ND2-N 2.87Å; N751-R774 PolarHBondContact ND2-O 2.86Å; N751-R774 PolarHBondContact OD1-N 3.45Å
752	T	77.5	Confident	70	Confident	88 Å²	88	62 Å²	62	54%	0.54	36%	0.362	S	S	.	.			trans	-113.6	19.1	-179.8	53.1	0	0	0	0	112.4	A747 N750	A747-T752 WeakPolarHBondContact CA-OG1 3.45Å; A747-T752 PolarHBondContact O-N 3.46Å; A747-T752 PolarHBondContact O-OG1 3.08Å; N750-T752 HydrophobicContact CB-CG2 4.01Å; N750-T752 PolarHBondContact O-N 2.84Å
753	L	71.2	Confident	68	Low	29 Å²	29	65.5 Å²	65.5	15%	0.152	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-56.2	133.4	172.5	-73.1	162.8	0	0	0	109.2	F668 A747 L748 S755	F668-L753 HydrophobicContact CB-CD2 4.05Å; F668-L753 HydrophobicContact CD1-CB 4.3Å; F668-L753 HydrophobicContact CD2-CB 3.86Å; F668-L753 HydrophobicContact CD2-CD1 3.57Å; F668-L753 HydrophobicContact CD2-CD2 4.06Å; F668-L753 HydrophobicContact CD2-CG 4.03Å; F668-L753 HydrophobicContact CE1-CB 4.44Å; F668-L753 HydrophobicContact CE2-CB 4.05Å; F668-L753 HydrophobicContact CE2-CD1 3.77Å; F668-L753 HydrophobicContact CE2-CG 4.44Å; F668-L753 HydrophobicContact CG-CB 4.02Å; F668-L753 HydrophobicContact CG-CD1 4.43Å; F668-L753 HydrophobicContact CG-CD2 4.19Å; F668-L753 HydrophobicContact CG-CG 4.43Å; F668-L753 HydrophobicContact CZ-CB 4.32Å; A747-L753 HydrophobicContact CB-CD2 4Å; A747-L753 HydrophobicContact CB-CG 4.42Å; A747-L753 PolarHBondContact O-N 3.17Å; L748-L753 HydrophobicContact CB-CD1 4.05Å; L748-L753 HydrophobicContact CB-CD2 4.39Å; L748-L753 HydrophobicContact CB-CG 4.35Å; L748-L753 HydrophobicContact CD1-CD1 3.52Å; L748-L753 HydrophobicContact CG-CD1 4.38Å; L753-S755 PolarHBondContact O-N 2.83Å
754	P	63.3	Low	65.9	Low	79 Å²	79	63.3 Å²	63.3	51%	0.513	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-59.3	136.5	-176.3	22.5	-31.1	0	0	0	110	F668 A756	F668-P754 WeakPolarHBondContact CD1-O 3.43Å; F668-P754 WeakPolarHBondContact CE1-O 3.5Å; P754-A756 PolarHBondContact O-N 3.48Å; P754-A756 VanDerWaalsContact O-N 3.12Å
755	S	55.7	Low	64	Low	97 Å²	97	68.7 Å²	68.7	68%	0.678	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-57.6	118.7	164.2	38.5	0	0	0	0	107.3	L753 E757	L753-S755 PolarHBondContact O-N 2.83Å; S755-E757 PolarHBondContact O-N 3.29Å
756	A	51.1	Low	62.4	Low	28 Å²	28	68.9 Å²	68.9	23%	0.231	40%	0.398	C	S	.	.			trans	-53.7	99.9	-165.8	0	0	0	0	0	112.3	P754 I758 L768	P754-A756 PolarHBondContact O-N 3.48Å; P754-A756 VanDerWaalsContact O-N 3.12Å; A756-I758 HydrophobicContact CB-CB 4.25Å; A756-I758 HydrophobicContact CB-CD1 4.04Å; A756-I758 HydrophobicContact CB-CG1 4.04Å; A756-I758 PolarHBondContact O-N 2.74Å; A756-L768 HydrophobicContact CB-CD1 3.75Å; A756-L768 HydrophobicContact CB-CD2 3.76Å; A756-L768 HydrophobicContact CB-CG 4.26Å
757	E	47	Very low	61.4	Low	185 Å²	185	72.6 Å²	72.6	86%	0.864	41%	0.412	S	S	*	.			trans	-77.2	1.2	161.6	-65.8	-176.4	170.3	0	0	111	S755 V759	S755-E757 PolarHBondContact O-N 3.29Å; E757-V759 PolarHBondContact O-N 3.01Å
758	I	50.3	Low	60.4	Low	18 Å²	18	74.8 Å²	74.8	9%	0.092	42%	0.421	C	S	.	.	S	Bend	trans	-58.3	-21.7	-170.4	-58.7	176.3	0	0	0	113	T667 E670 M673 F687 A756	T667-I758 WeakPolarHBondContact O-CD1 3.43Å; E670-I758 HydrophobicContact CB-CG1 4.18Å; E670-I758 HydrophobicContact CB-CG2 4.14Å; E670-I758 HydrophobicContact CG-CG2 4.13Å; M673-I758 HydrophobicContact CB-CG2 4.35Å; F687-I758 HydrophobicContact CZ-CG2 4.42Å; A756-I758 HydrophobicContact CB-CB 4.25Å; A756-I758 HydrophobicContact CB-CD1 4.04Å; A756-I758 HydrophobicContact CB-CG1 4.04Å; A756-I758 PolarHBondContact O-N 2.74Å
759	V	49.6	Very low	59.9	Low	31 Å²	31	75.6 Å²	75.6	19%	0.188	42%	0.424	C	S	.	.	S	Bend	trans	-137	133.3	-179.1	-173.6	0	0	0	0	109.3	I677 F687 E757 L763	I677-V759 HydrophobicContact CD1-CG2 4.09Å; F687-V759 HydrophobicContact CE2-CG2 3.82Å; F687-V759 HydrophobicContact CZ-CG2 3.75Å; E757-V759 PolarHBondContact O-N 3.01Å; V759-L763 HydrophobicContact CG1-CB 3.67Å; V759-L763 HydrophobicContact CG1-CD2 4.11Å; V759-L763 HydrophobicContact CG1-CG 4.42Å
760	E	50.4	Low	59.4	Low	141 Å²	141	75 Å²	75	66%	0.659	43%	0.425	S	S	*	.			trans	-43	127.9	173.7	-133.5	176.1	-163.3	0	0	110.5	A762 L763	E760-A762 PolarHBondContact O-N 2.96Å; E760-L763 PolarHBondContact O-N 3.22Å
761	P	45.7	Very low	59.3	Low	112 Å²	112	74.3 Å²	74.3	73%	0.727	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-58.9	-21.3	-175.1	19	-30.8	0	0	0	113.3	L763 L764	P761-L763 VanDerWaalsContact C-N 3.31Å; P761-L763 PolarHBondContact O-N 3.21Å; P761-L764 WeakPolarHBondContact O-CB 3.26Å; P761-L764 PolarHBondContact O-N 3.2Å; P761-L764 VanDerWaalsContact O-N 3.08Å
762	A	45.9	Very low	59.6	Low	92 Å²	92	71.3 Å²	71.3	76%	0.76	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-67.5	-25.7	175.7	0	0	0	0	0	114	E760 L764	E760-A762 PolarHBondContact O-N 2.96Å; A762-L764 VanDerWaalsContact C-N 3.25Å
763	L	48.1	Very low	59.4	Low	89 Å²	89	69.1 Å²	69.1	47%	0.466	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-78.8	-10.4	171.4	-105.2	92.7	0	0	0	112.5	N682 V759 E760 P761 N765	N682-L763 HydrophobicContact CB-CD2 4.36Å; V759-L763 HydrophobicContact CG1-CB 3.67Å; V759-L763 HydrophobicContact CG1-CD2 4.11Å; V759-L763 HydrophobicContact CG1-CG 4.42Å; E760-L763 PolarHBondContact O-N 3.22Å; P761-L763 VanDerWaalsContact C-N 3.31Å; P761-L763 PolarHBondContact O-N 3.21Å; L763-N765 PolarHBondContact O-N 3.49Å
764	L	46.5	Very low	59.6	Low	80 Å²	80	69 Å²	69	42%	0.419	39%	0.391	S	S	.	.			trans	-100.4	78.6	-162.7	-156.1	84.5	0	0	0	112.8	P761 A762 A766	P761-L764 WeakPolarHBondContact O-CB 3.26Å; P761-L764 PolarHBondContact O-N 3.2Å; P761-L764 VanDerWaalsContact O-N 3.08Å; A762-L764 VanDerWaalsContact C-N 3.25Å; L764-A766 HydrophobicContact CD1-CB 4.06Å; L764-A766 WeakPolarHBondContact CD2-O 3.05Å; L764-A766 WeakPolarHBondContact CG-O 3.38Å
765	N	49.8	Very low	59.2	Low	156 Å²	156	68.7 Å²	68.7	83%	0.834	39%	0.389	S	S	*	.			trans	-79.7	-10	149.1	-81.9	-19.1	0	0	0	111.6	L763	L763-N765 PolarHBondContact O-N 3.49Å
766	A	56.8	Low	59	Low	7 Å²	7	67.9 Å²	67.9	6%	0.058	38%	0.377	C	S	.	.			trans	-77.5	147.8	-178.9	0	0	0	0	0	112.5	Q684 E685 L764	Q684-A766 HydrophobicContact CB-CB 4.28Å; Q684-A766 WeakPolarHBondContact O-CB 3.43Å; E685-A766 CarbonylContact O-C 3.59Å; E685-A766 VanDerWaalsContact O-CA 3.3Å; E685-A766 WeakPolarHBondContact O-CA 3.49Å; L764-A766 HydrophobicContact CD1-CB 4.06Å; L764-A766 WeakPolarHBondContact CD2-O 3.05Å; L764-A766 WeakPolarHBondContact CG-O 3.38Å
767	K	66.1	Low	58.5	Low	106 Å²	106	71.4 Å²	71.4	46%	0.461	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	145.1	171.2	-75.5	-179.2	169.7	-174.4	0	110.3	L71 E685 I686 F687	L71-K767 HydrophobicContact CD1-CB 4.41Å; L71-K767 HydrophobicContact CD1-CD 3.47Å; L71-K767 VanDerWaalsContact CD1-CD 3.47Å; L71-K767 HydrophobicContact CD2-CB 3.81Å; L71-K767 HydrophobicContact CD2-CD 3.93Å; L71-K767 HydrophobicContact CG-CD 4.37Å; E685-K767 PolarHBondContact O-N 3.15Å; I686-K767 CarbonylContact C-O 3.55Å; I686-K767 WeakPolarHBondContact CA-O 3.5Å; F687-K767 PolarHBondContact N-O 2.68Å
768	L	65.9	Low	57.8	Low	61 Å²	61	64.4 Å²	64.4	32%	0.319	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	139.1	172.8	-74.7	158.7	0	0	0	110.1	F687 A756	F687-L768 HydrophobicContact CB-CD2 4.04Å; F687-L768 HydrophobicContact CD1-CD2 3.67Å; F687-L768 HydrophobicContact CG-CD2 4.28Å; A756-L768 HydrophobicContact CB-CD1 3.75Å; A756-L768 HydrophobicContact CB-CD2 3.76Å; A756-L768 HydrophobicContact CB-CG 4.26Å
769	R	75.4	Confident	56.8	Low	17 Å²	17	68.9 Å²	68.9	6%	0.064	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-60.6	137.6	169	175.5	-178.1	165.9	173.8	-8.6	109.1	Y70 L74 V90 E95 I686 F687 Q688 V771	Y70-R769 HydrophobicContact CD1-CG 3.94Å; Y70-R769 HydrophobicContact CE1-CG 4.24Å; L74-R769 HydrophobicContact CD2-CG 4.25Å; V90-R769 PolarHBondContact O-NH1 2.9Å; V90-R769 PolarHBondContact O-NH2 3.37Å; E95-R769 IonicContact OE1-NH1 3.63Å; E95-R769 PolarHBondContact OE1-NH1 3.12Å; I686-R769 HydrophobicContact CG2-CB 3.89Å; F687-R769 PolarHBondContact O-N 3.37Å; Q688-R769 HydrophobicContact CB-CB 4.34Å; Q688-R769 VanDerWaalsContact CD-NH1 3.29Å; R769-V771 PolarHBondContact O-N 3.11Å
770	P	73.1	Confident	55.8	Low	33 Å²	33	69.5 Å²	69.5	21%	0.214	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-57.9	121.6	169.4	-26.4	37.2	0	0	0	111.8	Y70 P75	Y70-P770 VanDerWaalsContact O-CD 3.29Å; Y70-P770 WeakPolarHBondContact O-CD 3.48Å; Y70-P770 VanDerWaalsContact O-CG 3.31Å; Y70-P770 WeakPolarHBondContact O-CG 3.43Å; P75-P770 HydrophobicContact CG-CB 3.89Å; P75-P770 HydrophobicContact CG-CG 3.65Å
771	V	80	Confident	55.2	Low	41 Å²	41	71.6 Å²	71.6	25%	0.248	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-71.9	136.9	174.8	178.7	0	0	0	0	108.6	F668 R769 P773	F668-V771 HydrophobicContact CE2-CG2 3.63Å; F668-V771 HydrophobicContact CZ-CG2 3.77Å; R769-V771 PolarHBondContact O-N 3.11Å; V771-P773 WeakPolarHBondContact O-CD 3.39Å
772	M	81.7	Confident	54.6	Low	7 Å²	7	73.1 Å²	73.1	3%	0.034	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-57.5	123.8	173.9	-179.7	69.2	-168.2	0	0	109.2	Q78 L82 E87 R774	Q78-M772 HydrophobicContact CB-SD 3.68Å; Q78-M772 HydrophobicContact CG-SD 3.59Å; Q78-M772 VanDerWaalsContact CG-SD 3.59Å; L82-M772 HydrophobicContact CB-CE 4.06Å; L82-M772 HydrophobicContact CD1-CE 4.15Å; E87-M772 HydrophobicContact CG-CG 4.13Å; M772-R774 PolarHBondContact O-N 3.29Å; M772-R774 PolarHBondContact O-NH1 2.95Å
773	P	74.8	Confident	53.8	Low	43 Å²	43	71.9 Å²	71.9	28%	0.279	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-63.4	123.4	175.7	-20	31.6	0	0	0	110.3	L82 V771 P775	L82-P773 HydrophobicContact CD2-CB 4.26Å; V771-P773 WeakPolarHBondContact O-CD 3.39Å; P773-P775 WeakPolarHBondContact O-CD 3.42Å
774	R	74.1	Confident	52.8	Low	25 Å²	25	77.4 Å²	77.4	9%	0.094	42%	0.423	C	S	.	.			trans	-118.5	66.4	177.1	-64.7	176.9	-173.9	92.5	-4.2	110.1	E87 D664 N751 M772 L776	E87-R774 IonicContact OE1-CZ 3.26Å; E87-R774 IonicContact OE1-NE 2.63Å; E87-R774 IonicContact OE1-NH2 3.25Å; E87-R774 PolarHBondContact OE1-NH2 3.09Å; D664-R774 IonicContact OD2-CZ 3Å; D664-R774 VanDerWaalsContact OD2-CZ 3.25Å; D664-R774 IonicContact OD2-NH1 2.81Å; D664-R774 PolarHBondContact OD2-NH1 3.47Å; D664-R774 IonicContact OD2-NH2 2.91Å; D664-R774 PolarHBondContact OD2-NH2 2.83Å; N751-R774 PolarHBondContact ND2-N 2.87Å; N751-R774 PolarHBondContact ND2-O 2.86Å; N751-R774 PolarHBondContact OD1-N 3.45Å; M772-R774 PolarHBondContact O-N 3.29Å; M772-R774 PolarHBondContact O-NH1 2.95Å; R774-L776 PolarHBondContact O-N 3.08Å
775	P	56.2	Low	51.8	Low	73 Å²	73	77.7 Å²	77.7	47%	0.474	44%	0.436	S	S	.	.			trans	-64.7	112.8	177	26.1	-30.9	0	0	0	108.2	L82 P773 V777	L82-P775 HydrophobicContact CD2-CG 4.48Å; P773-P775 WeakPolarHBondContact O-CD 3.42Å; P775-V777 VanDerWaalsContact C-N 3.3Å; P775-V777 PolarHBondContact O-N 3.45Å
776	L	50.8	Low	50.7	Low	80 Å²	80	72.5 Å²	72.5	42%	0.419	42%	0.416	S	S	.	.			trans	-61.4	97.4	164.3	-78.2	170.9	0	0	0	107.9	F749 R774 C778 C790	F749-L776 HydrophobicContact CB-CD1 3.91Å; F749-L776 HydrophobicContact CB-CG 4.26Å; R774-L776 PolarHBondContact O-N 3.08Å; L776-C778 VanDerWaalsContact C-N 3.27Å; L776-C778 PolarHBondContact O-N 3.28Å; L776-C790 HydrophobicContact CD1-CB 4.39Å
777	V	41.4	Very low	49.3	Very low	102 Å²	102	76.4 Å²	76.4	62%	0.618	45%	0.448	S	S	*	.			trans	-75.9	88.1	169.6	-174	0	0	0	0	106.7	P775 T779 A785	P775-V777 VanDerWaalsContact C-N 3.3Å; P775-V777 PolarHBondContact O-N 3.45Å; V777-T779 HydrophobicContact CG1-CG2 4.29Å; V777-T779 PolarHBondContact O-N 2.92Å; V777-A785 HydrophobicContact CG1-CB 4.46Å
778	C	32.1	Very low	47.4	Very low	39 Å²	39	83.2 Å²	83.2	26%	0.264	47%	0.47	S	S	.	.			trans	-66.7	102.7	165.3	-73.9	0	0	0	0	107.8	L776 S780 A785 A786	L776-C778 VanDerWaalsContact C-N 3.27Å; L776-C778 PolarHBondContact O-N 3.28Å; C778-S780 PolarHBondContact O-N 2.99Å; C778-A785 CarbonylContact O-C 3.53Å; C778-A785 WeakPolarHBondContact O-CA 3.41Å; C778-A786 WeakPolarHBondContact CB-O 3.47Å; C778-A786 PolarHBondContact O-N 2.94Å
779	T	28.9	Very low	45.6	Very low	111 Å²	111	82.6 Å²	82.6	68%	0.681	48%	0.479	S	S	*	.	B	Isolated β-bridge	trans	-73.4	110.5	164	48.2	0	0	0	0	107.2	V777	V777-T779 HydrophobicContact CG1-CG2 4.29Å; V777-T779 PolarHBondContact O-N 2.92Å
780	S	27.3	Very low	43.5	Very low	44 Å²	44	83 Å²	83	31%	0.308	48%	0.484	S	S	.	.			trans	-65.5	155.1	159.4	60.9	0	0	0	0	108.4	C778 D782 G783 R784	C778-S780 PolarHBondContact O-N 2.99Å; S780-D782 PolarHBondContact O-N 3.14Å; S780-G783 PolarHBondContact O-N 3.38Å; S780-R784 PolarHBondContact N-O 3.25Å; S780-R784 PolarHBondContact OG-N 3.35Å; S780-R784 PolarHBondContact OG-O 2.83Å
781	H	37.6	Very low	41.3	Very low	186 Å²	186	84.2 Å²	84.2	86%	0.861	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-18.5	176.5	-102.2	-72.1	0	0	0	113.7
782	D	35.2	Very low	38.9	Very low	143 Å²	143	90.4 Å²	90.4	77%	0.765	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	15.3	176.7	-66.1	-18	0	0	0	114	S780 R784	S780-D782 PolarHBondContact O-N 3.14Å; D782-R784 PolarHBondContact O-N 3.02Å
783	G	28.3	Very low	36.3	Very low	67 Å²	67	98.6 Å²	98.6	69%	0.691	56%	0.559	S	S	*	*	S	Bend	trans	67.6	9.2	176	0	0	0	0	0	114.8	S780	S780-G783 PolarHBondContact O-N 3.38Å
784	R	26.8	Very low	34.2	Very low	205 Å²	205	98.1 Å²	98.1	77%	0.774	55%	0.554	S	S	*	*			trans	-97.7	123	175.6	-69.7	-176.4	178.1	179.7	0.4	110.2	S780 D782 A786	S780-R784 PolarHBondContact N-O 3.25Å; S780-R784 PolarHBondContact OG-N 3.35Å; S780-R784 PolarHBondContact OG-O 2.83Å; D782-R784 PolarHBondContact O-N 3.02Å; R784-A786 PolarHBondContact O-N 2.79Å
785	A	25.8	Very low	32.1	Very low	85 Å²	85	101.6 Å²	101.6	70%	0.702	57%	0.572	S	S	*	*	B	Isolated β-bridge	trans	-57.1	114.5	176.6	0	0	0	0	0	110.7	V777 C778	V777-A785 HydrophobicContact CG1-CB 4.46Å; C778-A785 CarbonylContact O-C 3.53Å; C778-A785 WeakPolarHBondContact O-CA 3.41Å
786	A	26.6	Very low	30.9	Very low	48 Å²	48	99.1 Å²	99.1	40%	0.397	56%	0.557	S	S	.	*			trans	-118.8	91.3	-174.8	0	0	0	0	0	111.2	C778 R784 R788	C778-A786 WeakPolarHBondContact CB-O 3.47Å; C778-A786 PolarHBondContact O-N 2.94Å; R784-A786 PolarHBondContact O-N 2.79Å; A786-R788 PolarHBondContact O-N 3.05Å
787	A	26.9	Very low	30.1	Very low	89 Å²	89	98.9 Å²	98.9	74%	0.736	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	15.6	-172.7	0	0	0	0	0	117.4
788	R	26.5	Very low	29.3	Very low	248 Å²	248	103 Å²	103	94%	0.936	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	6.9	-172.2	-76.9	-171.6	178.2	176.8	0.5	116.5	A786	A786-R788 PolarHBondContact O-N 3.05Å
789	G	27.6	Very low	29	Very low	48 Å²	48	105.6 Å²	105.6	50%	0.495	58%	0.576	S	S	.	*			trans	-87.3	-2.5	-175.7	0	0	0	0	0	117.5	A791	G789-A791 VanDerWaalsContact C-N 3.34Å; G789-A791 PolarHBondContact O-N 2.92Å
790	C	32.4	Very low	28.8	Very low	25 Å²	25	107 Å²	107	17%	0.169	58%	0.579	C	S	.	*	T	Hydrogen-bonded Turn	trans	-63.8	-17.3	-154.5	-65.1	0	0	0	0	118.4	N750 L776 Q792	N750-C790 WeakPolarHBondContact OD1-CB 3.45Å; N750-C790 PolarHBondContact OD1-SG 3.04Å; L776-C790 HydrophobicContact CD1-CB 4.39Å; C790-Q792 PolarHBondContact O-N 2.77Å
791	A	27.3	Very low	28.6	Very low	60 Å²	60	113 Å²	113	50%	0.496	60%	0.602	S	S	.	*	H	α-helix	trans	-77	-19.4	-172.5	0	0	0	0	0	114.4	G789 M795	G789-A791 VanDerWaalsContact C-N 3.34Å; G789-A791 PolarHBondContact O-N 2.92Å; A791-M795 HydrophobicContact CB-CE 4.11Å; A791-M795 WeakPolarHBondContact O-CB 3.46Å; A791-M795 WeakPolarHBondContact O-CE 3.42Å; A791-M795 WeakPolarHBondContact O-CG 3.48Å
792	Q	27.8	Very low	28	Very low	171 Å²	171	112.1 Å²	112.1	80%	0.799	63%	0.627	S	S	*	*	H	α-helix	trans	-95	-28	-166	-123.1	168.6	-15.9	0	0	115.1	C790	C790-Q792 PolarHBondContact O-N 2.77Å
793	F	27.5	Very low	27.7	Very low	178 Å²	178	110.6 Å²	110.6	78%	0.781	62%	0.62	S	S	*	*	H	α-helix	trans	-77.5	-39.3	-176.3	-123.1	-93.5	0	0	0	112.8	S796	F793-S796 PolarHBondContact O-OG 3.21Å; F793-S796 VanDerWaalsContact O-OG 3.08Å
794	I	31.8	Very low	27.6	Very low	34 Å²	34	112.9 Å²	112.9	17%	0.174	62%	0.617	C	S	.	*	H	α-helix	trans	-77.7	-34.1	178.9	-60	168.5	0	0	0	111	L745 V746 F749 S796	L745-I794 HydrophobicContact CB-CG2 4.4Å; V746-I794 HydrophobicContact CG2-CB 4.19Å; V746-I794 HydrophobicContact CG2-CD1 3.89Å; V746-I794 HydrophobicContact CG2-CG2 4.06Å; F749-I794 HydrophobicContact CB-CD1 4.17Å; F749-I794 HydrophobicContact CD2-CD1 3.59Å; F749-I794 HydrophobicContact CD2-CG1 4.48Å; F749-I794 HydrophobicContact CE2-CD1 4.42Å; F749-I794 HydrophobicContact CG-CD1 4.22Å; I794-S796 PolarHBondContact O-N 2.95Å; I794-S796 VanDerWaalsContact O-N 3.1Å
795	M	28.8	Very low	27.7	Very low	97 Å²	97	107.8 Å²	107.8	48%	0.478	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.5	16.8	178.2	-71.9	-149.8	-89.4	0	0	115.1	A791 H797 R798	A791-M795 HydrophobicContact CB-CE 4.11Å; A791-M795 WeakPolarHBondContact O-CB 3.46Å; A791-M795 WeakPolarHBondContact O-CE 3.42Å; A791-M795 WeakPolarHBondContact O-CG 3.48Å; M795-H797 PolarHBondContact O-N 3.44Å; M795-R798 PolarHBondContact O-N 3.18Å
796	S	31.7	Very low	27.8	Very low	22 Å²	22	109.1 Å²	109.1	15%	0.154	60%	0.602	C	S	.	*	T	Hydrogen-bonded Turn	trans	-68.5	-1.2	178	57.7	0	0	0	0	114.6	I508 R654 F793 I794 R798	I508-S796 WeakPolarHBondContact CD1-O 3.47Å; R654-S796 PolarHBondContact NH1-OG 3.29Å; F793-S796 PolarHBondContact O-OG 3.21Å; F793-S796 VanDerWaalsContact O-OG 3.08Å; I794-S796 PolarHBondContact O-N 2.95Å; I794-S796 VanDerWaalsContact O-N 3.1Å; S796-R798 PolarHBondContact O-N 3.48Å
797	H	33.2	Very low	27.9	Very low	75 Å²	75	112.9 Å²	112.9	35%	0.347	62%	0.615	S	S	.	*			trans	-93.3	57.3	163.3	-89.8	-69.1	0	0	0	111.9	M795	M795-H797 PolarHBondContact O-N 3.44Å
798	R	25	Very low	27.9	Very low	188 Å²	188	114.5 Å²	114.5	71%	0.709	61%	0.607	S	S	*	*			trans	-86	108.7	161.5	-100.3	-171.8	177.9	-173.4	0.1	109	M795 S796	M795-R798 PolarHBondContact O-N 3.18Å; S796-R798 PolarHBondContact O-N 3.48Å
799	C	26.2	Very low	28	Very low	94 Å²	94	105 Å²	105	64%	0.635	58%	0.584	S	S	*	*			trans	48.9	88.3	149.2	-53.5	0	0	0	0	116.4
800	D	24.7	Very low	28.1	Very low	139 Å²	139	109.4 Å²	109.4	74%	0.743	59%	0.591	S	S	*	*			trans	-84.9	82.6	131.7	-78.2	-44.6	0	0	0	106.1
801	E	23	Very low	27.7	Very low	170 Å²	170	116.4 Å²	116.4	79%	0.794	63%	0.626	S	S	*	*			trans	-85.3	100.6	152.1	-84.1	-175.9	164.8	0	0	106.2
802	A	25.7	Very low	27.8	Very low	169 Å²	169	121.5 Å²	121.5	100%	1.397	64%	0.637	S	S	*	*			trans	-141.5	0	150.7	0	0	0	0	0	107.7

Retrieved 802 of 802 residues in 1975 ms (Link to these results)

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