A0A096NAE1_PAPAN Loading...

BMP/retinoic acid inducible neural specific 3

AlphaFold DB , UniProt , Accession A0A096NAE1, Species PAPAN (Papio anubis, Olive baboon), Gene BRINP3, Length 766 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.8	Very low	38.4	Very low	237 Å²	237	156.8 Å²	156.8	100%	1.167	79%	0.788	S	S	*	*				0	152.8	0	-78.2	-179.8	-174.6	0	0	108.2
2	I	34.2	Very low	39.3	Very low	164 Å²	164	157.7 Å²	157.7	84%	0.841	78%	0.783	S	S	*	*			trans	106.3	83.5	-174.6	-56.4	155.6	0	0	0	110.4
3	W	33.2	Very low	40.1	Very low	256 Å²	256	150.8 Å²	150.8	97%	0.97	76%	0.76	S	S	*	*			trans	-163.1	85	149.9	-110.8	80.3	0	0	0	105.9
4	R	36.5	Very low	40.8	Very low	252 Å²	252	148.6 Å²	148.6	95%	0.951	75%	0.75	S	S	*	*			trans	176.9	82.9	164.3	-103.5	176.6	-175.3	-163.2	1.8	109.1
5	S	38.7	Very low	41.2	Very low	115 Å²	115	146.4 Å²	146.4	80%	0.804	74%	0.738	S	S	*	*	S	Bend	trans	-162.8	15.1	162.9	-151.3	0	0	0	0	115.5
6	R	38.3	Very low	41.8	Very low	233 Å²	233	139.9 Å²	139.9	88%	0.879	72%	0.715	S	S	*	*	S	Bend	trans	-108.3	-17.4	-179.4	-91.1	-175.9	174.1	176.9	-2.5	115.8
7	A	37.8	Very low	42.3	Very low	88 Å²	88	137.5 Å²	137.5	73%	0.727	70%	0.703	S	S	*	*	H	α-helix	trans	-83.8	-19.5	-179.2	0	0	0	0	0	114.3
8	G	39.2	Very low	42.6	Very low	42 Å²	42	141 Å²	141	43%	0.433	71%	0.706	S	S	.	*	H	α-helix	trans	-77.6	-36.5	178.6	0	0	0	0	0	113.3	E10 L11 F12	G8-E10 PolarHBondContact O-N 3.44Å; G8-L11 PolarHBondContact O-N 3.31Å; G8-F12 VanDerWaalsContact O-CD2 3.29Å; G8-F12 WeakPolarHBondContact O-CD2 2.69Å; G8-F12 PolarHBondContact O-N 2.9Å; G8-F12 VanDerWaalsContact O-N 3.16Å
9	A	40.9	Very low	42.7	Very low	68 Å²	68	140.4 Å²	140.4	56%	0.562	70%	0.701	S	S	*	*	H	α-helix	trans	-69.5	-35.5	-173.8	0	0	0	0	0	113.1	S13	A9-S13 WeakPolarHBondContact O-CB 3.14Å; A9-S13 PolarHBondContact O-N 3.36Å; A9-S13 VanDerWaalsContact O-N 3.07Å
10	E	42.3	Very low	43	Very low	144 Å²	144	143.5 Å²	143.5	67%	0.673	70%	0.704	S	S	*	*	H	α-helix	trans	-72.5	-34	177.2	-69.4	-163.6	166.1	0	0	112.5	G8 S13 L14	G8-E10 PolarHBondContact O-N 3.44Å; E10-S13 PolarHBondContact O-N 3.02Å; E10-L14 WeakPolarHBondContact O-CB 3.31Å; E10-L14 PolarHBondContact O-N 3.15Å
11	L	46.1	Very low	43.4	Very low	126 Å²	126	140.5 Å²	140.5	66%	0.66	69%	0.69	S	S	*	*	H	α-helix	trans	-70.2	-39.7	177.8	-139.4	97.4	0	0	0	111.9	G8 M15	G8-L11 PolarHBondContact O-N 3.31Å; L11-M15 WeakPolarHBondContact O-CB 3.43Å; L11-M15 VanDerWaalsContact O-CG 3.27Å; L11-M15 WeakPolarHBondContact O-CG 3.03Å; L11-M15 PolarHBondContact O-N 3.47Å
12	F	48.8	Very low	44	Very low	167 Å²	167	131.4 Å²	131.4	73%	0.732	65%	0.653	S	S	*	*	H	α-helix	trans	-69.4	-34	174.7	-85.3	-74.4	0	0	0	112.4	G8 A16	G8-F12 VanDerWaalsContact O-CD2 3.29Å; G8-F12 WeakPolarHBondContact O-CD2 2.69Å; G8-F12 PolarHBondContact O-N 2.9Å; G8-F12 VanDerWaalsContact O-N 3.16Å; F12-A16 VanDerWaalsContact O-CB 3.3Å; F12-A16 WeakPolarHBondContact O-CB 3.4Å; F12-A16 PolarHBondContact O-N 3.41Å
13	S	50.1	Low	44.7	Very low	69 Å²	69	129 Å²	129	48%	0.483	64%	0.641	S	S	.	*	H	α-helix	trans	-70.1	-36.8	176.1	-167.1	0	0	0	0	112.4	A9 E10 L17	A9-S13 WeakPolarHBondContact O-CB 3.14Å; A9-S13 PolarHBondContact O-N 3.36Å; A9-S13 VanDerWaalsContact O-N 3.07Å; E10-S13 PolarHBondContact O-N 3.02Å; S13-L17 WeakPolarHBondContact O-CB 3.37Å; S13-L17 PolarHBondContact O-N 3.19Å
14	L	49.3	Very low	45.2	Very low	119 Å²	119	119.7 Å²	119.7	62%	0.623	62%	0.615	S	S	*	*	H	α-helix	trans	-69.1	-38.5	174.5	-89.2	153	0	0	0	112.4	E10 W18	E10-L14 WeakPolarHBondContact O-CB 3.31Å; E10-L14 PolarHBondContact O-N 3.15Å; L14-W18 PolarHBondContact O-N 2.65Å; L14-W18 VanDerWaalsContact O-N 3.08Å
15	M	47	Very low	45.5	Very low	116 Å²	116	112.6 Å²	112.6	57%	0.571	60%	0.595	S	S	*	*	H	α-helix	trans	-67.1	-41	174.1	-73	-80.3	-72.9	0	0	112.1	L11 W18 E19	L11-M15 WeakPolarHBondContact O-CB 3.43Å; L11-M15 VanDerWaalsContact O-CG 3.27Å; L11-M15 WeakPolarHBondContact O-CG 3.03Å; L11-M15 PolarHBondContact O-N 3.47Å; M15-W18 PolarHBondContact O-N 3.4Å; M15-E19 PolarHBondContact O-N 2.98Å
16	A	50.8	Low	45.5	Very low	43 Å²	43	113 Å²	113	36%	0.355	59%	0.585	S	S	.	*	H	α-helix	trans	-67.6	-35.8	176.7	0	0	0	0	0	112.6	F12 W18 E19 W20	F12-A16 VanDerWaalsContact O-CB 3.3Å; F12-A16 WeakPolarHBondContact O-CB 3.4Å; F12-A16 PolarHBondContact O-N 3.41Å; A16-W18 VanDerWaalsContact C-N 3.34Å; A16-E19 PolarHBondContact O-N 3.34Å; A16-W20 WeakPolarHBondContact O-CB 3.4Å; A16-W20 PolarHBondContact O-N 3.05Å
17	L	51.3	Low	45.4	Very low	99 Å²	99	105.9 Å²	105.9	52%	0.518	57%	0.57	S	S	.	*	H	α-helix	trans	-64.8	-38.1	172	-102	146.4	0	0	0	111.7	S13 W20 I21	S13-L17 WeakPolarHBondContact O-CB 3.37Å; S13-L17 PolarHBondContact O-N 3.19Å; L17-W20 PolarHBondContact O-N 3.3Å; L17-I21 WeakPolarHBondContact O-CB 3.35Å; L17-I21 WeakPolarHBondContact O-CD1 3.22Å; L17-I21 WeakPolarHBondContact O-CG1 3.44Å; L17-I21 PolarHBondContact O-N 3.47Å
18	W	46.2	Very low	45.2	Very low	200 Å²	200	111.2 Å²	111.2	76%	0.758	57%	0.571	S	S	*	*	H	α-helix	trans	-71.1	-38.3	175.2	-110.1	31.3	0	0	0	113.3	L14 M15 A16 I21 A22	L14-W18 PolarHBondContact O-N 2.65Å; L14-W18 VanDerWaalsContact O-N 3.08Å; M15-W18 PolarHBondContact O-N 3.4Å; A16-W18 VanDerWaalsContact C-N 3.34Å; W18-I21 PolarHBondContact O-N 2.84Å; W18-A22 VanDerWaalsContact O-CB 3.23Å; W18-A22 WeakPolarHBondContact O-CB 3.43Å; W18-A22 PolarHBondContact O-N 3.21Å
19	E	45.2	Very low	45.1	Very low	129 Å²	129	113.4 Å²	113.4	60%	0.603	58%	0.576	S	S	*	*	H	α-helix	trans	-65.9	-37.6	171.7	-79.9	-170.1	161.9	0	0	112	M15 A16 A22 L23	M15-E19 PolarHBondContact O-N 2.98Å; A16-E19 PolarHBondContact O-N 3.34Å; E19-A22 PolarHBondContact O-N 2.65Å; E19-L23 WeakPolarHBondContact O-CB 3.09Å; E19-L23 WeakPolarHBondContact O-CD1 3.26Å; E19-L23 WeakPolarHBondContact O-CG 3.48Å; E19-L23 PolarHBondContact O-N 2.85Å
20	W	48.1	Very low	44.8	Very low	202 Å²	202	115.9 Å²	115.9	77%	0.765	58%	0.579	S	S	*	*	H	α-helix	trans	-69.8	-36.9	175.2	-86.7	55.1	0	0	0	112.6	A16 L17 S24	A16-W20 WeakPolarHBondContact O-CB 3.4Å; A16-W20 PolarHBondContact O-N 3.05Å; L17-W20 PolarHBondContact O-N 3.3Å; W20-S24 WeakPolarHBondContact O-CB 3.47Å; W20-S24 PolarHBondContact O-N 3.5Å; W20-S24 PolarHBondContact O-OG 3.21Å
21	I	51	Low	44.3	Very low	81 Å²	81	111.5 Å²	111.5	42%	0.415	57%	0.567	S	S	.	*	H	α-helix	trans	-67.2	-44.1	173.2	-69.8	163.6	0	0	0	109.7	L17 W18 S24 L25	L17-I21 WeakPolarHBondContact O-CB 3.35Å; L17-I21 WeakPolarHBondContact O-CD1 3.22Å; L17-I21 WeakPolarHBondContact O-CG1 3.44Å; L17-I21 PolarHBondContact O-N 3.47Å; W18-I21 PolarHBondContact O-N 2.84Å; I21-S24 PolarHBondContact O-N 2.87Å; I21-S24 PolarHBondContact O-OG 2.97Å; I21-L25 HydrophobicContact CG2-CD1 3.72Å; I21-L25 WeakPolarHBondContact O-CB 3.08Å; I21-L25 PolarHBondContact O-N 2.88Å
22	A	48.8	Very low	43.6	Very low	47 Å²	47	110.3 Å²	110.3	39%	0.388	57%	0.565	S	S	.	*	H	α-helix	trans	-66.4	-38.4	176.7	0	0	0	0	0	113	W18 E19 H26	W18-A22 VanDerWaalsContact O-CB 3.23Å; W18-A22 WeakPolarHBondContact O-CB 3.43Å; W18-A22 PolarHBondContact O-N 3.21Å; E19-A22 PolarHBondContact O-N 2.65Å; A22-H26 VanDerWaalsContact O-CB 3.3Å; A22-H26 WeakPolarHBondContact O-CB 3.32Å; A22-H26 PolarHBondContact O-CD2 3.28Å; A22-H26 PolarHBondContact O-N 3.26Å
23	L	48.3	Very low	42.7	Very low	112 Å²	112	105 Å²	105	59%	0.586	55%	0.552	S	S	*	*	H	α-helix	trans	-70.1	-37.2	173.2	-83	157.1	0	0	0	111.4	E19 H26 C27	E19-L23 WeakPolarHBondContact O-CB 3.09Å; E19-L23 WeakPolarHBondContact O-CD1 3.26Å; E19-L23 WeakPolarHBondContact O-CG 3.48Å; E19-L23 PolarHBondContact O-N 2.85Å; L23-H26 PolarHBondContact O-N 3.3Å; L23-C27 WeakPolarHBondContact O-CB 3.23Å; L23-C27 PolarHBondContact O-N 2.76Å
24	S	44.2	Very low	41.7	Very low	62 Å²	62	105 Å²	105	43%	0.434	56%	0.556	S	S	.	*	H	α-helix	trans	-69.9	-36.9	175.1	77.1	0	0	0	0	112.1	W20 I21 C27 W28	W20-S24 WeakPolarHBondContact O-CB 3.47Å; W20-S24 PolarHBondContact O-N 3.5Å; W20-S24 PolarHBondContact O-OG 3.21Å; I21-S24 PolarHBondContact O-N 2.87Å; I21-S24 PolarHBondContact O-OG 2.97Å; S24-C27 PolarHBondContact O-N 2.9Å; S24-W28 VanDerWaalsContact O-CB 3.32Å; S24-W28 WeakPolarHBondContact O-CB 3.06Å; S24-W28 PolarHBondContact O-N 2.85Å
25	L	42.3	Very low	40.7	Very low	102 Å²	102	105.2 Å²	105.2	53%	0.534	56%	0.562	S	S	.	*	H	α-helix	trans	-69.3	-40.6	172.6	-92	147.6	0	0	0	111.3	I21 W28 V29	I21-L25 HydrophobicContact CG2-CD1 3.72Å; I21-L25 WeakPolarHBondContact O-CB 3.08Å; I21-L25 PolarHBondContact O-N 2.88Å; L25-W28 PolarHBondContact O-N 2.94Å; L25-V29 VanDerWaalsContact O-CB 3.28Å; L25-V29 WeakPolarHBondContact O-CB 3.33Å; L25-V29 WeakPolarHBondContact O-CG2 3.32Å; L25-V29 PolarHBondContact O-N 3.29Å
26	H	40.1	Very low	39.8	Very low	124 Å²	124	103.5 Å²	103.5	57%	0.574	56%	0.562	S	S	*	*	H	α-helix	trans	-70	-33.4	173.5	-85.9	-43.6	0	0	0	112.6	A22 L23 V29 L30	A22-H26 VanDerWaalsContact O-CB 3.3Å; A22-H26 WeakPolarHBondContact O-CB 3.32Å; A22-H26 PolarHBondContact O-CD2 3.28Å; A22-H26 PolarHBondContact O-N 3.26Å; L23-H26 PolarHBondContact O-N 3.3Å; H26-V29 PolarHBondContact O-N 3.42Å; H26-L30 WeakPolarHBondContact O-CB 3.43Å; H26-L30 WeakPolarHBondContact O-CD1 3.5Å; H26-L30 VanDerWaalsContact O-CG 3.23Å; H26-L30 WeakPolarHBondContact O-CG 3.49Å; H26-L30 PolarHBondContact O-N 3.4Å
27	C	35.6	Very low	38.6	Very low	84 Å²	84	107.5 Å²	107.5	57%	0.568	58%	0.577	S	S	*	*	H	α-helix	trans	-75.3	-31.9	175.9	-149	0	0	0	0	111.6	L23 S24 A31	L23-C27 WeakPolarHBondContact O-CB 3.23Å; L23-C27 PolarHBondContact O-N 2.76Å; S24-C27 PolarHBondContact O-N 2.9Å; C27-A31 WeakPolarHBondContact O-CB 3.4Å; C27-A31 PolarHBondContact O-N 3.48Å
28	W	33	Very low	37.5	Very low	200 Å²	200	110.5 Å²	110.5	76%	0.758	59%	0.588	S	S	*	*	H	α-helix	trans	-71.7	-39.4	168.5	-90.2	47	0	0	0	112.3	S24 L25 A31 V32	S24-W28 VanDerWaalsContact O-CB 3.32Å; S24-W28 WeakPolarHBondContact O-CB 3.06Å; S24-W28 PolarHBondContact O-N 2.85Å; L25-W28 PolarHBondContact O-N 2.94Å; W28-A31 PolarHBondContact O-N 2.92Å; W28-V32 VanDerWaalsContact O-CB 3.26Å; W28-V32 WeakPolarHBondContact O-CB 3.39Å; W28-V32 WeakPolarHBondContact O-CG2 3.48Å; W28-V32 PolarHBondContact O-N 2.04Å
29	V	38.2	Very low	36.8	Very low	88 Å²	88	109.2 Å²	109.2	53%	0.533	59%	0.591	S	S	.	*	H	α-helix	trans	-69.1	-35.3	174.9	171.2	0	0	0	0	111.2	L25 H26 A33	L25-V29 VanDerWaalsContact O-CB 3.28Å; L25-V29 WeakPolarHBondContact O-CB 3.33Å; L25-V29 WeakPolarHBondContact O-CG2 3.32Å; L25-V29 PolarHBondContact O-N 3.29Å; H26-V29 PolarHBondContact O-N 3.42Å; V29-A33 WeakPolarHBondContact O-CB 3.49Å; V29-A33 PolarHBondContact O-N 2.76Å
30	L	33.7	Very low	36	Very low	120 Å²	120	105.7 Å²	105.7	63%	0.628	58%	0.584	S	S	*	*	H	α-helix	trans	-74.7	-34.2	173.1	-77.4	162.4	0	0	0	112.6	H26 A33 A34	H26-L30 WeakPolarHBondContact O-CB 3.43Å; H26-L30 WeakPolarHBondContact O-CD1 3.5Å; H26-L30 VanDerWaalsContact O-CG 3.23Å; H26-L30 WeakPolarHBondContact O-CG 3.49Å; H26-L30 PolarHBondContact O-N 3.4Å; L30-A33 PolarHBondContact O-N 2.85Å; L30-A34 WeakPolarHBondContact O-CB 3.3Å; L30-A34 PolarHBondContact O-N 2.81Å
31	A	31.7	Very low	35.6	Very low	51 Å²	51	100.6 Å²	100.6	42%	0.421	58%	0.575	S	S	.	*	H	α-helix	trans	-72.7	-35.5	173.5	0	0	0	0	0	112	C27 W28 A34 V35	C27-A31 WeakPolarHBondContact O-CB 3.4Å; C27-A31 PolarHBondContact O-N 3.48Å; W28-A31 PolarHBondContact O-N 2.92Å; A31-A34 PolarHBondContact O-N 3.25Å; A31-V35 WeakPolarHBondContact O-CB 3.27Å; A31-V35 VanDerWaalsContact O-CG2 3.25Å; A31-V35 WeakPolarHBondContact O-CG2 3.46Å; A31-V35 PolarHBondContact O-N 3.3Å
32	V	33	Very low	35.2	Very low	102 Å²	102	99.5 Å²	99.5	62%	0.618	57%	0.574	S	S	*	*	H	α-helix	trans	-71.1	-34	172.1	174	0	0	0	0	110.8	W28 S36	W28-V32 VanDerWaalsContact O-CB 3.26Å; W28-V32 WeakPolarHBondContact O-CB 3.39Å; W28-V32 WeakPolarHBondContact O-CG2 3.48Å; W28-V32 PolarHBondContact O-N 2.04Å; V32-S36 VanDerWaalsContact O-CB 3.25Å; V32-S36 WeakPolarHBondContact O-CB 3.33Å; V32-S36 PolarHBondContact O-N 3.32Å; V32-S36 VanDerWaalsContact O-N 3.14Å
33	A	30	Very low	35	Very low	55 Å²	55	102.1 Å²	102.1	46%	0.455	59%	0.587	S	S	.	*	H	α-helix	trans	-71.3	-36.6	171.3	0	0	0	0	0	112.9	V29 L30 S36	V29-A33 WeakPolarHBondContact O-CB 3.49Å; V29-A33 PolarHBondContact O-N 2.76Å; L30-A33 PolarHBondContact O-N 2.85Å; A33-S36 PolarHBondContact O-N 3.3Å
34	A	28.2	Very low	35.2	Very low	70 Å²	70	103.3 Å²	103.3	58%	0.579	59%	0.588	S	S	*	*	H	α-helix	trans	-77.1	-24.1	179.4	0	0	0	0	0	113.6	L30 A31	L30-A34 WeakPolarHBondContact O-CB 3.3Å; L30-A34 PolarHBondContact O-N 2.81Å; A31-A34 PolarHBondContact O-N 3.25Å
35	V	28.8	Very low	35.7	Very low	122 Å²	122	103 Å²	103	74%	0.739	58%	0.581	S	S	*	*	H	α-helix	trans	-90.2	-15.1	173.3	-179.7	0	0	0	0	112	A31 D37	A31-V35 WeakPolarHBondContact O-CB 3.27Å; A31-V35 VanDerWaalsContact O-CG2 3.25Å; A31-V35 WeakPolarHBondContact O-CG2 3.46Å; A31-V35 PolarHBondContact O-N 3.3Å; V35-D37 PolarHBondContact O-N 3.23Å
36	S	26.5	Very low	36.6	Very low	81 Å²	81	105.6 Å²	105.6	57%	0.566	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-12	171.6	177.9	0	0	0	0	113.8	V32 A33	V32-S36 VanDerWaalsContact O-CB 3.25Å; V32-S36 WeakPolarHBondContact O-CB 3.33Å; V32-S36 PolarHBondContact O-N 3.32Å; V32-S36 VanDerWaalsContact O-N 3.14Å; A33-S36 PolarHBondContact O-N 3.3Å
37	D	26.9	Very low	37.6	Very low	127 Å²	127	101.1 Å²	101.1	68%	0.679	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	12.2	-166.8	-131.3	6.7	0	0	0	115.2	V35	V35-D37 PolarHBondContact O-N 3.23Å
38	Q	27.8	Very low	39	Very low	161 Å²	161	100.7 Å²	100.7	75%	0.752	56%	0.556	S	S	*	*	S	Bend	trans	-102	31.3	171.6	-71.9	-164.5	-3.2	0	0	113.8
39	H	31.7	Very low	40.5	Very low	174 Å²	174	92.9 Å²	92.9	81%	0.806	53%	0.532	S	S	*	.	S	Bend	trans	160.5	49.7	151.3	-84.5	33.8	0	0	0	108.6	T41	H39-T41 PolarHBondContact O-N 2.81Å
40	A	27.8	Very low	41.8	Very low	55 Å²	55	89.8 Å²	89.8	46%	0.455	51%	0.512	S	S	.	.	S	Bend	trans	-51.7	130.2	140.2	0	0	0	0	0	105.4	S42	A40-S42 PolarHBondContact O-N 2.85Å
41	T	39.8	Very low	43.1	Very low	95 Å²	95	86.1 Å²	86.1	58%	0.583	49%	0.491	S	S	*	.			trans	-19.1	122.4	173	37.4	0	0	0	0	110.8	H39	H39-T41 PolarHBondContact O-N 2.81Å
42	S	43.2	Very low	44.8	Very low	57 Å²	57	84 Å²	84	40%	0.399	48%	0.475	S	S	.	.			trans	-46.5	138.3	176.6	95.5	0	0	0	0	107.2	A40 F44 D45	A40-S42 PolarHBondContact O-N 2.85Å; S42-F44 PolarHBondContact O-N 3.07Å; S42-D45 WeakPolarHBondContact CB-OD1 3.43Å; S42-D45 WeakPolarHBondContact O-CB 3.42Å; S42-D45 PolarHBondContact O-N 3.5Å; S42-D45 PolarHBondContact OG-N 3.18Å; S42-D45 PolarHBondContact OG-OD1 2.64Å
43	P	44.6	Very low	46.4	Very low	102 Å²	102	82 Å²	82	66%	0.662	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-13.1	-170.3	-28	33.2	0	0	0	114.6	W46	P43-W46 PolarHBondContact O-NE1 2.98Å
44	F	51.7	Low	48.3	Very low	138 Å²	138	84.5 Å²	84.5	61%	0.605	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	2.6	-176.8	-57.8	-60.3	0	0	0	114.3	S42 W46 L47	S42-F44 PolarHBondContact O-N 3.07Å; F44-W46 PolarHBondContact O-N 2.91Å; F44-L47 HydrophobicContact CB-CD1 3.96Å; F44-L47 HydrophobicContact CD1-CD1 3.69Å; F44-L47 HydrophobicContact CG-CD1 4.25Å; F44-L47 VanDerWaalsContact O-CB 3.26Å; F44-L47 WeakPolarHBondContact O-CB 3.29Å; F44-L47 PolarHBondContact O-N 3.23Å
45	D	54.7	Low	50.3	Low	55 Å²	55	83.6 Å²	83.6	29%	0.294	45%	0.448	S	S	.	.	H	α-helix	trans	-58.8	-34.4	179.6	-95.8	26.3	0	0	0	111.9	S42 L47 L48 S49 K375	S42-D45 WeakPolarHBondContact CB-OD1 3.43Å; S42-D45 WeakPolarHBondContact O-CB 3.42Å; S42-D45 PolarHBondContact O-N 3.5Å; S42-D45 PolarHBondContact OG-N 3.18Å; S42-D45 PolarHBondContact OG-OD1 2.64Å; D45-L47 PolarHBondContact O-N 2.92Å; D45-L48 PolarHBondContact O-N 3.13Å; D45-L48 VanDerWaalsContact O-N 3.17Å; D45-S49 PolarHBondContact O-N 2.72Å; D45-S49 VanDerWaalsContact O-N 3.12Å; D45-K375 IonicContact OD2-NZ 2.82Å; D45-K375 PolarHBondContact OD2-NZ 3.34Å
46	W	61.3	Low	52.3	Low	156 Å²	156	86.2 Å²	86.2	59%	0.591	45%	0.445	S	S	*	.	H	α-helix	trans	-62.4	-28	177.4	73	-89.6	0	0	0	112.7	P43 F44 L48 S49 G52 P53	P43-W46 PolarHBondContact O-NE1 2.98Å; F44-W46 PolarHBondContact O-N 2.91Å; W46-L48 PolarHBondContact O-N 2.85Å; W46-S49 PolarHBondContact O-OG 2.82Å; W46-G52 VanDerWaalsContact O-CA 3.23Å; W46-G52 WeakPolarHBondContact O-CA 3.36Å; W46-P53 HydrophobicContact CZ3-CG 4.24Å
47	L	62.7	Low	54.8	Low	31 Å²	31	84.2 Å²	84.2	16%	0.162	43%	0.431	C	S	.	.	H	α-helix	trans	-67.6	-27.7	178.9	-69.6	169.7	0	0	0	112.8	F44 D45 G52 P53 F54	F44-L47 HydrophobicContact CB-CD1 3.96Å; F44-L47 HydrophobicContact CD1-CD1 3.69Å; F44-L47 HydrophobicContact CG-CD1 4.25Å; F44-L47 VanDerWaalsContact O-CB 3.26Å; F44-L47 WeakPolarHBondContact O-CB 3.29Å; F44-L47 PolarHBondContact O-N 3.23Å; D45-L47 PolarHBondContact O-N 2.92Å; L47-G52 CarbonylContact O-C 3.55Å; L47-G52 WeakPolarHBondContact O-CA 3.39Å; L47-P53 HydrophobicContact CD2-CG 3.65Å; L47-F54 HydrophobicContact CB-CD2 3.84Å; L47-F54 HydrophobicContact CB-CE2 4.24Å; L47-F54 HydrophobicContact CD1-CD2 4.46Å; L47-F54 HydrophobicContact CD1-CE2 4.08Å; L47-F54 HydrophobicContact CD2-CD2 4.15Å; L47-F54 HydrophobicContact CD2-CE2 3.81Å; L47-F54 HydrophobicContact CG-CD2 4.39Å; L47-F54 HydrophobicContact CG-CE2 4.29Å; L47-F54 PolarHBondContact O-N 2.96Å
48	L	64.2	Low	57	Low	75 Å²	75	85.2 Å²	85.2	39%	0.393	43%	0.432	S	S	.	.	H	α-helix	trans	-105.7	-6.9	-176	-57.3	179	0	0	0	113.3	D45 W46 F54 H55 Y60	D45-L48 PolarHBondContact O-N 3.13Å; D45-L48 VanDerWaalsContact O-N 3.17Å; W46-L48 PolarHBondContact O-N 2.85Å; L48-F54 HydrophobicContact CD2-CB 4.2Å; L48-H55 PolarHBondContact O-ND1 3.07Å; L48-Y60 HydrophobicContact CB-CE2 4.32Å; L48-Y60 HydrophobicContact CD1-CE2 4.47Å; L48-Y60 HydrophobicContact CD2-CD2 3.94Å; L48-Y60 HydrophobicContact CD2-CE2 3.87Å; L48-Y60 HydrophobicContact CG-CE2 4.45Å
49	S	65.1	Low	59.2	Low	36 Å²	36	81.7 Å²	81.7	25%	0.252	42%	0.415	S	S	.	.	S	Bend	trans	-56.8	160	172.8	69.3	0	0	0	0	111.7	D45 W46 K51 G52 H55	D45-S49 PolarHBondContact O-N 2.72Å; D45-S49 VanDerWaalsContact O-N 3.12Å; W46-S49 PolarHBondContact O-OG 2.82Å; S49-K51 PolarHBondContact O-N 2.95Å; S49-G52 WeakPolarHBondContact O-CA 3.41Å; S49-G52 PolarHBondContact O-N 2.9Å; S49-G52 PolarHBondContact OG-N 2.98Å; S49-G52 VanDerWaalsContact OG-N 3.17Å; S49-H55 WeakPolarHBondContact O-CB 3.44Å
50	D	63.7	Low	61.3	Low	22 Å²	22	76.3 Å²	76.3	12%	0.118	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-28.7	178.5	-75.5	-20.5	0	0	0	114.5	H55 P292 M294 D295	D50-H55 PolarHBondContact O-CD2 2.77Å; D50-H55 IonicContact OD1-CE1 2.66Å; D50-H55 PolarHBondContact OD1-CE1 2.76Å; D50-H55 IonicContact OD1-ND1 3.65Å; D50-H55 IonicContact OD1-NE2 3.71Å; D50-H55 PolarHBondContact OD1-NE2 2.77Å; D50-P292 HydrophobicContact CB-CB 4.26Å; D50-M294 VanDerWaalsContact OD2-CB 3.31Å; D50-M294 WeakPolarHBondContact OD2-CB 3.43Å; D50-M294 PolarHBondContact OD2-N 3.34Å; D50-M294 VanDerWaalsContact OD2-N 3.15Å; D50-D295 PolarHBondContact N-OD2 3.46Å; D50-D295 PolarHBondContact OD2-N 2.91Å
51	K	62.3	Low	63.8	Low	43 Å²	43	76.2 Å²	76.2	19%	0.187	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	4.2	179.1	-55.2	-158.4	177.2	-141.8	0	113.9	S49 E268 C289	S49-K51 PolarHBondContact O-N 2.95Å; K51-E268 IonicContact NZ-OE2 3.24Å; K51-E268 PolarHBondContact NZ-OE2 2.83Å; K51-C289 VanDerWaalsContact CE-O 3.27Å; K51-C289 WeakPolarHBondContact CE-O 2.98Å; K51-C289 PolarHBondContact NZ-O 3.33Å
52	G	67.6	Low	65.7	Low	7 Å²	7	75.4 Å²	75.4	7%	0.072	37%	0.374	C	S	.	.	S	Bend	trans	-67.8	148.1	173.8	0	0	0	0	0	111.4	W46 L47 S49 F54 H55	W46-G52 VanDerWaalsContact O-CA 3.23Å; W46-G52 WeakPolarHBondContact O-CA 3.36Å; L47-G52 CarbonylContact O-C 3.55Å; L47-G52 WeakPolarHBondContact O-CA 3.39Å; S49-G52 WeakPolarHBondContact O-CA 3.41Å; S49-G52 PolarHBondContact O-N 2.9Å; S49-G52 PolarHBondContact OG-N 2.98Å; S49-G52 VanDerWaalsContact OG-N 3.17Å; G52-F54 PolarHBondContact O-N 2.79Å; G52-F54 VanDerWaalsContact O-N 3.08Å; G52-H55 PolarHBondContact O-N 2.79Å
53	P	66.2	Low	67.4	Low	61 Å²	61	76 Å²	76	40%	0.396	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.7	-178.1	24.1	-35.8	0	0	0	113.9	W46 L47	W46-P53 HydrophobicContact CZ3-CG 4.24Å; L47-P53 HydrophobicContact CD2-CG 3.65Å
54	F	70.1	Confident	69.1	Low	107 Å²	107	72.9 Å²	72.9	47%	0.469	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-6.3	-178.2	-57.9	-49	0	0	0	114.4	L47 L48 G52 R56 S57 Y60	L47-F54 HydrophobicContact CB-CD2 3.84Å; L47-F54 HydrophobicContact CB-CE2 4.24Å; L47-F54 HydrophobicContact CD1-CD2 4.46Å; L47-F54 HydrophobicContact CD1-CE2 4.08Å; L47-F54 HydrophobicContact CD2-CD2 4.15Å; L47-F54 HydrophobicContact CD2-CE2 3.81Å; L47-F54 HydrophobicContact CG-CD2 4.39Å; L47-F54 HydrophobicContact CG-CE2 4.29Å; L47-F54 PolarHBondContact O-N 2.96Å; L48-F54 HydrophobicContact CD2-CB 4.2Å; G52-F54 PolarHBondContact O-N 2.79Å; G52-F54 VanDerWaalsContact O-N 3.08Å; F54-R56 PolarHBondContact O-N 3.13Å; F54-S57 VanDerWaalsContact O-CB 3.28Å; F54-S57 WeakPolarHBondContact O-CB 3.44Å; F54-S57 PolarHBondContact O-N 2.91Å; F54-S57 PolarHBondContact O-OG 2.82Å; F54-Y60 WeakPolarHBondContact O-CB 3.28Å
55	H	70.3	Confident	70.5	Confident	51 Å²	51	69.9 Å²	69.9	24%	0.236	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-33.9	-179.8	-173.6	86	0	0	0	112.9	L48 S49 D50 G52 Y60 T61	L48-H55 PolarHBondContact O-ND1 3.07Å; S49-H55 WeakPolarHBondContact O-CB 3.44Å; D50-H55 PolarHBondContact O-CD2 2.77Å; D50-H55 IonicContact OD1-CE1 2.66Å; D50-H55 PolarHBondContact OD1-CE1 2.76Å; D50-H55 IonicContact OD1-ND1 3.65Å; D50-H55 IonicContact OD1-NE2 3.71Å; D50-H55 PolarHBondContact OD1-NE2 2.77Å; G52-H55 PolarHBondContact O-N 2.79Å; H55-Y60 AromaticContact ND1-CE1 3.71Å; H55-Y60 WeakPolarHBondContact O-CD1 3.37Å; H55-T61 WeakPolarHBondContact O-CG2 3.46Å
56	R	70.8	Confident	71.9	Confident	176 Å²	176	70.4 Å²	70.4	66%	0.664	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	4.1	175.6	-62.5	-176.3	-179.3	176.1	0.4	113.6	F54 Q58 N266	F54-R56 PolarHBondContact O-N 3.13Å; R56-Q58 PolarHBondContact O-N 2.85Å; R56-N266 PolarHBondContact NH2-ND2 3.37Å
57	S	77.8	Confident	72.8	Confident	40 Å²	40	65.7 Å²	65.7	28%	0.28	33%	0.328	S	S	.	.			trans	-69	134.9	177.2	71.6	0	0	0	0	109.4	F54 E59 Y60 T61	F54-S57 VanDerWaalsContact O-CB 3.28Å; F54-S57 WeakPolarHBondContact O-CB 3.44Å; F54-S57 PolarHBondContact O-N 2.91Å; F54-S57 PolarHBondContact O-OG 2.82Å; S57-E59 PolarHBondContact O-N 3.37Å; S57-Y60 PolarHBondContact O-N 2.92Å; S57-Y60 WeakPolarHBondContact OG-CB 3.46Å; S57-Y60 PolarHBondContact OG-N 2.99Å; S57-T61 PolarHBondContact O-N 2.79Å; S57-T61 PolarHBondContact O-OG1 3.48Å
58	Q	74.9	Confident	73.6	Confident	148 Å²	148	72.6 Å²	72.6	69%	0.692	35%	0.352	S	S	*	.	H	α-helix	trans	-58.5	-36.5	-175.8	-170.7	163.9	2.3	0	0	111.9	R56 T61 D62	R56-Q58 PolarHBondContact O-N 2.85Å; Q58-T61 WeakPolarHBondContact CA-OG1 3.49Å; Q58-T61 PolarHBondContact O-OG1 2.79Å; Q58-D62 WeakPolarHBondContact O-CB 3.42Å; Q58-D62 PolarHBondContact O-N 2.76Å
59	E	72.5	Confident	74.4	Confident	86 Å²	86	74.2 Å²	74.2	40%	0.402	36%	0.357	S	S	.	.	H	α-helix	trans	-66.7	-38.3	176.4	-66	-170.3	-155.3	0	0	113.5	S57 F63 R74 P234	S57-E59 PolarHBondContact O-N 3.37Å; E59-F63 VanDerWaalsContact O-CB 3.31Å; E59-F63 WeakPolarHBondContact O-CB 3.46Å; E59-F63 PolarHBondContact O-N 2.99Å; E59-R74 IonicContact OE2-NH2 3Å; E59-P234 VanDerWaalsContact OE1-CB 3.3Å; E59-P234 WeakPolarHBondContact OE1-CB 3.3Å; E59-P234 VanDerWaalsContact OE1-CG 3.29Å; E59-P234 WeakPolarHBondContact OE1-CG 3.48Å
60	Y	77.3	Confident	75	Confident	62 Å²	62	73.8 Å²	73.8	24%	0.243	36%	0.359	C	S	.	.	H	α-helix	trans	-71	-44.7	177.7	179.5	-101.1	0	0	0	110.9	L48 F54 H55 S57 D62 F63 V64	L48-Y60 HydrophobicContact CB-CE2 4.32Å; L48-Y60 HydrophobicContact CD1-CE2 4.47Å; L48-Y60 HydrophobicContact CD2-CD2 3.94Å; L48-Y60 HydrophobicContact CD2-CE2 3.87Å; L48-Y60 HydrophobicContact CG-CE2 4.45Å; F54-Y60 WeakPolarHBondContact O-CB 3.28Å; H55-Y60 AromaticContact ND1-CE1 3.71Å; H55-Y60 WeakPolarHBondContact O-CD1 3.37Å; S57-Y60 PolarHBondContact O-N 2.92Å; S57-Y60 WeakPolarHBondContact OG-CB 3.46Å; S57-Y60 PolarHBondContact OG-N 2.99Å; Y60-D62 VanDerWaalsContact C-N 3.34Å; Y60-D62 PolarHBondContact O-N 2.78Å; Y60-F63 PolarHBondContact O-N 2.83Å; Y60-V64 HydrophobicContact CD1-CG2 4.08Å; Y60-V64 HydrophobicContact CD2-CG2 4.4Å; Y60-V64 HydrophobicContact CE1-CG2 3.67Å; Y60-V64 HydrophobicContact CE2-CG2 4.02Å; Y60-V64 HydrophobicContact CG-CG2 4.43Å; Y60-V64 VanDerWaalsContact O-CG2 3.31Å; Y60-V64 WeakPolarHBondContact O-CG2 3.49Å; Y60-V64 PolarHBondContact O-N 2.82Å
61	T	78.9	Confident	76	Confident	53 Å²	53	73.8 Å²	73.8	33%	0.325	36%	0.358	S	S	.	.	H	α-helix	trans	-61.3	-44.1	176	53.7	0	0	0	0	111.2	H55 S57 Q58 F63 V64 D65	H55-T61 WeakPolarHBondContact O-CG2 3.46Å; S57-T61 PolarHBondContact O-N 2.79Å; S57-T61 PolarHBondContact O-OG1 3.48Å; Q58-T61 WeakPolarHBondContact CA-OG1 3.49Å; Q58-T61 PolarHBondContact O-OG1 2.79Å; T61-F63 VanDerWaalsContact C-N 3.33Å; T61-F63 PolarHBondContact O-N 2.92Å; T61-V64 PolarHBondContact O-N 2.78Å; T61-D65 WeakPolarHBondContact O-CB 3.38Å; T61-D65 PolarHBondContact O-N 2.92Å
62	D	79.7	Confident	76.8	Confident	77 Å²	77	74.7 Å²	74.7	41%	0.412	37%	0.369	S	S	.	.	H	α-helix	trans	-61.2	-42.8	175.8	-74.6	-12.9	0	0	0	110.8	Q58 Y60 R66	Q58-D62 WeakPolarHBondContact O-CB 3.42Å; Q58-D62 PolarHBondContact O-N 2.76Å; Y60-D62 VanDerWaalsContact C-N 3.34Å; Y60-D62 PolarHBondContact O-N 2.78Å; D62-R66 WeakPolarHBondContact O-CB 3.2Å; D62-R66 WeakPolarHBondContact O-CG 3.4Å; D62-R66 PolarHBondContact O-N 3.29Å
63	F	80.1	Confident	77.5	Confident	70 Å²	70	75.5 Å²	75.5	31%	0.307	37%	0.373	S	S	.	.	H	α-helix	trans	-63.6	-45.2	176	176.8	-93.3	0	0	0	112.4	E59 Y60 T61 R66 S67 R74 F150	E59-F63 VanDerWaalsContact O-CB 3.31Å; E59-F63 WeakPolarHBondContact O-CB 3.46Å; E59-F63 PolarHBondContact O-N 2.99Å; Y60-F63 PolarHBondContact O-N 2.83Å; T61-F63 VanDerWaalsContact C-N 3.33Å; T61-F63 PolarHBondContact O-N 2.92Å; F63-R66 PolarHBondContact O-N 3.25Å; F63-S67 WeakPolarHBondContact O-CB 3.4Å; F63-S67 PolarHBondContact O-N 3.16Å; F63-R74 HydrophobicContact CD2-CB 4.43Å; F63-R74 HydrophobicContact CE2-CB 4.17Å; F63-F150 HydrophobicContact CD2-CE1 4.03Å
64	V	79.4	Confident	78.4	Confident	37 Å²	37	77.1 Å²	77.1	22%	0.224	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-43.4	178.8	170	0	0	0	0	110.7	Y60 T61 S67 R68	Y60-V64 HydrophobicContact CD1-CG2 4.08Å; Y60-V64 HydrophobicContact CD2-CG2 4.4Å; Y60-V64 HydrophobicContact CE1-CG2 3.67Å; Y60-V64 HydrophobicContact CE2-CG2 4.02Å; Y60-V64 HydrophobicContact CG-CG2 4.43Å; Y60-V64 VanDerWaalsContact O-CG2 3.31Å; Y60-V64 WeakPolarHBondContact O-CG2 3.49Å; Y60-V64 PolarHBondContact O-N 2.82Å; T61-V64 PolarHBondContact O-N 2.78Å; V64-S67 WeakPolarHBondContact O-CB 3.44Å; V64-S67 PolarHBondContact O-N 3.41Å; V64-R68 WeakPolarHBondContact O-CG 3.23Å; V64-R68 PolarHBondContact O-N 3.04Å
65	D	81.9	Confident	79.2	Confident	75 Å²	75	75.4 Å²	75.4	40%	0.401	36%	0.362	S	S	.	.	H	α-helix	trans	-65.7	-39.5	177.3	-76.3	-18.1	0	0	0	112	T61 S67 R68 Q69	T61-D65 WeakPolarHBondContact O-CB 3.38Å; T61-D65 PolarHBondContact O-N 2.92Å; D65-S67 VanDerWaalsContact C-N 3.33Å; D65-R68 PolarHBondContact O-N 3.29Å; D65-R68 IonicContact OD1-NH1 3.28Å; D65-Q69 VanDerWaalsContact O-CG 3.28Å; D65-Q69 WeakPolarHBondContact O-CG 3.25Å; D65-Q69 PolarHBondContact O-N 3.39Å
66	R	83.1	Confident	80	Confident	65 Å²	65	75.6 Å²	75.6	25%	0.245	36%	0.362	C	S	.	.	H	α-helix	trans	-66.1	-36.9	172.7	-65.1	-70.5	178.2	-140.2	-7.2	111.5	D62 F63 Q69 G70 F71 F150	D62-R66 WeakPolarHBondContact O-CB 3.2Å; D62-R66 WeakPolarHBondContact O-CG 3.4Å; D62-R66 PolarHBondContact O-N 3.29Å; F63-R66 PolarHBondContact O-N 3.25Å; R66-Q69 WeakPolarHBondContact O-CB 3.25Å; R66-Q69 PolarHBondContact O-N 2.87Å; R66-G70 PolarHBondContact O-N 2.92Å; R66-F71 HydrophobicContact CB-CB 4.48Å; R66-F71 HydrophobicContact CB-CD2 4.26Å; R66-F71 WeakPolarHBondContact O-CB 3.35Å; R66-F71 WeakPolarHBondContact O-CD2 3.39Å; R66-F71 PolarHBondContact O-N 3.02Å; R66-F71 VanDerWaalsContact O-N 3.09Å; R66-F150 HydrophobicContact CB-CD1 3.98Å; R66-F150 HydrophobicContact CB-CE1 4.12Å; R66-F150 HydrophobicContact CB-CG 4.4Å; R66-F150 HydrophobicContact CG-CD1 4.24Å; R66-F150 HydrophobicContact CG-CD2 4.44Å; R66-F150 HydrophobicContact CG-CE1 4.16Å; R66-F150 HydrophobicContact CG-CE2 4.37Å; R66-F150 HydrophobicContact CG-CG 4.37Å; R66-F150 HydrophobicContact CG-CZ 4.23Å
67	S	80.1	Confident	80.7	Confident	58 Å²	58	69.4 Å²	69.4	41%	0.406	34%	0.342	S	S	.	.	H	α-helix	trans	-65	-42.3	175.8	-167.1	0	0	0	0	111.8	F63 V64 D65 Q69 G70 F71	F63-S67 WeakPolarHBondContact O-CB 3.4Å; F63-S67 PolarHBondContact O-N 3.16Å; V64-S67 WeakPolarHBondContact O-CB 3.44Å; V64-S67 PolarHBondContact O-N 3.41Å; D65-S67 VanDerWaalsContact C-N 3.33Å; S67-Q69 VanDerWaalsContact C-N 3.26Å; S67-Q69 PolarHBondContact O-N 2.82Å; S67-G70 PolarHBondContact O-N 3.1Å; S67-F71 WeakPolarHBondContact CA-O 3.43Å
68	R	79.4	Confident	80.8	Confident	175 Å²	175	72.1 Å²	72.1	66%	0.66	35%	0.347	S	S	*	.	H	α-helix	trans	-60.6	-34.5	172	-73.2	174.2	174.5	174.7	-3	112.6	V64 D65 G70	V64-R68 WeakPolarHBondContact O-CG 3.23Å; V64-R68 PolarHBondContact O-N 3.04Å; D65-R68 PolarHBondContact O-N 3.29Å; D65-R68 IonicContact OD1-NH1 3.28Å; R68-G70 PolarHBondContact O-N 2.96Å
69	Q	80.8	Confident	80.9	Confident	110 Å²	110	70.3 Å²	70.3	51%	0.514	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-1.3	173.7	-69.6	166	17.3	0	0	113.8	D65 R66 S67 F71	D65-Q69 VanDerWaalsContact O-CG 3.28Å; D65-Q69 WeakPolarHBondContact O-CG 3.25Å; D65-Q69 PolarHBondContact O-N 3.39Å; R66-Q69 WeakPolarHBondContact O-CB 3.25Å; R66-Q69 PolarHBondContact O-N 2.87Å; S67-Q69 VanDerWaalsContact C-N 3.26Å; S67-Q69 PolarHBondContact O-N 2.82Å; Q69-F71 HydrophobicContact CB-CD2 4.04Å; Q69-F71 HydrophobicContact CB-CE2 4.09Å
70	G	78.6	Confident	80.9	Confident	27 Å²	27	68.7 Å²	68.7	28%	0.278	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.9	0.3	175.5	0	0	0	0	0	115.1	R66 S67 R68 S72 D152	R66-G70 PolarHBondContact O-N 2.92Å; S67-G70 PolarHBondContact O-N 3.1Å; R68-G70 PolarHBondContact O-N 2.96Å; G70-S72 PolarHBondContact O-N 2.84Å; G70-D152 VanDerWaalsContact O-CG 3.27Å
71	F	84.5	Confident	80.5	Confident	22 Å²	22	68.3 Å²	68.3	10%	0.096	33%	0.326	C	S	.	.			trans	-78.4	113.4	176.9	-60.9	-76.6	0	0	0	110.8	R66 S67 Q69 F150 D152 K206	R66-F71 HydrophobicContact CB-CB 4.48Å; R66-F71 HydrophobicContact CB-CD2 4.26Å; R66-F71 WeakPolarHBondContact O-CB 3.35Å; R66-F71 WeakPolarHBondContact O-CD2 3.39Å; R66-F71 PolarHBondContact O-N 3.02Å; R66-F71 VanDerWaalsContact O-N 3.09Å; S67-F71 WeakPolarHBondContact CA-O 3.43Å; Q69-F71 HydrophobicContact CB-CD2 4.04Å; Q69-F71 HydrophobicContact CB-CE2 4.09Å; F71-F150 HydrophobicContact CB-CB 3.92Å; F71-F150 HydrophobicContact CD1-CB 3.99Å; F71-F150 HydrophobicContact CG-CB 3.9Å; F71-D152 HydrophobicContact CD1-CB 4.1Å; F71-D152 HydrophobicContact CE1-CB 4.44Å; F71-K206 HydrophobicContact CE1-CB 3.95Å; F71-K206 HydrophobicContact CE2-CB 4.11Å; F71-K206 HydrophobicContact CZ-CB 3.7Å
72	S	78.2	Confident	79.7	Confident	62 Å²	62	67.8 Å²	67.8	43%	0.434	33%	0.33	S	S	.	.			trans	-92.4	-21.2	-174.3	58	0	0	0	0	114.6	G70 V151 K153	G70-S72 PolarHBondContact O-N 2.84Å; S72-V151 PolarHBondContact N-O 2.83Å; S72-V151 PolarHBondContact OG-O 2.9Å; S72-K153 WeakPolarHBondContact OG-CG 3.21Å
73	T	83.7	Confident	79.2	Confident	24 Å²	24	72.8 Å²	72.8	15%	0.147	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	135.1	-172.5	31.4	0	0	0	0	111.5	F150 V151 K153	T73-F150 CarbonylContact O-C 3.53Å; T73-F150 WeakPolarHBondContact O-CA 3.48Å; T73-V151 PolarHBondContact N-O 2.95Å; T73-V151 VanDerWaalsContact N-O 3.1Å; T73-V151 PolarHBondContact O-N 3.05Å; T73-V151 WeakPolarHBondContact OG1-CB 3.43Å; T73-V151 PolarHBondContact OG1-O 3.39Å; T73-V151 VanDerWaalsContact OG1-O 3.06Å; T73-K153 HydrophobicContact CG2-CD 4.19Å
74	R	85.6	Confident	78.7	Confident	94 Å²	94	77.7 Å²	77.7	36%	0.355	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.8	175.5	-179.9	-173.6	178	-175.7	0.8	108.8	E59 F63 T148 F150	E59-R74 IonicContact OE2-NH2 3Å; F63-R74 HydrophobicContact CD2-CB 4.43Å; F63-R74 HydrophobicContact CE2-CB 4.17Å; R74-T148 HydrophobicContact CG-CG2 3.67Å; R74-F150 HydrophobicContact CB-CD1 4.15Å; R74-F150 HydrophobicContact CB-CE1 4.14Å; R74-F150 HydrophobicContact CG-CD1 4.24Å; R74-F150 HydrophobicContact CG-CE1 3.9Å; R74-F150 HydrophobicContact CG-CZ 4.31Å
75	Y	86.1	Confident	78.6	Confident	71 Å²	71	82.9 Å²	82.9	28%	0.278	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	120.6	166.9	-65.5	-75.1	0	0	0	108.1	T148 I149 V151 L174 H178	Y75-T148 CarbonylContact O-C 3.53Å; Y75-T148 VanDerWaalsContact O-CA 3.29Å; Y75-T148 WeakPolarHBondContact O-CA 3.24Å; Y75-I149 PolarHBondContact N-O 2.92Å; Y75-I149 PolarHBondContact O-N 3.12Å; Y75-V151 HydrophobicContact CD2-CG2 3.79Å; Y75-V151 HydrophobicContact CE2-CB 4.42Å; Y75-V151 HydrophobicContact CE2-CG2 3.95Å; Y75-L174 HydrophobicContact CE2-CD1 3.99Å; Y75-H178 AromaticContact CD1-NE2 3.82Å; Y75-H178 AromaticContact CE1-NE2 3.23Å; Y75-H178 WeakPolarHBondContact CE1-NE2 3.35Å; Y75-H178 AromaticContact CE2-NE2 4Å; Y75-H178 AromaticContact CZ-NE2 3.34Å; Y75-H178 VanDerWaalsContact CZ-NE2 3.34Å
76	K	85.9	Confident	78.3	Confident	55 Å²	55	82.7 Å²	82.7	24%	0.239	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.9	172.4	-175.9	-173.6	-179.6	-156.7	0	107.4	E144 E235	K76-E144 WeakPolarHBondContact CE-OE1 3.5Å; K76-E144 IonicContact NZ-OE1 2.75Å; K76-E144 PolarHBondContact NZ-OE1 3.27Å; K76-E235 IonicContact NZ-OE1 3.19Å; K76-E235 PolarHBondContact NZ-OE1 3Å
77	I	85.8	Confident	78.1	Confident	47 Å²	47	82.2 Å²	82.2	24%	0.241	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	141.1	164.6	59.8	169.3	0	0	0	107.5	S146 L147 A181 Y184 F185	I77-S146 CarbonylContact O-C 3.43Å; I77-S146 VanDerWaalsContact O-CA 3.22Å; I77-S146 WeakPolarHBondContact O-CA 3.48Å; I77-S146 WeakPolarHBondContact O-CB 3.39Å; I77-L147 HydrophobicContact CD1-CB 4.14Å; I77-L147 HydrophobicContact CD1-CD2 4.04Å; I77-L147 HydrophobicContact CG1-CB 3.74Å; I77-L147 HydrophobicContact CG1-CD2 4.38Å; I77-L147 PolarHBondContact N-O 3.4Å; I77-L147 PolarHBondContact O-N 3.02Å; I77-A181 HydrophobicContact CD1-CB 3.99Å; I77-A181 WeakPolarHBondContact CD1-O 3.47Å; I77-Y184 HydrophobicContact CD1-CD1 4.02Å; I77-Y184 HydrophobicContact CD1-CG 4.3Å; I77-F185 HydrophobicContact CB-CE2 4.22Å; I77-F185 HydrophobicContact CD1-CE2 4Å; I77-F185 HydrophobicContact CD1-CZ 4.47Å; I77-F185 HydrophobicContact CG1-CE2 4.25Å; I77-F185 HydrophobicContact CG1-CZ 4.43Å
78	Y	79.9	Confident	78	Confident	96 Å²	96	82.3 Å²	82.3	38%	0.376	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154.1	-177.5	67.2	-82.4	0	0	0	110.7	E80 E145 S146 F185 E235	Y78-E80 HydrophobicContact CD2-CG 4.17Å; Y78-E80 HydrophobicContact CE2-CG 4.26Å; Y78-E145 CarbonylContact C-O 3.51Å; Y78-E145 VanDerWaalsContact CA-O 3.29Å; Y78-E145 WeakPolarHBondContact CA-O 3.22Å; Y78-S146 VanDerWaalsContact CB-CB 3.44Å; Y78-F185 VanDerWaalsContact C-CZ 3.41Å; Y78-E235 WeakPolarHBondContact CE1-OE1 3.35Å; Y78-E235 VanDerWaalsContact CE2-OE2 3.31Å; Y78-E235 WeakPolarHBondContact CE2-OE2 3.5Å; Y78-E235 PolarHBondContact OH-OE2 3.1Å
79	R	77.2	Confident	77.5	Confident	111 Å²	111	79.3 Å²	79.3	42%	0.419	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.4	172	-179.8	177.2	179.6	-165.6	-2.9	107.6	F81 E145 F185	R79-F81 HydrophobicContact CB-CZ 4.34Å; R79-F81 VanDerWaalsContact CD-CE1 3.5Å; R79-F81 HydrophobicContact CG-CD1 4.46Å; R79-F81 HydrophobicContact CG-CE1 3.84Å; R79-F81 HydrophobicContact CG-CZ 3.92Å; R79-F81 VanDerWaalsContact CZ-CE1 3.48Å; R79-F81 VanDerWaalsContact NE-CE1 3.29Å; R79-E145 PolarHBondContact N-O 3.19Å; R79-E145 PolarHBondContact O-N 2.98Å; R79-F185 HydrophobicContact CB-CD1 3.87Å; R79-F185 HydrophobicContact CB-CE1 3.35Å; R79-F185 HydrophobicContact CB-CE2 4.37Å; R79-F185 HydrophobicContact CB-CZ 3.66Å
80	E	73.7	Confident	76.9	Confident	51 Å²	51	75.6 Å²	75.6	24%	0.238	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	143.6	173.6	-65.1	171.7	-142.1	0	0	110.3	Y78 R83 G143	Y78-E80 HydrophobicContact CD2-CG 4.17Å; Y78-E80 HydrophobicContact CE2-CG 4.26Å; E80-R83 IonicContact OE1-NH2 3.93Å; E80-R83 PolarHBondContact OE1-NH2 2.9Å; E80-R83 VanDerWaalsContact OE1-NH2 3.1Å; E80-R83 IonicContact OE2-CZ 2.94Å; E80-R83 IonicContact OE2-NE 3.5Å; E80-R83 PolarHBondContact OE2-NE 3.47Å; E80-R83 IonicContact OE2-NH2 3.97Å; E80-R83 PolarHBondContact OE2-NH2 2.9Å; E80-G143 CarbonylContact C-O 3.53Å; E80-G143 WeakPolarHBondContact CA-O 3.33Å
81	F	68.9	Low	76.7	Confident	55 Å²	55	74.7 Å²	74.7	24%	0.241	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132	175.1	-51.9	-77	0	0	0	110.5	R79 G142 G143 E145 Y220	R79-F81 HydrophobicContact CB-CZ 4.34Å; R79-F81 VanDerWaalsContact CD-CE1 3.5Å; R79-F81 HydrophobicContact CG-CD1 4.46Å; R79-F81 HydrophobicContact CG-CE1 3.84Å; R79-F81 HydrophobicContact CG-CZ 3.92Å; R79-F81 VanDerWaalsContact CZ-CE1 3.48Å; R79-F81 VanDerWaalsContact NE-CE1 3.29Å; F81-G142 WeakPolarHBondContact O-CA 3.14Å; F81-G143 PolarHBondContact N-O 2.9Å; F81-G143 PolarHBondContact O-N 2.92Å; F81-E145 HydrophobicContact CE2-CB 3.53Å; F81-E145 HydrophobicContact CZ-CB 4.1Å; F81-E145 WeakPolarHBondContact CZ-OE2 3.45Å; F81-Y220 WeakPolarHBondContact CD1-OH 3.39Å; F81-Y220 WeakPolarHBondContact CE1-OH 3.19Å
82	G	61	Low	75.8	Confident	41 Å²	41	76.9 Å²	76.9	42%	0.423	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	59.9	91.1	174	0	0	0	0	0	113.4	W84 G142	G82-W84 PolarHBondContact O-N 2.96Å; G82-G142 WeakPolarHBondContact O-CA 3.38Å
83	R	68.3	Low	75.2	Confident	183 Å²	183	81.5 Å²	81.5	69%	0.691	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	95.5	176.6	-72.6	179.5	172.5	172.6	-2.6	110.8	E80	E80-R83 IonicContact OE1-NH2 3.93Å; E80-R83 PolarHBondContact OE1-NH2 2.9Å; E80-R83 VanDerWaalsContact OE1-NH2 3.1Å; E80-R83 IonicContact OE2-CZ 2.94Å; E80-R83 IonicContact OE2-NE 3.5Å; E80-R83 PolarHBondContact OE2-NE 3.47Å; E80-R83 IonicContact OE2-NH2 3.97Å; E80-R83 PolarHBondContact OE2-NH2 2.9Å
84	W	71.5	Confident	74.5	Confident	173 Å²	173	84.7 Å²	84.7	66%	0.655	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	109.3	173.7	-57.7	91	0	0	0	109.3	G82 V86 T140 L141	G82-W84 PolarHBondContact O-N 2.96Å; W84-V86 PolarHBondContact O-N 2.77Å; W84-T140 WeakPolarHBondContact O-CA 3.31Å; W84-L141 HydrophobicContact CB-CB 4.36Å; W84-L141 PolarHBondContact N-O 3.33Å; W84-L141 PolarHBondContact O-N 3.18Å
85	K	75.5	Confident	73.5	Confident	146 Å²	146	86.2 Å²	86.2	64%	0.635	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	111.2	170.4	-171.8	178.1	179.5	-178.9	0	108.4	N87	K85-N87 WeakPolarHBondContact CE-OD1 3.13Å
86	V	75.8	Confident	72.3	Confident	70 Å²	70	91 Å²	91	42%	0.424	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124.8	175.3	-179.3	0	0	0	0	108.6	W84 S138 A139 L141	W84-V86 PolarHBondContact O-N 2.77Å; V86-S138 VanDerWaalsContact O-CA 3.26Å; V86-S138 WeakPolarHBondContact O-CA 3.47Å; V86-A139 PolarHBondContact N-O 2.82Å; V86-A139 PolarHBondContact O-N 3.37Å; V86-L141 HydrophobicContact CB-CD1 4.16Å; V86-L141 HydrophobicContact CB-CG 4.27Å; V86-L141 HydrophobicContact CG2-CD1 3.41Å; V86-L141 VanDerWaalsContact CG2-CD1 3.41Å; V86-L141 HydrophobicContact CG2-CG 3.76Å
87	N	79.3	Confident	71.1	Confident	56 Å²	56	94.7 Å²	94.7	30%	0.299	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	147	174.2	-66.3	-9.5	0	0	0	110	K85 L89 E92 S138	K85-N87 WeakPolarHBondContact CE-OD1 3.13Å; N87-L89 PolarHBondContact O-N 3.18Å; N87-L89 VanDerWaalsContact O-N 3.08Å; N87-E92 VanDerWaalsContact CB-OE1 3.3Å; N87-E92 WeakPolarHBondContact CB-OE1 3.13Å; N87-E92 PolarHBondContact ND2-OE1 3.43Å; N87-S138 VanDerWaalsContact OD1-CB 3.27Å; N87-S138 WeakPolarHBondContact OD1-CB 3.46Å
88	N	78.1	Confident	70	Confident	59 Å²	59	95.7 Å²	95.7	32%	0.316	46%	0.462	S	S	.	.			trans	-76.7	96.3	174.1	-170.3	-22	0	0	0	110.3	A90 V91 E92 L136 L137	N88-A90 PolarHBondContact O-N 3.45Å; N88-A90 VanDerWaalsContact O-N 3.15Å; N88-A90 WeakPolarHBondContact OD1-CB 3.01Å; N88-A90 PolarHBondContact OD1-N 2.93Å; N88-V91 HydrophobicContact CB-CB 4.34Å; N88-V91 HydrophobicContact CB-CG2 4.06Å; N88-V91 PolarHBondContact O-N 3.41Å; N88-E92 PolarHBondContact O-N 3.4Å; N88-E92 VanDerWaalsContact O-N 3.1Å; N88-L136 PolarHBondContact ND2-O 3.26Å; N88-L137 VanDerWaalsContact CB-O 3.25Å; N88-L137 WeakPolarHBondContact CB-O 3.2Å; N88-L137 PolarHBondContact N-O 2.79Å
89	L	69.4	Low	69.3	Low	112 Å²	112	93.3 Å²	93.3	59%	0.586	46%	0.46	S	S	*	.	H	α-helix	trans	-56.4	-29.6	-180	-67.8	173.3	0	0	0	113.4	N87 V91 R93	N87-L89 PolarHBondContact O-N 3.18Å; N87-L89 VanDerWaalsContact O-N 3.08Å; L89-V91 VanDerWaalsContact C-N 3.31Å; L89-R93 WeakPolarHBondContact O-CB 3Å; L89-R93 VanDerWaalsContact O-CG 3.27Å; L89-R93 WeakPolarHBondContact O-CG 3.3Å; L89-R93 PolarHBondContact O-N 3.44Å
90	A	68.8	Low	68.8	Low	33 Å²	33	93.7 Å²	93.7	27%	0.273	48%	0.476	S	S	.	.	H	α-helix	trans	-67.5	-35.7	178.2	0	0	0	0	0	111.5	N88 R94 L101 P102	N88-A90 PolarHBondContact O-N 3.45Å; N88-A90 VanDerWaalsContact O-N 3.15Å; N88-A90 WeakPolarHBondContact OD1-CB 3.01Å; N88-A90 PolarHBondContact OD1-N 2.93Å; A90-R94 PolarHBondContact O-N 3.33Å; A90-L101 VanDerWaalsContact C-CD2 3.44Å; A90-L101 HydrophobicContact CB-CD2 3.91Å; A90-L101 WeakPolarHBondContact O-CD2 3.4Å; A90-P102 HydrophobicContact CB-CG 4.24Å
91	V	72.6	Confident	68.8	Low	8 Å²	8	92.3 Å²	92.3	5%	0.048	47%	0.471	C	S	.	.	H	α-helix	trans	-80.8	-38.7	-179.8	-175.4	0	0	0	0	111.5	N88 L89 R93 R94 N95 L101 F135 L137	N88-V91 HydrophobicContact CB-CB 4.34Å; N88-V91 HydrophobicContact CB-CG2 4.06Å; N88-V91 PolarHBondContact O-N 3.41Å; L89-V91 VanDerWaalsContact C-N 3.31Å; V91-R93 VanDerWaalsContact C-N 3.34Å; V91-R93 PolarHBondContact O-N 2.88Å; V91-R94 PolarHBondContact O-N 2.84Å; V91-N95 PolarHBondContact O-N 2.75Å; V91-L101 HydrophobicContact CB-CD2 4.45Å; V91-L101 HydrophobicContact CG2-CD2 3.88Å; V91-F135 HydrophobicContact CG2-CD2 4.43Å; V91-F135 HydrophobicContact CG2-CE2 3.75Å; V91-L137 HydrophobicContact CB-CD2 4.1Å; V91-L137 HydrophobicContact CG1-CD2 3.48Å; V91-L137 VanDerWaalsContact CG1-CD2 3.48Å; V91-L137 HydrophobicContact CG2-CD2 4.18Å
92	E	67.3	Low	69.2	Low	67 Å²	67	94.9 Å²	94.9	31%	0.313	49%	0.493	S	S	.	.	H	α-helix	trans	-59.7	-45.4	172.4	-72.4	-176.6	162	0	0	111	N87 N88 R94 N95 F96	N87-E92 VanDerWaalsContact CB-OE1 3.3Å; N87-E92 WeakPolarHBondContact CB-OE1 3.13Å; N87-E92 PolarHBondContact ND2-OE1 3.43Å; N88-E92 PolarHBondContact O-N 3.4Å; N88-E92 VanDerWaalsContact O-N 3.1Å; E92-R94 VanDerWaalsContact C-N 3.31Å; E92-R94 PolarHBondContact O-N 3.3Å; E92-N95 PolarHBondContact O-N 3.01Å; E92-F96 HydrophobicContact CB-CD2 4.31Å; E92-F96 HydrophobicContact CB-CE2 4.45Å; E92-F96 WeakPolarHBondContact O-CD2 3.3Å; E92-F96 PolarHBondContact O-N 3.39Å
93	R	64.7	Low	70.2	Confident	160 Å²	160	94.9 Å²	94.9	60%	0.604	48%	0.483	S	S	*	.	H	α-helix	trans	-60.2	-34.9	177.7	-77.4	179.2	-179.1	-175.1	1.5	113.9	L89 V91 N95 L97	L89-R93 WeakPolarHBondContact O-CB 3Å; L89-R93 VanDerWaalsContact O-CG 3.27Å; L89-R93 WeakPolarHBondContact O-CG 3.3Å; L89-R93 PolarHBondContact O-N 3.44Å; V91-R93 VanDerWaalsContact C-N 3.34Å; V91-R93 PolarHBondContact O-N 2.88Å; R93-N95 VanDerWaalsContact C-N 3.35Å; R93-L97 HydrophobicContact CG-CD1 4.39Å; R93-L97 WeakPolarHBondContact O-CB 3.05Å; R93-L97 PolarHBondContact O-N 3.01Å
94	R	70	Confident	71.1	Confident	91 Å²	91	89 Å²	89	34%	0.343	47%	0.473	S	S	.	.	H	α-helix	trans	-61.4	-44.5	173	176.1	-179.2	175.9	-172.9	2.3	111.3	A90 V91 E92 G98 L101 V245	A90-R94 PolarHBondContact O-N 3.33Å; V91-R94 PolarHBondContact O-N 2.84Å; E92-R94 VanDerWaalsContact C-N 3.31Å; E92-R94 PolarHBondContact O-N 3.3Å; R94-G98 VanDerWaalsContact O-CA 3.28Å; R94-G98 WeakPolarHBondContact O-CA 3.46Å; R94-G98 PolarHBondContact O-N 3.03Å; R94-L101 HydrophobicContact CB-CG 4.19Å; R94-L101 VanDerWaalsContact CD-CD1 3.47Å; R94-V245 PolarHBondContact NH1-O 3.31Å
95	N	64.6	Low	71.8	Confident	126 Å²	126	85.7 Å²	85.7	67%	0.674	47%	0.474	S	S	*	.	H	α-helix	trans	-71.5	-34.6	-178.1	-67.1	-14.4	0	0	0	112.3	V91 E92 R93	V91-N95 PolarHBondContact O-N 2.75Å; E92-N95 PolarHBondContact O-N 3.01Å; R93-N95 VanDerWaalsContact C-N 3.35Å
96	F	59.3	Low	72.4	Confident	171 Å²	171	83.4 Å²	83.4	75%	0.75	47%	0.466	S	S	*	.	H	α-helix	trans	-84.9	-37	-179.4	-78.6	-73.5	0	0	0	114.4	E92	E92-F96 HydrophobicContact CB-CD2 4.31Å; E92-F96 HydrophobicContact CB-CE2 4.45Å; E92-F96 WeakPolarHBondContact O-CD2 3.3Å; E92-F96 PolarHBondContact O-N 3.39Å
97	L	61.1	Low	73	Confident	132 Å²	132	80.7 Å²	80.7	69%	0.691	45%	0.448	S	S	*	.	H	α-helix	trans	-115.7	-3	-170.5	-65	161.8	0	0	0	113.7	R93 S99	R93-L97 HydrophobicContact CG-CD1 4.39Å; R93-L97 WeakPolarHBondContact O-CB 3.05Å; R93-L97 PolarHBondContact O-N 3.01Å; L97-S99 PolarHBondContact O-N 3.48Å; L97-S99 VanDerWaalsContact O-N 3.1Å
98	G	62.9	Low	73.3	Confident	68 Å²	68	82.1 Å²	82.1	70%	0.701	45%	0.452	S	S	*	.			trans	64.6	10.8	-176.6	0	0	0	0	0	114.5	R94	R94-G98 VanDerWaalsContact O-CA 3.28Å; R94-G98 WeakPolarHBondContact O-CA 3.46Å; R94-G98 PolarHBondContact O-N 3.03Å
99	S	64.5	Low	73.7	Confident	47 Å²	47	86.5 Å²	86.5	33%	0.329	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-75.8	145.1	-178	54.5	0	0	0	0	111.7	L97	L97-S99 PolarHBondContact O-N 3.48Å; L97-S99 VanDerWaalsContact O-N 3.1Å
100	P	68.6	Low	74.6	Confident	118 Å²	118	82.1 Å²	82.1	77%	0.766	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-66	139.4	177.7	27.9	-33.6	0	0	0	110.1
101	L	73.1	Confident	75.4	Confident	23 Å²	23	81.2 Å²	81.2	12%	0.12	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-59.7	132	176	-86.8	155.4	0	0	0	110.5	A90 V91 R94 L103 L246	A90-L101 VanDerWaalsContact C-CD2 3.44Å; A90-L101 HydrophobicContact CB-CD2 3.91Å; A90-L101 WeakPolarHBondContact O-CD2 3.4Å; V91-L101 HydrophobicContact CB-CD2 4.45Å; V91-L101 HydrophobicContact CG2-CD2 3.88Å; R94-L101 HydrophobicContact CB-CG 4.19Å; R94-L101 VanDerWaalsContact CD-CD1 3.47Å; L101-L103 VanDerWaalsContact C-N 3.29Å; L101-L103 HydrophobicContact CB-CD2 3.89Å; L101-L103 HydrophobicContact CB-CG 4.31Å; L101-L103 PolarHBondContact O-N 3.09Å; L101-L246 HydrophobicContact CD1-CD2 3.28Å
102	P	77.4	Confident	76.1	Confident	109 Å²	109	90.3 Å²	90.3	71%	0.708	47%	0.465	S	S	*	.			trans	-73.1	85	172.9	30.2	-33.7	0	0	0	109.5	A90	A90-P102 HydrophobicContact CB-CG 4.24Å
103	L	82.1	Confident	77	Confident	41 Å²	41	93.1 Å²	93.1	22%	0.215	48%	0.482	C	S	.	.			trans	-80.4	150.3	176.5	-46.4	172.8	0	0	0	110.4	L101 F107 F108 L246	L101-L103 VanDerWaalsContact C-N 3.29Å; L101-L103 HydrophobicContact CB-CD2 3.89Å; L101-L103 HydrophobicContact CB-CG 4.31Å; L101-L103 PolarHBondContact O-N 3.09Å; L103-F107 HydrophobicContact CB-CD1 4.09Å; L103-F107 HydrophobicContact CD1-CD1 3.9Å; L103-F107 HydrophobicContact CD1-CE1 3.96Å; L103-F107 HydrophobicContact CG-CD1 4.45Å; L103-F108 HydrophobicContact CB-CD2 3.82Å; L103-F108 HydrophobicContact CB-CE2 3.47Å; L103-F108 VanDerWaalsContact CB-CE2 3.47Å; L103-F108 HydrophobicContact CB-CZ 4.16Å; L103-F108 HydrophobicContact CD1-CE1 4.14Å; L103-F108 HydrophobicContact CD1-CE2 3.88Å; L103-F108 HydrophobicContact CD1-CZ 3.65Å; L103-F108 HydrophobicContact CG-CE2 3.91Å; L103-F108 HydrophobicContact CG-CZ 4.1Å; L103-L246 HydrophobicContact CD2-CD1 3.97Å
104	A	85.6	Confident	78.1	Confident	58 Å²	58	86.1 Å²	86.1	48%	0.479	46%	0.456	S	S	.	.			trans	-57.8	138.5	176.7	0	0	0	0	0	111.1	E106 F107 F108	A104-E106 PolarHBondContact O-N 3.41Å; A104-F107 HydrophobicContact CB-CB 4.31Å; A104-F107 WeakPolarHBondContact O-CB 3.35Å; A104-F107 PolarHBondContact O-N 3.4Å; A104-F108 PolarHBondContact O-N 3.31Å
105	P	86.1	Confident	78.7	Confident	104 Å²	104	83.5 Å²	83.5	68%	0.675	46%	0.457	S	S	*	.	H	α-helix	trans	-59.8	-34.1	-178.2	23.2	-33.3	0	0	0	112.2	F107 F108 R109	P105-F107 VanDerWaalsContact C-N 3.34Å; P105-F107 PolarHBondContact O-N 2.94Å; P105-F108 PolarHBondContact O-N 3.31Å; P105-R109 WeakPolarHBondContact O-CB 3.37Å; P105-R109 PolarHBondContact O-N 2.96Å
106	E	88.7	Confident	79.5	Confident	99 Å²	99	88 Å²	88	46%	0.463	47%	0.465	S	S	.	.	H	α-helix	trans	-62.3	-37.7	173.4	-68.9	-58.4	143.7	0	0	112.9	A104 R109 N110	A104-E106 PolarHBondContact O-N 3.41Å; E106-R109 PolarHBondContact O-N 3.18Å; E106-N110 VanDerWaalsContact O-CG 3.25Å; E106-N110 PolarHBondContact O-N 2.75Å; E106-N110 PolarHBondContact O-ND2 2.87Å
107	F	88.1	Confident	80.6	Confident	12 Å²	12	90.1 Å²	90.1	5%	0.053	47%	0.468	C	S	.	.	H	α-helix	trans	-67	-45.2	177.5	-176.5	-108	0	0	0	110.9	L103 A104 P105 R109 N110 I111 L127 Y131 L243 L247	L103-F107 HydrophobicContact CB-CD1 4.09Å; L103-F107 HydrophobicContact CD1-CD1 3.9Å; L103-F107 HydrophobicContact CD1-CE1 3.96Å; L103-F107 HydrophobicContact CG-CD1 4.45Å; A104-F107 HydrophobicContact CB-CB 4.31Å; A104-F107 WeakPolarHBondContact O-CB 3.35Å; A104-F107 PolarHBondContact O-N 3.4Å; P105-F107 VanDerWaalsContact C-N 3.34Å; P105-F107 PolarHBondContact O-N 2.94Å; F107-R109 VanDerWaalsContact C-N 3.33Å; F107-R109 PolarHBondContact O-N 3.17Å; F107-N110 PolarHBondContact O-N 2.97Å; F107-I111 HydrophobicContact CD1-CD1 3.78Å; F107-I111 HydrophobicContact CE1-CD1 3.39Å; F107-I111 HydrophobicContact CE1-CG1 4.41Å; F107-I111 HydrophobicContact CZ-CD1 3.8Å; F107-I111 HydrophobicContact CZ-CG1 4.49Å; F107-I111 WeakPolarHBondContact O-CG1 3.4Å; F107-I111 PolarHBondContact O-N 3.11Å; F107-L127 HydrophobicContact CD2-CD2 4.47Å; F107-L127 HydrophobicContact CE2-CD2 3.94Å; F107-Y131 HydrophobicContact CB-CE1 4.43Å; F107-Y131 AromaticContact CD2-CD1 3.93Å; F107-Y131 HydrophobicContact CD2-CD1 3.93Å; F107-Y131 AromaticContact CD2-CD2 3.73Å; F107-Y131 HydrophobicContact CD2-CD2 3.73Å; F107-Y131 AromaticContact CD2-CE1 3.91Å; F107-Y131 HydrophobicContact CD2-CE1 3.91Å; F107-Y131 AromaticContact CD2-CE2 3.71Å; F107-Y131 HydrophobicContact CD2-CE2 3.71Å; F107-Y131 AromaticContact CD2-CG 3.84Å; F107-Y131 HydrophobicContact CD2-CG 3.84Å; F107-Y131 AromaticContact CD2-CZ 3.79Å; F107-Y131 HydrophobicContact CE2-CD1 4.45Å; F107-Y131 AromaticContact CE2-CD2 3.9Å; F107-Y131 HydrophobicContact CE2-CD2 3.9Å; F107-Y131 HydrophobicContact CE2-CE2 4.3Å; F107-Y131 AromaticContact CE2-CG 3.98Å; F107-Y131 HydrophobicContact CE2-CG 3.98Å; F107-L243 HydrophobicContact CE2-CD2 4.13Å; F107-L243 HydrophobicContact CZ-CD1 4.12Å; F107-L243 HydrophobicContact CZ-CD2 4.16Å; F107-L243 HydrophobicContact CZ-CG 4.27Å; F107-L247 HydrophobicContact CZ-CD2 4.2Å
108	F	85.5	Confident	81.9	Confident	87 Å²	87	83.9 Å²	83.9	38%	0.382	44%	0.435	S	S	.	.	H	α-helix	trans	-60.5	-41.5	173.9	-89	-66.7	0	0	0	112.7	L103 A104 P105 N110 I111 R112	L103-F108 HydrophobicContact CB-CD2 3.82Å; L103-F108 HydrophobicContact CB-CE2 3.47Å; L103-F108 VanDerWaalsContact CB-CE2 3.47Å; L103-F108 HydrophobicContact CB-CZ 4.16Å; L103-F108 HydrophobicContact CD1-CE1 4.14Å; L103-F108 HydrophobicContact CD1-CE2 3.88Å; L103-F108 HydrophobicContact CD1-CZ 3.65Å; L103-F108 HydrophobicContact CG-CE2 3.91Å; L103-F108 HydrophobicContact CG-CZ 4.1Å; A104-F108 PolarHBondContact O-N 3.31Å; P105-F108 PolarHBondContact O-N 3.31Å; F108-N110 VanDerWaalsContact C-N 3.35Å; F108-I111 PolarHBondContact O-N 3.46Å; F108-R112 WeakPolarHBondContact O-CG 3.45Å; F108-R112 PolarHBondContact O-N 2.85Å
109	R	87.6	Confident	83	Confident	150 Å²	150	84.2 Å²	84.2	57%	0.566	42%	0.423	S	S	*	.	H	α-helix	trans	-60.1	-45.7	176.3	-174.7	-178.7	178.4	-174.7	0.4	111	P105 E106 F107 I111 R112 L113	P105-R109 WeakPolarHBondContact O-CB 3.37Å; P105-R109 PolarHBondContact O-N 2.96Å; E106-R109 PolarHBondContact O-N 3.18Å; F107-R109 VanDerWaalsContact C-N 3.33Å; F107-R109 PolarHBondContact O-N 3.17Å; R109-I111 PolarHBondContact O-N 2.79Å; R109-R112 PolarHBondContact O-N 3.22Å; R109-L113 HydrophobicContact CG-CD1 4.15Å; R109-L113 VanDerWaalsContact O-CG 3.31Å; R109-L113 WeakPolarHBondContact O-CG 3.39Å; R109-L113 PolarHBondContact O-N 2.95Å
110	N	87.4	Confident	84.1	Confident	20 Å²	20	83.4 Å²	83.4	11%	0.107	42%	0.415	C	S	.	.	H	α-helix	trans	-65.1	-38.4	179.6	-68.1	-33.4	0	0	0	112.4	E106 F107 F108 R112 L113 L114 K130 Y131	E106-N110 VanDerWaalsContact O-CG 3.25Å; E106-N110 PolarHBondContact O-N 2.75Å; E106-N110 PolarHBondContact O-ND2 2.87Å; F107-N110 PolarHBondContact O-N 2.97Å; F108-N110 VanDerWaalsContact C-N 3.35Å; N110-R112 PolarHBondContact O-N 3.36Å; N110-L113 PolarHBondContact O-N 2.72Å; N110-L114 WeakPolarHBondContact O-CG 3.37Å; N110-L114 PolarHBondContact O-N 3.39Å; N110-K130 PolarHBondContact ND2-NZ 2.95Å; N110-Y131 PolarHBondContact ND2-OH 2.86Å
111	I	86.9	Confident	84.8	Confident	14 Å²	14	84.8 Å²	84.8	7%	0.072	41%	0.412	C	S	.	.	H	α-helix	trans	-62.4	-43.2	172.9	-66.8	170.1	0	0	0	111.1	F107 F108 R109 L113 L114 L127 L247 P248 L251	F107-I111 HydrophobicContact CD1-CD1 3.78Å; F107-I111 HydrophobicContact CE1-CD1 3.39Å; F107-I111 HydrophobicContact CE1-CG1 4.41Å; F107-I111 HydrophobicContact CZ-CD1 3.8Å; F107-I111 HydrophobicContact CZ-CG1 4.49Å; F107-I111 WeakPolarHBondContact O-CG1 3.4Å; F107-I111 PolarHBondContact O-N 3.11Å; F108-I111 PolarHBondContact O-N 3.46Å; R109-I111 PolarHBondContact O-N 2.79Å; I111-L113 VanDerWaalsContact C-N 3.33Å; I111-L113 PolarHBondContact O-N 3.02Å; I111-L114 PolarHBondContact O-N 3.19Å; I111-L127 HydrophobicContact CG1-CD2 4.15Å; I111-L247 HydrophobicContact CD1-CD2 3.63Å; I111-L247 HydrophobicContact CG1-CD2 4Å; I111-P248 HydrophobicContact CG2-CG 4.4Å; I111-L251 HydrophobicContact CG2-CD1 4.33Å
112	R	86.3	Confident	85.5	Confident	199 Å²	199	87.7 Å²	87.7	75%	0.751	42%	0.424	S	S	*	.	H	α-helix	trans	-65.5	-36.2	179.3	-71.5	176.8	-174.1	173.2	3	112.5	F108 R109 N110 L114 G115	F108-R112 WeakPolarHBondContact O-CG 3.45Å; F108-R112 PolarHBondContact O-N 2.85Å; R109-R112 PolarHBondContact O-N 3.22Å; N110-R112 PolarHBondContact O-N 3.36Å; R112-L114 VanDerWaalsContact C-N 3.25Å; R112-L114 PolarHBondContact O-N 3.49Å; R112-G115 PolarHBondContact O-N 2.78Å
113	L	87.4	Confident	86.1	Confident	127 Å²	127	82.6 Å²	82.6	67%	0.665	39%	0.391	S	S	*	.	H	α-helix	trans	-66.6	-23.6	178.8	-72.6	171	0	0	0	113.4	R109 N110 I111 G115	R109-L113 HydrophobicContact CG-CD1 4.15Å; R109-L113 VanDerWaalsContact O-CG 3.31Å; R109-L113 WeakPolarHBondContact O-CG 3.39Å; R109-L113 PolarHBondContact O-N 2.95Å; N110-L113 PolarHBondContact O-N 2.72Å; I111-L113 VanDerWaalsContact C-N 3.33Å; I111-L113 PolarHBondContact O-N 3.02Å; L113-G115 VanDerWaalsContact C-N 3.29Å; L113-G115 PolarHBondContact O-N 2.65Å
114	L	86.3	Confident	86.4	Confident	13 Å²	13	81.3 Å²	81.3	7%	0.068	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-20.6	177.3	-71.7	170.9	0	0	0	113.9	N110 I111 R112 P118 Q122 N126 L127	N110-L114 WeakPolarHBondContact O-CG 3.37Å; N110-L114 PolarHBondContact O-N 3.39Å; I111-L114 PolarHBondContact O-N 3.19Å; R112-L114 VanDerWaalsContact C-N 3.25Å; R112-L114 PolarHBondContact O-N 3.49Å; L114-P118 HydrophobicContact CB-CB 4.02Å; L114-P118 HydrophobicContact CB-CG 4.2Å; L114-P118 HydrophobicContact CD2-CB 4.06Å; L114-Q122 HydrophobicContact CD2-CB 3.9Å; L114-N126 HydrophobicContact CD2-CB 4.22Å; L114-L127 HydrophobicContact CD1-CD1 3.39Å; L114-L127 HydrophobicContact CD1-CD2 4.49Å; L114-L127 HydrophobicContact CD1-CG 3.78Å
115	G	83.3	Confident	86.5	Confident	35 Å²	35	84.1 Å²	84.1	36%	0.361	39%	0.388	S	S	.	.			trans	67.4	-166.5	-177.8	0	0	0	0	0	114.1	R112 L113	R112-G115 PolarHBondContact O-N 2.78Å; L113-G115 VanDerWaalsContact C-N 3.29Å; L113-G115 PolarHBondContact O-N 2.65Å
116	R	80.8	Confident	86.6	Confident	222 Å²	222	82.5 Å²	82.5	84%	0.838	37%	0.374	S	S	*	.	S	Bend	trans	-81	-23.5	-174	-69.8	-175.3	179.1	177.9	-0.3	114.7	Y250	R116-Y250 WeakPolarHBondContact O-CD2 3.32Å
117	R	82.5	Confident	86.6	Confident	215 Å²	215	77.9 Å²	77.9	81%	0.811	35%	0.352	S	S	*	.	S	Bend	trans	-138.1	63.7	-177	-67.5	-174.3	178.4	-176.7	-0.2	111.6
118	P	87.8	Confident	86.7	Confident	1 Å²	1	77.5 Å²	77.5	1%	0.006	35%	0.351	C	S	.	.			trans	-65.6	150.5	176.6	26.9	-33.6	0	0	0	111.7	L114 Q122 I123 L251 R254	L114-P118 HydrophobicContact CB-CB 4.02Å; L114-P118 HydrophobicContact CB-CG 4.2Å; L114-P118 HydrophobicContact CD2-CB 4.06Å; P118-Q122 HydrophobicContact CB-CB 4.42Å; P118-I123 HydrophobicContact CB-CD1 4.47Å; P118-I123 HydrophobicContact CB-CG1 4.02Å; P118-I123 HydrophobicContact CG-CD1 4.03Å; P118-I123 HydrophobicContact CG-CG1 3.96Å; P118-L251 HydrophobicContact CG-CD2 3.46Å; P118-L251 VanDerWaalsContact CG-CD2 3.46Å; P118-R254 PolarHBondContact O-NH1 2.9Å
119	T	87.4	Confident	86.8	Confident	74 Å²	74	78.9 Å²	78.9	45%	0.454	36%	0.357	S	S	.	.			trans	-75.2	157.4	169.9	64.5	0	0	0	0	110.5	Q121 Q122 I123	T119-Q121 PolarHBondContact O-N 3.3Å; T119-Q122 PolarHBondContact O-N 3.35Å; T119-Q122 VanDerWaalsContact O-N 3.15Å; T119-Q122 VanDerWaalsContact OG1-CG 3.25Å; T119-Q122 WeakPolarHBondContact OG1-CG 3.41Å; T119-Q122 PolarHBondContact OG1-N 2.76Å; T119-Q122 PolarHBondContact OG1-OE1 3.01Å; T119-I123 PolarHBondContact O-N 3.19Å
120	L	86.3	Confident	86.9	Confident	31 Å²	31	77.6 Å²	77.6	16%	0.162	36%	0.355	C	S	.	.	H	α-helix	trans	-58.8	-36.7	178.9	-63	177.1	0	0	0	111.7	I123 T124 Q257 A258 E270	L120-I123 PolarHBondContact O-N 3.23Å; L120-T124 PolarHBondContact O-N 3.49Å; L120-T124 PolarHBondContact O-OG1 2.78Å; L120-Q257 HydrophobicContact CD1-CG 4.26Å; L120-Q257 HydrophobicContact CD2-CB 4.21Å; L120-Q257 HydrophobicContact CD2-CG 4.28Å; L120-A258 HydrophobicContact CB-CB 4.43Å; L120-A258 HydrophobicContact CD2-CB 4.05Å; L120-E270 HydrophobicContact CD1-CG 4.32Å
121	Q	84.6	Confident	87	Confident	147 Å²	147	80 Å²	80	69%	0.687	36%	0.363	S	S	*	.	H	α-helix	trans	-63.7	-43.4	175.9	-69.5	178.4	-8.2	0	0	112.5	T119 I123 T124 E125	T119-Q121 PolarHBondContact O-N 3.3Å; Q121-I123 VanDerWaalsContact C-N 3.3Å; Q121-I123 PolarHBondContact O-N 2.74Å; Q121-T124 PolarHBondContact O-N 3.11Å; Q121-T124 VanDerWaalsContact O-N 3.16Å; Q121-E125 WeakPolarHBondContact O-CG 3.45Å; Q121-E125 PolarHBondContact O-N 2.88Å
122	Q	88.2	Confident	87	Confident	83 Å²	83	80.7 Å²	80.7	39%	0.388	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-37.7	177.8	-75.1	170.7	-17.8	0	0	112.3	L114 P118 T119 N126	L114-Q122 HydrophobicContact CD2-CB 3.9Å; P118-Q122 HydrophobicContact CB-CB 4.42Å; T119-Q122 PolarHBondContact O-N 3.35Å; T119-Q122 VanDerWaalsContact O-N 3.15Å; T119-Q122 VanDerWaalsContact OG1-CG 3.25Å; T119-Q122 WeakPolarHBondContact OG1-CG 3.41Å; T119-Q122 PolarHBondContact OG1-N 2.76Å; T119-Q122 PolarHBondContact OG1-OE1 3.01Å; Q122-N126 VanDerWaalsContact O-CB 3.3Å; Q122-N126 WeakPolarHBondContact O-CB 3.42Å; Q122-N126 PolarHBondContact O-N 2.69Å; Q122-N126 VanDerWaalsContact O-N 3.09Å; Q122-N126 PolarHBondContact O-ND2 3Å
123	I	89.1	Confident	87.1	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.015	35%	0.347	C	S	.	.	H	α-helix	trans	-65.8	-45.7	174.3	-63.4	171.8	0	0	0	110.1	P118 T119 L120 Q121 E125 L127 I128 R254 F255 A258	P118-I123 HydrophobicContact CB-CD1 4.47Å; P118-I123 HydrophobicContact CB-CG1 4.02Å; P118-I123 HydrophobicContact CG-CD1 4.03Å; P118-I123 HydrophobicContact CG-CG1 3.96Å; T119-I123 PolarHBondContact O-N 3.19Å; L120-I123 PolarHBondContact O-N 3.23Å; Q121-I123 VanDerWaalsContact C-N 3.3Å; Q121-I123 PolarHBondContact O-N 2.74Å; I123-E125 PolarHBondContact O-N 3.49Å; I123-L127 HydrophobicContact CG2-CD1 4.38Å; I123-L127 WeakPolarHBondContact O-CA 3.3Å; I123-L127 WeakPolarHBondContact O-CB 3.36Å; I123-L127 PolarHBondContact O-N 3.38Å; I123-I128 HydrophobicContact CG2-CD1 4.15Å; I123-I128 HydrophobicContact CG2-CG1 4.48Å; I123-I128 PolarHBondContact O-N 3.15Å; I123-R254 HydrophobicContact CD1-CB 3.74Å; I123-F255 HydrophobicContact CG2-CB 4.5Å; I123-F255 HydrophobicContact CG2-CD2 3.69Å; I123-F255 HydrophobicContact CG2-CE2 4.42Å; I123-F255 HydrophobicContact CG2-CG 4.49Å; I123-A258 HydrophobicContact CB-CB 4.08Å; I123-A258 HydrophobicContact CG2-CB 3.84Å
124	T	88.2	Confident	87.1	Confident	14 Å²	14	70.8 Å²	70.8	9%	0.086	34%	0.335	C	S	.	.	I	π-helix	trans	-62	-44.8	-179	-60.4	0	0	0	0	112.4	L120 Q121 I128 K129 Y262	L120-T124 PolarHBondContact O-N 3.49Å; L120-T124 PolarHBondContact O-OG1 2.78Å; Q121-T124 PolarHBondContact O-N 3.11Å; Q121-T124 VanDerWaalsContact O-N 3.16Å; T124-I128 PolarHBondContact O-N 3.45Å; T124-K129 HydrophobicContact CG2-CG 4.46Å; T124-K129 WeakPolarHBondContact O-CG 3.45Å; T124-K129 PolarHBondContact O-N 3.19Å; T124-Y262 HydrophobicContact CG2-CD2 3.63Å; T124-Y262 HydrophobicContact CG2-CE2 4.36Å; T124-Y262 HydrophobicContact CG2-CG 4.18Å
125	E	88.1	Confident	87.1	Confident	116 Å²	116	71.7 Å²	71.7	54%	0.542	34%	0.338	S	S	.	.	I	π-helix	trans	-75.1	-43.6	-177.1	-69.1	177.7	170.3	0	0	113.1	Q121 I123	Q121-E125 WeakPolarHBondContact O-CG 3.45Å; Q121-E125 PolarHBondContact O-N 2.88Å; I123-E125 PolarHBondContact O-N 3.49Å
126	N	88.5	Confident	87.1	Confident	70 Å²	70	73.2 Å²	73.2	37%	0.374	34%	0.338	S	S	.	.	I	π-helix	trans	-88.5	-26.7	-173.6	-64.3	-55.2	0	0	0	113.9	L114 Q122	L114-N126 HydrophobicContact CD2-CB 4.22Å; Q122-N126 VanDerWaalsContact O-CB 3.3Å; Q122-N126 WeakPolarHBondContact O-CB 3.42Å; Q122-N126 PolarHBondContact O-N 2.69Å; Q122-N126 VanDerWaalsContact O-N 3.09Å; Q122-N126 PolarHBondContact O-ND2 3Å
127	L	89.6	Confident	87.3	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.01	31%	0.306	C	S	.	.	I	π-helix	trans	-110.2	-63.5	179.8	-65.4	174.5	0	0	0	112.3	F107 I111 L114 I123 K130 Y131 L247 F255	F107-L127 HydrophobicContact CD2-CD2 4.47Å; F107-L127 HydrophobicContact CE2-CD2 3.94Å; I111-L127 HydrophobicContact CG1-CD2 4.15Å; L114-L127 HydrophobicContact CD1-CD1 3.39Å; L114-L127 HydrophobicContact CD1-CD2 4.49Å; L114-L127 HydrophobicContact CD1-CG 3.78Å; I123-L127 HydrophobicContact CG2-CD1 4.38Å; I123-L127 WeakPolarHBondContact O-CA 3.3Å; I123-L127 WeakPolarHBondContact O-CB 3.36Å; I123-L127 PolarHBondContact O-N 3.38Å; L127-K130 PolarHBondContact O-N 3.43Å; L127-Y131 HydrophobicContact CD2-CD2 4.23Å; L127-Y131 HydrophobicContact CD2-CE2 4.44Å; L127-Y131 WeakPolarHBondContact O-CB 3.49Å; L127-Y131 PolarHBondContact O-N 3.06Å; L127-L247 HydrophobicContact CD1-CD1 4.37Å; L127-L247 HydrophobicContact CD1-CD2 4.23Å; L127-F255 HydrophobicContact CB-CE2 4.18Å; L127-F255 HydrophobicContact CD1-CD2 4.39Å
128	I	89.6	Confident	87.3	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.021	27%	0.271	C	S	.	.	I	π-helix	trans	-66	-47.4	-166.7	-63.7	165.5	0	0	0	112.1	I123 T124 K130 G132 T133 F255 A258 A259 Y262	I123-I128 HydrophobicContact CG2-CD1 4.15Å; I123-I128 HydrophobicContact CG2-CG1 4.48Å; I123-I128 PolarHBondContact O-N 3.15Å; T124-I128 PolarHBondContact O-N 3.45Å; I128-K130 VanDerWaalsContact C-N 3.29Å; I128-K130 PolarHBondContact O-N 3.32Å; I128-G132 WeakPolarHBondContact O-CA 3.45Å; I128-G132 PolarHBondContact O-N 3.37Å; I128-T133 HydrophobicContact CG2-CG2 3.71Å; I128-F255 HydrophobicContact CD1-CD2 4.49Å; I128-F255 HydrophobicContact CD1-CE2 4.23Å; I128-F255 HydrophobicContact CG1-CD2 4.22Å; I128-F255 HydrophobicContact CG1-CE2 3.54Å; I128-F255 HydrophobicContact CG1-CZ 3.91Å; I128-A258 HydrophobicContact CD1-CB 3.78Å; I128-A259 HydrophobicContact CD1-CB 4.05Å; I128-Y262 HydrophobicContact CG2-CD1 3.56Å; I128-Y262 HydrophobicContact CG2-CE1 3.93Å; I128-Y262 HydrophobicContact CG2-CG 3.94Å
129	K	87.6	Confident	86.9	Confident	117 Å²	117	54.5 Å²	54.5	51%	0.509	27%	0.271	S	S	.	.	H	α-helix	trans	-66.4	-29.8	179.4	-75.4	-178.4	179.2	174.9	0	113.1	T124 Y262	T124-K129 HydrophobicContact CG2-CG 4.46Å; T124-K129 WeakPolarHBondContact O-CG 3.45Å; T124-K129 PolarHBondContact O-N 3.19Å; K129-Y262 HydrophobicContact CG-CE2 4.04Å
130	K	89.3	Confident	86.3	Confident	122 Å²	122	52.5 Å²	52.5	53%	0.53	26%	0.259	S	S	.	.	H	α-helix	trans	-90	-38.3	-174.7	-171.8	172.8	178.6	-177.6	0	113.4	N110 L127 I128	N110-K130 PolarHBondContact ND2-NZ 2.95Å; L127-K130 PolarHBondContact O-N 3.43Å; I128-K130 VanDerWaalsContact C-N 3.29Å; I128-K130 PolarHBondContact O-N 3.32Å
131	Y	88.8	Confident	85.7	Confident	71 Å²	71	52.9 Å²	52.9	28%	0.278	26%	0.261	S	S	.	.	H	α-helix	trans	-117.4	-7.7	-173.3	-59.2	-74.5	0	0	0	113.8	F107 N110 L127	F107-Y131 HydrophobicContact CB-CE1 4.43Å; F107-Y131 AromaticContact CD2-CD1 3.93Å; F107-Y131 HydrophobicContact CD2-CD1 3.93Å; F107-Y131 AromaticContact CD2-CD2 3.73Å; F107-Y131 HydrophobicContact CD2-CD2 3.73Å; F107-Y131 AromaticContact CD2-CE1 3.91Å; F107-Y131 HydrophobicContact CD2-CE1 3.91Å; F107-Y131 AromaticContact CD2-CE2 3.71Å; F107-Y131 HydrophobicContact CD2-CE2 3.71Å; F107-Y131 AromaticContact CD2-CG 3.84Å; F107-Y131 HydrophobicContact CD2-CG 3.84Å; F107-Y131 AromaticContact CD2-CZ 3.79Å; F107-Y131 HydrophobicContact CE2-CD1 4.45Å; F107-Y131 AromaticContact CE2-CD2 3.9Å; F107-Y131 HydrophobicContact CE2-CD2 3.9Å; F107-Y131 HydrophobicContact CE2-CE2 4.3Å; F107-Y131 AromaticContact CE2-CG 3.98Å; F107-Y131 HydrophobicContact CE2-CG 3.98Å; N110-Y131 PolarHBondContact ND2-OH 2.86Å; L127-Y131 HydrophobicContact CD2-CD2 4.23Å; L127-Y131 HydrophobicContact CD2-CE2 4.44Å; L127-Y131 WeakPolarHBondContact O-CB 3.49Å; L127-Y131 PolarHBondContact O-N 3.06Å
132	G	87.4	Confident	85	Confident	29 Å²	29	46.2 Å²	46.2	30%	0.299	23%	0.231	S	C	.	.			trans	82.5	-179.1	-175.6	0	0	0	0	0	113.5	I128	I128-G132 WeakPolarHBondContact O-CA 3.45Å; I128-G132 PolarHBondContact O-N 3.37Å
133	T	87.6	Confident	84.2	Confident	28 Å²	28	42.7 Å²	42.7	17%	0.172	22%	0.217	C	C	.	.	S	Bend	trans	-91.9	-21.3	177.2	51.3	0	0	0	0	112.9	I128 L243 A259 I263	I128-T133 HydrophobicContact CG2-CG2 3.71Å; T133-L243 WeakPolarHBondContact O-CB 3.46Å; T133-L243 PolarHBondContact O-N 2.92Å; T133-A259 HydrophobicContact CG2-CB 3.9Å; T133-I263 HydrophobicContact CG2-CD1 4.07Å
134	H	88.3	Confident	83.4	Confident	90 Å²	90	42.9 Å²	42.9	42%	0.417	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155.4	-175.4	-62.5	75.8	0	0	0	110.8	L240 Q241	H134-L240 HydrophobicContact CB-CB 3.98Å; H134-L240 HydrophobicContact CB-CD1 4.21Å; H134-L240 HydrophobicContact CB-CD2 4.43Å; H134-L240 HydrophobicContact CB-CG 4.44Å; H134-Q241 CarbonylContact C-O 3.43Å; H134-Q241 VanDerWaalsContact CA-O 3.25Å; H134-Q241 WeakPolarHBondContact CA-O 3.34Å; H134-Q241 WeakPolarHBondContact CB-O 3.37Å
135	F	85.9	Confident	83	Confident	32 Å²	32	43.1 Å²	43.1	14%	0.14	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	159.6	169.9	69.1	-83.8	0	0	0	110.7	V91 L137 L240 Q241 L243 L246	V91-F135 HydrophobicContact CG2-CD2 4.43Å; V91-F135 HydrophobicContact CG2-CE2 3.75Å; F135-L137 HydrophobicContact CE2-CD2 3.69Å; F135-L137 HydrophobicContact CE2-CG 4.5Å; F135-L137 HydrophobicContact CZ-CD2 4.23Å; F135-L240 WeakPolarHBondContact O-CA 3.45Å; F135-Q241 HydrophobicContact CD1-CB 4.49Å; F135-Q241 VanDerWaalsContact CD1-O 3.26Å; F135-Q241 WeakPolarHBondContact CD1-O 3.27Å; F135-Q241 HydrophobicContact CE1-CB 3.84Å; F135-Q241 HydrophobicContact CE1-CG 3.97Å; F135-Q241 HydrophobicContact CE2-CB 4.3Å; F135-Q241 HydrophobicContact CZ-CB 3.74Å; F135-Q241 HydrophobicContact CZ-CG 3.94Å; F135-Q241 PolarHBondContact N-O 3.34Å; F135-Q241 PolarHBondContact O-N 3.47Å; F135-L243 HydrophobicContact CB-CD1 4.43Å; F135-L243 HydrophobicContact CD1-CD1 4.1Å; F135-L246 HydrophobicContact CD1-CD1 3.92Å; F135-L246 HydrophobicContact CD1-CG 4.24Å; F135-L246 HydrophobicContact CE1-CD1 3.92Å; F135-L246 HydrophobicContact CE1-CD2 4.18Å; F135-L246 HydrophobicContact CE1-CG 3.8Å; F135-L246 HydrophobicContact CG-CD1 4.29Å; F135-L246 HydrophobicContact CZ-CD1 4.29Å; F135-L246 HydrophobicContact CZ-CD2 4.11Å; F135-L246 HydrophobicContact CZ-CG 4.22Å
136	L	84.3	Confident	82.6	Confident	67 Å²	67	37.7 Å²	37.7	35%	0.351	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	124.1	-175.2	-173.1	69.5	0	0	0	112.2	N88 S138 A139 I238 L240	N88-L136 PolarHBondContact ND2-O 3.26Å; L136-S138 WeakPolarHBondContact CD1-O 3.46Å; L136-A139 HydrophobicContact CD1-CB 3.97Å; L136-A139 HydrophobicContact CD2-CB 3.99Å; L136-A139 HydrophobicContact CG-CB 4.45Å; L136-I238 HydrophobicContact CD1-CG2 3.31Å; L136-L240 HydrophobicContact CD1-CD2 4.13Å
137	L	83.8	Confident	82.5	Confident	34 Å²	34	34.3 Å²	34.3	18%	0.178	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-54.8	170.7	-72	-175.8	0	0	0	112.3	N88 V91 F135 Q239 Q241	N88-L137 VanDerWaalsContact CB-O 3.25Å; N88-L137 WeakPolarHBondContact CB-O 3.2Å; N88-L137 PolarHBondContact N-O 2.79Å; V91-L137 HydrophobicContact CB-CD2 4.1Å; V91-L137 HydrophobicContact CG1-CD2 3.48Å; V91-L137 VanDerWaalsContact CG1-CD2 3.48Å; V91-L137 HydrophobicContact CG2-CD2 4.18Å; F135-L137 HydrophobicContact CE2-CD2 3.69Å; F135-L137 HydrophobicContact CE2-CG 4.5Å; F135-L137 HydrophobicContact CZ-CD2 4.23Å; L137-Q239 HydrophobicContact CB-CB 4.34Å; L137-Q239 HydrophobicContact CB-CG 4.21Å; L137-Q239 WeakPolarHBondContact CB-O 3.42Å; L137-Q239 HydrophobicContact CD1-CG 4.2Å; L137-Q239 PolarHBondContact N-O 3.21Å; L137-Q241 HydrophobicContact CD1-CB 3.64Å; L137-Q241 HydrophobicContact CD1-CG 4.48Å; L137-Q241 HydrophobicContact CD2-CB 4.08Å; L137-Q241 HydrophobicContact CG-CB 3.68Å
138	S	82.7	Confident	82.4	Confident	9 Å²	9	34.5 Å²	34.5	6%	0.063	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	147.7	174.7	68.5	0	0	0	0	109.4	V86 N87 L136 Q239	V86-S138 VanDerWaalsContact O-CA 3.26Å; V86-S138 WeakPolarHBondContact O-CA 3.47Å; N87-S138 VanDerWaalsContact OD1-CB 3.27Å; N87-S138 WeakPolarHBondContact OD1-CB 3.46Å; L136-S138 WeakPolarHBondContact CD1-O 3.46Å; S138-Q239 PolarHBondContact N-O 3.04Å; S138-Q239 PolarHBondContact O-N 3.27Å; S138-Q239 VanDerWaalsContact OG-CB 3.31Å; S138-Q239 WeakPolarHBondContact OG-CB 3.41Å; S138-Q239 PolarHBondContact OG-OE1 3.49Å
139	A	79.1	Confident	82.4	Confident	2 Å²	2	34.5 Å²	34.5	2%	0.017	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	150.7	171.9	0	0	0	0	0	109.2	V86 L136 L141 V231	V86-A139 PolarHBondContact N-O 2.82Å; V86-A139 PolarHBondContact O-N 3.37Å; L136-A139 HydrophobicContact CD1-CB 3.97Å; L136-A139 HydrophobicContact CD2-CB 3.99Å; L136-A139 HydrophobicContact CG-CB 4.45Å; A139-L141 HydrophobicContact CB-CD2 4.39Å; A139-V231 HydrophobicContact CB-CG1 4.31Å
140	T	76	Confident	82.4	Confident	32 Å²	32	29.6 Å²	29.6	20%	0.196	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	119	157.9	53.6	0	0	0	0	108.2	W84 N236 K237	W84-T140 WeakPolarHBondContact O-CA 3.31Å; T140-N236 WeakPolarHBondContact O-CB 3.48Å; T140-N236 PolarHBondContact O-OD1 2.91Å; T140-N236 WeakPolarHBondContact OG1-CA 3.35Å; T140-K237 HydrophobicContact CG2-CB 4.38Å; T140-K237 PolarHBondContact N-O 3.25Å; T140-K237 PolarHBondContact OG1-N 2.96Å
141	L	72.4	Confident	82.4	Confident	38 Å²	38	23.8 Å²	23.8	20%	0.199	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	131.4	169.9	-56.6	-173.6	0	0	0	108	W84 V86 A139 V229 V231	W84-L141 HydrophobicContact CB-CB 4.36Å; W84-L141 PolarHBondContact N-O 3.33Å; W84-L141 PolarHBondContact O-N 3.18Å; V86-L141 HydrophobicContact CB-CD1 4.16Å; V86-L141 HydrophobicContact CB-CG 4.27Å; V86-L141 HydrophobicContact CG2-CD1 3.41Å; V86-L141 VanDerWaalsContact CG2-CD1 3.41Å; V86-L141 HydrophobicContact CG2-CG 3.76Å; A139-L141 HydrophobicContact CB-CD2 4.39Å; L141-V229 VanDerWaalsContact C-CG1 3.45Å; L141-V229 HydrophobicContact CB-CB 4.24Å; L141-V229 HydrophobicContact CB-CG1 3.5Å; L141-V231 HydrophobicContact CD2-CB 4.26Å; L141-V231 HydrophobicContact CD2-CG2 3.24Å
142	G	71	Confident	82.3	Confident	7 Å²	7	20.9 Å²	20.9	7%	0.072	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	-176.2	173.3	0	0	0	0	0	112.1	F81 G82 V229	F81-G142 WeakPolarHBondContact O-CA 3.14Å; G82-G142 WeakPolarHBondContact O-CA 3.38Å; G142-V229 VanDerWaalsContact CA-CG1 3.45Å; G142-V229 WeakPolarHBondContact O-CG1 2.98Å
143	G	71.2	Confident	81.9	Confident	9 Å²	9	25 Å²	25	9%	0.093	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	152.6	165.9	0	0	0	0	0	110.9	E80 F81 T212	E80-G143 CarbonylContact C-O 3.53Å; E80-G143 WeakPolarHBondContact CA-O 3.33Å; F81-G143 PolarHBondContact N-O 2.9Å; F81-G143 PolarHBondContact O-N 2.92Å; G143-T212 CarbonylContact C-O 3.6Å; G143-T212 WeakPolarHBondContact CA-O 3.41Å
144	E	72.9	Confident	81.4	Confident	7 Å²	7	32.7 Å²	32.7	3%	0.033	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.7	174.5	-175.5	-174.7	166.5	0	0	109.3	K76 S146 R211 T212	K76-E144 WeakPolarHBondContact CE-OE1 3.5Å; K76-E144 IonicContact NZ-OE1 2.75Å; K76-E144 PolarHBondContact NZ-OE1 3.27Å; E144-S146 WeakPolarHBondContact OE1-CB 3.18Å; E144-R211 WeakPolarHBondContact O-CA 3.27Å; E144-T212 PolarHBondContact N-O 3.26Å; E144-T212 PolarHBondContact O-N 2.96Å; E144-T212 PolarHBondContact O-OG1 3.26Å
145	E	78.3	Confident	80.7	Confident	20 Å²	20	33 Å²	33	9%	0.093	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117.7	160.4	173.8	175.4	-138.8	0	0	108	Y78 R79 F81 Y184 F185 R211	Y78-E145 CarbonylContact C-O 3.51Å; Y78-E145 VanDerWaalsContact CA-O 3.29Å; Y78-E145 WeakPolarHBondContact CA-O 3.22Å; R79-E145 PolarHBondContact N-O 3.19Å; R79-E145 PolarHBondContact O-N 2.98Å; F81-E145 HydrophobicContact CE2-CB 3.53Å; F81-E145 HydrophobicContact CZ-CB 4.1Å; F81-E145 WeakPolarHBondContact CZ-OE2 3.45Å; E145-Y184 HydrophobicContact CG-CE1 4Å; E145-Y184 WeakPolarHBondContact CG-OH 3Å; E145-Y184 PolarHBondContact OE1-OH 2.69Å; E145-F185 HydrophobicContact CG-CE1 4.28Å; E145-R211 HydrophobicContact CB-CG 4.38Å; E145-R211 HydrophobicContact CG-CG 4.12Å; E145-R211 IonicContact OE1-CZ 2.8Å; E145-R211 VanDerWaalsContact OE1-CZ 3.24Å; E145-R211 IonicContact OE1-NE 3.21Å; E145-R211 PolarHBondContact OE1-NE 3.46Å; E145-R211 IonicContact OE1-NH2 3.84Å; E145-R211 PolarHBondContact OE1-NH2 3.47Å
146	S	81.1	Confident	80	Confident	1 Å²	1	33 Å²	33	1%	0.007	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142	176.8	89.1	0	0	0	0	113	I77 Y78 E144 T210	I77-S146 CarbonylContact O-C 3.43Å; I77-S146 VanDerWaalsContact O-CA 3.22Å; I77-S146 WeakPolarHBondContact O-CA 3.48Å; I77-S146 WeakPolarHBondContact O-CB 3.39Å; Y78-S146 VanDerWaalsContact CB-CB 3.44Å; E144-S146 WeakPolarHBondContact OE1-CB 3.18Å; S146-T210 PolarHBondContact N-O 3.4Å; S146-T210 PolarHBondContact O-N 2.93Å; S146-T210 PolarHBondContact O-OG1 3.22Å; S146-T210 PolarHBondContact OG-OG1 3.4Å
147	L	86.8	Confident	78.8	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.4	170.5	-179.7	72.1	0	0	0	107.9	I77 I149 Y184 L192 L195 V207	I77-L147 HydrophobicContact CD1-CB 4.14Å; I77-L147 HydrophobicContact CD1-CD2 4.04Å; I77-L147 HydrophobicContact CG1-CB 3.74Å; I77-L147 HydrophobicContact CG1-CD2 4.38Å; I77-L147 PolarHBondContact N-O 3.4Å; I77-L147 PolarHBondContact O-N 3.02Å; L147-I149 HydrophobicContact CD2-CD1 4.02Å; L147-I149 HydrophobicContact CD2-CG1 4.24Å; L147-I149 HydrophobicContact CG-CD1 4.44Å; L147-I149 HydrophobicContact CG-CG1 4.11Å; L147-Y184 HydrophobicContact CB-CD1 3.96Å; L147-Y184 HydrophobicContact CB-CD2 4.4Å; L147-Y184 HydrophobicContact CB-CE1 3.88Å; L147-Y184 HydrophobicContact CB-CE2 4.32Å; L147-Y184 HydrophobicContact CB-CG 4.22Å; L147-Y184 HydrophobicContact CD1-CD2 4.43Å; L147-Y184 HydrophobicContact CD1-CE2 4.24Å; L147-Y184 HydrophobicContact CD2-CD1 4.34Å; L147-Y184 HydrophobicContact CD2-CD2 3.83Å; L147-Y184 HydrophobicContact CD2-CE2 4.41Å; L147-Y184 HydrophobicContact CD2-CG 3.79Å; L147-Y184 HydrophobicContact CG-CD2 4.46Å; L147-L192 HydrophobicContact CD1-CD2 3.83Å; L147-L195 HydrophobicContact CD1-CD1 4.49Å; L147-L195 HydrophobicContact CD2-CD1 3.71Å; L147-V207 HydrophobicContact CD1-CG1 3.43Å; L147-V207 VanDerWaalsContact CD1-CG1 3.43Å; L147-V207 HydrophobicContact CG-CG1 4.46Å
148	T	87.3	Confident	77.5	Confident	6 Å²	6	40.1 Å²	40.1	4%	0.037	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127	171.8	-59.2	0	0	0	0	109.9	R74 Y75 F150 V207 T208	R74-T148 HydrophobicContact CG-CG2 3.67Å; Y75-T148 CarbonylContact O-C 3.53Å; Y75-T148 VanDerWaalsContact O-CA 3.29Å; Y75-T148 WeakPolarHBondContact O-CA 3.24Å; T148-F150 HydrophobicContact CG2-CD2 4.11Å; T148-F150 HydrophobicContact CG2-CE2 3.57Å; T148-F150 HydrophobicContact CG2-CZ 3.84Å; T148-V207 WeakPolarHBondContact O-CA 3.14Å; T148-T208 WeakPolarHBondContact CB-OG1 3.33Å; T148-T208 PolarHBondContact N-O 3.4Å; T148-T208 PolarHBondContact O-N 2.93Å; T148-T208 PolarHBondContact O-OG1 3.36Å
149	I	88.9	Confident	76	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	113.7	177.9	-50.7	175.8	0	0	0	108.1	Y75 L147 V151 A181 L195 I205 V207	Y75-I149 PolarHBondContact N-O 2.92Å; Y75-I149 PolarHBondContact O-N 3.12Å; L147-I149 HydrophobicContact CD2-CD1 4.02Å; L147-I149 HydrophobicContact CD2-CG1 4.24Å; L147-I149 HydrophobicContact CG-CD1 4.44Å; L147-I149 HydrophobicContact CG-CG1 4.11Å; I149-V151 HydrophobicContact CG2-CG2 3.83Å; I149-A181 HydrophobicContact CD1-CB 4.17Å; I149-L195 HydrophobicContact CD1-CD1 4.19Å; I149-L195 HydrophobicContact CD1-CD2 4.16Å; I149-I205 HydrophobicContact CG2-CB 4.2Å; I149-I205 HydrophobicContact CG2-CG2 4.49Å; I149-V207 HydrophobicContact CG2-CG2 4.38Å
150	F	88.3	Confident	74.6	Confident	13 Å²	13	51.9 Å²	51.9	6%	0.057	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	135.9	169.8	-63	-89.7	0	0	0	109.5	F63 R66 F71 T73 R74 T148 I205 K206	F63-F150 HydrophobicContact CD2-CE1 4.03Å; R66-F150 HydrophobicContact CB-CD1 3.98Å; R66-F150 HydrophobicContact CB-CE1 4.12Å; R66-F150 HydrophobicContact CB-CG 4.4Å; R66-F150 HydrophobicContact CG-CD1 4.24Å; R66-F150 HydrophobicContact CG-CD2 4.44Å; R66-F150 HydrophobicContact CG-CE1 4.16Å; R66-F150 HydrophobicContact CG-CE2 4.37Å; R66-F150 HydrophobicContact CG-CG 4.37Å; R66-F150 HydrophobicContact CG-CZ 4.23Å; F71-F150 HydrophobicContact CB-CB 3.92Å; F71-F150 HydrophobicContact CD1-CB 3.99Å; F71-F150 HydrophobicContact CG-CB 3.9Å; T73-F150 CarbonylContact O-C 3.53Å; T73-F150 WeakPolarHBondContact O-CA 3.48Å; R74-F150 HydrophobicContact CB-CD1 4.15Å; R74-F150 HydrophobicContact CB-CE1 4.14Å; R74-F150 HydrophobicContact CG-CD1 4.24Å; R74-F150 HydrophobicContact CG-CE1 3.9Å; R74-F150 HydrophobicContact CG-CZ 4.31Å; T148-F150 HydrophobicContact CG2-CD2 4.11Å; T148-F150 HydrophobicContact CG2-CE2 3.57Å; T148-F150 HydrophobicContact CG2-CZ 3.84Å; F150-I205 CarbonylContact O-C 3.59Å; F150-I205 WeakPolarHBondContact O-CA 3.3Å; F150-K206 HydrophobicContact CB-CB 4.2Å; F150-K206 PolarHBondContact N-O 3.49Å; F150-K206 PolarHBondContact O-N 3.44Å
151	V	88.1	Confident	73.1	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	126.1	-169	179.6	0	0	0	0	110.3	S72 T73 Y75 I149 L156 L177 I205	S72-V151 PolarHBondContact N-O 2.83Å; S72-V151 PolarHBondContact OG-O 2.9Å; T73-V151 PolarHBondContact N-O 2.95Å; T73-V151 VanDerWaalsContact N-O 3.1Å; T73-V151 PolarHBondContact O-N 3.05Å; T73-V151 WeakPolarHBondContact OG1-CB 3.43Å; T73-V151 PolarHBondContact OG1-O 3.39Å; T73-V151 VanDerWaalsContact OG1-O 3.06Å; Y75-V151 HydrophobicContact CD2-CG2 3.79Å; Y75-V151 HydrophobicContact CE2-CB 4.42Å; Y75-V151 HydrophobicContact CE2-CG2 3.95Å; I149-V151 HydrophobicContact CG2-CG2 3.83Å; V151-L156 HydrophobicContact CG1-CD1 3.13Å; V151-L177 HydrophobicContact CG2-CD1 4.48Å; V151-I205 HydrophobicContact CG2-CG2 4.17Å
152	D	86.4	Confident	72.2	Confident	10 Å²	10	60.3 Å²	60.3	5%	0.053	30%	0.304	C	S	.	.			trans	-91.7	103	169.8	-179.5	-10.2	0	0	0	109.1	G70 F71 R154 K155 L156 A204	G70-D152 VanDerWaalsContact O-CG 3.27Å; F71-D152 HydrophobicContact CD1-CB 4.1Å; F71-D152 HydrophobicContact CE1-CB 4.44Å; D152-R154 PolarHBondContact O-N 3.34Å; D152-R154 WeakPolarHBondContact OD1-CB 3.33Å; D152-R154 PolarHBondContact OD1-N 3.41Å; D152-K155 HydrophobicContact CB-CB 4.46Å; D152-K155 HydrophobicContact CB-CD 4.48Å; D152-K155 PolarHBondContact O-N 3.29Å; D152-K155 VanDerWaalsContact OD2-CD 3.24Å; D152-K155 WeakPolarHBondContact OD2-CD 3.3Å; D152-K155 WeakPolarHBondContact OD2-CE 3.37Å; D152-K155 VanDerWaalsContact OD2-CG 3.3Å; D152-K155 WeakPolarHBondContact OD2-CG 3.48Å; D152-L156 PolarHBondContact O-N 3.31Å; D152-A204 PolarHBondContact N-O 3.08Å
153	K	79.6	Confident	70.8	Confident	115 Å²	115	65.3 Å²	65.3	50%	0.5	34%	0.338	S	S	.	.	H	α-helix	trans	-59.5	-30.5	-178.8	-77	179.4	169.3	173.6	0	113.1	S72 T73 S157	S72-K153 WeakPolarHBondContact OG-CG 3.21Å; T73-K153 HydrophobicContact CG2-CD 4.19Å; K153-S157 WeakPolarHBondContact O-CB 3.48Å; K153-S157 PolarHBondContact O-N 2.94Å; K153-S157 PolarHBondContact O-OG 2.03Å
154	R	76.5	Confident	69.4	Low	189 Å²	189	71.8 Å²	71.8	71%	0.713	37%	0.371	S	S	*	.	H	α-helix	trans	-72.6	-39	-174.5	-56.5	173.9	179.2	175.4	0.2	111.4	D152 S157 K158	D152-R154 PolarHBondContact O-N 3.34Å; D152-R154 WeakPolarHBondContact OD1-CB 3.33Å; D152-R154 PolarHBondContact OD1-N 3.41Å; R154-S157 PolarHBondContact O-OG 2.97Å; R154-K158 WeakPolarHBondContact O-CB 3.36Å; R154-K158 WeakPolarHBondContact O-CG 3.15Å; R154-K158 PolarHBondContact O-N 3.38Å
155	K	74.6	Confident	68.1	Low	97 Å²	97	77.5 Å²	77.5	42%	0.422	41%	0.411	S	S	.	.	H	α-helix	trans	-76.6	-28.6	178.9	-70.4	-179.9	-174.4	178.6	0	112.6	D152 A204	D152-K155 HydrophobicContact CB-CB 4.46Å; D152-K155 HydrophobicContact CB-CD 4.48Å; D152-K155 PolarHBondContact O-N 3.29Å; D152-K155 VanDerWaalsContact OD2-CD 3.24Å; D152-K155 WeakPolarHBondContact OD2-CD 3.3Å; D152-K155 WeakPolarHBondContact OD2-CE 3.37Å; D152-K155 VanDerWaalsContact OD2-CG 3.3Å; D152-K155 WeakPolarHBondContact OD2-CG 3.48Å; K155-A204 HydrophobicContact CB-CB 3.8Å
156	L	71.4	Confident	66.7	Low	32 Å²	32	81.6 Å²	81.6	17%	0.168	44%	0.442	C	S	.	.	H	α-helix	trans	-72	-40.3	172.1	-90.2	145.8	0	0	0	112.7	V151 D152 V172 L177 A204 I205	V151-L156 HydrophobicContact CG1-CD1 3.13Å; D152-L156 PolarHBondContact O-N 3.31Å; L156-V172 HydrophobicContact CD2-CG1 4.22Å; L156-V172 WeakPolarHBondContact CD2-O 3.36Å; L156-L177 HydrophobicContact CD1-CD1 4.21Å; L156-L177 HydrophobicContact CD2-CD1 4.28Å; L156-A204 HydrophobicContact CD1-CB 4.19Å; L156-A204 HydrophobicContact CG-CB 3.93Å; L156-I205 HydrophobicContact CD1-CG2 4.41Å
157	S	59	Low	65.2	Low	74 Å²	74	87.1 Å²	87.1	52%	0.517	48%	0.476	S	S	.	.	H	α-helix	trans	-75.1	-35	-179.3	67.1	0	0	0	0	113.5	K153 R154 R159 A160	K153-S157 WeakPolarHBondContact O-CB 3.48Å; K153-S157 PolarHBondContact O-N 2.94Å; K153-S157 PolarHBondContact O-OG 2.03Å; R154-S157 PolarHBondContact O-OG 2.97Å; S157-R159 PolarHBondContact O-N 3.21Å; S157-R159 VanDerWaalsContact O-N 3.16Å; S157-A160 PolarHBondContact O-N 3.36Å
158	K	55.2	Low	63.3	Low	177 Å²	177	95.9 Å²	95.9	77%	0.77	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.7	-177.5	-84.6	-175.6	175.7	-169.7	0	115	R154	R154-K158 WeakPolarHBondContact O-CB 3.36Å; R154-K158 WeakPolarHBondContact O-CG 3.15Å; R154-K158 PolarHBondContact O-N 3.38Å
159	R	52.2	Low	61.4	Low	171 Å²	171	100 Å²	100	65%	0.645	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-1.5	179.6	-126.8	178.2	-175.7	168.2	2.2	113.6	S157 A201	S157-R159 PolarHBondContact O-N 3.21Å; S157-R159 VanDerWaalsContact O-N 3.16Å; R159-A201 PolarHBondContact NH1-O 2.76Å
160	A	49.3	Very low	59.9	Low	86 Å²	86	103.7 Å²	103.7	71%	0.711	58%	0.578	S	S	*	*	S	Bend	trans	-87	-17.3	179	0	0	0	0	0	113.8	S157	S157-A160 PolarHBondContact O-N 3.36Å
161	E	44.5	Very low	58.5	Low	191 Å²	191	107.3 Å²	107.3	89%	0.893	61%	0.605	S	S	*	*	S	Bend	trans	-115.7	12.7	-172.4	-73.6	-176.3	164.2	0	0	115.2
162	G	53.6	Low	57.5	Low	56 Å²	56	109.2 Å²	109.2	58%	0.577	62%	0.616	S	S	*	*			trans	-173.8	98.2	173	0	0	0	0	0	115.1
163	S	41.6	Very low	56.9	Low	113 Å²	113	111.6 Å²	111.6	79%	0.79	63%	0.631	S	S	*	*				174.5	145.9	129.7	61.5	0	0	0	0	111.7
164	D	41.8	Very low	56.9	Low	145 Å²	145	109.6 Å²	109.6	78%	0.775	63%	0.626	S	S	*	*			trans	-41.5	148.5	-177.2	-62.9	-58.9	0	0	0	118.7	S166	D164-S166 PolarHBondContact O-N 3.1Å
165	S	45.7	Very low	57.1	Low	126 Å²	126	107.4 Å²	107.4	88%	0.881	62%	0.624	S	S	*	*	S	Bend	trans	-65	78.8	171.9	54.9	0	0	0	0	113.6
166	S	49.4	Very low	57.4	Low	107 Å²	107	104.7 Å²	104.7	75%	0.748	62%	0.615	S	S	*	*			trans	-155.6	21.8	166.1	65.8	0	0	0	0	117.1	D164	D164-S166 PolarHBondContact O-N 3.1Å
167	T	48.4	Very low	58.1	Low	116 Å²	116	103.3 Å²	103.3	71%	0.712	61%	0.608	S	S	*	*			trans	-141	119.6	167.8	3.4	0	0	0	0	111.2	S169	T167-S169 PolarHBondContact O-N 3.16Å
168	N	46.9	Very low	59.2	Low	185 Å²	185	103.8 Å²	103.8	99%	0.989	60%	0.602	S	S	*	*			trans	-69.2	49.2	176.6	-74.1	-19	0	0	0	112.5
169	S	48.2	Very low	60.7	Low	91 Å²	91	101.8 Å²	101.8	64%	0.636	60%	0.596	S	S	*	*			trans	-100.6	101.5	162.3	59	0	0	0	0	106.9	T167 S171	T167-S169 PolarHBondContact O-N 3.16Å; S169-S171 PolarHBondContact O-N 3.27Å
170	S	56.8	Low	62.3	Low	82 Å²	82	94.5 Å²	94.5	57%	0.573	57%	0.569	S	S	*	*			trans	-43.3	115.5	173.6	54.5	0	0	0	0	109.2	V172	S170-V172 PolarHBondContact O-N 2.66Å; S170-V172 VanDerWaalsContact O-N 3.1Å
171	S	58.8	Low	64	Low	89 Å²	89	90.9 Å²	90.9	62%	0.622	54%	0.539	S	S	*	.			trans	-52.4	121	175	46.4	0	0	0	0	108	S169 T173	S169-S171 PolarHBondContact O-N 3.27Å; S171-T173 PolarHBondContact O-N 3.02Å; S171-T173 VanDerWaalsContact O-N 3.07Å
172	V	66.9	Low	66	Low	41 Å²	41	85.2 Å²	85.2	25%	0.248	53%	0.525	C	S	.	.			trans	-75.3	104.3	-175.1	177.7	0	0	0	0	107.2	L156 S170 L177 I198	L156-V172 HydrophobicContact CD2-CG1 4.22Å; L156-V172 WeakPolarHBondContact CD2-O 3.36Å; S170-V172 PolarHBondContact O-N 2.66Å; S170-V172 VanDerWaalsContact O-N 3.1Å; V172-L177 HydrophobicContact CG1-CD1 4.32Å; V172-L177 HydrophobicContact CG1-CD2 4.16Å; V172-L177 HydrophobicContact CG1-CG 3.99Å; V172-I198 HydrophobicContact CB-CG2 4.43Å; V172-I198 HydrophobicContact CG1-CD1 4.31Å; V172-I198 HydrophobicContact CG1-CG2 3.84Å; V172-I198 HydrophobicContact CG2-CD1 4.2Å; V172-I198 HydrophobicContact CG2-CG1 3.96Å; V172-I198 HydrophobicContact CG2-CG2 3.99Å
173	T	75.4	Confident	67.6	Low	60 Å²	60	84.3 Å²	84.3	37%	0.368	51%	0.51	S	S	.	.			trans	-91.6	161.6	173.9	65.4	0	0	0	0	110.6	S171 E175 T176 L177	S171-T173 PolarHBondContact O-N 3.02Å; S171-T173 VanDerWaalsContact O-N 3.07Å; T173-E175 PolarHBondContact O-N 3.12Å; T173-T176 PolarHBondContact N-OG1 3.31Å; T173-T176 VanDerWaalsContact N-OG1 3.14Å; T173-T176 PolarHBondContact O-N 3.14Å; T173-T176 VanDerWaalsContact O-N 3.1Å; T173-T176 PolarHBondContact O-OG1 2.8Å; T173-T176 WeakPolarHBondContact OG1-CG2 3.38Å; T173-T176 PolarHBondContact OG1-N 3.47Å; T173-L177 PolarHBondContact O-N 3.27Å
174	L	78.2	Confident	69.7	Low	73 Å²	73	79 Å²	79	38%	0.382	47%	0.472	S	S	.	.	H	α-helix	trans	-57.3	-34.8	176.5	-171.5	65.1	0	0	0	112.1	Y75 L177 H178	Y75-L174 HydrophobicContact CE2-CD1 3.99Å; L174-L177 PolarHBondContact O-N 3.22Å; L174-H178 PolarHBondContact O-N 3.07Å; L174-H178 VanDerWaalsContact O-N 3.1Å
175	E	80.3	Confident	71.6	Confident	143 Å²	143	75.3 Å²	75.3	67%	0.668	45%	0.45	S	S	*	.	H	α-helix	trans	-65.5	-40.2	176.9	-66.3	170.3	-177.8	0	0	112.1	T173 L177 H178 Q179	T173-E175 PolarHBondContact O-N 3.12Å; E175-L177 VanDerWaalsContact C-N 3.29Å; E175-L177 PolarHBondContact O-N 3Å; E175-H178 PolarHBondContact O-N 3.09Å; E175-Q179 WeakPolarHBondContact O-CG 3.47Å; E175-Q179 PolarHBondContact O-N 3.11Å
176	T	82.8	Confident	73.5	Confident	40 Å²	40	76.6 Å²	76.6	25%	0.245	45%	0.445	C	S	.	.	H	α-helix	trans	-63.9	-34.8	175.7	63.1	0	0	0	0	112.2	T173 Q179 L180	T173-T176 PolarHBondContact N-OG1 3.31Å; T173-T176 VanDerWaalsContact N-OG1 3.14Å; T173-T176 PolarHBondContact O-N 3.14Å; T173-T176 VanDerWaalsContact O-N 3.1Å; T173-T176 PolarHBondContact O-OG1 2.8Å; T173-T176 WeakPolarHBondContact OG1-CG2 3.38Å; T173-T176 PolarHBondContact OG1-N 3.47Å; T176-Q179 PolarHBondContact O-N 2.75Å; T176-L180 WeakPolarHBondContact O-CB 3.41Å; T176-L180 VanDerWaalsContact O-CG 3.26Å; T176-L180 WeakPolarHBondContact O-CG 3.5Å; T176-L180 PolarHBondContact O-N 3.37Å
177	L	84.6	Confident	75.2	Confident	3 Å²	3	75.4 Å²	75.4	2%	0.016	43%	0.43	C	S	.	.	H	α-helix	trans	-68.2	-38.8	174.5	-70.6	170.3	0	0	0	111.8	V151 L156 V172 T173 L174 E175 L180 A181 L195 I198 I205	V151-L177 HydrophobicContact CG2-CD1 4.48Å; L156-L177 HydrophobicContact CD1-CD1 4.21Å; L156-L177 HydrophobicContact CD2-CD1 4.28Å; V172-L177 HydrophobicContact CG1-CD1 4.32Å; V172-L177 HydrophobicContact CG1-CD2 4.16Å; V172-L177 HydrophobicContact CG1-CG 3.99Å; T173-L177 PolarHBondContact O-N 3.27Å; L174-L177 PolarHBondContact O-N 3.22Å; E175-L177 VanDerWaalsContact C-N 3.29Å; E175-L177 PolarHBondContact O-N 3Å; L177-L180 PolarHBondContact O-N 3.13Å; L177-A181 VanDerWaalsContact O-CB 3.3Å; L177-A181 WeakPolarHBondContact O-CB 3.44Å; L177-A181 PolarHBondContact O-N 3.32Å; L177-L195 HydrophobicContact CD2-CD2 4Å; L177-I198 HydrophobicContact CD2-CD1 4.49Å; L177-I198 HydrophobicContact CD2-CG2 4.46Å; L177-I205 HydrophobicContact CD1-CG2 3.73Å; L177-I205 HydrophobicContact CD2-CD1 3.84Å; L177-I205 HydrophobicContact CD2-CG2 4.14Å
178	H	83.7	Confident	76.9	Confident	84 Å²	84	73.3 Å²	73.3	39%	0.389	41%	0.409	S	S	.	.	H	α-helix	trans	-65.3	-41.2	174.6	-72.4	179.5	0	0	0	112.1	Y75 L174 E175 A181 A182	Y75-H178 AromaticContact CD1-NE2 3.82Å; Y75-H178 AromaticContact CE1-NE2 3.23Å; Y75-H178 WeakPolarHBondContact CE1-NE2 3.35Å; Y75-H178 AromaticContact CE2-NE2 4Å; Y75-H178 AromaticContact CZ-NE2 3.34Å; Y75-H178 VanDerWaalsContact CZ-NE2 3.34Å; L174-H178 PolarHBondContact O-N 3.07Å; L174-H178 VanDerWaalsContact O-N 3.1Å; E175-H178 PolarHBondContact O-N 3.09Å; H178-A181 PolarHBondContact O-N 3.15Å; H178-A182 WeakPolarHBondContact O-CB 3.31Å; H178-A182 PolarHBondContact O-N 3.42Å
179	Q	85.5	Confident	78.6	Confident	136 Å²	136	68.2 Å²	68.2	64%	0.636	38%	0.382	S	S	*	.	H	α-helix	trans	-63.6	-44	175.3	-72.2	177.3	-5.1	0	0	111.9	E175 T176 A181 A182 S183	E175-Q179 WeakPolarHBondContact O-CG 3.47Å; E175-Q179 PolarHBondContact O-N 3.11Å; T176-Q179 PolarHBondContact O-N 2.75Å; Q179-A181 VanDerWaalsContact C-N 3.35Å; Q179-A182 PolarHBondContact O-N 2.96Å; Q179-S183 PolarHBondContact O-N 3.49Å; Q179-S183 PolarHBondContact O-OG 3.46Å
180	L	86.4	Confident	80.5	Confident	18 Å²	18	66.1 Å²	66.1	9%	0.094	37%	0.367	C	S	.	.	H	α-helix	trans	-65.6	-37.3	176.6	-71.6	172.3	0	0	0	112.7	T176 L177 S183 Y184 R194 L195 I198	T176-L180 WeakPolarHBondContact O-CB 3.41Å; T176-L180 VanDerWaalsContact O-CG 3.26Å; T176-L180 WeakPolarHBondContact O-CG 3.5Å; T176-L180 PolarHBondContact O-N 3.37Å; L177-L180 PolarHBondContact O-N 3.13Å; L180-S183 WeakPolarHBondContact CA-OG 3.19Å; L180-S183 PolarHBondContact O-N 3.16Å; L180-S183 PolarHBondContact O-OG 3.39Å; L180-S183 VanDerWaalsContact O-OG 3.04Å; L180-Y184 PolarHBondContact O-N 2.73Å; L180-R194 HydrophobicContact CD1-CG 4.09Å; L180-R194 HydrophobicContact CD2-CB 4.39Å; L180-R194 HydrophobicContact CD2-CG 4.09Å; L180-L195 HydrophobicContact CB-CD2 4.15Å; L180-L195 HydrophobicContact CB-CG 4.44Å; L180-L195 HydrophobicContact CD1-CD2 4.14Å; L180-I198 HydrophobicContact CD1-CD1 3.55Å
181	A	85.3	Confident	81.9	Confident	9 Å²	9	62.3 Å²	62.3	7%	0.074	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-47	172.2	0	0	0	0	0	110.3	I77 I149 L177 H178 Q179 S183 Y184	I77-A181 HydrophobicContact CD1-CB 3.99Å; I77-A181 WeakPolarHBondContact CD1-O 3.47Å; I149-A181 HydrophobicContact CD1-CB 4.17Å; L177-A181 VanDerWaalsContact O-CB 3.3Å; L177-A181 WeakPolarHBondContact O-CB 3.44Å; L177-A181 PolarHBondContact O-N 3.32Å; H178-A181 PolarHBondContact O-N 3.15Å; Q179-A181 VanDerWaalsContact C-N 3.35Å; A181-S183 VanDerWaalsContact C-N 3.28Å; A181-S183 PolarHBondContact O-N 3.22Å; A181-Y184 WeakPolarHBondContact O-CB 3.46Å; A181-Y184 PolarHBondContact O-N 3.3Å; A181-Y184 VanDerWaalsContact O-N 3.11Å
182	A	85.1	Confident	83.2	Confident	72 Å²	72	58.8 Å²	58.8	60%	0.595	32%	0.315	S	S	*	.	H	α-helix	trans	-60.6	-35.5	178.4	0	0	0	0	0	113	H178 Q179 Y184	H178-A182 WeakPolarHBondContact O-CB 3.31Å; H178-A182 PolarHBondContact O-N 3.42Å; Q179-A182 PolarHBondContact O-N 2.96Å; A182-Y184 VanDerWaalsContact C-N 3.31Å; A182-Y184 PolarHBondContact O-N 2.96Å
183	S	87.1	Confident	84.3	Confident	37 Å²	37	64.4 Å²	64.4	26%	0.259	33%	0.331	S	S	.	.	H	α-helix	trans	-79.7	-8.3	178.7	61.1	0	0	0	0	114.3	Q179 L180 A181 F185 I186 D187 T191	Q179-S183 PolarHBondContact O-N 3.49Å; Q179-S183 PolarHBondContact O-OG 3.46Å; L180-S183 WeakPolarHBondContact CA-OG 3.19Å; L180-S183 PolarHBondContact O-N 3.16Å; L180-S183 PolarHBondContact O-OG 3.39Å; L180-S183 VanDerWaalsContact O-OG 3.04Å; A181-S183 VanDerWaalsContact C-N 3.28Å; A181-S183 PolarHBondContact O-N 3.22Å; S183-F185 VanDerWaalsContact C-N 3.33Å; S183-F185 PolarHBondContact O-N 2.96Å; S183-I186 PolarHBondContact O-N 2.89Å; S183-D187 PolarHBondContact O-N 3.38Å; S183-T191 WeakPolarHBondContact OG-CG2 3.44Å
184	Y	86.8	Confident	84.8	Confident	1 Å²	1	68.4 Å²	68.4	0%	0.004	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-42.1	-176.1	170.8	-104.7	0	0	0	113.2	I77 E145 L147 L180 A181 A182 I186 R188 L192 E209	I77-Y184 HydrophobicContact CD1-CD1 4.02Å; I77-Y184 HydrophobicContact CD1-CG 4.3Å; E145-Y184 HydrophobicContact CG-CE1 4Å; E145-Y184 WeakPolarHBondContact CG-OH 3Å; E145-Y184 PolarHBondContact OE1-OH 2.69Å; L147-Y184 HydrophobicContact CB-CD1 3.96Å; L147-Y184 HydrophobicContact CB-CD2 4.4Å; L147-Y184 HydrophobicContact CB-CE1 3.88Å; L147-Y184 HydrophobicContact CB-CE2 4.32Å; L147-Y184 HydrophobicContact CB-CG 4.22Å; L147-Y184 HydrophobicContact CD1-CD2 4.43Å; L147-Y184 HydrophobicContact CD1-CE2 4.24Å; L147-Y184 HydrophobicContact CD2-CD1 4.34Å; L147-Y184 HydrophobicContact CD2-CD2 3.83Å; L147-Y184 HydrophobicContact CD2-CE2 4.41Å; L147-Y184 HydrophobicContact CD2-CG 3.79Å; L147-Y184 HydrophobicContact CG-CD2 4.46Å; L180-Y184 PolarHBondContact O-N 2.73Å; A181-Y184 WeakPolarHBondContact O-CB 3.46Å; A181-Y184 PolarHBondContact O-N 3.3Å; A181-Y184 VanDerWaalsContact O-N 3.11Å; A182-Y184 VanDerWaalsContact C-N 3.31Å; A182-Y184 PolarHBondContact O-N 2.96Å; Y184-I186 VanDerWaalsContact C-N 3.26Å; Y184-I186 PolarHBondContact O-N 3.48Å; Y184-R188 HydrophobicContact CD2-CG 4.1Å; Y184-R188 HydrophobicContact CE2-CG 3.56Å; Y184-R188 VanDerWaalsContact O-CA 3.29Å; Y184-R188 WeakPolarHBondContact O-CA 3.17Å; Y184-R188 PolarHBondContact O-N 3.24Å; Y184-L192 HydrophobicContact CD2-CG 4.28Å; Y184-L192 HydrophobicContact CE2-CD1 4.08Å; Y184-L192 HydrophobicContact CE2-CD2 4.07Å; Y184-L192 HydrophobicContact CE2-CG 3.87Å; Y184-E209 WeakPolarHBondContact OH-CG 3.5Å; Y184-E209 PolarHBondContact OH-OE1 2.82Å
185	F	82.6	Confident	85.2	Confident	68 Å²	68	65 Å²	65	30%	0.298	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-11.4	179.1	-64.1	-61	0	0	0	114.1	I77 Y78 R79 E145 S183	I77-F185 HydrophobicContact CB-CE2 4.22Å; I77-F185 HydrophobicContact CD1-CE2 4Å; I77-F185 HydrophobicContact CD1-CZ 4.47Å; I77-F185 HydrophobicContact CG1-CE2 4.25Å; I77-F185 HydrophobicContact CG1-CZ 4.43Å; Y78-F185 VanDerWaalsContact C-CZ 3.41Å; R79-F185 HydrophobicContact CB-CD1 3.87Å; R79-F185 HydrophobicContact CB-CE1 3.35Å; R79-F185 HydrophobicContact CB-CE2 4.37Å; R79-F185 HydrophobicContact CB-CZ 3.66Å; E145-F185 HydrophobicContact CG-CE1 4.28Å; S183-F185 VanDerWaalsContact C-N 3.33Å; S183-F185 PolarHBondContact O-N 2.96Å
186	I	84.3	Confident	85.6	Confident	153 Å²	153	62.2 Å²	62.2	79%	0.785	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-47.8	179.4	-60.2	173.8	0	0	0	110	S183 Y184	S183-I186 PolarHBondContact O-N 2.89Å; Y184-I186 VanDerWaalsContact C-N 3.26Å; Y184-I186 PolarHBondContact O-N 3.48Å
187	D	85.4	Confident	85.8	Confident	82 Å²	82	66.5 Å²	66.5	44%	0.439	33%	0.326	S	S	.	.	S	Bend	trans	-137.9	84.3	179.9	-176	3.6	0	0	0	110.6	S183 S190 T191	S183-D187 PolarHBondContact O-N 3.38Å; D187-S190 PolarHBondContact O-OG 2.94Å; D187-S190 PolarHBondContact OD1-N 3.08Å; D187-S190 PolarHBondContact OD1-OG 3Å; D187-S190 WeakPolarHBondContact OD2-CB 3.44Å; D187-S190 PolarHBondContact OD2-OG 2.88Å; D187-T191 WeakPolarHBondContact O-CB 3.29Å; D187-T191 WeakPolarHBondContact O-CG2 3.34Å; D187-T191 PolarHBondContact O-N 2.78Å; D187-T191 PolarHBondContact O-OG1 3.29Å
188	R	83.3	Confident	85.8	Confident	73 Å²	73	67.1 Å²	67.1	28%	0.275	33%	0.329	S	S	.	.	H	α-helix	trans	-64.3	-48.1	-171.9	-170.7	-165.1	76	113.3	-1.8	113.4	Y184 S190 T191 L192 E209 R211	Y184-R188 HydrophobicContact CD2-CG 4.1Å; Y184-R188 HydrophobicContact CE2-CG 3.56Å; Y184-R188 VanDerWaalsContact O-CA 3.29Å; Y184-R188 WeakPolarHBondContact O-CA 3.17Å; Y184-R188 PolarHBondContact O-N 3.24Å; R188-S190 PolarHBondContact O-N 3.45Å; R188-T191 WeakPolarHBondContact CA-OG1 3.18Å; R188-T191 PolarHBondContact O-N 2.57Å; R188-T191 PolarHBondContact O-OG1 3.28Å; R188-L192 HydrophobicContact CG-CD1 4.03Å; R188-L192 WeakPolarHBondContact O-CB 3.36Å; R188-L192 PolarHBondContact O-N 2.76Å; R188-E209 IonicContact CZ-OE1 3.97Å; R188-E209 IonicContact NH1-OE1 2.95Å; R188-E209 PolarHBondContact NH1-OE1 3.45Å; R188-E209 IonicContact NH1-OE2 3.33Å; R188-E209 PolarHBondContact NH1-OE2 3.17Å; R188-R211 VanDerWaalsContact NH1-CZ 3.26Å
189	D	84.4	Confident	85.9	Confident	78 Å²	78	64.8 Å²	64.8	42%	0.417	32%	0.318	S	S	.	.	H	α-helix	trans	-72.3	-33.3	-169.5	-67.4	-23	0	0	0	111.6	R193	D189-R193 WeakPolarHBondContact O-CB 3.29Å; D189-R193 WeakPolarHBondContact O-CG 3.19Å; D189-R193 PolarHBondContact O-N 3.31Å; D189-R193 PolarHBondContact O-NE 3.49Å
190	S	86.2	Confident	85.8	Confident	46 Å²	46	64.7 Å²	64.7	32%	0.322	32%	0.321	S	S	.	.	H	α-helix	trans	-75	-39.8	176.5	82.2	0	0	0	0	111.6	D187 R188 R193 R194	D187-S190 PolarHBondContact O-OG 2.94Å; D187-S190 PolarHBondContact OD1-N 3.08Å; D187-S190 PolarHBondContact OD1-OG 3Å; D187-S190 WeakPolarHBondContact OD2-CB 3.44Å; D187-S190 PolarHBondContact OD2-OG 2.88Å; R188-S190 PolarHBondContact O-N 3.45Å; S190-R193 PolarHBondContact O-N 3.16Å; S190-R194 WeakPolarHBondContact O-CB 3.25Å; S190-R194 PolarHBondContact O-N 3.37Å
191	T	87.4	Confident	85.6	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.018	35%	0.345	C	S	.	.	H	α-helix	trans	-68.4	-44.6	-180	51.2	0	0	0	0	112.2	S183 D187 R188 R193 R194 L195	S183-T191 WeakPolarHBondContact OG-CG2 3.44Å; D187-T191 WeakPolarHBondContact O-CB 3.29Å; D187-T191 WeakPolarHBondContact O-CG2 3.34Å; D187-T191 PolarHBondContact O-N 2.78Å; D187-T191 PolarHBondContact O-OG1 3.29Å; R188-T191 WeakPolarHBondContact CA-OG1 3.18Å; R188-T191 PolarHBondContact O-N 2.57Å; R188-T191 PolarHBondContact O-OG1 3.28Å; T191-R193 PolarHBondContact O-N 3.39Å; T191-R194 PolarHBondContact O-N 3.18Å; T191-L195 WeakPolarHBondContact O-CB 3.48Å; T191-L195 VanDerWaalsContact O-CG 3.31Å; T191-L195 WeakPolarHBondContact O-CG 3.4Å; T191-L195 PolarHBondContact O-N 3.5Å
192	L	86.6	Confident	85.1	Confident	15 Å²	15	68.1 Å²	68.1	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-61.7	-43	174.5	-80.3	175.5	0	0	0	112	L147 Y184 R188 R194 L195 H196 V207 E209	L147-L192 HydrophobicContact CD1-CD2 3.83Å; Y184-L192 HydrophobicContact CD2-CG 4.28Å; Y184-L192 HydrophobicContact CE2-CD1 4.08Å; Y184-L192 HydrophobicContact CE2-CD2 4.07Å; Y184-L192 HydrophobicContact CE2-CG 3.87Å; R188-L192 HydrophobicContact CG-CD1 4.03Å; R188-L192 WeakPolarHBondContact O-CB 3.36Å; R188-L192 PolarHBondContact O-N 2.76Å; L192-R194 VanDerWaalsContact C-N 3.32Å; L192-R194 PolarHBondContact O-N 3.07Å; L192-L195 PolarHBondContact O-N 3.46Å; L192-H196 WeakPolarHBondContact O-CB 3.48Å; L192-H196 PolarHBondContact O-CD2 3.4Å; L192-H196 PolarHBondContact O-N 2.96Å; L192-V207 HydrophobicContact CD2-CG1 4.42Å; L192-E209 WeakPolarHBondContact CD1-OE2 3.49Å; L192-E209 HydrophobicContact CD2-CB 4.49Å
193	R	88.1	Confident	84.9	Confident	158 Å²	158	68.6 Å²	68.6	60%	0.596	35%	0.345	S	S	*	.	H	α-helix	trans	-57.6	-46.8	174.2	-84.8	-179.2	-91.7	163.9	-12.3	111.1	D189 S190 T191 H196 H197	D189-R193 WeakPolarHBondContact O-CB 3.29Å; D189-R193 WeakPolarHBondContact O-CG 3.19Å; D189-R193 PolarHBondContact O-N 3.31Å; D189-R193 PolarHBondContact O-NE 3.49Å; S190-R193 PolarHBondContact O-N 3.16Å; T191-R193 PolarHBondContact O-N 3.39Å; R193-H196 PolarHBondContact O-N 2.97Å; R193-H197 PolarHBondContact O-CD2 3.12Å; R193-H197 PolarHBondContact O-N 3.4Å
194	R	86.6	Confident	84.6	Confident	145 Å²	145	66.9 Å²	66.9	55%	0.547	33%	0.334	S	S	.	.	H	α-helix	trans	-65.5	-41.1	179.3	-167.4	156.6	179.1	174.7	3.3	112.5	L180 S190 T191 L192 H197 I198	L180-R194 HydrophobicContact CD1-CG 4.09Å; L180-R194 HydrophobicContact CD2-CB 4.39Å; L180-R194 HydrophobicContact CD2-CG 4.09Å; S190-R194 WeakPolarHBondContact O-CB 3.25Å; S190-R194 PolarHBondContact O-N 3.37Å; T191-R194 PolarHBondContact O-N 3.18Å; L192-R194 VanDerWaalsContact C-N 3.32Å; L192-R194 PolarHBondContact O-N 3.07Å; R194-H197 PolarHBondContact O-N 3.32Å; R194-I198 HydrophobicContact CG-CD1 4.4Å; R194-I198 VanDerWaalsContact O-CG1 3.27Å; R194-I198 WeakPolarHBondContact O-CG1 3.23Å; R194-I198 PolarHBondContact O-N 3.39Å
195	L	87.9	Confident	84.6	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-66.1	-40.2	175.3	-75.8	173.7	0	0	0	112.3	L147 I149 L177 L180 T191 L192 I198 Q199 I205 V207	L147-L195 HydrophobicContact CD1-CD1 4.49Å; L147-L195 HydrophobicContact CD2-CD1 3.71Å; I149-L195 HydrophobicContact CD1-CD1 4.19Å; I149-L195 HydrophobicContact CD1-CD2 4.16Å; L177-L195 HydrophobicContact CD2-CD2 4Å; L180-L195 HydrophobicContact CB-CD2 4.15Å; L180-L195 HydrophobicContact CB-CG 4.44Å; L180-L195 HydrophobicContact CD1-CD2 4.14Å; T191-L195 WeakPolarHBondContact O-CB 3.48Å; T191-L195 VanDerWaalsContact O-CG 3.31Å; T191-L195 WeakPolarHBondContact O-CG 3.4Å; T191-L195 PolarHBondContact O-N 3.5Å; L192-L195 PolarHBondContact O-N 3.46Å; L195-I198 PolarHBondContact O-N 3.04Å; L195-Q199 WeakPolarHBondContact O-CB 3.32Å; L195-Q199 PolarHBondContact O-N 2.86Å; L195-I205 HydrophobicContact CD2-CD1 4.17Å; L195-V207 HydrophobicContact CB-CG2 4.13Å; L195-V207 HydrophobicContact CD1-CG1 4.48Å
196	H	87.3	Confident	84.9	Confident	85 Å²	85	66.8 Å²	66.8	39%	0.394	33%	0.333	S	S	.	.	H	α-helix	trans	-65.8	-39.9	173.3	-81.6	-58.8	0	0	0	112.3	L192 R193 I198 Q199 I200	L192-H196 WeakPolarHBondContact O-CB 3.48Å; L192-H196 PolarHBondContact O-CD2 3.4Å; L192-H196 PolarHBondContact O-N 2.96Å; R193-H196 PolarHBondContact O-N 2.97Å; H196-I198 VanDerWaalsContact C-N 3.33Å; H196-I198 PolarHBondContact O-N 3.49Å; H196-Q199 PolarHBondContact O-N 2.92Å; H196-I200 VanDerWaalsContact O-CG1 3.3Å; H196-I200 WeakPolarHBondContact O-CG1 3.25Å; H196-I200 PolarHBondContact O-N 2.91Å
197	H	86.9	Confident	85	Confident	130 Å²	130	60 Å²	60	60%	0.602	30%	0.299	S	S	*	.	H	α-helix	trans	-59.3	-44.2	172	-81	-60.8	0	0	0	111.8	R193 R194 I200 A201	R193-H197 PolarHBondContact O-CD2 3.12Å; R193-H197 PolarHBondContact O-N 3.4Å; R194-H197 PolarHBondContact O-N 3.32Å; H197-I200 PolarHBondContact O-N 3.04Å; H197-A201 WeakPolarHBondContact O-CB 3.44Å; H197-A201 PolarHBondContact O-N 2.88Å
198	I	84.4	Confident	85	Confident	17 Å²	17	58.2 Å²	58.2	9%	0.087	29%	0.291	C	S	.	.	H	α-helix	trans	-65	-40.9	176.4	-67.2	166	0	0	0	111.4	V172 L177 L180 R194 L195 H196 I200 A201 S202 I205	V172-I198 HydrophobicContact CB-CG2 4.43Å; V172-I198 HydrophobicContact CG1-CD1 4.31Å; V172-I198 HydrophobicContact CG1-CG2 3.84Å; V172-I198 HydrophobicContact CG2-CD1 4.2Å; V172-I198 HydrophobicContact CG2-CG1 3.96Å; V172-I198 HydrophobicContact CG2-CG2 3.99Å; L177-I198 HydrophobicContact CD2-CD1 4.49Å; L177-I198 HydrophobicContact CD2-CG2 4.46Å; L180-I198 HydrophobicContact CD1-CD1 3.55Å; R194-I198 HydrophobicContact CG-CD1 4.4Å; R194-I198 VanDerWaalsContact O-CG1 3.27Å; R194-I198 WeakPolarHBondContact O-CG1 3.23Å; R194-I198 PolarHBondContact O-N 3.39Å; L195-I198 PolarHBondContact O-N 3.04Å; H196-I198 VanDerWaalsContact C-N 3.33Å; H196-I198 PolarHBondContact O-N 3.49Å; I198-I200 VanDerWaalsContact C-N 3.35Å; I198-I200 PolarHBondContact O-N 2.66Å; I198-A201 PolarHBondContact O-N 2.97Å; I198-S202 WeakPolarHBondContact O-CB 3.32Å; I198-S202 PolarHBondContact O-N 3.43Å; I198-S202 PolarHBondContact O-OG 3.33Å; I198-I205 HydrophobicContact CB-CD1 3.87Å; I198-I205 HydrophobicContact CG2-CD1 3.47Å; I198-I205 VanDerWaalsContact CG2-CD1 3.47Å; I198-I205 HydrophobicContact CG2-CG1 3.96Å
199	Q	86.6	Confident	84.9	Confident	35 Å²	35	57.9 Å²	57.9	16%	0.164	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-44.9	175.7	171.8	170.9	-33.5	0	0	111.5	L195 H196 T203 I205	L195-Q199 WeakPolarHBondContact O-CB 3.32Å; L195-Q199 PolarHBondContact O-N 2.86Å; H196-Q199 PolarHBondContact O-N 2.92Å; Q199-T203 VanDerWaalsContact O-CA 3.26Å; Q199-T203 WeakPolarHBondContact O-CA 3.36Å; Q199-T203 PolarHBondContact O-N 2.96Å; Q199-I205 HydrophobicContact CB-CD1 4.47Å; Q199-I205 HydrophobicContact CB-CG1 3.95Å; Q199-I205 VanDerWaalsContact CG-O 3.3Å; Q199-I205 WeakPolarHBondContact CG-O 3.35Å
200	I	82.9	Confident	84.5	Confident	134 Å²	134	57 Å²	57	69%	0.687	29%	0.29	S	S	*	.	H	α-helix	trans	-70	-43.7	178.6	-64.8	164.7	0	0	0	110.8	H196 H197 I198	H196-I200 VanDerWaalsContact O-CG1 3.3Å; H196-I200 WeakPolarHBondContact O-CG1 3.25Å; H196-I200 PolarHBondContact O-N 2.91Å; H197-I200 PolarHBondContact O-N 3.04Å; I198-I200 VanDerWaalsContact C-N 3.35Å; I198-I200 PolarHBondContact O-N 2.66Å
201	A	81.6	Confident	83.8	Confident	72 Å²	72	59.6 Å²	59.6	60%	0.595	29%	0.293	S	S	*	.	H	α-helix	trans	-77.1	-25.8	-173.3	0	0	0	0	0	114.7	R159 H197 I198	R159-A201 PolarHBondContact NH1-O 2.76Å; H197-A201 WeakPolarHBondContact O-CB 3.44Å; H197-A201 PolarHBondContact O-N 2.88Å; I198-A201 PolarHBondContact O-N 2.97Å
202	S	76.4	Confident	82.6	Confident	27 Å²	27	62 Å²	62	19%	0.189	31%	0.308	C	S	.	.	H	α-helix	trans	-115.3	-25.1	-176.8	71.9	0	0	0	0	113.8	I198 A204	I198-S202 WeakPolarHBondContact O-CB 3.32Å; I198-S202 PolarHBondContact O-N 3.43Å; I198-S202 PolarHBondContact O-OG 3.33Å; S202-A204 PolarHBondContact O-N 3.07Å; S202-A204 PolarHBondContact OG-N 3.41Å; S202-A204 VanDerWaalsContact OG-N 3.14Å
203	T	79.6	Confident	81.4	Confident	81 Å²	81	62 Å²	62	50%	0.497	31%	0.311	S	S	.	.	S	Bend	trans	51.1	8.1	-165.2	71.8	0	0	0	0	114.5	Q199 I205	Q199-T203 VanDerWaalsContact O-CA 3.26Å; Q199-T203 WeakPolarHBondContact O-CA 3.36Å; Q199-T203 PolarHBondContact O-N 2.96Å; T203-I205 VanDerWaalsContact C-N 3.33Å
204	A	82.1	Confident	79.7	Confident	2 Å²	2	56.7 Å²	56.7	2%	0.017	30%	0.297	C	S	.	.	S	Bend	trans	-83.9	-15.3	-174.8	0	0	0	0	0	111.9	D152 K155 L156 S202	D152-A204 PolarHBondContact N-O 3.08Å; K155-A204 HydrophobicContact CB-CB 3.8Å; L156-A204 HydrophobicContact CD1-CB 4.19Å; L156-A204 HydrophobicContact CG-CB 3.93Å; S202-A204 PolarHBondContact O-N 3.07Å; S202-A204 PolarHBondContact OG-N 3.41Å; S202-A204 VanDerWaalsContact OG-N 3.14Å
205	I	87.1	Confident	78	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.2	177.1	70.6	171.2	0	0	0	111.2	I149 F150 V151 L156 L177 L195 I198 Q199 T203 V207	I149-I205 HydrophobicContact CG2-CB 4.2Å; I149-I205 HydrophobicContact CG2-CG2 4.49Å; F150-I205 CarbonylContact O-C 3.59Å; F150-I205 WeakPolarHBondContact O-CA 3.3Å; V151-I205 HydrophobicContact CG2-CG2 4.17Å; L156-I205 HydrophobicContact CD1-CG2 4.41Å; L177-I205 HydrophobicContact CD1-CG2 3.73Å; L177-I205 HydrophobicContact CD2-CD1 3.84Å; L177-I205 HydrophobicContact CD2-CG2 4.14Å; L195-I205 HydrophobicContact CD2-CD1 4.17Å; I198-I205 HydrophobicContact CB-CD1 3.87Å; I198-I205 HydrophobicContact CG2-CD1 3.47Å; I198-I205 VanDerWaalsContact CG2-CD1 3.47Å; I198-I205 HydrophobicContact CG2-CG1 3.96Å; Q199-I205 HydrophobicContact CB-CD1 4.47Å; Q199-I205 HydrophobicContact CB-CG1 3.95Å; Q199-I205 VanDerWaalsContact CG-O 3.3Å; Q199-I205 WeakPolarHBondContact CG-O 3.35Å; T203-I205 VanDerWaalsContact C-N 3.33Å; I205-V207 HydrophobicContact CD1-CG2 3.94Å; I205-V207 HydrophobicContact CG1-CG2 4.33Å
206	K	87.3	Confident	76	Confident	64 Å²	64	59.9 Å²	59.9	28%	0.278	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	123.4	168.1	-179.2	71.6	179.3	-174.6	0	108.8	F71 F150	F71-K206 HydrophobicContact CE1-CB 3.95Å; F71-K206 HydrophobicContact CE2-CB 4.11Å; F71-K206 HydrophobicContact CZ-CB 3.7Å; F150-K206 HydrophobicContact CB-CB 4.2Å; F150-K206 PolarHBondContact N-O 3.49Å; F150-K206 PolarHBondContact O-N 3.44Å
207	V	87.6	Confident	74	Confident	10 Å²	10	58.9 Å²	58.9	6%	0.061	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.2	-173.2	-174.8	0	0	0	0	109.2	L147 T148 I149 L192 L195 I205	L147-V207 HydrophobicContact CD1-CG1 3.43Å; L147-V207 VanDerWaalsContact CD1-CG1 3.43Å; L147-V207 HydrophobicContact CG-CG1 4.46Å; T148-V207 WeakPolarHBondContact O-CA 3.14Å; I149-V207 HydrophobicContact CG2-CG2 4.38Å; L192-V207 HydrophobicContact CD2-CG1 4.42Å; L195-V207 HydrophobicContact CB-CG2 4.13Å; L195-V207 HydrophobicContact CD1-CG1 4.48Å; I205-V207 HydrophobicContact CD1-CG2 3.94Å; I205-V207 HydrophobicContact CG1-CG2 4.33Å
208	T	84	Confident	71.8	Confident	45 Å²	45	58.5 Å²	58.5	28%	0.276	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	110.9	175.2	52.7	0	0	0	0	108.7	T148	T148-T208 WeakPolarHBondContact CB-OG1 3.33Å; T148-T208 PolarHBondContact N-O 3.4Å; T148-T208 PolarHBondContact O-N 2.93Å; T148-T208 PolarHBondContact O-OG1 3.36Å
209	E	82.3	Confident	70	Confident	67 Å²	67	63.4 Å²	63.4	31%	0.313	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.5	167.7	-180	178.5	-142.3	0	0	108.2	Y184 R188 L192 R211	Y184-E209 WeakPolarHBondContact OH-CG 3.5Å; Y184-E209 PolarHBondContact OH-OE1 2.82Å; R188-E209 IonicContact CZ-OE1 3.97Å; R188-E209 IonicContact NH1-OE1 2.95Å; R188-E209 PolarHBondContact NH1-OE1 3.45Å; R188-E209 IonicContact NH1-OE2 3.33Å; R188-E209 PolarHBondContact NH1-OE2 3.17Å; L192-E209 WeakPolarHBondContact CD1-OE2 3.49Å; L192-E209 HydrophobicContact CD2-CB 4.49Å; E209-R211 HydrophobicContact CG-CG 4.33Å; E209-R211 IonicContact OE1-CZ 3.89Å; E209-R211 IonicContact OE1-NE 2.8Å; E209-R211 PolarHBondContact OE1-NE 2.92Å
210	T	75.4	Confident	68.3	Low	60 Å²	60	69 Å²	69	37%	0.368	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.8	172	59.4	0	0	0	0	108.6	S146	S146-T210 PolarHBondContact N-O 3.4Å; S146-T210 PolarHBondContact O-N 2.93Å; S146-T210 PolarHBondContact O-OG1 3.22Å; S146-T210 PolarHBondContact OG-OG1 3.4Å
211	R	70.9	Confident	66.8	Low	100 Å²	100	69.2 Å²	69.2	38%	0.377	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	111	176.4	-75.9	174.1	160.8	-156.9	-12.6	107.5	E144 E145 R188 E209 L215	E144-R211 WeakPolarHBondContact O-CA 3.27Å; E145-R211 HydrophobicContact CB-CG 4.38Å; E145-R211 HydrophobicContact CG-CG 4.12Å; E145-R211 IonicContact OE1-CZ 2.8Å; E145-R211 VanDerWaalsContact OE1-CZ 3.24Å; E145-R211 IonicContact OE1-NE 3.21Å; E145-R211 PolarHBondContact OE1-NE 3.46Å; E145-R211 IonicContact OE1-NH2 3.84Å; E145-R211 PolarHBondContact OE1-NH2 3.47Å; R188-R211 VanDerWaalsContact NH1-CZ 3.26Å; E209-R211 HydrophobicContact CG-CG 4.33Å; E209-R211 IonicContact OE1-CZ 3.89Å; E209-R211 IonicContact OE1-NE 2.8Å; E209-R211 PolarHBondContact OE1-NE 2.92Å; R211-L215 HydrophobicContact CB-CD2 4.1Å
212	T	64.3	Low	65.3	Low	54 Å²	54	71.7 Å²	71.7	33%	0.331	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.9	178.7	58.6	0	0	0	0	108.4	G143 E144 S233	G143-T212 CarbonylContact C-O 3.6Å; G143-T212 WeakPolarHBondContact CA-O 3.41Å; E144-T212 PolarHBondContact N-O 3.26Å; E144-T212 PolarHBondContact O-N 2.96Å; E144-T212 PolarHBondContact O-OG1 3.26Å; T212-S233 PolarHBondContact OG1-OG 3.25Å; T212-S233 VanDerWaalsContact OG1-OG 3.13Å
213	G	59.8	Low	64.1	Low	13 Å²	13	76.4 Å²	76.4	13%	0.134	43%	0.429	C	S	.	.	S	Bend	trans	130.6	-172.8	-171.9	0	0	0	0	0	112	L215	G213-L215 PolarHBondContact O-N 2.7Å
214	P	53.6	Low	62.4	Low	48 Å²	48	80.8 Å²	80.8	31%	0.312	45%	0.449	S	S	.	.			trans	-67.2	92.3	-174.2	31.3	-39.2	0	0	0	110.9	G216 V226 S228	P214-G216 PolarHBondContact O-N 3.02Å; P214-V226 HydrophobicContact CB-CG1 3.95Å; P214-V226 HydrophobicContact CG-CG1 3.64Å; P214-S228 WeakPolarHBondContact CA-OG 3.43Å
215	L	49.7	Very low	60.7	Low	146 Å²	146	84.3 Å²	84.3	76%	0.764	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	25.5	178.6	-79.1	159.6	0	0	0	113.9	R211 G213	R211-L215 HydrophobicContact CB-CD2 4.1Å; G213-L215 PolarHBondContact O-N 2.7Å
216	G	47.1	Very low	58.7	Low	66 Å²	66	86.9 Å²	86.9	68%	0.68	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.1	-5	-170.9	0	0	0	0	0	117	P214	P214-G216 PolarHBondContact O-N 3.02Å
217	C	44.1	Very low	56.7	Low	63 Å²	63	89.6 Å²	89.6	43%	0.426	52%	0.516	S	S	.	.			trans	-110.7	85	179.6	-62	0	0	0	0	109.7	N219	C217-N219 PolarHBondContact O-N 3.37Å; C217-N219 VanDerWaalsContact O-N 3.11Å
218	S	40.6	Very low	55	Low	123 Å²	123	91.6 Å²	91.6	86%	0.86	53%	0.531	S	S	*	.	S	Bend	trans	-68.3	3.3	174.6	41.1	0	0	0	0	114.4
219	N	47.6	Very low	53.6	Low	120 Å²	120	91.5 Å²	91.5	64%	0.642	53%	0.53	S	S	*	.	S	Bend	trans	-129.3	132.2	167.1	-89.1	-7.3	0	0	0	110.4	C217 D221	C217-N219 PolarHBondContact O-N 3.37Å; C217-N219 VanDerWaalsContact O-N 3.11Å; N219-D221 PolarHBondContact O-N 3.03Å; N219-D221 VanDerWaalsContact O-N 3.13Å
220	Y	51	Low	52.4	Low	152 Å²	152	91.9 Å²	91.9	60%	0.596	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-7.5	179.3	-99.8	-97.2	0	0	0	114.4	F81	F81-Y220 WeakPolarHBondContact CD1-OH 3.39Å; F81-Y220 WeakPolarHBondContact CE1-OH 3.19Å
221	D	50.9	Low	51.5	Low	139 Å²	139	91.6 Å²	91.6	74%	0.743	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-10	-165.2	-65.7	-32.4	0	0	0	115.3	N219	N219-D221 PolarHBondContact O-N 3.03Å; N219-D221 VanDerWaalsContact O-N 3.13Å
222	N	49.9	Very low	50.7	Low	124 Å²	124	94.4 Å²	94.4	66%	0.663	55%	0.549	S	S	*	.			trans	-119.4	73.6	178.6	-83	-16.7	0	0	0	112.1	D224	N222-D224 VanDerWaalsContact C-N 3.28Å; N222-D224 PolarHBondContact O-N 2.92Å
223	L	51.3	Low	50.4	Low	125 Å²	125	92 Å²	92	65%	0.654	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-72.7	-10.9	178.8	-81.4	135.9	0	0	0	114.8	S225 V226	L223-S225 VanDerWaalsContact C-N 3.33Å; L223-S225 PolarHBondContact O-N 3.01Å; L223-V226 WeakPolarHBondContact O-CG2 3.49Å
224	D	43.9	Very low	50.3	Low	174 Å²	174	95 Å²	95	93%	0.93	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-83	-1.2	-173.5	-73.9	-17.2	0	0	0	114.8	N222	N222-D224 VanDerWaalsContact C-N 3.28Å; N222-D224 PolarHBondContact O-N 2.92Å
225	S	46.2	Very low	50.6	Low	76 Å²	76	95.9 Å²	95.9	53%	0.531	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-122.4	27.5	-177.7	62.3	0	0	0	0	114.2	L223 S227	L223-S225 VanDerWaalsContact C-N 3.33Å; L223-S225 PolarHBondContact O-N 3.01Å; S225-S227 PolarHBondContact O-N 2.62Å
226	V	46.3	Very low	51.3	Low	56 Å²	56	89.8 Å²	89.8	34%	0.339	52%	0.52	S	S	.	.			trans	-77.6	90	-178.6	-176.7	0	0	0	0	110.7	P214 L223 V229	P214-V226 HydrophobicContact CB-CG1 3.95Å; P214-V226 HydrophobicContact CG-CG1 3.64Å; L223-V226 WeakPolarHBondContact O-CG2 3.49Å; V226-V229 HydrophobicContact CG1-CG2 3.59Å
227	S	43.7	Very low	52.5	Low	120 Å²	120	94.9 Å²	94.9	84%	0.839	52%	0.523	S	S	*	.			trans	-90.1	4.1	-175.9	43.1	0	0	0	0	115	S225	S225-S227 PolarHBondContact O-N 2.62Å
228	S	51.7	Low	54.1	Low	52 Å²	52	95.5 Å²	95.5	36%	0.364	52%	0.522	S	S	.	.			trans	-144.6	70.1	179.3	53.5	0	0	0	0	113.5	P214	P214-S228 WeakPolarHBondContact CA-OG 3.43Å
229	V	55.2	Low	56.2	Low	44 Å²	44	94.7 Å²	94.7	27%	0.267	50%	0.504	S	S	.	.			trans	-87.9	115.7	164.1	-163.2	0	0	0	0	108.4	L141 G142 V226	L141-V229 VanDerWaalsContact C-CG1 3.45Å; L141-V229 HydrophobicContact CB-CB 4.24Å; L141-V229 HydrophobicContact CB-CG1 3.5Å; G142-V229 VanDerWaalsContact CA-CG1 3.45Å; G142-V229 WeakPolarHBondContact O-CG1 2.98Å; V226-V229 HydrophobicContact CG1-CG2 3.59Å
230	L	57.7	Low	58	Low	75 Å²	75	93.4 Å²	93.4	39%	0.393	50%	0.497	S	S	.	.	B	Isolated β-bridge	trans	-97.8	137.5	-175.8	-67.3	173	0	0	0	111	Q232 N236	L230-Q232 HydrophobicContact CB-CB 4.34Å; L230-Q232 PolarHBondContact O-N 3.42Å; L230-N236 PolarHBondContact O-ND2 3.06Å
231	V	56.8	Low	59.7	Low	53 Å²	53	89 Å²	89	32%	0.321	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-10.5	170.1	-177	0	0	0	0	111.5	A139 L141 S233 N236 I238	A139-V231 HydrophobicContact CB-CG1 4.31Å; L141-V231 HydrophobicContact CD2-CB 4.26Å; L141-V231 HydrophobicContact CD2-CG2 3.24Å; V231-S233 VanDerWaalsContact C-N 3.32Å; V231-S233 PolarHBondContact O-N 3.07Å; V231-N236 VanDerWaalsContact C-ND2 3.31Å; V231-N236 PolarHBondContact O-ND2 3.03Å; V231-I238 HydrophobicContact CG1-CD1 3.93Å; V231-I238 HydrophobicContact CG1-CG1 4.31Å
232	Q	53.7	Low	61.4	Low	159 Å²	159	82.7 Å²	82.7	74%	0.743	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-7	-166.5	-78.6	-177.5	-25.1	0	0	116.2	L230	L230-Q232 HydrophobicContact CB-CB 4.34Å; L230-Q232 PolarHBondContact O-N 3.42Å
233	S	58.3	Low	63.3	Low	5 Å²	5	77.2 Å²	77.2	4%	0.035	42%	0.42	C	S	.	.			trans	-67.9	129.8	177.6	-51.4	0	0	0	0	110.2	T212 V231 E235 N236	T212-S233 PolarHBondContact OG1-OG 3.25Å; T212-S233 VanDerWaalsContact OG1-OG 3.13Å; V231-S233 VanDerWaalsContact C-N 3.32Å; V231-S233 PolarHBondContact O-N 3.07Å; S233-E235 PolarHBondContact O-N 2.86Å; S233-E235 VanDerWaalsContact O-N 3.08Å; S233-N236 WeakPolarHBondContact CB-ND2 3.41Å; S233-N236 PolarHBondContact N-ND2 3.49Å; S233-N236 VanDerWaalsContact O-CB 3.31Å; S233-N236 WeakPolarHBondContact O-CB 3.37Å; S233-N236 PolarHBondContact O-N 2.84Å; S233-N236 PolarHBondContact O-ND2 2.71Å
234	P	57.7	Low	65	Low	75 Å²	75	74 Å²	74	49%	0.487	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.9	-174.2	27	-37.1	0	0	0	113.5	E59	E59-P234 VanDerWaalsContact OE1-CB 3.3Å; E59-P234 WeakPolarHBondContact OE1-CB 3.3Å; E59-P234 VanDerWaalsContact OE1-CG 3.29Å; E59-P234 WeakPolarHBondContact OE1-CG 3.48Å
235	E	58.8	Low	67	Low	67 Å²	67	68.1 Å²	68.1	31%	0.313	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-0.9	179	-56.1	-143.5	-160.2	0	0	113.6	K76 Y78 S233 K237	K76-E235 IonicContact NZ-OE1 3.19Å; K76-E235 PolarHBondContact NZ-OE1 3Å; Y78-E235 WeakPolarHBondContact CE1-OE1 3.35Å; Y78-E235 VanDerWaalsContact CE2-OE2 3.31Å; Y78-E235 WeakPolarHBondContact CE2-OE2 3.5Å; Y78-E235 PolarHBondContact OH-OE2 3.1Å; S233-E235 PolarHBondContact O-N 2.86Å; S233-E235 VanDerWaalsContact O-N 3.08Å; E235-K237 PolarHBondContact O-N 3.46Å
236	N	65.6	Low	68.9	Low	18 Å²	18	66 Å²	66	10%	0.096	36%	0.355	C	S	.	.	S	Bend	trans	-63.5	127.7	171.7	-72.9	-27.4	0	0	0	109.5	T140 L230 V231 S233 I238	T140-N236 WeakPolarHBondContact O-CB 3.48Å; T140-N236 PolarHBondContact O-OD1 2.91Å; T140-N236 WeakPolarHBondContact OG1-CA 3.35Å; L230-N236 PolarHBondContact O-ND2 3.06Å; V231-N236 VanDerWaalsContact C-ND2 3.31Å; V231-N236 PolarHBondContact O-ND2 3.03Å; S233-N236 WeakPolarHBondContact CB-ND2 3.41Å; S233-N236 PolarHBondContact N-ND2 3.49Å; S233-N236 VanDerWaalsContact O-CB 3.31Å; S233-N236 WeakPolarHBondContact O-CB 3.37Å; S233-N236 PolarHBondContact O-N 2.84Å; S233-N236 PolarHBondContact O-ND2 2.71Å; N236-I238 HydrophobicContact CB-CG1 4.32Å; N236-I238 PolarHBondContact O-N 3.1Å
237	K	71.3	Confident	70.8	Confident	172 Å²	172	63.7 Å²	63.7	75%	0.748	34%	0.341	S	S	*	.			trans	-75.9	94.3	174.8	-67.1	-176.4	-177.7	-179.1	0	108.2	T140 E235	T140-K237 HydrophobicContact CG2-CB 4.38Å; T140-K237 PolarHBondContact N-O 3.25Å; T140-K237 PolarHBondContact OG1-N 2.96Å; E235-K237 PolarHBondContact O-N 3.46Å
238	I	78.8	Confident	72.8	Confident	77 Å²	77	60.3 Å²	60.3	40%	0.395	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	118.9	177.1	-53.8	179.5	0	0	0	108.5	L136 V231 N236 L240	L136-I238 HydrophobicContact CD1-CG2 3.31Å; V231-I238 HydrophobicContact CG1-CD1 3.93Å; V231-I238 HydrophobicContact CG1-CG1 4.31Å; N236-I238 HydrophobicContact CB-CG1 4.32Å; N236-I238 PolarHBondContact O-N 3.1Å; I238-L240 HydrophobicContact CG2-CD1 4.38Å; I238-L240 HydrophobicContact CG2-CD2 3.53Å; I238-L240 HydrophobicContact CG2-CG 3.68Å
239	Q	83.4	Confident	74.4	Confident	105 Å²	105	64 Å²	64	49%	0.491	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	111.7	169.2	-168.2	179.1	5.3	0	0	108.7	L137 S138	L137-Q239 HydrophobicContact CB-CB 4.34Å; L137-Q239 HydrophobicContact CB-CG 4.21Å; L137-Q239 WeakPolarHBondContact CB-O 3.42Å; L137-Q239 HydrophobicContact CD1-CG 4.2Å; L137-Q239 PolarHBondContact N-O 3.21Å; S138-Q239 PolarHBondContact N-O 3.04Å; S138-Q239 PolarHBondContact O-N 3.27Å; S138-Q239 VanDerWaalsContact OG-CB 3.31Å; S138-Q239 WeakPolarHBondContact OG-CB 3.41Å; S138-Q239 PolarHBondContact OG-OE1 3.49Å
240	L	85.5	Confident	75.9	Confident	93 Å²	93	67.5 Å²	67.5	49%	0.487	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	144.4	180	-66.3	179.2	0	0	0	110.6	H134 F135 L136 I238	H134-L240 HydrophobicContact CB-CB 3.98Å; H134-L240 HydrophobicContact CB-CD1 4.21Å; H134-L240 HydrophobicContact CB-CD2 4.43Å; H134-L240 HydrophobicContact CB-CG 4.44Å; F135-L240 WeakPolarHBondContact O-CA 3.45Å; L136-L240 HydrophobicContact CD1-CD2 4.13Å; I238-L240 HydrophobicContact CG2-CD1 4.38Å; I238-L240 HydrophobicContact CG2-CD2 3.53Å; I238-L240 HydrophobicContact CG2-CG 3.68Å
241	Q	86.3	Confident	77.3	Confident	59 Å²	59	64 Å²	64	28%	0.276	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	142.2	166.7	-174.5	169.4	24.5	0	0	109.5	H134 F135 L137 L243 V245	H134-Q241 CarbonylContact C-O 3.43Å; H134-Q241 VanDerWaalsContact CA-O 3.25Å; H134-Q241 WeakPolarHBondContact CA-O 3.34Å; H134-Q241 WeakPolarHBondContact CB-O 3.37Å; F135-Q241 HydrophobicContact CD1-CB 4.49Å; F135-Q241 VanDerWaalsContact CD1-O 3.26Å; F135-Q241 WeakPolarHBondContact CD1-O 3.27Å; F135-Q241 HydrophobicContact CE1-CB 3.84Å; F135-Q241 HydrophobicContact CE1-CG 3.97Å; F135-Q241 HydrophobicContact CE2-CB 4.3Å; F135-Q241 HydrophobicContact CZ-CB 3.74Å; F135-Q241 HydrophobicContact CZ-CG 3.94Å; F135-Q241 PolarHBondContact N-O 3.34Å; F135-Q241 PolarHBondContact O-N 3.47Å; L137-Q241 HydrophobicContact CD1-CB 3.64Å; L137-Q241 HydrophobicContact CD1-CG 4.48Å; L137-Q241 HydrophobicContact CD2-CB 4.08Å; L137-Q241 HydrophobicContact CG-CB 3.68Å; Q241-L243 PolarHBondContact O-N 3.01Å; Q241-V245 HydrophobicContact CG-CG2 4.24Å
242	G	87.1	Confident	78.9	Confident	7 Å²	7	64.4 Å²	64.4	7%	0.072	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	135.1	179.7	0	0	0	0	0	111.8	Q244 V245	G242-Q244 PolarHBondContact O-N 3.46Å; G242-Q244 VanDerWaalsContact O-N 3.12Å; G242-V245 PolarHBondContact O-N 3.2Å
243	L	89.6	Confident	80.5	Confident	9 Å²	9	64.6 Å²	64.6	5%	0.047	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-62.6	-19.6	-177.6	-167.9	71.1	0	0	0	112.4	F107 T133 F135 Q241 V245 L246 F255	F107-L243 HydrophobicContact CE2-CD2 4.13Å; F107-L243 HydrophobicContact CZ-CD1 4.12Å; F107-L243 HydrophobicContact CZ-CD2 4.16Å; F107-L243 HydrophobicContact CZ-CG 4.27Å; T133-L243 WeakPolarHBondContact O-CB 3.46Å; T133-L243 PolarHBondContact O-N 2.92Å; F135-L243 HydrophobicContact CB-CD1 4.43Å; F135-L243 HydrophobicContact CD1-CD1 4.1Å; Q241-L243 PolarHBondContact O-N 3.01Å; L243-V245 PolarHBondContact O-N 3.41Å; L243-V245 VanDerWaalsContact O-N 3.1Å; L243-L246 HydrophobicContact CD1-CD1 3.89Å; L243-L246 HydrophobicContact CD1-CG 4.48Å; L243-L246 PolarHBondContact O-N 2.79Å; L243-F255 HydrophobicContact CB-CE1 4.09Å; L243-F255 HydrophobicContact CB-CZ 3.85Å; L243-F255 HydrophobicContact CD2-CE2 4.22Å; L243-F255 HydrophobicContact CD2-CZ 3.97Å; L243-F255 HydrophobicContact CG-CZ 4.38Å
244	Q	87.9	Confident	81.9	Confident	58 Å²	58	69 Å²	69	27%	0.271	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-53.3	-32	175.6	69.4	-81.9	8.8	0	0	112.8	G242 L246 L247 Q252 F255 V256	G242-Q244 PolarHBondContact O-N 3.46Å; G242-Q244 VanDerWaalsContact O-N 3.12Å; Q244-L246 PolarHBondContact O-N 3.28Å; Q244-L246 VanDerWaalsContact O-N 3.15Å; Q244-L247 PolarHBondContact O-N 2.92Å; Q244-Q252 HydrophobicContact CB-CB 4.41Å; Q244-Q252 HydrophobicContact CB-CG 4.45Å; Q244-Q252 WeakPolarHBondContact O-CG 3.38Å; Q244-F255 HydrophobicContact CB-CD1 3.93Å; Q244-V256 HydrophobicContact CB-CG2 4.33Å; Q244-V256 HydrophobicContact CG-CG2 4.24Å
245	V	86.3	Confident	83.5	Confident	51 Å²	51	65.5 Å²	65.5	31%	0.309	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-68	-15.9	-178.9	-177.7	0	0	0	0	112.9	R94 Q241 G242 L243	R94-V245 PolarHBondContact NH1-O 3.31Å; Q241-V245 HydrophobicContact CG-CG2 4.24Å; G242-V245 PolarHBondContact O-N 3.2Å; L243-V245 PolarHBondContact O-N 3.41Å; L243-V245 VanDerWaalsContact O-N 3.1Å
246	L	84.6	Confident	85	Confident	32 Å²	32	65.1 Å²	65.1	17%	0.168	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-95.5	-10.6	175.1	-53.3	-171.2	0	0	0	112.6	L101 L103 F135 L243 Q244	L101-L246 HydrophobicContact CD1-CD2 3.28Å; L103-L246 HydrophobicContact CD2-CD1 3.97Å; F135-L246 HydrophobicContact CD1-CD1 3.92Å; F135-L246 HydrophobicContact CD1-CG 4.24Å; F135-L246 HydrophobicContact CE1-CD1 3.92Å; F135-L246 HydrophobicContact CE1-CD2 4.18Å; F135-L246 HydrophobicContact CE1-CG 3.8Å; F135-L246 HydrophobicContact CG-CD1 4.29Å; F135-L246 HydrophobicContact CZ-CD1 4.29Å; F135-L246 HydrophobicContact CZ-CD2 4.11Å; F135-L246 HydrophobicContact CZ-CG 4.22Å; L243-L246 HydrophobicContact CD1-CD1 3.89Å; L243-L246 HydrophobicContact CD1-CG 4.48Å; L243-L246 PolarHBondContact O-N 2.79Å; Q244-L246 PolarHBondContact O-N 3.28Å; Q244-L246 VanDerWaalsContact O-N 3.15Å
247	L	86	Confident	86	Confident	7 Å²	7	67.8 Å²	67.8	4%	0.037	33%	0.329	C	S	.	.	S	Bend	trans	-91.4	150.5	-178.4	-60.5	179.3	0	0	0	111.1	F107 I111 L127 Q244 L251 Q252 F255	F107-L247 HydrophobicContact CZ-CD2 4.2Å; I111-L247 HydrophobicContact CD1-CD2 3.63Å; I111-L247 HydrophobicContact CG1-CD2 4Å; L127-L247 HydrophobicContact CD1-CD1 4.37Å; L127-L247 HydrophobicContact CD1-CD2 4.23Å; Q244-L247 PolarHBondContact O-N 2.92Å; L247-L251 HydrophobicContact CB-CB 4.39Å; L247-Q252 PolarHBondContact O-NE2 3.14Å; L247-F255 HydrophobicContact CD1-CB 3.67Å; L247-F255 HydrophobicContact CD1-CD1 4.17Å; L247-F255 HydrophobicContact CD1-CD2 3.38Å; L247-F255 HydrophobicContact CD1-CE2 4.02Å; L247-F255 HydrophobicContact CD1-CG 3.46Å; L247-F255 VanDerWaalsContact CD1-CG 3.46Å
248	P	86.3	Confident	86.8	Confident	48 Å²	48	59.6 Å²	59.6	31%	0.312	29%	0.293	S	S	.	.			trans	-55.2	145.6	170.6	-24.2	33.6	0	0	0	112.3	I111 Y250 L251 Q252	I111-P248 HydrophobicContact CG2-CG 4.4Å; P248-Y250 HydrophobicContact CB-CD1 3.58Å; P248-Y250 HydrophobicContact CB-CE1 3.23Å; P248-Y250 HydrophobicContact CG-CE1 3.9Å; P248-Y250 PolarHBondContact O-N 3.44Å; P248-Y250 VanDerWaalsContact O-N 3.09Å; P248-L251 PolarHBondContact O-N 2.88Å; P248-Q252 PolarHBondContact O-N 3.13Å
249	D	85.5	Confident	87.3	Confident	131 Å²	131	56.5 Å²	56.5	70%	0.701	28%	0.279	S	S	*	.	H	α-helix	trans	-52.1	-39.9	-173.2	-59.3	-31.2	0	0	0	113.6	L251 Q252	D249-L251 PolarHBondContact O-N 3Å; D249-L251 VanDerWaalsContact O-N 3.16Å; D249-Q252 PolarHBondContact O-N 3.29Å; D249-Q252 PolarHBondContact OD1-NE2 3.46Å
250	Y	86.3	Confident	87.4	Confident	116 Å²	116	55 Å²	55	46%	0.455	27%	0.274	S	S	.	.	H	α-helix	trans	-65.7	-16.7	178.9	72.5	-89.7	0	0	0	114.6	R116 P248	R116-Y250 WeakPolarHBondContact O-CD2 3.32Å; P248-Y250 HydrophobicContact CB-CD1 3.58Å; P248-Y250 HydrophobicContact CB-CE1 3.23Å; P248-Y250 HydrophobicContact CG-CE1 3.9Å; P248-Y250 PolarHBondContact O-N 3.44Å; P248-Y250 VanDerWaalsContact O-N 3.09Å
251	L	87.9	Confident	87.4	Confident	3 Å²	3	51 Å²	51	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-100.5	-15.6	176.6	-66.7	-177.9	0	0	0	113.3	I111 P118 L247 P248 D249 E253 R254 F255	I111-L251 HydrophobicContact CG2-CD1 4.33Å; P118-L251 HydrophobicContact CG-CD2 3.46Å; P118-L251 VanDerWaalsContact CG-CD2 3.46Å; L247-L251 HydrophobicContact CB-CB 4.39Å; P248-L251 PolarHBondContact O-N 2.88Å; D249-L251 PolarHBondContact O-N 3Å; D249-L251 VanDerWaalsContact O-N 3.16Å; L251-E253 PolarHBondContact O-N 2.91Å; L251-R254 PolarHBondContact O-N 2.97Å; L251-F255 WeakPolarHBondContact O-CB 3.48Å; L251-F255 PolarHBondContact O-N 3.42Å
252	Q	89.2	Confident	87.3	Confident	60 Å²	60	52.2 Å²	52.2	28%	0.28	26%	0.256	S	S	.	.	H	α-helix	trans	-61.1	-51	-172.3	-68.4	179.4	12.4	0	0	111.9	Q244 L247 P248 D249 F255 V256	Q244-Q252 HydrophobicContact CB-CB 4.41Å; Q244-Q252 HydrophobicContact CB-CG 4.45Å; Q244-Q252 WeakPolarHBondContact O-CG 3.38Å; L247-Q252 PolarHBondContact O-NE2 3.14Å; P248-Q252 PolarHBondContact O-N 3.13Å; D249-Q252 PolarHBondContact O-N 3.29Å; D249-Q252 PolarHBondContact OD1-NE2 3.46Å; Q252-F255 PolarHBondContact O-N 2.97Å; Q252-V256 WeakPolarHBondContact O-CG2 3.37Å; Q252-V256 PolarHBondContact O-N 3.42Å
253	E	88.4	Confident	87	Confident	164 Å²	164	54.9 Å²	54.9	77%	0.766	27%	0.268	S	S	*	.	H	α-helix	trans	-62.7	-46.2	-179.6	-171.5	-178.1	-175.2	0	0	111.8	L251 F255 V256 Q257	L251-E253 PolarHBondContact O-N 2.91Å; E253-F255 VanDerWaalsContact C-N 3.3Å; E253-F255 PolarHBondContact O-N 2.83Å; E253-V256 PolarHBondContact O-N 3.43Å; E253-Q257 PolarHBondContact O-N 3.37Å
254	R	88.6	Confident	86.4	Confident	97 Å²	97	56.1 Å²	56.1	37%	0.366	28%	0.28	S	S	.	.	H	α-helix	trans	-64	-35.6	176.9	-70.4	-170.4	176.7	-144.9	-5.5	112.5	P118 I123 L251 Q257 A258	P118-R254 PolarHBondContact O-NH1 2.9Å; I123-R254 HydrophobicContact CD1-CB 3.74Å; L251-R254 PolarHBondContact O-N 2.97Å; R254-Q257 PolarHBondContact O-N 3.03Å; R254-A258 VanDerWaalsContact O-CB 3.28Å; R254-A258 WeakPolarHBondContact O-CB 3.3Å; R254-A258 PolarHBondContact O-N 3.08Å
255	F	90.8	Very high	86.1	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.009	27%	0.267	C	S	.	.	H	α-helix	trans	-65.5	-43.6	174.9	-179.2	-90.1	0	0	0	111.2	I123 L127 I128 L243 Q244 L247 L251 Q252 E253 A258 A259	I123-F255 HydrophobicContact CG2-CB 4.5Å; I123-F255 HydrophobicContact CG2-CD2 3.69Å; I123-F255 HydrophobicContact CG2-CE2 4.42Å; I123-F255 HydrophobicContact CG2-CG 4.49Å; L127-F255 HydrophobicContact CB-CE2 4.18Å; L127-F255 HydrophobicContact CD1-CD2 4.39Å; I128-F255 HydrophobicContact CD1-CD2 4.49Å; I128-F255 HydrophobicContact CD1-CE2 4.23Å; I128-F255 HydrophobicContact CG1-CD2 4.22Å; I128-F255 HydrophobicContact CG1-CE2 3.54Å; I128-F255 HydrophobicContact CG1-CZ 3.91Å; L243-F255 HydrophobicContact CB-CE1 4.09Å; L243-F255 HydrophobicContact CB-CZ 3.85Å; L243-F255 HydrophobicContact CD2-CE2 4.22Å; L243-F255 HydrophobicContact CD2-CZ 3.97Å; L243-F255 HydrophobicContact CG-CZ 4.38Å; Q244-F255 HydrophobicContact CB-CD1 3.93Å; L247-F255 HydrophobicContact CD1-CB 3.67Å; L247-F255 HydrophobicContact CD1-CD1 4.17Å; L247-F255 HydrophobicContact CD1-CD2 3.38Å; L247-F255 HydrophobicContact CD1-CE2 4.02Å; L247-F255 HydrophobicContact CD1-CG 3.46Å; L247-F255 VanDerWaalsContact CD1-CG 3.46Å; L251-F255 WeakPolarHBondContact O-CB 3.48Å; L251-F255 PolarHBondContact O-N 3.42Å; Q252-F255 PolarHBondContact O-N 2.97Å; E253-F255 VanDerWaalsContact C-N 3.3Å; E253-F255 PolarHBondContact O-N 2.83Å; F255-A258 PolarHBondContact O-N 3.49Å; F255-A259 HydrophobicContact CE1-CB 4.49Å; F255-A259 WeakPolarHBondContact O-CB 3.39Å; F255-A259 PolarHBondContact O-N 2.94Å
256	V	89.2	Confident	85.7	Confident	58 Å²	58	52.7 Å²	52.7	35%	0.352	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-45.2	175.6	173.9	0	0	0	0	110.5	Q244 Q252 E253 A258 A259 L260	Q244-V256 HydrophobicContact CB-CG2 4.33Å; Q244-V256 HydrophobicContact CG-CG2 4.24Å; Q252-V256 WeakPolarHBondContact O-CG2 3.37Å; Q252-V256 PolarHBondContact O-N 3.42Å; E253-V256 PolarHBondContact O-N 3.43Å; V256-A258 PolarHBondContact O-N 3.3Å; V256-A259 PolarHBondContact O-N 3.43Å; V256-L260 HydrophobicContact CG1-CD1 4.02Å; V256-L260 HydrophobicContact CG1-CG 4.39Å; V256-L260 WeakPolarHBondContact O-CG 3.42Å; V256-L260 PolarHBondContact O-N 3.49Å
257	Q	87.6	Confident	85.3	Confident	75 Å²	75	54.4 Å²	54.4	35%	0.35	28%	0.276	S	S	.	.	H	α-helix	trans	-62	-42.9	176.7	-169.8	-178.7	9.9	0	0	112.4	L120 E253 R254 S261	L120-Q257 HydrophobicContact CD1-CG 4.26Å; L120-Q257 HydrophobicContact CD2-CB 4.21Å; L120-Q257 HydrophobicContact CD2-CG 4.28Å; E253-Q257 PolarHBondContact O-N 3.37Å; R254-Q257 PolarHBondContact O-N 3.03Å; Q257-S261 WeakPolarHBondContact O-CB 3.35Å; Q257-S261 PolarHBondContact O-N 2.95Å; Q257-S261 PolarHBondContact O-OG 3.17Å
258	A	88.5	Confident	85.1	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65	-39.9	175.5	0	0	0	0	0	111.7	L120 I123 I128 R254 F255 V256 S261 Y262	L120-A258 HydrophobicContact CB-CB 4.43Å; L120-A258 HydrophobicContact CD2-CB 4.05Å; I123-A258 HydrophobicContact CB-CB 4.08Å; I123-A258 HydrophobicContact CG2-CB 3.84Å; I128-A258 HydrophobicContact CD1-CB 3.78Å; R254-A258 VanDerWaalsContact O-CB 3.28Å; R254-A258 WeakPolarHBondContact O-CB 3.3Å; R254-A258 PolarHBondContact O-N 3.08Å; F255-A258 PolarHBondContact O-N 3.49Å; V256-A258 PolarHBondContact O-N 3.3Å; A258-S261 PolarHBondContact O-N 3.08Å; A258-Y262 WeakPolarHBondContact O-CB 3.38Å; A258-Y262 PolarHBondContact O-N 3.41Å
259	A	88.4	Confident	84.9	Confident	11 Å²	11	54.9 Å²	54.9	9%	0.091	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-43.2	177.4	0	0	0	0	0	112.1	I128 T133 F255 V256 Y262 I263	I128-A259 HydrophobicContact CD1-CB 4.05Å; T133-A259 HydrophobicContact CG2-CB 3.9Å; F255-A259 HydrophobicContact CE1-CB 4.49Å; F255-A259 WeakPolarHBondContact O-CB 3.39Å; F255-A259 PolarHBondContact O-N 2.94Å; V256-A259 PolarHBondContact O-N 3.43Å; A259-Y262 PolarHBondContact O-N 3.39Å; A259-I263 WeakPolarHBondContact O-CB 3.12Å; A259-I263 VanDerWaalsContact O-CG1 3.3Å; A259-I263 WeakPolarHBondContact O-CG1 3.01Å; A259-I263 PolarHBondContact O-N 3.29Å
260	L	85.6	Confident	85	Confident	75 Å²	75	53.2 Å²	53.2	39%	0.393	27%	0.266	S	S	.	.	H	α-helix	trans	-65.7	-40.1	174.6	-69.1	174.1	0	0	0	111.6	V256 Y262 I263 A264 F271	V256-L260 HydrophobicContact CG1-CD1 4.02Å; V256-L260 HydrophobicContact CG1-CG 4.39Å; V256-L260 WeakPolarHBondContact O-CG 3.42Å; V256-L260 PolarHBondContact O-N 3.49Å; L260-Y262 VanDerWaalsContact C-N 3.31Å; L260-Y262 PolarHBondContact O-N 3.06Å; L260-I263 PolarHBondContact O-N 3.37Å; L260-A264 VanDerWaalsContact O-CB 3.27Å; L260-A264 WeakPolarHBondContact O-CB 3.27Å; L260-A264 PolarHBondContact O-N 3.06Å; L260-F271 HydrophobicContact CB-CB 4.25Å; L260-F271 HydrophobicContact CB-CD1 3.81Å; L260-F271 HydrophobicContact CB-CE1 4.38Å; L260-F271 HydrophobicContact CB-CG 4.11Å; L260-F271 HydrophobicContact CD1-CD1 4.04Å; L260-F271 HydrophobicContact CD1-CE1 4.09Å
261	S	85.3	Confident	85	Confident	8 Å²	8	49.8 Å²	49.8	6%	0.056	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-36.4	174	-55.2	0	0	0	0	112	Q257 A258 C265 S267 F271	Q257-S261 WeakPolarHBondContact O-CB 3.35Å; Q257-S261 PolarHBondContact O-N 2.95Å; Q257-S261 PolarHBondContact O-OG 3.17Å; A258-S261 PolarHBondContact O-N 3.08Å; S261-C265 CarbonylContact O-C 3.51Å; S261-C265 WeakPolarHBondContact O-CA 3.49Å; S261-C265 VanDerWaalsContact O-CB 3.24Å; S261-C265 WeakPolarHBondContact O-CB 3.44Å; S261-C265 PolarHBondContact O-N 3.33Å; S261-S267 PolarHBondContact O-N 3.08Å; S261-F271 PolarHBondContact OG-N 3.25Å
262	Y	85	Confident	84.9	Confident	85 Å²	85	52 Å²	52	33%	0.333	27%	0.265	S	S	.	.	H	α-helix	trans	-69.1	-44.7	175.7	178.5	-106.8	0	0	0	112.3	T124 I128 K129 A258 A259 L260 N266	T124-Y262 HydrophobicContact CG2-CD2 3.63Å; T124-Y262 HydrophobicContact CG2-CE2 4.36Å; T124-Y262 HydrophobicContact CG2-CG 4.18Å; I128-Y262 HydrophobicContact CG2-CD1 3.56Å; I128-Y262 HydrophobicContact CG2-CE1 3.93Å; I128-Y262 HydrophobicContact CG2-CG 3.94Å; K129-Y262 HydrophobicContact CG-CE2 4.04Å; A258-Y262 WeakPolarHBondContact O-CB 3.38Å; A258-Y262 PolarHBondContact O-N 3.41Å; A259-Y262 PolarHBondContact O-N 3.39Å; L260-Y262 VanDerWaalsContact C-N 3.31Å; L260-Y262 PolarHBondContact O-N 3.06Å; Y262-N266 WeakPolarHBondContact O-CA 3.34Å; Y262-N266 PolarHBondContact O-N 2.97Å
263	I	80	Confident	84.6	Confident	62 Å²	62	52.4 Å²	52.4	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-79.1	-52.7	-175.8	-64.5	167	0	0	0	111.7	T133 A259 L260	T133-I263 HydrophobicContact CG2-CD1 4.07Å; A259-I263 WeakPolarHBondContact O-CB 3.12Å; A259-I263 VanDerWaalsContact O-CG1 3.3Å; A259-I263 WeakPolarHBondContact O-CG1 3.01Å; A259-I263 PolarHBondContact O-N 3.29Å; L260-I263 PolarHBondContact O-N 3.37Å
264	A	77.7	Confident	84.4	Confident	35 Å²	35	51.1 Å²	51.1	29%	0.289	27%	0.265	S	S	.	.	H	α-helix	trans	-82.1	-32.9	-172.6	0	0	0	0	0	112.9	L260 F271	L260-A264 VanDerWaalsContact O-CB 3.27Å; L260-A264 WeakPolarHBondContact O-CB 3.27Å; L260-A264 PolarHBondContact O-N 3.06Å; A264-F271 HydrophobicContact CB-CD2 3.84Å; A264-F271 HydrophobicContact CB-CE2 3.92Å
265	C	80	Confident	83.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.292	C	S	.	.	S	Bend	trans	-105.4	6	-177.6	-49.8	0	0	0	0	113.5	S261 S267 E268 C280	S261-C265 CarbonylContact O-C 3.51Å; S261-C265 WeakPolarHBondContact O-CA 3.49Å; S261-C265 VanDerWaalsContact O-CB 3.24Å; S261-C265 WeakPolarHBondContact O-CB 3.44Å; S261-C265 PolarHBondContact O-N 3.33Å; C265-S267 PolarHBondContact O-N 3.33Å; C265-E268 WeakPolarHBondContact O-CB 3.14Å; C265-E268 PolarHBondContact O-N 3.42Å; C265-C280 WeakPolarHBondContact CA-SG 3.18Å; C265-C280 HydrophobicContact CB-CB 3.68Å; C265-C280 WeakPolarHBondContact CB-SG 3.48Å; C265-C280 VanDerWaalsContact SG-CA 3.59Å; C265-C280 WeakPolarHBondContact SG-CB 3.42Å; C265-C280 CovalentContact SG-SG 2.01Å; C265-C280 PolarHBondContact SG-SG 2.96Å
266	N	79.3	Confident	83.3	Confident	37 Å²	37	64.1 Å²	64.1	20%	0.198	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	29.9	-177	-76.1	-29.3	0	0	0	114	R56 Y262 E268	R56-N266 PolarHBondContact NH2-ND2 3.37Å; Y262-N266 WeakPolarHBondContact O-CA 3.34Å; Y262-N266 PolarHBondContact O-N 2.97Å; N266-E268 HydrophobicContact CB-CG 4.45Å; N266-E268 PolarHBondContact O-N 3.01Å
267	S	75.8	Confident	82.7	Confident	69 Å²	69	63.6 Å²	63.6	48%	0.483	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	15.3	-172.4	66.9	0	0	0	0	116.5	S261 C265 G269	S261-S267 PolarHBondContact O-N 3.08Å; C265-S267 PolarHBondContact O-N 3.33Å; S267-G269 VanDerWaalsContact C-N 3.34Å
268	E	81.1	Confident	82.5	Confident	51 Å²	51	63.1 Å²	63.1	24%	0.238	34%	0.335	C	S	.	.	S	Bend	trans	-84	-10.9	176.2	-62.8	168	176.8	0	0	112.6	K51 C265 N266 G283 F286 C289	K51-E268 IonicContact NZ-OE2 3.24Å; K51-E268 PolarHBondContact NZ-OE2 2.83Å; C265-E268 WeakPolarHBondContact O-CB 3.14Å; C265-E268 PolarHBondContact O-N 3.42Å; N266-E268 HydrophobicContact CB-CG 4.45Å; N266-E268 PolarHBondContact O-N 3.01Å; E268-G283 PolarHBondContact O-N 2.8Å; E268-G283 VanDerWaalsContact O-N 3.1Å; E268-F286 HydrophobicContact CB-CB 4.04Å; E268-F286 HydrophobicContact CB-CD2 4.12Å; E268-F286 HydrophobicContact CB-CG 4.12Å; E268-F286 HydrophobicContact CG-CB 4.44Å; E268-F286 HydrophobicContact CG-CD1 4.44Å; E268-F286 HydrophobicContact CG-CD2 4.19Å; E268-F286 HydrophobicContact CG-CG 4.11Å; E268-C289 HydrophobicContact CB-CB 3.91Å
269	G	83.9	Confident	82.2	Confident	14 Å²	14	65.7 Å²	65.7	14%	0.144	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	-177.1	-177	0	0	0	0	0	113.2	S267 H281	S267-G269 VanDerWaalsContact C-N 3.34Å; G269-H281 CarbonylContact C-O 3.4Å; G269-H281 WeakPolarHBondContact CA-O 3.19Å
270	E	86.2	Confident	82.1	Confident	95 Å²	95	65.6 Å²	65.6	44%	0.444	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	133.3	179.5	-62.8	-174.8	170.5	0	0	111.1	L120 C280 H281	L120-E270 HydrophobicContact CD1-CG 4.32Å; E270-C280 CarbonylContact O-C 3.52Å; E270-C280 WeakPolarHBondContact O-CA 3.37Å; E270-H281 PolarHBondContact N-O 3.43Å; E270-H281 PolarHBondContact O-N 3.43Å
271	F	86.2	Confident	82.2	Confident	44 Å²	44	67.3 Å²	67.3	19%	0.193	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	124.1	178.8	-171.7	-103.4	0	0	0	111.3	L260 S261 A264 C273 C278	L260-F271 HydrophobicContact CB-CB 4.25Å; L260-F271 HydrophobicContact CB-CD1 3.81Å; L260-F271 HydrophobicContact CB-CE1 4.38Å; L260-F271 HydrophobicContact CB-CG 4.11Å; L260-F271 HydrophobicContact CD1-CD1 4.04Å; L260-F271 HydrophobicContact CD1-CE1 4.09Å; S261-F271 PolarHBondContact OG-N 3.25Å; A264-F271 HydrophobicContact CB-CD2 3.84Å; A264-F271 HydrophobicContact CB-CE2 3.92Å; F271-C273 WeakPolarHBondContact CE1-SG 3.24Å; F271-C278 HydrophobicContact CE1-CB 4.36Å; F271-C278 HydrophobicContact CE2-CB 4.05Å; F271-C278 HydrophobicContact CZ-CB 3.61Å
272	I	86	Confident	82.3	Confident	50 Å²	50	68.3 Å²	68.3	26%	0.256	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.1	-178.3	-55.6	-178.9	0	0	0	109.4	K274 C278 W279 H281	I272-K274 HydrophobicContact CG2-CG 4.21Å; I272-C278 CarbonylContact O-C 3.52Å; I272-C278 WeakPolarHBondContact O-CA 3.23Å; I272-W279 HydrophobicContact CG2-CZ2 4.49Å; I272-W279 PolarHBondContact N-O 2.91Å; I272-W279 PolarHBondContact O-N 3.34Å; I272-H281 HydrophobicContact CD1-CB 3.7Å; I272-H281 HydrophobicContact CG1-CB 4.39Å
273	C	83.6	Confident	82.2	Confident	68 Å²	68	65.4 Å²	65.4	46%	0.459	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	128.3	170.1	-64.7	0	0	0	0	110	F271 D277 C278	F271-C273 WeakPolarHBondContact CE1-SG 3.24Å; C273-D277 WeakPolarHBondContact CA-O 3.38Å; C273-C278 HydrophobicContact CB-CB 4.11Å; C273-C278 WeakPolarHBondContact CB-SG 3.43Å; C273-C278 WeakPolarHBondContact SG-CB 3.47Å; C273-C278 CovalentContact SG-SG 2.04Å; C273-C278 PolarHBondContact SG-SG 3.48Å
274	K	84.4	Confident	82.3	Confident	137 Å²	137	68.9 Å²	68.9	60%	0.596	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.1	169.5	-65.8	-171.6	178.3	-177.7	0	109	I272 N276 D277 W279	I272-K274 HydrophobicContact CG2-CG 4.21Å; K274-N276 PolarHBondContact O-N 3.47Å; K274-D277 PolarHBondContact N-O 2.92Å; K274-D277 PolarHBondContact O-N 2.87Å; K274-D277 VanDerWaalsContact O-O 3.05Å; K274-W279 HydrophobicContact CB-CH2 3.85Å; K274-W279 HydrophobicContact CB-CZ3 3.97Å; K274-W279 HydrophobicContact CD-CH2 4.02Å; K274-W279 HydrophobicContact CG-CH2 3.97Å; K274-W279 HydrophobicContact CG-CZ3 4.43Å
275	E	76.4	Confident	82.6	Confident	197 Å²	197	75.9 Å²	75.9	92%	0.921	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	49.8	172.1	-60.2	175.9	-173.4	0	0	113.8	D277	E275-D277 PolarHBondContact O-N 3.28Å; E275-D277 VanDerWaalsContact O-N 3.12Å
276	N	78.2	Confident	82.7	Confident	176 Å²	176	81 Å²	81	94%	0.941	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	8.2	-176.2	-68.1	-12.1	0	0	0	116.4	K274	K274-N276 PolarHBondContact O-N 3.47Å
277	D	78.1	Confident	82.6	Confident	47 Å²	47	83 Å²	83	25%	0.251	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121.6	172.4	-161.2	-21.4	0	0	0	108.9	C273 K274 E275 W279 K381 R382	C273-D277 WeakPolarHBondContact CA-O 3.38Å; K274-D277 PolarHBondContact N-O 2.92Å; K274-D277 PolarHBondContact O-N 2.87Å; K274-D277 VanDerWaalsContact O-O 3.05Å; E275-D277 PolarHBondContact O-N 3.28Å; E275-D277 VanDerWaalsContact O-N 3.12Å; D277-W279 HydrophobicContact CB-CZ3 4.42Å; D277-W279 WeakPolarHBondContact O-CZ3 3.3Å; D277-K381 IonicContact OD2-NZ 3.84Å; D277-K381 PolarHBondContact OD2-NZ 3.43Å; D277-R382 IonicContact OD1-CZ 2.92Å; D277-R382 IonicContact OD1-NE 3.49Å; D277-R382 IonicContact OD1-NH2 3.83Å; D277-R382 PolarHBondContact OD1-NH2 3.47Å; D277-R382 IonicContact OD2-CZ 2.62Å; D277-R382 IonicContact OD2-NH2 3.67Å; D277-R382 PolarHBondContact OD2-NH2 3.16Å
278	C	82.8	Confident	82.7	Confident	64 Å²	64	85 Å²	85	43%	0.432	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.1	-177.6	-64.8	0	0	0	0	110.5	F271 I272 C273	F271-C278 HydrophobicContact CE1-CB 4.36Å; F271-C278 HydrophobicContact CE2-CB 4.05Å; F271-C278 HydrophobicContact CZ-CB 3.61Å; I272-C278 CarbonylContact O-C 3.52Å; I272-C278 WeakPolarHBondContact O-CA 3.23Å; C273-C278 HydrophobicContact CB-CB 4.11Å; C273-C278 WeakPolarHBondContact CB-SG 3.43Å; C273-C278 WeakPolarHBondContact SG-CB 3.47Å; C273-C278 CovalentContact SG-SG 2.04Å; C273-C278 PolarHBondContact SG-SG 3.48Å
279	W	82.9	Confident	82.6	Confident	55 Å²	55	82.7 Å²	82.7	21%	0.208	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	170.2	-177.8	70.3	99.8	0	0	0	112.5	I272 K274 D277 R382	I272-W279 HydrophobicContact CG2-CZ2 4.49Å; I272-W279 PolarHBondContact N-O 2.91Å; I272-W279 PolarHBondContact O-N 3.34Å; K274-W279 HydrophobicContact CB-CH2 3.85Å; K274-W279 HydrophobicContact CB-CZ3 3.97Å; K274-W279 HydrophobicContact CD-CH2 4.02Å; K274-W279 HydrophobicContact CG-CH2 3.97Å; K274-W279 HydrophobicContact CG-CZ3 4.43Å; D277-W279 HydrophobicContact CB-CZ3 4.42Å; D277-W279 WeakPolarHBondContact O-CZ3 3.3Å; W279-R382 VanDerWaalsContact CD1-NH1 3.34Å; W279-R382 VanDerWaalsContact CG-CZ 3.43Å; W279-R382 VanDerWaalsContact CZ3-NH2 3.35Å
280	C	85.9	Confident	82.4	Confident	8 Å²	8	83.9 Å²	83.9	5%	0.054	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	124	175.6	-56.7	0	0	0	0	110.4	C265 E270 C282 C289 N290	C265-C280 WeakPolarHBondContact CA-SG 3.18Å; C265-C280 HydrophobicContact CB-CB 3.68Å; C265-C280 WeakPolarHBondContact CB-SG 3.48Å; C265-C280 VanDerWaalsContact SG-CA 3.59Å; C265-C280 WeakPolarHBondContact SG-CB 3.42Å; C265-C280 CovalentContact SG-SG 2.01Å; C265-C280 PolarHBondContact SG-SG 2.96Å; E270-C280 CarbonylContact O-C 3.52Å; E270-C280 WeakPolarHBondContact O-CA 3.37Å; C280-C282 PolarHBondContact O-N 3.31Å; C280-C289 VanDerWaalsContact CB-SG 3.58Å; C280-N290 WeakPolarHBondContact CA-OD1 3.2Å; C280-N290 WeakPolarHBondContact CB-OD1 3.35Å; C280-N290 PolarHBondContact N-OD1 3.07Å; C280-N290 PolarHBondContact O-ND2 2.78Å; C280-N290 PolarHBondContact O-OD1 2.81Å
281	H	87.2	Confident	82.1	Confident	112 Å²	112	79.9 Å²	79.9	52%	0.519	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	105.7	165.2	-174	59.6	0	0	0	108.9	G269 E270 I272	G269-H281 CarbonylContact C-O 3.4Å; G269-H281 WeakPolarHBondContact CA-O 3.19Å; E270-H281 PolarHBondContact N-O 3.43Å; E270-H281 PolarHBondContact O-N 3.43Å; I272-H281 HydrophobicContact CD1-CB 3.7Å; I272-H281 HydrophobicContact CG1-CB 4.39Å
282	C	86.8	Confident	81.7	Confident	29 Å²	29	78.6 Å²	78.6	20%	0.196	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	133.3	-172	-59.8	0	0	0	0	112.6	C280 F286 C289 N290	C280-C282 PolarHBondContact O-N 3.31Å; C282-F286 VanDerWaalsContact CB-O 3.3Å; C282-F286 WeakPolarHBondContact CB-O 3.11Å; C282-C289 WeakPolarHBondContact CA-SG 3.2Å; C282-C289 HydrophobicContact CB-CB 3.77Å; C282-C289 WeakPolarHBondContact CB-SG 3.32Å; C282-C289 VanDerWaalsContact SG-CA 3.53Å; C282-C289 WeakPolarHBondContact SG-CB 3.32Å; C282-C289 PolarHBondContact SG-N 2.82Å; C282-C289 CovalentContact SG-SG 2.02Å; C282-C289 PolarHBondContact SG-SG 2.76Å; C282-N290 PolarHBondContact SG-ND2 2.8Å
283	G	83.8	Confident	81.3	Confident	24 Å²	24	79 Å²	79	25%	0.247	42%	0.419	C	S	.	.			trans	-68.3	158.5	170.4	0	0	0	0	0	111.7	E268 K285 F286	E268-G283 PolarHBondContact O-N 2.8Å; E268-G283 VanDerWaalsContact O-N 3.1Å; G283-K285 PolarHBondContact O-N 3.49Å; G283-K285 VanDerWaalsContact O-N 3.09Å; G283-F286 CarbonylContact O-C 3.32Å; G283-F286 VanDerWaalsContact O-C 3.32Å; G283-F286 PolarHBondContact O-N 3.43Å
284	P	82.4	Confident	80.9	Confident	135 Å²	135	80 Å²	80	88%	0.877	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-21.3	-178.2	25.4	-34.9	0	0	0	113.6
285	K	84.1	Confident	80.6	Confident	182 Å²	182	75.3 Å²	75.3	79%	0.791	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-21.2	175.6	-65.5	-176.3	179.6	-179.5	0	113.3	G283	G283-K285 PolarHBondContact O-N 3.49Å; G283-K285 VanDerWaalsContact O-N 3.09Å
286	F	80.9	Confident	80.8	Confident	106 Å²	106	66 Å²	66	47%	0.465	36%	0.357	S	S	.	.			trans	-136.7	65.7	-173.9	-58.9	-74.9	0	0	0	110.2	E268 C282 G283 E288 C289	E268-F286 HydrophobicContact CB-CB 4.04Å; E268-F286 HydrophobicContact CB-CD2 4.12Å; E268-F286 HydrophobicContact CB-CG 4.12Å; E268-F286 HydrophobicContact CG-CB 4.44Å; E268-F286 HydrophobicContact CG-CD1 4.44Å; E268-F286 HydrophobicContact CG-CD2 4.19Å; E268-F286 HydrophobicContact CG-CG 4.11Å; C282-F286 VanDerWaalsContact CB-O 3.3Å; C282-F286 WeakPolarHBondContact CB-O 3.11Å; G283-F286 CarbonylContact O-C 3.32Å; G283-F286 VanDerWaalsContact O-C 3.32Å; G283-F286 PolarHBondContact O-N 3.43Å; F286-E288 PolarHBondContact O-N 2.86Å; F286-E288 VanDerWaalsContact O-N 3.12Å; F286-C289 HydrophobicContact CB-CB 4.41Å; F286-C289 WeakPolarHBondContact O-CB 2.99Å; F286-C289 PolarHBondContact O-N 2.84Å; F286-C289 VanDerWaalsContact O-N 3.11Å
287	P	78.9	Confident	81.1	Confident	81 Å²	81	62.1 Å²	62.1	53%	0.526	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.7	-175.3	25.3	-34.7	0	0	0	113.4
288	E	77	Confident	81.3	Confident	110 Å²	110	61.8 Å²	61.8	51%	0.514	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	22.5	179.3	-59.8	-172.8	165.3	0	0	113.3	F286 N290 C291	F286-E288 PolarHBondContact O-N 2.86Å; F286-E288 VanDerWaalsContact O-N 3.12Å; E288-N290 PolarHBondContact O-N 2.94Å; E288-C291 HydrophobicContact CB-CB 4.21Å; E288-C291 WeakPolarHBondContact O-CB 3.37Å; E288-C291 PolarHBondContact O-N 3.25Å
289	C	78.7	Confident	81.3	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.014	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.2	-175.7	86.5	0	0	0	0	115	K51 E268 C280 C282 F286	K51-C289 VanDerWaalsContact CE-O 3.27Å; K51-C289 WeakPolarHBondContact CE-O 2.98Å; K51-C289 PolarHBondContact NZ-O 3.33Å; E268-C289 HydrophobicContact CB-CB 3.91Å; C280-C289 VanDerWaalsContact CB-SG 3.58Å; C282-C289 WeakPolarHBondContact CA-SG 3.2Å; C282-C289 HydrophobicContact CB-CB 3.77Å; C282-C289 WeakPolarHBondContact CB-SG 3.32Å; C282-C289 VanDerWaalsContact SG-CA 3.53Å; C282-C289 WeakPolarHBondContact SG-CB 3.32Å; C282-C289 PolarHBondContact SG-N 2.82Å; C282-C289 CovalentContact SG-SG 2.02Å; C282-C289 PolarHBondContact SG-SG 2.76Å; F286-C289 HydrophobicContact CB-CB 4.41Å; F286-C289 WeakPolarHBondContact O-CB 2.99Å; F286-C289 PolarHBondContact O-N 2.84Å; F286-C289 VanDerWaalsContact O-N 3.11Å
290	N	79	Confident	81.4	Confident	40 Å²	40	58.7 Å²	58.7	21%	0.214	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-3.9	174.4	-68.6	-54.6	0	0	0	113.3	C280 C282 E288 P292 R382	C280-N290 WeakPolarHBondContact CA-OD1 3.2Å; C280-N290 WeakPolarHBondContact CB-OD1 3.35Å; C280-N290 PolarHBondContact N-OD1 3.07Å; C280-N290 PolarHBondContact O-ND2 2.78Å; C280-N290 PolarHBondContact O-OD1 2.81Å; C282-N290 PolarHBondContact SG-ND2 2.8Å; E288-N290 PolarHBondContact O-N 2.94Å; N290-P292 WeakPolarHBondContact O-CD 3.18Å; N290-R382 HydrophobicContact CB-CB 4.05Å
291	C	81.1	Confident	81.4	Confident	11 Å²	11	64.9 Å²	64.9	7%	0.074	35%	0.347	C	S	.	.			trans	-94.1	115.8	-171.1	-158.9	0	0	0	0	111.4	E288 S293 I296 C383	E288-C291 HydrophobicContact CB-CB 4.21Å; E288-C291 WeakPolarHBondContact O-CB 3.37Å; E288-C291 PolarHBondContact O-N 3.25Å; C291-S293 PolarHBondContact O-N 3.36Å; C291-I296 VanDerWaalsContact SG-CD1 3.54Å; C291-C383 HydrophobicContact CB-CB 3.68Å; C291-C383 WeakPolarHBondContact CB-SG 3.35Å; C291-C383 WeakPolarHBondContact SG-CB 3.45Å; C291-C383 CovalentContact SG-SG 2.03Å; C291-C383 PolarHBondContact SG-SG 3.2Å
292	P	77.9	Confident	81.4	Confident	16 Å²	16	61.9 Å²	61.9	10%	0.104	34%	0.335	C	S	.	.			trans	-84.5	89.4	172.6	34	-32.1	0	0	0	109.3	D50 N290 M294 D295 I296 L379	D50-P292 HydrophobicContact CB-CB 4.26Å; N290-P292 WeakPolarHBondContact O-CD 3.18Å; P292-M294 PolarHBondContact O-N 3.09Å; P292-D295 HydrophobicContact CB-CB 4.03Å; P292-D295 HydrophobicContact CG-CB 4.39Å; P292-I296 VanDerWaalsContact O-CG1 3.27Å; P292-I296 WeakPolarHBondContact O-CG1 3.24Å; P292-I296 PolarHBondContact O-N 2.78Å; P292-L379 HydrophobicContact CG-CB 4.29Å; P292-L379 HydrophobicContact CG-CD2 3.93Å
293	S	77.1	Confident	81.4	Confident	58 Å²	58	60.9 Å²	60.9	41%	0.406	33%	0.327	S	S	.	.	H	α-helix	trans	-66.4	-36	-170.9	56.2	0	0	0	0	113.4	C291 Q297	C291-S293 PolarHBondContact O-N 3.36Å; S293-Q297 WeakPolarHBondContact O-CB 3.42Å; S293-Q297 VanDerWaalsContact O-CG 3.28Å; S293-Q297 WeakPolarHBondContact O-CG 3.3Å; S293-Q297 PolarHBondContact O-N 2.94Å
294	M	76.2	Confident	81.6	Confident	89 Å²	89	64.8 Å²	64.8	44%	0.438	34%	0.342	S	S	.	.	H	α-helix	trans	-74.6	-40.9	-179.2	-61.7	-63.6	-59	0	0	110.6	D50 P292 I296 Q297 A298	D50-M294 VanDerWaalsContact OD2-CB 3.31Å; D50-M294 WeakPolarHBondContact OD2-CB 3.43Å; D50-M294 PolarHBondContact OD2-N 3.34Å; D50-M294 VanDerWaalsContact OD2-N 3.15Å; P292-M294 PolarHBondContact O-N 3.09Å; M294-I296 PolarHBondContact O-N 3.47Å; M294-Q297 PolarHBondContact O-N 2.9Å; M294-A298 WeakPolarHBondContact O-CB 3.31Å; M294-A298 PolarHBondContact O-N 3.48Å
295	D	77	Confident	81.9	Confident	40 Å²	40	65.5 Å²	65.5	21%	0.214	33%	0.327	C	S	.	.	H	α-helix	trans	-62	-42.6	174.8	-69.9	-41.2	0	0	0	111.6	D50 P292 A298 M299 L379	D50-D295 PolarHBondContact N-OD2 3.46Å; D50-D295 PolarHBondContact OD2-N 2.91Å; P292-D295 HydrophobicContact CB-CB 4.03Å; P292-D295 HydrophobicContact CG-CB 4.39Å; D295-A298 PolarHBondContact O-N 2.02Å; D295-M299 VanDerWaalsContact O-CG 3.23Å; D295-M299 WeakPolarHBondContact O-CG 3.41Å; D295-M299 PolarHBondContact O-N 2.83Å; D295-L379 HydrophobicContact CB-CD1 4.29Å
296	I	81.4	Confident	82.1	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-48	175.8	-69.8	168.1	0	0	0	110.5	C291 P292 M294 A298 M299 E300 L376 L379	C291-I296 VanDerWaalsContact SG-CD1 3.54Å; P292-I296 VanDerWaalsContact O-CG1 3.27Å; P292-I296 WeakPolarHBondContact O-CG1 3.24Å; P292-I296 PolarHBondContact O-N 2.78Å; M294-I296 PolarHBondContact O-N 3.47Å; I296-A298 VanDerWaalsContact C-N 3.32Å; I296-A298 PolarHBondContact O-N 2.81Å; I296-M299 PolarHBondContact O-N 3.45Å; I296-E300 HydrophobicContact CG2-CG 4.4Å; I296-E300 WeakPolarHBondContact O-CG 3.12Å; I296-E300 PolarHBondContact O-N 3.21Å; I296-L376 HydrophobicContact CG2-CD2 4.28Å; I296-L379 HydrophobicContact CG1-CB 4.24Å
297	Q	83.1	Confident	82.5	Confident	93 Å²	93	53.8 Å²	53.8	44%	0.435	28%	0.279	S	S	.	.	H	α-helix	trans	-60.6	-40.9	177.6	-77	175	-7.7	0	0	112.1	S293 M294 M299 E300 E301	S293-Q297 WeakPolarHBondContact O-CB 3.42Å; S293-Q297 VanDerWaalsContact O-CG 3.28Å; S293-Q297 WeakPolarHBondContact O-CG 3.3Å; S293-Q297 PolarHBondContact O-N 2.94Å; M294-Q297 PolarHBondContact O-N 2.9Å; Q297-M299 VanDerWaalsContact C-N 3.33Å; Q297-M299 PolarHBondContact O-N 3.36Å; Q297-E300 PolarHBondContact O-N 3.09Å; Q297-E301 WeakPolarHBondContact O-CB 3.31Å; Q297-E301 PolarHBondContact O-N 3.29Å
298	A	82.2	Confident	83	Confident	41 Å²	41	56 Å²	56	34%	0.339	28%	0.282	S	S	.	.	H	α-helix	trans	-65.4	-36.3	176.6	0	0	0	0	0	112.1	M294 D295 I296 N302	M294-A298 WeakPolarHBondContact O-CB 3.31Å; M294-A298 PolarHBondContact O-N 3.48Å; D295-A298 PolarHBondContact O-N 2.02Å; I296-A298 VanDerWaalsContact C-N 3.32Å; I296-A298 PolarHBondContact O-N 2.81Å; A298-N302 WeakPolarHBondContact O-CB 3.11Å; A298-N302 VanDerWaalsContact O-CG 3.24Å; A298-N302 PolarHBondContact O-N 3.16Å; A298-N302 PolarHBondContact O-ND2 3.21Å
299	M	83.8	Confident	83.6	Confident	28 Å²	28	53 Å²	53	14%	0.138	27%	0.272	C	S	.	.	H	α-helix	trans	-69.4	-39.6	173.9	-66.5	-64.7	169	0	0	111.9	D295 I296 Q297 N302 L303 I372 K375 L376 L379	D295-M299 VanDerWaalsContact O-CG 3.23Å; D295-M299 WeakPolarHBondContact O-CG 3.41Å; D295-M299 PolarHBondContact O-N 2.83Å; I296-M299 PolarHBondContact O-N 3.45Å; Q297-M299 VanDerWaalsContact C-N 3.33Å; Q297-M299 PolarHBondContact O-N 3.36Å; M299-N302 PolarHBondContact O-N 2.76Å; M299-L303 WeakPolarHBondContact O-CG 3.41Å; M299-L303 PolarHBondContact O-N 3.06Å; M299-I372 HydrophobicContact CB-CG2 4.13Å; M299-I372 HydrophobicContact SD-CG2 4.06Å; M299-K375 HydrophobicContact CE-CD 3.52Å; M299-K375 VanDerWaalsContact CE-CE 3.47Å; M299-K375 HydrophobicContact CE-CG 4.2Å; M299-K375 HydrophobicContact SD-CD 4.27Å; M299-L376 HydrophobicContact CB-CD1 3.99Å; M299-L376 HydrophobicContact CB-CG 4.07Å; M299-L379 HydrophobicContact CG-CD1 4.29Å
300	E	85.1	Confident	84.1	Confident	26 Å²	26	53.5 Å²	53.5	12%	0.121	27%	0.273	C	S	.	.	H	α-helix	trans	-61.5	-46.2	173.2	-71.4	175.9	157.1	0	0	111.2	I296 Q297 N302 L303 L304 L376 K385 L388	I296-E300 HydrophobicContact CG2-CG 4.4Å; I296-E300 WeakPolarHBondContact O-CG 3.12Å; I296-E300 PolarHBondContact O-N 3.21Å; Q297-E300 PolarHBondContact O-N 3.09Å; E300-N302 VanDerWaalsContact C-N 3.33Å; E300-N302 PolarHBondContact O-N 3.08Å; E300-L303 WeakPolarHBondContact O-CB 3.13Å; E300-L303 PolarHBondContact O-N 2.68Å; E300-L303 VanDerWaalsContact O-N 3.16Å; E300-L304 WeakPolarHBondContact O-CG 3.28Å; E300-L304 PolarHBondContact O-N 2.9Å; E300-L376 HydrophobicContact CG-CD1 4.17Å; E300-K385 IonicContact OE2-NZ 2.86Å; E300-L388 PolarHBondContact OE1-N 3.29Å; E300-L388 VanDerWaalsContact OE1-N 3.11Å
301	E	86.5	Confident	84.6	Confident	138 Å²	138	58.3 Å²	58.3	65%	0.645	29%	0.292	S	S	*	.	H	α-helix	trans	-63	-38.9	175.7	-170.3	-177.8	179	0	0	111.8	Q297 L303 L304 R305	Q297-E301 WeakPolarHBondContact O-CB 3.31Å; Q297-E301 PolarHBondContact O-N 3.29Å; E301-L303 VanDerWaalsContact C-N 3.34Å; E301-L303 PolarHBondContact O-N 2.75Å; E301-L304 PolarHBondContact O-N 3.43Å; E301-R305 WeakPolarHBondContact O-CB 3.18Å; E301-R305 PolarHBondContact O-N 2.78Å
302	N	86.5	Confident	85	Confident	49 Å²	49	59.9 Å²	59.9	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-38.6	173.7	-80.9	-46.4	0	0	0	112.4	A298 M299 E300 R305 I306 I372	A298-N302 WeakPolarHBondContact O-CB 3.11Å; A298-N302 VanDerWaalsContact O-CG 3.24Å; A298-N302 PolarHBondContact O-N 3.16Å; A298-N302 PolarHBondContact O-ND2 3.21Å; M299-N302 PolarHBondContact O-N 2.76Å; E300-N302 VanDerWaalsContact C-N 3.33Å; E300-N302 PolarHBondContact O-N 3.08Å; N302-R305 PolarHBondContact O-N 3Å; N302-R305 PolarHBondContact OD1-NH2 3.15Å; N302-I306 WeakPolarHBondContact O-CG1 3.17Å; N302-I306 PolarHBondContact O-N 3.11Å; N302-I372 HydrophobicContact CB-CD1 4.29Å
303	L	87.3	Confident	85.6	Confident	8 Å²	8	63.8 Å²	63.8	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-64.9	-44.4	173.5	-73.5	175.3	0	0	0	111.1	M299 E300 E301 R305 I306 T307 A369 I372 V373 L376	M299-L303 WeakPolarHBondContact O-CG 3.41Å; M299-L303 PolarHBondContact O-N 3.06Å; E300-L303 WeakPolarHBondContact O-CB 3.13Å; E300-L303 PolarHBondContact O-N 2.68Å; E300-L303 VanDerWaalsContact O-N 3.16Å; E301-L303 VanDerWaalsContact C-N 3.34Å; E301-L303 PolarHBondContact O-N 2.75Å; L303-R305 VanDerWaalsContact C-N 3.33Å; L303-R305 PolarHBondContact O-N 2.89Å; L303-I306 WeakPolarHBondContact O-CB 2.95Å; L303-I306 PolarHBondContact O-N 3.41Å; L303-I306 VanDerWaalsContact O-N 3.1Å; L303-T307 PolarHBondContact O-N 3.08Å; L303-T307 PolarHBondContact O-OG1 3.43Å; L303-T307 VanDerWaalsContact O-OG1 3.1Å; L303-A369 HydrophobicContact CD2-CB 4.21Å; L303-I372 HydrophobicContact CD1-CG2 4.2Å; L303-I372 HydrophobicContact CD2-CB 3.97Å; L303-I372 HydrophobicContact CD2-CD1 4.5Å; L303-I372 HydrophobicContact CD2-CG2 3.78Å; L303-I372 HydrophobicContact CG-CB 4.45Å; L303-I372 HydrophobicContact CG-CG2 3.69Å; L303-V373 HydrophobicContact CD1-CG2 4.13Å; L303-V373 HydrophobicContact CD2-CG2 4.18Å; L303-L376 HydrophobicContact CD1-CD1 3.87Å
304	L	87.9	Confident	86.2	Confident	106 Å²	106	61.2 Å²	61.2	56%	0.555	30%	0.301	S	S	*	.	H	α-helix	trans	-57.6	-46	174.6	-71.3	173.5	0	0	0	111.5	E300 E301 I306 T307 E308	E300-L304 WeakPolarHBondContact O-CG 3.28Å; E300-L304 PolarHBondContact O-N 2.9Å; E301-L304 PolarHBondContact O-N 3.43Å; L304-I306 VanDerWaalsContact C-N 3.3Å; L304-I306 PolarHBondContact O-N 2.96Å; L304-T307 CarbonylContact O-C 3.58Å; L304-T307 WeakPolarHBondContact O-CA 3.23Å; L304-T307 WeakPolarHBondContact O-CB 3.39Å; L304-T307 PolarHBondContact O-N 2.94Å; L304-E308 WeakPolarHBondContact O-CG 3.49Å; L304-E308 PolarHBondContact O-N 2.82Å
305	R	88.4	Confident	86.8	Confident	149 Å²	149	59.2 Å²	59.2	56%	0.562	30%	0.296	S	S	*	.	H	α-helix	trans	-62	-37.1	175.7	-169	180	67	-174.1	-5.3	112	E301 N302 L303 T307 E308 T309	E301-R305 WeakPolarHBondContact O-CB 3.18Å; E301-R305 PolarHBondContact O-N 2.78Å; N302-R305 PolarHBondContact O-N 3Å; N302-R305 PolarHBondContact OD1-NH2 3.15Å; L303-R305 VanDerWaalsContact C-N 3.33Å; L303-R305 PolarHBondContact O-N 2.89Å; R305-T307 VanDerWaalsContact C-N 3.35Å; R305-E308 PolarHBondContact O-N 3.49Å; R305-T309 WeakPolarHBondContact O-CG2 3.42Å; R305-T309 PolarHBondContact O-N 2.82Å; R305-T309 PolarHBondContact O-OG1 3.01Å; R305-T309 VanDerWaalsContact O-OG1 3.07Å
306	I	88.2	Confident	87.4	Confident	13 Å²	13	61.1 Å²	61.1	7%	0.067	31%	0.306	C	S	.	.	H	α-helix	trans	-63.6	-43.4	172.9	-70.9	168.5	0	0	0	110.3	N302 L303 L304 E308 T309 W310 L365 K368 A369 I372	N302-I306 WeakPolarHBondContact O-CG1 3.17Å; N302-I306 PolarHBondContact O-N 3.11Å; L303-I306 WeakPolarHBondContact O-CB 2.95Å; L303-I306 PolarHBondContact O-N 3.41Å; L303-I306 VanDerWaalsContact O-N 3.1Å; L304-I306 VanDerWaalsContact C-N 3.3Å; L304-I306 PolarHBondContact O-N 2.96Å; I306-E308 VanDerWaalsContact C-N 3.32Å; I306-E308 PolarHBondContact O-N 2.01Å; I306-T309 WeakPolarHBondContact CA-OG1 3.3Å; I306-T309 PolarHBondContact O-N 3.38Å; I306-T309 PolarHBondContact O-OG1 2.83Å; I306-W310 VanDerWaalsContact O-CB 3.24Å; I306-W310 WeakPolarHBondContact O-CB 3.1Å; I306-W310 PolarHBondContact O-N 2.76Å; I306-L365 HydrophobicContact CG2-CB 4.41Å; I306-K368 HydrophobicContact CD1-CB 4.39Å; I306-A369 HydrophobicContact CD1-CB 4.28Å; I306-A369 HydrophobicContact CG2-CB 4.24Å; I306-I372 HydrophobicContact CD1-CD1 3.39Å
307	T	88.9	Confident	87.8	Confident	29 Å²	29	61.1 Å²	61.1	18%	0.178	31%	0.306	C	S	.	.	H	α-helix	trans	-61.4	-39.3	175.5	-51.7	0	0	0	0	112.2	L303 L304 R305 W310 K311	L303-T307 PolarHBondContact O-N 3.08Å; L303-T307 PolarHBondContact O-OG1 3.43Å; L303-T307 VanDerWaalsContact O-OG1 3.1Å; L304-T307 CarbonylContact O-C 3.58Å; L304-T307 WeakPolarHBondContact O-CA 3.23Å; L304-T307 WeakPolarHBondContact O-CB 3.39Å; L304-T307 PolarHBondContact O-N 2.94Å; R305-T307 VanDerWaalsContact C-N 3.35Å; T307-W310 WeakPolarHBondContact O-CB 3.31Å; T307-W310 PolarHBondContact O-N 3.21Å; T307-K311 WeakPolarHBondContact O-CG 3.4Å; T307-K311 PolarHBondContact O-N 2.73Å
308	E	89.6	Confident	88	Confident	128 Å²	128	58.4 Å²	58.4	60%	0.598	29%	0.293	S	S	*	.	H	α-helix	trans	-66.3	-48.6	175	-72.1	175.2	176.9	0	0	112.1	L304 R305 I306 W310 K311 A312	L304-E308 WeakPolarHBondContact O-CG 3.49Å; L304-E308 PolarHBondContact O-N 2.82Å; R305-E308 PolarHBondContact O-N 3.49Å; I306-E308 VanDerWaalsContact C-N 3.32Å; I306-E308 PolarHBondContact O-N 2.01Å; E308-W310 VanDerWaalsContact C-N 3.26Å; E308-W310 PolarHBondContact O-N 3.22Å; E308-K311 WeakPolarHBondContact O-CB 3.45Å; E308-K311 PolarHBondContact O-N 3.26Å; E308-K311 VanDerWaalsContact O-N 3.1Å; E308-A312 PolarHBondContact O-N 3.4Å
309	T	89.5	Confident	88.3	Confident	48 Å²	48	62 Å²	62	29%	0.294	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-34.7	175.7	55.6	0	0	0	0	112.3	R305 I306 A312 Y313	R305-T309 WeakPolarHBondContact O-CG2 3.42Å; R305-T309 PolarHBondContact O-N 2.82Å; R305-T309 PolarHBondContact O-OG1 3.01Å; R305-T309 VanDerWaalsContact O-OG1 3.07Å; I306-T309 WeakPolarHBondContact CA-OG1 3.3Å; I306-T309 PolarHBondContact O-N 3.38Å; I306-T309 PolarHBondContact O-OG1 2.83Å; T309-A312 PolarHBondContact O-N 3.16Å; T309-Y313 PolarHBondContact O-N 3.46Å
310	W	89.9	Confident	88.6	Confident	11 Å²	11	61.1 Å²	61.1	4%	0.042	30%	0.3	C	S	.	.	H	α-helix	trans	-61.9	-45.1	172.5	-170.8	-79	0	0	0	111.4	I306 T307 E308 N314 M362 L365 F366 P392	I306-W310 VanDerWaalsContact O-CB 3.24Å; I306-W310 WeakPolarHBondContact O-CB 3.1Å; I306-W310 PolarHBondContact O-N 2.76Å; T307-W310 WeakPolarHBondContact O-CB 3.31Å; T307-W310 PolarHBondContact O-N 3.21Å; E308-W310 VanDerWaalsContact C-N 3.26Å; E308-W310 PolarHBondContact O-N 3.22Å; W310-N314 PolarHBondContact NE1-ND2 3.36Å; W310-N314 PolarHBondContact O-N 3.46Å; W310-N314 PolarHBondContact O-ND2 2.99Å; W310-M362 HydrophobicContact CD2-CE 4.32Å; W310-M362 VanDerWaalsContact CE2-CE 3.49Å; W310-M362 HydrophobicContact CH2-CB 3.59Å; W310-M362 HydrophobicContact CH2-CE 4.4Å; W310-M362 HydrophobicContact CH2-CG 3.76Å; W310-M362 HydrophobicContact CH2-SD 4.05Å; W310-M362 HydrophobicContact CZ2-CB 4.12Å; W310-M362 HydrophobicContact CZ2-CE 3.51Å; W310-M362 HydrophobicContact CZ2-CG 3.8Å; W310-M362 HydrophobicContact CZ2-SD 3.59Å; W310-M362 VanDerWaalsContact CZ2-SD 3.59Å; W310-M362 HydrophobicContact CZ3-CB 3.96Å; W310-M362 HydrophobicContact CZ3-CG 4.16Å; W310-M362 VanDerWaalsContact CZ3-O 3.23Å; W310-M362 WeakPolarHBondContact CZ3-O 3.41Å; W310-L365 HydrophobicContact CE3-CB 3.9Å; W310-L365 HydrophobicContact CE3-CD1 4.11Å; W310-L365 HydrophobicContact CZ3-CB 4.02Å; W310-F366 HydrophobicContact CZ3-CB 4.2Å; W310-P392 HydrophobicContact CB-CB 4.33Å; W310-P392 HydrophobicContact CD2-CB 3.67Å; W310-P392 HydrophobicContact CD2-CG 3.88Å; W310-P392 HydrophobicContact CE3-CB 4.12Å; W310-P392 HydrophobicContact CE3-CG 3.79Å; W310-P392 HydrophobicContact CG-CB 3.74Å; W310-P392 HydrophobicContact CG-CG 4.24Å; W310-P392 HydrophobicContact CZ3-CG 4.26Å
311	K	88.7	Confident	88.8	Confident	141 Å²	141	65.3 Å²	65.3	61%	0.613	32%	0.323	S	S	*	.	H	α-helix	trans	-63.5	-42.6	174.9	-72.8	175.3	-178.9	179.2	0	111.5	T307 E308 N314 S315	T307-K311 WeakPolarHBondContact O-CG 3.4Å; T307-K311 PolarHBondContact O-N 2.73Å; E308-K311 WeakPolarHBondContact O-CB 3.45Å; E308-K311 PolarHBondContact O-N 3.26Å; E308-K311 VanDerWaalsContact O-N 3.1Å; K311-N314 PolarHBondContact O-N 2.95Å; K311-S315 PolarHBondContact O-N 3.19Å
312	A	90.4	Very high	88.9	Confident	44 Å²	44	62.4 Å²	62.4	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-59.1	-51.7	177.3	0	0	0	0	0	111.6	E308 T309 N314 S315 D316	E308-A312 PolarHBondContact O-N 3.4Å; T309-A312 PolarHBondContact O-N 3.16Å; A312-N314 VanDerWaalsContact C-N 3.26Å; A312-N314 PolarHBondContact O-N 3.47Å; A312-S315 CarbonylContact O-C 3.58Å; A312-S315 WeakPolarHBondContact O-CA 3.23Å; A312-S315 WeakPolarHBondContact O-CB 3.5Å; A312-S315 PolarHBondContact O-N 2.68Å; A312-D316 PolarHBondContact O-N 3.14Å
313	Y	90.1	Very high	89	Confident	98 Å²	98	60.3 Å²	60.3	38%	0.384	30%	0.298	S	S	.	.	H	α-helix	trans	-60.2	-34.3	177.8	-70.8	-17.7	0	0	0	113.9	T309 F317 L365	T309-Y313 PolarHBondContact O-N 3.46Å; Y313-F317 WeakPolarHBondContact O-CB 3.4Å; Y313-F317 PolarHBondContact O-N 2.8Å; Y313-F317 VanDerWaalsContact O-N 3.1Å; Y313-L365 HydrophobicContact CD2-CD1 3.61Å; Y313-L365 HydrophobicContact CE2-CD1 3.61Å; Y313-L365 HydrophobicContact CE2-CG 4.3Å
314	N	88.9	Confident	89.1	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-67	-42.6	172.9	-77.9	-65.3	0	0	0	112.1	W310 K311 A312 F317 E318 M362 R395 W400	W310-N314 PolarHBondContact NE1-ND2 3.36Å; W310-N314 PolarHBondContact O-N 3.46Å; W310-N314 PolarHBondContact O-ND2 2.99Å; K311-N314 PolarHBondContact O-N 2.95Å; A312-N314 VanDerWaalsContact C-N 3.26Å; A312-N314 PolarHBondContact O-N 3.47Å; N314-F317 PolarHBondContact O-N 2.95Å; N314-E318 PolarHBondContact O-N 2.86Å; N314-E318 VanDerWaalsContact O-N 3.07Å; N314-M362 VanDerWaalsContact ND2-CE 3.31Å; N314-M362 WeakPolarHBondContact ND2-CE 3.12Å; N314-M362 WeakPolarHBondContact OD1-CE 3.05Å; N314-R395 WeakPolarHBondContact OD1-CD 3.38Å; N314-R395 PolarHBondContact OD1-NH1 3.31Å; N314-W400 HydrophobicContact CB-CH2 4.43Å; N314-W400 VanDerWaalsContact OD1-CZ2 3.27Å; N314-W400 WeakPolarHBondContact OD1-CZ2 3.17Å
315	S	88.6	Confident	89.1	Confident	48 Å²	48	63.8 Å²	63.8	34%	0.336	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-44.6	176.2	-151.7	0	0	0	0	111	K311 A312 F317 E318 E319	K311-S315 PolarHBondContact O-N 3.19Å; A312-S315 CarbonylContact O-C 3.58Å; A312-S315 WeakPolarHBondContact O-CA 3.23Å; A312-S315 WeakPolarHBondContact O-CB 3.5Å; A312-S315 PolarHBondContact O-N 2.68Å; S315-F317 PolarHBondContact O-N 3.36Å; S315-E318 PolarHBondContact O-N 2.94Å; S315-E318 VanDerWaalsContact O-N 3.11Å; S315-E319 WeakPolarHBondContact O-CB 2.92Å; S315-E319 WeakPolarHBondContact O-CG 3.32Å; S315-E319 PolarHBondContact O-N 2.72Å
316	D	90.6	Very high	89.2	Confident	80 Å²	80	56.9 Å²	56.9	43%	0.428	29%	0.286	S	S	.	.	H	α-helix	trans	-62.8	-29.8	178.2	-64.6	-13.1	0	0	0	112.4	A312 S320	A312-D316 PolarHBondContact O-N 3.14Å; D316-S320 WeakPolarHBondContact O-CB 3.41Å; D316-S320 PolarHBondContact O-N 2.98Å
317	F	90.3	Very high	89.1	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.009	29%	0.291	C	S	.	.	H	α-helix	trans	-74.1	-45.2	172.4	178.8	-97.9	0	0	0	111.4	Y313 N314 S315 E319 S320 F323 F351 R354 Y355 L358 W400	Y313-F317 WeakPolarHBondContact O-CB 3.4Å; Y313-F317 PolarHBondContact O-N 2.8Å; Y313-F317 VanDerWaalsContact O-N 3.1Å; N314-F317 PolarHBondContact O-N 2.95Å; S315-F317 PolarHBondContact O-N 3.36Å; F317-E319 VanDerWaalsContact C-N 3.32Å; F317-E319 PolarHBondContact O-N 2.93Å; F317-S320 WeakPolarHBondContact O-CB 3.11Å; F317-S320 PolarHBondContact O-N 2.96Å; F317-S320 PolarHBondContact O-OG 3.14Å; F317-F323 HydrophobicContact CD1-CD2 4.37Å; F317-F323 AromaticContact CE1-CD2 3.84Å; F317-F323 HydrophobicContact CE1-CD2 3.84Å; F317-F323 HydrophobicContact CE1-CE2 4.3Å; F317-F323 HydrophobicContact CZ-CD2 4.33Å; F317-F323 WeakPolarHBondContact O-CB 3.25Å; F317-F351 HydrophobicContact CE1-CE2 4.35Å; F317-F351 HydrophobicContact CE1-CZ 4.33Å; F317-F351 HydrophobicContact CE2-CE2 4.16Å; F317-F351 AromaticContact CZ-CE2 3.6Å; F317-F351 HydrophobicContact CZ-CE2 3.6Å; F317-F351 AromaticContact CZ-CZ 3.73Å; F317-F351 HydrophobicContact CZ-CZ 3.73Å; F317-R354 HydrophobicContact CD2-CG 3.91Å; F317-R354 HydrophobicContact CE2-CB 4.45Å; F317-R354 HydrophobicContact CE2-CG 3.94Å; F317-Y355 HydrophobicContact CE2-CD2 4.43Å; F317-Y355 HydrophobicContact CZ-CD2 4.08Å; F317-L358 HydrophobicContact CB-CD1 4.36Å; F317-L358 HydrophobicContact CB-CD2 3.95Å; F317-L358 HydrophobicContact CD1-CD2 4.05Å; F317-L358 HydrophobicContact CD2-CB 4.31Å; F317-L358 HydrophobicContact CD2-CD2 4.01Å; F317-L358 HydrophobicContact CG-CD2 3.73Å; F317-W400 HydrophobicContact CD1-CD2 4.27Å; F317-W400 HydrophobicContact CD1-CE3 4.04Å; F317-W400 AromaticContact CD1-CH2 3.54Å; F317-W400 HydrophobicContact CD1-CH2 3.54Å; F317-W400 AromaticContact CD1-CZ2 3.79Å; F317-W400 HydrophobicContact CD1-CZ2 3.79Å; F317-W400 AromaticContact CD1-CZ3 3.69Å; F317-W400 HydrophobicContact CD1-CZ3 3.69Å; F317-W400 AromaticContact CE1-CD2 3.98Å; F317-W400 HydrophobicContact CE1-CD2 3.98Å; F317-W400 AromaticContact CE1-CE3 3.89Å; F317-W400 HydrophobicContact CE1-CE3 3.89Å; F317-W400 HydrophobicContact CE1-CH2 4.22Å; F317-W400 HydrophobicContact CE1-CZ2 4.3Å; F317-W400 HydrophobicContact CE1-CZ3 4.03Å; F317-W400 HydrophobicContact CG-CH2 4.47Å
318	E	86.8	Confident	89	Confident	35 Å²	35	64.9 Å²	64.9	16%	0.164	32%	0.319	C	S	.	.	H	α-helix	trans	-64.9	-34.3	178.6	-169.5	166.4	-170.9	0	0	112.3	N314 S315 F323 R403 F407	N314-E318 PolarHBondContact O-N 2.86Å; N314-E318 VanDerWaalsContact O-N 3.07Å; S315-E318 PolarHBondContact O-N 2.94Å; S315-E318 VanDerWaalsContact O-N 3.11Å; E318-F323 WeakPolarHBondContact O-CD1 3.3Å; E318-R403 IonicContact OE1-CZ 2.86Å; E318-R403 VanDerWaalsContact OE1-CZ 3.28Å; E318-R403 IonicContact OE1-NE 3.65Å; E318-R403 PolarHBondContact OE1-NE 2.88Å; E318-R403 IonicContact OE1-NH2 2.76Å; E318-R403 PolarHBondContact OE1-NH2 2.99Å; E318-R403 IonicContact OE2-NE 3.8Å; E318-R403 IonicContact OE2-NH2 2.66Å; E318-F407 HydrophobicContact CG-CE2 3.98Å; E318-F407 HydrophobicContact CG-CZ 3.94Å; E318-F407 WeakPolarHBondContact OE1-CE2 3.18Å; E318-F407 WeakPolarHBondContact OE1-CZ 3.22Å
319	E	88	Confident	88.9	Confident	117 Å²	117	66.3 Å²	66.3	55%	0.547	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-9.2	177.5	-70.3	-179.3	-162.5	0	0	114.1	S315 F317 K324	S315-E319 WeakPolarHBondContact O-CB 2.92Å; S315-E319 WeakPolarHBondContact O-CG 3.32Å; S315-E319 PolarHBondContact O-N 2.72Å; F317-E319 VanDerWaalsContact C-N 3.32Å; F317-E319 PolarHBondContact O-N 2.93Å; E319-K324 VanDerWaalsContact O-CE 3.3Å; E319-K324 WeakPolarHBondContact O-CE 3.26Å; E319-K324 PolarHBondContact O-NZ 2.91Å
320	S	90.9	Very high	88.7	Confident	10 Å²	10	64.4 Å²	64.4	7%	0.07	31%	0.307	C	S	.	.			trans	-60.1	146.3	-177	68.8	0	0	0	0	112.7	D316 F317 E322 F323 K324	D316-S320 WeakPolarHBondContact O-CB 3.41Å; D316-S320 PolarHBondContact O-N 2.98Å; F317-S320 WeakPolarHBondContact O-CB 3.11Å; F317-S320 PolarHBondContact O-N 2.96Å; F317-S320 PolarHBondContact O-OG 3.14Å; S320-E322 WeakPolarHBondContact CB-OE2 3.16Å; S320-E322 PolarHBondContact O-N 2.93Å; S320-F323 PolarHBondContact O-N 2.76Å; S320-F323 VanDerWaalsContact OG-CB 3.32Å; S320-F323 WeakPolarHBondContact OG-CB 3.2Å; S320-F323 PolarHBondContact OG-N 3.06Å; S320-K324 PolarHBondContact O-N 3.12Å; S320-K324 VanDerWaalsContact O-N 3.07Å
321	D	88.6	Confident	88.4	Confident	114 Å²	114	65.5 Å²	65.5	61%	0.61	32%	0.315	S	S	*	.	H	α-helix	trans	-64.1	-33.3	177.9	-71.9	-31.9	0	0	0	110.8	K324 L325	D321-K324 PolarHBondContact O-N 2.71Å; D321-L325 WeakPolarHBondContact O-CB 3.13Å; D321-L325 WeakPolarHBondContact O-CD1 3.43Å; D321-L325 WeakPolarHBondContact O-CG 3.25Å; D321-L325 PolarHBondContact O-N 2.95Å
322	E	89.8	Confident	87.8	Confident	76 Å²	76	62.9 Å²	62.9	36%	0.355	31%	0.306	S	S	.	.	H	α-helix	trans	-62.2	-43.9	175	-61.6	84	173.6	0	0	112	S320 L325 F326 R354	S320-E322 WeakPolarHBondContact CB-OE2 3.16Å; S320-E322 PolarHBondContact O-N 2.93Å; E322-L325 PolarHBondContact O-N 3.29Å; E322-F326 WeakPolarHBondContact O-CB 3.11Å; E322-F326 PolarHBondContact O-N 3.38Å; E322-R354 HydrophobicContact CB-CB 4.43Å; E322-R354 HydrophobicContact CB-CG 4.47Å
323	F	88.6	Confident	87	Confident	6 Å²	6	65.4 Å²	65.4	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-46.4	175.9	-176.2	-87.8	0	0	0	111.1	F317 E318 S320 L325 F326 M327 F351 I404 F407	F317-F323 HydrophobicContact CD1-CD2 4.37Å; F317-F323 AromaticContact CE1-CD2 3.84Å; F317-F323 HydrophobicContact CE1-CD2 3.84Å; F317-F323 HydrophobicContact CE1-CE2 4.3Å; F317-F323 HydrophobicContact CZ-CD2 4.33Å; F317-F323 WeakPolarHBondContact O-CB 3.25Å; E318-F323 WeakPolarHBondContact O-CD1 3.3Å; S320-F323 PolarHBondContact O-N 2.76Å; S320-F323 VanDerWaalsContact OG-CB 3.32Å; S320-F323 WeakPolarHBondContact OG-CB 3.2Å; S320-F323 PolarHBondContact OG-N 3.06Å; F323-L325 PolarHBondContact O-N 3.35Å; F323-F326 PolarHBondContact O-N 3.21Å; F323-M327 HydrophobicContact CD1-CG 4.05Å; F323-M327 HydrophobicContact CE1-CG 3.73Å; F323-M327 HydrophobicContact CE1-SD 4.36Å; F323-M327 HydrophobicContact CZ-CG 4.21Å; F323-M327 HydrophobicContact CZ-SD 4.33Å; F323-M327 WeakPolarHBondContact O-CB 3.43Å; F323-M327 VanDerWaalsContact O-CG 3.29Å; F323-M327 WeakPolarHBondContact O-CG 3.02Å; F323-M327 PolarHBondContact O-N 3.42Å; F323-F351 HydrophobicContact CB-CE2 4.02Å; F323-F351 AromaticContact CD2-CE2 3.65Å; F323-F351 HydrophobicContact CD2-CE2 3.65Å; F323-F351 AromaticContact CD2-CZ 3.79Å; F323-F351 HydrophobicContact CD2-CZ 3.79Å; F323-F351 HydrophobicContact CE2-CZ 4.31Å; F323-F351 HydrophobicContact CG-CE2 4.25Å; F323-I404 HydrophobicContact CE2-CD1 4.32Å; F323-I404 HydrophobicContact CE2-CG1 3.83Å; F323-I404 HydrophobicContact CZ-CG1 3.93Å; F323-F407 HydrophobicContact CE1-CD2 4.14Å; F323-F407 HydrophobicContact CE1-CE2 4.09Å; F323-F407 HydrophobicContact CZ-CD2 4.02Å; F323-F407 HydrophobicContact CZ-CE2 4.11Å
324	K	88.7	Confident	86.4	Confident	100 Å²	100	64.8 Å²	64.8	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-64.1	-38	177.7	-71	168.8	178.7	156.2	0	112.6	E319 S320 D321 K328	E319-K324 VanDerWaalsContact O-CE 3.3Å; E319-K324 WeakPolarHBondContact O-CE 3.26Å; E319-K324 PolarHBondContact O-NZ 2.91Å; S320-K324 PolarHBondContact O-N 3.12Å; S320-K324 VanDerWaalsContact O-N 3.07Å; D321-K324 PolarHBondContact O-N 2.71Å; K324-K328 WeakPolarHBondContact O-CG 3.22Å; K324-K328 PolarHBondContact O-N 3.31Å
325	L	88.9	Confident	86.1	Confident	87 Å²	87	64.9 Å²	64.9	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-68.8	-42.5	176.5	-76.7	167.2	0	0	0	111.5	D321 E322 F323 K328 R329	D321-L325 WeakPolarHBondContact O-CB 3.13Å; D321-L325 WeakPolarHBondContact O-CD1 3.43Å; D321-L325 WeakPolarHBondContact O-CG 3.25Å; D321-L325 PolarHBondContact O-N 2.95Å; E322-L325 PolarHBondContact O-N 3.29Å; F323-L325 PolarHBondContact O-N 3.35Å; L325-K328 PolarHBondContact O-N 3.16Å; L325-R329 WeakPolarHBondContact O-CG 3.38Å; L325-R329 PolarHBondContact O-N 2.85Å
326	F	90.2	Very high	85.9	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-58.3	-49.7	173.2	177.9	-104.6	0	0	0	110.6	E322 F323 K328 R329 L330 I341 L344 W345 D348 F351 I404	E322-F326 WeakPolarHBondContact O-CB 3.11Å; E322-F326 PolarHBondContact O-N 3.38Å; F323-F326 PolarHBondContact O-N 3.21Å; F326-K328 VanDerWaalsContact C-N 3.28Å; F326-K328 PolarHBondContact O-N 3.15Å; F326-R329 PolarHBondContact O-N 2.88Å; F326-L330 HydrophobicContact CD1-CD1 4.28Å; F326-L330 HydrophobicContact CE1-CD1 3.86Å; F326-L330 HydrophobicContact CE1-CD2 4.09Å; F326-L330 HydrophobicContact CE1-CG 4.19Å; F326-L330 HydrophobicContact CE2-CD2 4.22Å; F326-L330 HydrophobicContact CZ-CD1 4.39Å; F326-L330 HydrophobicContact CZ-CD2 3.76Å; F326-L330 HydrophobicContact CZ-CG 4.33Å; F326-L330 PolarHBondContact O-N 2.02Å; F326-I341 HydrophobicContact CE1-CG2 4.38Å; F326-I341 HydrophobicContact CZ-CG2 4.38Å; F326-L344 HydrophobicContact CE2-CB 4.41Å; F326-W345 HydrophobicContact CE2-CB 4.35Å; F326-W345 HydrophobicContact CZ-CB 4.01Å; F326-D348 HydrophobicContact CD2-CB 4.19Å; F326-F351 HydrophobicContact CB-CB 4.42Å; F326-F351 HydrophobicContact CB-CD1 4.41Å; F326-F351 HydrophobicContact CB-CD2 4.07Å; F326-F351 HydrophobicContact CB-CE2 4.48Å; F326-F351 HydrophobicContact CB-CG 4.05Å; F326-F351 HydrophobicContact CD1-CD1 4.07Å; F326-F351 AromaticContact CD1-CE1 3.83Å; F326-F351 HydrophobicContact CD1-CE1 3.83Å; F326-F351 HydrophobicContact CD1-CZ 4.14Å; F326-F351 HydrophobicContact CD2-CB 4.43Å; F326-F351 HydrophobicContact CD2-CD1 4.01Å; F326-F351 HydrophobicContact CD2-CG 4.26Å; F326-F351 HydrophobicContact CE1-CD1 4.35Å; F326-F351 HydrophobicContact CE1-CE1 4Å; F326-F351 HydrophobicContact CE2-CD1 4.3Å; F326-F351 AromaticContact CG-CD1 3.89Å; F326-F351 HydrophobicContact CG-CD1 3.89Å; F326-F351 HydrophobicContact CG-CD2 4.39Å; F326-F351 HydrophobicContact CG-CE1 4.12Å; F326-F351 HydrophobicContact CG-CG 4.02Å; F326-F351 HydrophobicContact CZ-CD1 4.45Å; F326-F351 HydrophobicContact CZ-CE1 4.45Å; F326-I404 HydrophobicContact CE1-CD1 4.04Å
327	M	86.4	Confident	85.6	Confident	34 Å²	34	61.9 Å²	61.9	17%	0.167	29%	0.292	C	S	.	.	H	α-helix	trans	-55.4	-39.7	175.8	-74.6	-64.3	-58.5	0	0	113.1	F323 R329 L330 I404 F407 L408	F323-M327 HydrophobicContact CD1-CG 4.05Å; F323-M327 HydrophobicContact CE1-CG 3.73Å; F323-M327 HydrophobicContact CE1-SD 4.36Å; F323-M327 HydrophobicContact CZ-CG 4.21Å; F323-M327 HydrophobicContact CZ-SD 4.33Å; F323-M327 WeakPolarHBondContact O-CB 3.43Å; F323-M327 VanDerWaalsContact O-CG 3.29Å; F323-M327 WeakPolarHBondContact O-CG 3.02Å; F323-M327 PolarHBondContact O-N 3.42Å; M327-R329 VanDerWaalsContact C-N 3.35Å; M327-L330 HydrophobicContact SD-CD1 4.12Å; M327-I404 HydrophobicContact SD-CB 4.32Å; M327-I404 HydrophobicContact SD-CG1 4.23Å; M327-I404 HydrophobicContact SD-CG2 3.74Å; M327-F407 HydrophobicContact CE-CB 3.48Å; M327-F407 VanDerWaalsContact CE-CB 3.48Å; M327-F407 HydrophobicContact CE-CG 4.47Å; M327-F407 HydrophobicContact SD-CB 4.38Å; M327-L408 HydrophobicContact CE-CD2 3.51Å; M327-L408 HydrophobicContact CE-CG 3.84Å
328	K	86.4	Confident	85.4	Confident	176 Å²	176	63.6 Å²	63.6	77%	0.765	30%	0.303	S	S	*	.	H	α-helix	trans	-71	-26.1	176.6	-75.8	177.2	-179.9	179.8	0	113.9	K324 L325 F326	K324-K328 WeakPolarHBondContact O-CG 3.22Å; K324-K328 PolarHBondContact O-N 3.31Å; L325-K328 PolarHBondContact O-N 3.16Å; F326-K328 VanDerWaalsContact C-N 3.28Å; F326-K328 PolarHBondContact O-N 3.15Å
329	R	86.6	Confident	85.4	Confident	157 Å²	157	65.6 Å²	65.6	59%	0.592	32%	0.321	S	S	*	.	H	α-helix	trans	-82.5	-17.8	179	-74	174	179.9	176.4	-2.6	112.8	L325 F326 M327 D348	L325-R329 WeakPolarHBondContact O-CG 3.38Å; L325-R329 PolarHBondContact O-N 2.85Å; F326-R329 PolarHBondContact O-N 2.88Å; M327-R329 VanDerWaalsContact C-N 3.35Å; R329-D348 IonicContact CZ-OD2 3.13Å; R329-D348 IonicContact NH1-OD1 3.1Å; R329-D348 IonicContact NH1-OD2 2.76Å; R329-D348 PolarHBondContact NH1-OD2 3.35Å
330	L	86.3	Confident	85.3	Confident	8 Å²	8	62.6 Å²	62.6	4%	0.042	31%	0.31	C	S	.	.	S	Bend	trans	-65.2	132.6	179.1	-69.8	175.1	0	0	0	110.6	F326 M327 M332 L336 L344 I404 L408	F326-L330 HydrophobicContact CD1-CD1 4.28Å; F326-L330 HydrophobicContact CE1-CD1 3.86Å; F326-L330 HydrophobicContact CE1-CD2 4.09Å; F326-L330 HydrophobicContact CE1-CG 4.19Å; F326-L330 HydrophobicContact CE2-CD2 4.22Å; F326-L330 HydrophobicContact CZ-CD1 4.39Å; F326-L330 HydrophobicContact CZ-CD2 3.76Å; F326-L330 HydrophobicContact CZ-CG 4.33Å; F326-L330 PolarHBondContact O-N 2.02Å; M327-L330 HydrophobicContact SD-CD1 4.12Å; L330-M332 PolarHBondContact O-N 3.42Å; L330-L336 HydrophobicContact CB-CD1 4.11Å; L330-L336 HydrophobicContact CD2-CD1 4.24Å; L330-L344 HydrophobicContact CD2-CB 4.23Å; L330-L344 HydrophobicContact CD2-CD1 3.7Å; L330-I404 HydrophobicContact CD1-CG2 3.82Å; L330-L408 HydrophobicContact CD1-CD1 4.07Å; L330-L408 HydrophobicContact CD1-CD2 4.26Å
331	P	82.6	Confident	85.2	Confident	34 Å²	34	62.1 Å²	62.1	22%	0.221	31%	0.307	C	S	.	.			trans	-70.3	124.1	179.8	26	-31.4	0	0	0	110.7	N333 Y334 L336 L344	P331-N333 VanDerWaalsContact C-N 3.33Å; P331-Y334 HydrophobicContact CB-CE1 3.82Å; P331-Y334 HydrophobicContact CG-CE1 3.87Å; P331-Y334 WeakPolarHBondContact CG-OH 3.38Å; P331-L336 HydrophobicContact CG-CD1 4.2Å; P331-L336 HydrophobicContact CG-CD2 4.09Å; P331-L344 HydrophobicContact CG-CD1 4.42Å
332	M	76.3	Confident	85.2	Confident	86 Å²	86	59.9 Å²	59.9	42%	0.424	29%	0.294	S	S	.	.			trans	-94.5	12.2	177.3	-60.6	-61	-93.5	0	0	113.1	L330 L408	L330-M332 PolarHBondContact O-N 3.42Å; M332-L408 HydrophobicContact CE-CD2 3.95Å; M332-L408 HydrophobicContact SD-CD2 3.59Å; M332-L408 VanDerWaalsContact SD-CD2 3.59Å
333	N	73.8	Confident	85.2	Confident	98 Å²	98	61.5 Å²	61.5	52%	0.524	30%	0.301	S	S	.	.	S	Bend	trans	-87.1	-18.7	-173.3	-62.4	-11.6	0	0	0	112.5	P331 C452	P331-N333 VanDerWaalsContact C-N 3.33Å; N333-C452 PolarHBondContact O-SG 3.07Å; N333-C452 VanDerWaalsContact O-SG 3.34Å
334	Y	76.6	Confident	85.2	Confident	84 Å²	84	64 Å²	64	33%	0.329	31%	0.314	S	S	.	.	S	Bend	trans	-151.1	165.4	-179	59.3	-86.5	0	0	0	109.3	P331 L336	P331-Y334 HydrophobicContact CB-CE1 3.82Å; P331-Y334 HydrophobicContact CG-CE1 3.87Å; P331-Y334 WeakPolarHBondContact CG-OH 3.38Å; Y334-L336 HydrophobicContact CD2-CD2 3.97Å; Y334-L336 HydrophobicContact CE2-CD2 3.34Å; Y334-L336 HydrophobicContact CE2-CG 4.5Å
335	F	82.3	Confident	85.2	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.026	29%	0.294	C	S	.	.			trans	-72.7	140.8	179.4	178.3	-96.5	0	0	0	111.8	N337 Y409 F419 L439 C441 T442	F335-N337 WeakPolarHBondContact CD1-OD1 3.32Å; F335-N337 WeakPolarHBondContact CE1-OD1 3.36Å; F335-Y409 HydrophobicContact CD2-CD2 4.44Å; F335-Y409 HydrophobicContact CD2-CE1 4.16Å; F335-Y409 AromaticContact CD2-CE2 3.74Å; F335-Y409 HydrophobicContact CD2-CE2 3.74Å; F335-Y409 AromaticContact CD2-CZ 3.59Å; F335-Y409 AromaticContact CE2-CD2 3.92Å; F335-Y409 HydrophobicContact CE2-CD2 3.92Å; F335-Y409 AromaticContact CE2-CE2 3.43Å; F335-Y409 HydrophobicContact CE2-CE2 3.43Å; F335-Y409 VanDerWaalsContact CE2-CE2 3.43Å; F335-Y409 AromaticContact CE2-CZ 3.83Å; F335-Y409 HydrophobicContact CZ-CE2 4.32Å; F335-F419 AromaticContact CE2-CE1 3.95Å; F335-F419 HydrophobicContact CE2-CE1 3.95Å; F335-F419 AromaticContact CE2-CZ 3.62Å; F335-F419 HydrophobicContact CE2-CZ 3.62Å; F335-F419 AromaticContact CZ-CE1 3.87Å; F335-F419 HydrophobicContact CZ-CE1 3.87Å; F335-F419 AromaticContact CZ-CZ 3.86Å; F335-F419 HydrophobicContact CZ-CZ 3.86Å; F335-L439 HydrophobicContact CD2-CD2 4.05Å; F335-L439 HydrophobicContact CE2-CD2 3.91Å; F335-C441 PolarHBondContact N-O 3.34Å; F335-T442 HydrophobicContact CB-CG2 3.87Å; F335-T442 HydrophobicContact CD1-CG2 3.71Å; F335-T442 HydrophobicContact CG-CG2 3.97Å
336	L	84.8	Confident	85.2	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.295	C	S	.	.			trans	-114.2	110.9	-177.3	-63.7	177.2	0	0	0	111	L330 P331 Y334 I341 Q405 L408 Y409	L330-L336 HydrophobicContact CB-CD1 4.11Å; L330-L336 HydrophobicContact CD2-CD1 4.24Å; P331-L336 HydrophobicContact CG-CD1 4.2Å; P331-L336 HydrophobicContact CG-CD2 4.09Å; Y334-L336 HydrophobicContact CD2-CD2 3.97Å; Y334-L336 HydrophobicContact CE2-CD2 3.34Å; Y334-L336 HydrophobicContact CE2-CG 4.5Å; L336-I341 HydrophobicContact CB-CD1 4Å; L336-I341 HydrophobicContact CB-CG1 3.74Å; L336-I341 HydrophobicContact CD1-CG1 4.44Å; L336-Q405 PolarHBondContact O-NE2 3.19Å; L336-Q405 VanDerWaalsContact O-NE2 3.16Å; L336-L408 HydrophobicContact CD1-CD1 4.42Å; L336-Y409 PolarHBondContact N-OH 3.49Å
337	N	85.8	Confident	85.2	Confident	66 Å²	66	65.5 Å²	65.5	35%	0.353	33%	0.327	S	S	.	.			trans	-67.3	160.6	171.8	-62.2	19.3	0	0	0	111.1	F335 S339 T340 I341 E421	F335-N337 WeakPolarHBondContact CD1-OD1 3.32Å; F335-N337 WeakPolarHBondContact CE1-OD1 3.36Å; N337-S339 PolarHBondContact O-N 3.44Å; N337-T340 PolarHBondContact N-OG1 3.24Å; N337-T340 VanDerWaalsContact N-OG1 3.15Å; N337-T340 PolarHBondContact O-N 3.5Å; N337-T340 VanDerWaalsContact O-N 3.16Å; N337-T340 PolarHBondContact O-OG1 3.06Å; N337-I341 WeakPolarHBondContact O-CG1 3.37Å; N337-I341 PolarHBondContact O-N 2.94Å; N337-E421 VanDerWaalsContact CA-OE1 3.23Å; N337-E421 WeakPolarHBondContact CA-OE1 3.35Å; N337-E421 VanDerWaalsContact CB-OE1 3.31Å; N337-E421 WeakPolarHBondContact CB-OE1 3.5Å
338	T	86.1	Confident	85.3	Confident	38 Å²	38	64.8 Å²	64.8	23%	0.233	32%	0.324	C	S	.	.	H	α-helix	trans	-57.2	-34.9	176.6	43	0	0	0	0	112.8	M342 L401 E421	T338-M342 WeakPolarHBondContact O-CB 3.12Å; T338-M342 PolarHBondContact O-N 2.66Å; T338-L401 HydrophobicContact CG2-CB 4.1Å; T338-E421 WeakPolarHBondContact CB-OE2 3.34Å; T338-E421 WeakPolarHBondContact CG2-OE2 3.2Å; T338-E421 PolarHBondContact N-OE1 2.75Å; T338-E421 VanDerWaalsContact N-OE1 3.08Å; T338-E421 PolarHBondContact OG1-OE2 3.25Å
339	S	86.4	Confident	85.4	Confident	77 Å²	77	59.6 Å²	59.6	54%	0.538	31%	0.31	S	S	.	.	H	α-helix	trans	-68.3	-40.3	177.4	57.8	0	0	0	0	113.5	N337 M342 H343	N337-S339 PolarHBondContact O-N 3.44Å; S339-M342 PolarHBondContact O-N 2.93Å; S339-H343 PolarHBondContact O-N 2.94Å
340	T	86.5	Confident	85.5	Confident	53 Å²	53	56.4 Å²	56.4	33%	0.325	31%	0.305	S	S	.	.	H	α-helix	trans	-72.4	-38.4	179.1	59.5	0	0	0	0	110.9	N337 M342 H343 L344	N337-T340 PolarHBondContact N-OG1 3.24Å; N337-T340 VanDerWaalsContact N-OG1 3.15Å; N337-T340 PolarHBondContact O-N 3.5Å; N337-T340 VanDerWaalsContact O-N 3.16Å; N337-T340 PolarHBondContact O-OG1 3.06Å; T340-M342 VanDerWaalsContact C-N 3.32Å; T340-M342 PolarHBondContact O-N 3.36Å; T340-H343 PolarHBondContact O-N 3.31Å; T340-L344 WeakPolarHBondContact O-CG 3.4Å; T340-L344 PolarHBondContact O-N 3.47Å
341	I	88.6	Confident	85.6	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-43.3	171.7	-61.9	169.7	0	0	0	110	F326 L336 N337 H343 L344 W345 L401 I404 Q405 L408	F326-I341 HydrophobicContact CE1-CG2 4.38Å; F326-I341 HydrophobicContact CZ-CG2 4.38Å; L336-I341 HydrophobicContact CB-CD1 4Å; L336-I341 HydrophobicContact CB-CG1 3.74Å; L336-I341 HydrophobicContact CD1-CG1 4.44Å; N337-I341 WeakPolarHBondContact O-CG1 3.37Å; N337-I341 PolarHBondContact O-N 2.94Å; I341-H343 VanDerWaalsContact C-N 3.35Å; I341-H343 PolarHBondContact O-N 2.97Å; I341-L344 PolarHBondContact O-N 3.29Å; I341-W345 VanDerWaalsContact O-CB 3.27Å; I341-W345 WeakPolarHBondContact O-CB 3.42Å; I341-W345 PolarHBondContact O-N 3.3Å; I341-L401 HydrophobicContact CB-CD2 4.07Å; I341-L401 HydrophobicContact CG2-CD2 3.62Å; I341-I404 HydrophobicContact CD1-CG2 4.24Å; I341-I404 HydrophobicContact CG2-CD1 4.34Å; I341-I404 HydrophobicContact CG2-CG2 3.95Å; I341-Q405 HydrophobicContact CD1-CG 3.46Å; I341-Q405 VanDerWaalsContact CD1-CG 3.46Å; I341-L408 HydrophobicContact CD1-CD1 4.33Å
342	M	88.2	Confident	86	Confident	68 Å²	68	56.8 Å²	56.8	34%	0.335	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-40.5	176.7	-173.2	65.7	-173	0	0	112.1	T338 S339 T340 W345 T346 L401	T338-M342 WeakPolarHBondContact O-CB 3.12Å; T338-M342 PolarHBondContact O-N 2.66Å; S339-M342 PolarHBondContact O-N 2.93Å; T340-M342 VanDerWaalsContact C-N 3.32Å; T340-M342 PolarHBondContact O-N 3.36Å; M342-W345 WeakPolarHBondContact O-CB 3.34Å; M342-W345 PolarHBondContact O-N 2.94Å; M342-T346 HydrophobicContact CE-CG2 4.09Å; M342-T346 WeakPolarHBondContact O-CG2 3.27Å; M342-T346 PolarHBondContact O-N 2.79Å; M342-T346 PolarHBondContact O-OG1 3.38Å; M342-L401 HydrophobicContact CB-CD1 4.2Å; M342-L401 HydrophobicContact CB-CD2 4.2Å; M342-L401 HydrophobicContact SD-CD1 4.17Å; M342-L401 HydrophobicContact SD-CD2 4.42Å
343	H	88.7	Confident	86.7	Confident	110 Å²	110	60.3 Å²	60.3	51%	0.509	31%	0.312	S	S	.	.	H	α-helix	trans	-62	-48.7	174.5	177.3	-88	0	0	0	111.5	S339 T340 I341 W345 T346 M347	S339-H343 PolarHBondContact O-N 2.94Å; T340-H343 PolarHBondContact O-N 3.31Å; I341-H343 VanDerWaalsContact C-N 3.35Å; I341-H343 PolarHBondContact O-N 2.97Å; H343-W345 VanDerWaalsContact C-N 3.28Å; H343-W345 PolarHBondContact O-N 3.37Å; H343-T346 PolarHBondContact O-N 3.45Å; H343-T346 PolarHBondContact O-OG1 2.96Å; H343-M347 WeakPolarHBondContact O-CG 3.41Å; H343-M347 PolarHBondContact O-N 3.12Å; H343-M347 VanDerWaalsContact O-N 3.12Å
344	L	88.2	Confident	87.5	Confident	59 Å²	59	59.3 Å²	59.3	31%	0.309	30%	0.301	S	S	.	.	H	α-helix	trans	-62.8	-35.7	176.9	-68.4	173.7	0	0	0	112.3	F326 L330 P331 T340 I341 M347 D348	F326-L344 HydrophobicContact CE2-CB 4.41Å; L330-L344 HydrophobicContact CD2-CB 4.23Å; L330-L344 HydrophobicContact CD2-CD1 3.7Å; P331-L344 HydrophobicContact CG-CD1 4.42Å; T340-L344 WeakPolarHBondContact O-CG 3.4Å; T340-L344 PolarHBondContact O-N 3.47Å; I341-L344 PolarHBondContact O-N 3.29Å; L344-M347 PolarHBondContact O-N 3.17Å; L344-D348 PolarHBondContact O-N 2.75Å
345	W	90.7	Very high	88.1	Confident	3 Å²	3	56.5 Å²	56.5	1%	0.011	29%	0.29	C	S	.	.	H	α-helix	trans	-58.9	-53.2	171.9	-178.3	-35.9	0	0	0	110.3	F326 I341 M342 H343 M347 D348 F351 Y355 W400 L401 I404	F326-W345 HydrophobicContact CE2-CB 4.35Å; F326-W345 HydrophobicContact CZ-CB 4.01Å; I341-W345 VanDerWaalsContact O-CB 3.27Å; I341-W345 WeakPolarHBondContact O-CB 3.42Å; I341-W345 PolarHBondContact O-N 3.3Å; M342-W345 WeakPolarHBondContact O-CB 3.34Å; M342-W345 PolarHBondContact O-N 2.94Å; H343-W345 VanDerWaalsContact C-N 3.28Å; H343-W345 PolarHBondContact O-N 3.37Å; W345-M347 PolarHBondContact O-N 3.37Å; W345-D348 PolarHBondContact O-N 3.19Å; W345-F351 HydrophobicContact CB-CD1 4.49Å; W345-F351 AromaticContact CD1-CD1 3.68Å; W345-F351 AromaticContact CD2-CD1 3.77Å; W345-F351 HydrophobicContact CD2-CD1 3.77Å; W345-F351 AromaticContact CD2-CE1 3.32Å; W345-F351 HydrophobicContact CD2-CE1 3.32Å; W345-F351 HydrophobicContact CD2-CZ 4.42Å; W345-F351 AromaticContact CE2-CD1 3.66Å; W345-F351 AromaticContact CE2-CE1 3.29Å; W345-F351 HydrophobicContact CE3-CD1 4.49Å; W345-F351 AromaticContact CE3-CE1 3.65Å; W345-F351 HydrophobicContact CE3-CE1 3.65Å; W345-F351 HydrophobicContact CE3-CZ 4.49Å; W345-F351 AromaticContact CG-CD1 3.73Å; W345-F351 HydrophobicContact CG-CD1 3.73Å; W345-F351 AromaticContact CG-CE1 3.79Å; W345-F351 HydrophobicContact CG-CE1 3.79Å; W345-F351 AromaticContact CH2-CE1 3.87Å; W345-F351 HydrophobicContact CH2-CE1 3.87Å; W345-F351 HydrophobicContact CH2-CZ 4.09Å; W345-F351 HydrophobicContact CZ2-CD1 4.26Å; W345-F351 AromaticContact CZ2-CE1 3.57Å; W345-F351 HydrophobicContact CZ2-CE1 3.57Å; W345-F351 HydrophobicContact CZ2-CZ 4.01Å; W345-F351 AromaticContact CZ3-CE1 3.91Å; W345-F351 HydrophobicContact CZ3-CE1 3.91Å; W345-F351 HydrophobicContact CZ3-CZ 4.34Å; W345-F351 AromaticContact NE1-CD1 3.63Å; W345-F351 AromaticContact NE1-CE1 3.78Å; W345-Y355 AromaticContact CH2-CD2 3.94Å; W345-Y355 HydrophobicContact CH2-CD2 3.94Å; W345-Y355 HydrophobicContact CH2-CE2 4.16Å; W345-Y355 HydrophobicContact CH2-CG 4.32Å; W345-Y355 AromaticContact CZ2-CD1 3.96Å; W345-Y355 HydrophobicContact CZ2-CD1 3.96Å; W345-Y355 AromaticContact CZ2-CD2 3.55Å; W345-Y355 HydrophobicContact CZ2-CD2 3.55Å; W345-Y355 HydrophobicContact CZ2-CE1 4.45Å; W345-Y355 HydrophobicContact CZ2-CE2 4.07Å; W345-Y355 AromaticContact CZ2-CG 3.47Å; W345-Y355 HydrophobicContact CZ2-CG 3.47Å; W345-Y355 VanDerWaalsContact CZ2-CG 3.47Å; W345-W400 HydrophobicContact CH2-CB 3.73Å; W345-W400 HydrophobicContact CH2-CG 4.38Å; W345-W400 HydrophobicContact CZ3-CB 3.88Å; W345-L401 HydrophobicContact CE3-CD2 3.75Å; W345-L401 HydrophobicContact CE3-CG 4.5Å; W345-L401 HydrophobicContact CZ3-CD2 4.08Å; W345-L401 HydrophobicContact CZ3-CG 4.4Å; W345-I404 HydrophobicContact CE3-CD1 3.98Å; W345-I404 HydrophobicContact CZ3-CD1 3.7Å
346	T	88.2	Confident	88.5	Confident	78 Å²	78	60.3 Å²	60.3	48%	0.479	31%	0.308	S	S	.	.	H	α-helix	trans	-62.7	-24.8	-178.2	54.5	0	0	0	0	113.5	M342 H343	M342-T346 HydrophobicContact CE-CG2 4.09Å; M342-T346 WeakPolarHBondContact O-CG2 3.27Å; M342-T346 PolarHBondContact O-N 2.79Å; M342-T346 PolarHBondContact O-OG1 3.38Å; H343-T346 PolarHBondContact O-N 3.45Å; H343-T346 PolarHBondContact O-OG1 2.96Å
347	M	89.2	Confident	88.8	Confident	140 Å²	140	65.7 Å²	65.7	69%	0.69	33%	0.333	S	S	*	.	H	α-helix	trans	-77.1	-24.9	175.5	-68.9	-71	-108.6	0	0	113	H343 L344 W345 S349	H343-M347 WeakPolarHBondContact O-CG 3.41Å; H343-M347 PolarHBondContact O-N 3.12Å; H343-M347 VanDerWaalsContact O-N 3.12Å; L344-M347 PolarHBondContact O-N 3.17Å; W345-M347 PolarHBondContact O-N 3.37Å; M347-S349 PolarHBondContact O-N 2.02Å
348	D	89.3	Confident	89.1	Confident	20 Å²	20	63.1 Å²	63.1	11%	0.107	32%	0.319	C	S	.	.			trans	-89.2	97.6	177.3	-163.9	-36	0	0	0	111.2	F326 R329 L344 W345 N350 F351 Q352	F326-D348 HydrophobicContact CD2-CB 4.19Å; R329-D348 IonicContact CZ-OD2 3.13Å; R329-D348 IonicContact NH1-OD1 3.1Å; R329-D348 IonicContact NH1-OD2 2.76Å; R329-D348 PolarHBondContact NH1-OD2 3.35Å; L344-D348 PolarHBondContact O-N 2.75Å; W345-D348 PolarHBondContact O-N 3.19Å; D348-N350 VanDerWaalsContact C-N 3.25Å; D348-N350 PolarHBondContact O-N 2.91Å; D348-N350 PolarHBondContact OD1-N 2.83Å; D348-N350 VanDerWaalsContact OD1-N 3.08Å; D348-F351 HydrophobicContact CB-CB 4.04Å; D348-F351 PolarHBondContact O-N 2.83Å; D348-F351 PolarHBondContact OD1-N 3.11Å; D348-Q352 WeakPolarHBondContact O-CB 3.41Å; D348-Q352 PolarHBondContact O-N 2.68Å
349	S	87.8	Confident	89.2	Confident	67 Å²	67	64 Å²	64	47%	0.469	32%	0.321	S	S	.	.	H	α-helix	trans	-61.6	-30	-178.5	62.1	0	0	0	0	114	M347 R353	M347-S349 PolarHBondContact O-N 2.02Å; S349-R353 WeakPolarHBondContact O-CB 3.37Å; S349-R353 VanDerWaalsContact O-CG 3.25Å; S349-R353 WeakPolarHBondContact O-CG 3.04Å; S349-R353 PolarHBondContact O-N 2.86Å; S349-R353 VanDerWaalsContact O-N 3.16Å
350	N	89	Confident	89.4	Confident	89 Å²	89	65 Å²	65	48%	0.476	32%	0.319	S	S	.	.	H	α-helix	trans	-75.2	-44.1	-178	-69.5	-16.5	0	0	0	110.2	D348 R353 R354	D348-N350 VanDerWaalsContact C-N 3.25Å; D348-N350 PolarHBondContact O-N 2.91Å; D348-N350 PolarHBondContact OD1-N 2.83Å; D348-N350 VanDerWaalsContact OD1-N 3.08Å; N350-R353 PolarHBondContact O-N 2.82Å; N350-R354 PolarHBondContact O-N 3.06Å; N350-R354 VanDerWaalsContact O-N 3.14Å
351	F	89.8	Confident	89.6	Confident	1 Å²	1	63.8 Å²	63.8	0%	0.004	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-43.7	176.3	-172	-120.8	0	0	0	111.9	F317 F323 F326 W345 D348 R353 R354 Y355 I404	F317-F351 HydrophobicContact CE1-CE2 4.35Å; F317-F351 HydrophobicContact CE1-CZ 4.33Å; F317-F351 HydrophobicContact CE2-CE2 4.16Å; F317-F351 AromaticContact CZ-CE2 3.6Å; F317-F351 HydrophobicContact CZ-CE2 3.6Å; F317-F351 AromaticContact CZ-CZ 3.73Å; F317-F351 HydrophobicContact CZ-CZ 3.73Å; F323-F351 HydrophobicContact CB-CE2 4.02Å; F323-F351 AromaticContact CD2-CE2 3.65Å; F323-F351 HydrophobicContact CD2-CE2 3.65Å; F323-F351 AromaticContact CD2-CZ 3.79Å; F323-F351 HydrophobicContact CD2-CZ 3.79Å; F323-F351 HydrophobicContact CE2-CZ 4.31Å; F323-F351 HydrophobicContact CG-CE2 4.25Å; F326-F351 HydrophobicContact CB-CB 4.42Å; F326-F351 HydrophobicContact CB-CD1 4.41Å; F326-F351 HydrophobicContact CB-CD2 4.07Å; F326-F351 HydrophobicContact CB-CE2 4.48Å; F326-F351 HydrophobicContact CB-CG 4.05Å; F326-F351 HydrophobicContact CD1-CD1 4.07Å; F326-F351 AromaticContact CD1-CE1 3.83Å; F326-F351 HydrophobicContact CD1-CE1 3.83Å; F326-F351 HydrophobicContact CD1-CZ 4.14Å; F326-F351 HydrophobicContact CD2-CB 4.43Å; F326-F351 HydrophobicContact CD2-CD1 4.01Å; F326-F351 HydrophobicContact CD2-CG 4.26Å; F326-F351 HydrophobicContact CE1-CD1 4.35Å; F326-F351 HydrophobicContact CE1-CE1 4Å; F326-F351 HydrophobicContact CE2-CD1 4.3Å; F326-F351 AromaticContact CG-CD1 3.89Å; F326-F351 HydrophobicContact CG-CD1 3.89Å; F326-F351 HydrophobicContact CG-CD2 4.39Å; F326-F351 HydrophobicContact CG-CE1 4.12Å; F326-F351 HydrophobicContact CG-CG 4.02Å; F326-F351 HydrophobicContact CZ-CD1 4.45Å; F326-F351 HydrophobicContact CZ-CE1 4.45Å; W345-F351 HydrophobicContact CB-CD1 4.49Å; W345-F351 AromaticContact CD1-CD1 3.68Å; W345-F351 AromaticContact CD2-CD1 3.77Å; W345-F351 HydrophobicContact CD2-CD1 3.77Å; W345-F351 AromaticContact CD2-CE1 3.32Å; W345-F351 HydrophobicContact CD2-CE1 3.32Å; W345-F351 HydrophobicContact CD2-CZ 4.42Å; W345-F351 AromaticContact CE2-CD1 3.66Å; W345-F351 AromaticContact CE2-CE1 3.29Å; W345-F351 HydrophobicContact CE3-CD1 4.49Å; W345-F351 AromaticContact CE3-CE1 3.65Å; W345-F351 HydrophobicContact CE3-CE1 3.65Å; W345-F351 HydrophobicContact CE3-CZ 4.49Å; W345-F351 AromaticContact CG-CD1 3.73Å; W345-F351 HydrophobicContact CG-CD1 3.73Å; W345-F351 AromaticContact CG-CE1 3.79Å; W345-F351 HydrophobicContact CG-CE1 3.79Å; W345-F351 AromaticContact CH2-CE1 3.87Å; W345-F351 HydrophobicContact CH2-CE1 3.87Å; W345-F351 HydrophobicContact CH2-CZ 4.09Å; W345-F351 HydrophobicContact CZ2-CD1 4.26Å; W345-F351 AromaticContact CZ2-CE1 3.57Å; W345-F351 HydrophobicContact CZ2-CE1 3.57Å; W345-F351 HydrophobicContact CZ2-CZ 4.01Å; W345-F351 AromaticContact CZ3-CE1 3.91Å; W345-F351 HydrophobicContact CZ3-CE1 3.91Å; W345-F351 HydrophobicContact CZ3-CZ 4.34Å; W345-F351 AromaticContact NE1-CD1 3.63Å; W345-F351 AromaticContact NE1-CE1 3.78Å; D348-F351 HydrophobicContact CB-CB 4.04Å; D348-F351 PolarHBondContact O-N 2.83Å; D348-F351 PolarHBondContact OD1-N 3.11Å; F351-R353 PolarHBondContact O-N 2.94Å; F351-R354 PolarHBondContact O-N 3.49Å; F351-Y355 PolarHBondContact O-N 2.71Å; F351-I404 HydrophobicContact CZ-CD1 4.49Å
352	Q	90.1	Very high	89.6	Confident	49 Å²	49	64.1 Å²	64.1	23%	0.229	31%	0.314	C	S	.	.	H	α-helix	trans	-58.3	-46.3	176.5	-178.5	61.1	19.5	0	0	112.3	D348 R354 Y355 E356	D348-Q352 WeakPolarHBondContact O-CB 3.41Å; D348-Q352 PolarHBondContact O-N 2.68Å; Q352-R354 VanDerWaalsContact C-N 3.34Å; Q352-R354 PolarHBondContact O-N 2.88Å; Q352-Y355 PolarHBondContact O-N 3.37Å; Q352-E356 PolarHBondContact NE2-OE1 3.26Å; Q352-E356 WeakPolarHBondContact O-CG 3.37Å; Q352-E356 PolarHBondContact O-N 2.96Å
353	R	90.3	Very high	89.6	Confident	160 Å²	160	65.7 Å²	65.7	60%	0.604	32%	0.319	S	S	*	.	H	α-helix	trans	-61.6	-40.5	176.5	-76.8	174	-178.4	173.2	2.1	112.6	S349 N350 F351 Y355 E356 Q357	S349-R353 WeakPolarHBondContact O-CB 3.37Å; S349-R353 VanDerWaalsContact O-CG 3.25Å; S349-R353 WeakPolarHBondContact O-CG 3.04Å; S349-R353 PolarHBondContact O-N 2.86Å; S349-R353 VanDerWaalsContact O-N 3.16Å; N350-R353 PolarHBondContact O-N 2.82Å; F351-R353 PolarHBondContact O-N 2.94Å; R353-Y355 VanDerWaalsContact C-N 3.33Å; R353-E356 PolarHBondContact O-N 2.71Å; R353-Q357 WeakPolarHBondContact O-CG 3.42Å; R353-Q357 PolarHBondContact O-N 3.32Å
354	R	90.8	Very high	89.6	Confident	77 Å²	77	65.8 Å²	65.8	29%	0.291	32%	0.32	S	S	.	.	H	α-helix	trans	-64.7	-39.3	178.1	-176.6	60.3	177.8	172.8	-1.2	111.4	F317 E322 N350 F351 Q352 Q357 L358	F317-R354 HydrophobicContact CD2-CG 3.91Å; F317-R354 HydrophobicContact CE2-CB 4.45Å; F317-R354 HydrophobicContact CE2-CG 3.94Å; E322-R354 HydrophobicContact CB-CB 4.43Å; E322-R354 HydrophobicContact CB-CG 4.47Å; N350-R354 PolarHBondContact O-N 3.06Å; N350-R354 VanDerWaalsContact O-N 3.14Å; F351-R354 PolarHBondContact O-N 3.49Å; Q352-R354 VanDerWaalsContact C-N 3.34Å; Q352-R354 PolarHBondContact O-N 2.88Å; R354-Q357 PolarHBondContact O-N 3.35Å; R354-L358 PolarHBondContact O-N 2.9Å
355	Y	90.4	Very high	89.6	Confident	25 Å²	25	63.7 Å²	63.7	10%	0.098	31%	0.309	C	S	.	.	H	α-helix	trans	-67.7	-41.5	174.6	177.7	-104.4	0	0	0	112.9	F317 W345 F351 Q352 R353 Q357 L358 E359 S397 W400	F317-Y355 HydrophobicContact CE2-CD2 4.43Å; F317-Y355 HydrophobicContact CZ-CD2 4.08Å; W345-Y355 AromaticContact CH2-CD2 3.94Å; W345-Y355 HydrophobicContact CH2-CD2 3.94Å; W345-Y355 HydrophobicContact CH2-CE2 4.16Å; W345-Y355 HydrophobicContact CH2-CG 4.32Å; W345-Y355 AromaticContact CZ2-CD1 3.96Å; W345-Y355 HydrophobicContact CZ2-CD1 3.96Å; W345-Y355 AromaticContact CZ2-CD2 3.55Å; W345-Y355 HydrophobicContact CZ2-CD2 3.55Å; W345-Y355 HydrophobicContact CZ2-CE1 4.45Å; W345-Y355 HydrophobicContact CZ2-CE2 4.07Å; W345-Y355 AromaticContact CZ2-CG 3.47Å; W345-Y355 HydrophobicContact CZ2-CG 3.47Å; W345-Y355 VanDerWaalsContact CZ2-CG 3.47Å; F351-Y355 PolarHBondContact O-N 2.71Å; Q352-Y355 PolarHBondContact O-N 3.37Å; R353-Y355 VanDerWaalsContact C-N 3.33Å; Y355-Q357 VanDerWaalsContact C-N 3.29Å; Y355-Q357 PolarHBondContact O-N 3.49Å; Y355-L358 CarbonylContact O-C 3.56Å; Y355-L358 WeakPolarHBondContact O-CA 2.95Å; Y355-L358 WeakPolarHBondContact O-CB 3.14Å; Y355-L358 PolarHBondContact O-N 3.4Å; Y355-L358 VanDerWaalsContact O-N 3.08Å; Y355-E359 PolarHBondContact O-N 3.17Å; Y355-S397 PolarHBondContact OH-N 2.01Å; Y355-W400 AromaticContact CE2-CD1 3.63Å; Y355-W400 HydrophobicContact CE2-CG 4.45Å; Y355-W400 AromaticContact CE2-NE1 3.96Å
356	E	90.5	Very high	89.5	Confident	87 Å²	87	67 Å²	67	41%	0.407	32%	0.323	S	S	.	.	H	α-helix	trans	-60.3	-39.1	175.3	-75.1	170.7	-170.6	0	0	111.8	Q352 R353 L358 E359 I360	Q352-E356 PolarHBondContact NE2-OE1 3.26Å; Q352-E356 WeakPolarHBondContact O-CG 3.37Å; Q352-E356 PolarHBondContact O-N 2.96Å; R353-E356 PolarHBondContact O-N 2.71Å; E356-L358 PolarHBondContact O-N 3.44Å; E356-E359 PolarHBondContact O-N 2.88Å; E356-I360 WeakPolarHBondContact O-CD1 3.26Å; E356-I360 VanDerWaalsContact O-CG1 3.25Å; E356-I360 WeakPolarHBondContact O-CG1 3.46Å; E356-I360 PolarHBondContact O-N 3.04Å
357	Q	90.8	Very high	89.5	Confident	113 Å²	113	67.9 Å²	67.9	53%	0.528	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-43.1	172.3	-72.1	174.9	-3.8	0	0	112.2	R353 R354 Y355 S361	R353-Q357 WeakPolarHBondContact O-CG 3.42Å; R353-Q357 PolarHBondContact O-N 3.32Å; R354-Q357 PolarHBondContact O-N 3.35Å; Y355-Q357 VanDerWaalsContact C-N 3.29Å; Y355-Q357 PolarHBondContact O-N 3.49Å; Q357-S361 WeakPolarHBondContact O-CB 3.35Å; Q357-S361 PolarHBondContact O-N 3.22Å; Q357-S361 PolarHBondContact O-OG 2.9Å; Q357-S361 VanDerWaalsContact O-OG 3.07Å
358	L	90.7	Very high	89.5	Confident	11 Å²	11	66.9 Å²	66.9	6%	0.058	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-45.7	174.4	-179	70.2	0	0	0	110.8	F317 R354 Y355 E356 I360 S361 M362 W400	F317-L358 HydrophobicContact CB-CD1 4.36Å; F317-L358 HydrophobicContact CB-CD2 3.95Å; F317-L358 HydrophobicContact CD1-CD2 4.05Å; F317-L358 HydrophobicContact CD2-CB 4.31Å; F317-L358 HydrophobicContact CD2-CD2 4.01Å; F317-L358 HydrophobicContact CG-CD2 3.73Å; R354-L358 PolarHBondContact O-N 2.9Å; Y355-L358 CarbonylContact O-C 3.56Å; Y355-L358 WeakPolarHBondContact O-CA 2.95Å; Y355-L358 WeakPolarHBondContact O-CB 3.14Å; Y355-L358 PolarHBondContact O-N 3.4Å; Y355-L358 VanDerWaalsContact O-N 3.08Å; E356-L358 PolarHBondContact O-N 3.44Å; L358-I360 PolarHBondContact O-N 2.04Å; L358-S361 WeakPolarHBondContact CA-OG 3.37Å; L358-S361 PolarHBondContact O-N 3.39Å; L358-S361 PolarHBondContact O-OG 3.45Å; L358-M362 HydrophobicContact CD1-CE 4.4Å; L358-M362 HydrophobicContact CD1-CG 4.34Å; L358-M362 HydrophobicContact CG-CE 4.49Å; L358-M362 HydrophobicContact CG-CG 4.35Å; L358-M362 HydrophobicContact CG-SD 4.28Å; L358-M362 VanDerWaalsContact O-CB 3.31Å; L358-M362 WeakPolarHBondContact O-CB 3.34Å; L358-M362 VanDerWaalsContact O-CG 3.29Å; L358-M362 WeakPolarHBondContact O-CG 3.39Å; L358-M362 PolarHBondContact O-N 3.46Å; L358-W400 HydrophobicContact CD2-CZ2 3.8Å
359	E	89.7	Confident	89.5	Confident	58 Å²	58	66 Å²	66	27%	0.271	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-42.9	-179.1	-166.7	-172.8	165.9	0	0	112	Y355 E356 M362 K363	Y355-E359 PolarHBondContact O-N 3.17Å; E356-E359 PolarHBondContact O-N 2.88Å; E359-M362 PolarHBondContact O-N 3.31Å; E359-K363 HydrophobicContact CG-CD 4.43Å; E359-K363 WeakPolarHBondContact O-CB 3.05Å; E359-K363 VanDerWaalsContact O-CG 3.32Å; E359-K363 WeakPolarHBondContact O-CG 3.43Å; E359-K363 PolarHBondContact O-N 3.42Å; E359-K363 WeakPolarHBondContact OE1-CE 3.41Å; E359-K363 IonicContact OE1-NZ 3.01Å; E359-K363 PolarHBondContact OE1-NZ 3.03Å
360	I	90.5	Very high	89.5	Confident	98 Å²	98	66.7 Å²	66.7	50%	0.503	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-47.1	177.1	-67.8	164.6	0	0	0	110.6	E356 L358 M362 K363 Q364	E356-I360 WeakPolarHBondContact O-CD1 3.26Å; E356-I360 VanDerWaalsContact O-CG1 3.25Å; E356-I360 WeakPolarHBondContact O-CG1 3.46Å; E356-I360 PolarHBondContact O-N 3.04Å; L358-I360 PolarHBondContact O-N 2.04Å; I360-M362 PolarHBondContact O-N 2.97Å; I360-K363 PolarHBondContact O-N 3.36Å; I360-Q364 WeakPolarHBondContact O-CG 3.21Å; I360-Q364 PolarHBondContact O-N 3.18Å
361	S	90.1	Very high	89.4	Confident	27 Å²	27	68.7 Å²	68.7	19%	0.189	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-39.8	179.2	62.6	0	0	0	0	112.1	Q357 L358 Q364 L365	Q357-S361 WeakPolarHBondContact O-CB 3.35Å; Q357-S361 PolarHBondContact O-N 3.22Å; Q357-S361 PolarHBondContact O-OG 2.9Å; Q357-S361 VanDerWaalsContact O-OG 3.07Å; L358-S361 WeakPolarHBondContact CA-OG 3.37Å; L358-S361 PolarHBondContact O-N 3.39Å; L358-S361 PolarHBondContact O-OG 3.45Å; S361-Q364 PolarHBondContact O-N 3.36Å; S361-L365 WeakPolarHBondContact O-CG 3.44Å; S361-L365 PolarHBondContact O-N 3.21Å
362	M	88.3	Confident	89.2	Confident	6 Å²	6	70 Å²	70	3%	0.03	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-47.9	172.5	-79.8	-168.5	154.7	0	0	112.3	W310 N314 L358 E359 I360 Q364 L365 F366	W310-M362 HydrophobicContact CD2-CE 4.32Å; W310-M362 VanDerWaalsContact CE2-CE 3.49Å; W310-M362 HydrophobicContact CH2-CB 3.59Å; W310-M362 HydrophobicContact CH2-CE 4.4Å; W310-M362 HydrophobicContact CH2-CG 3.76Å; W310-M362 HydrophobicContact CH2-SD 4.05Å; W310-M362 HydrophobicContact CZ2-CB 4.12Å; W310-M362 HydrophobicContact CZ2-CE 3.51Å; W310-M362 HydrophobicContact CZ2-CG 3.8Å; W310-M362 HydrophobicContact CZ2-SD 3.59Å; W310-M362 VanDerWaalsContact CZ2-SD 3.59Å; W310-M362 HydrophobicContact CZ3-CB 3.96Å; W310-M362 HydrophobicContact CZ3-CG 4.16Å; W310-M362 VanDerWaalsContact CZ3-O 3.23Å; W310-M362 WeakPolarHBondContact CZ3-O 3.41Å; N314-M362 VanDerWaalsContact ND2-CE 3.31Å; N314-M362 WeakPolarHBondContact ND2-CE 3.12Å; N314-M362 WeakPolarHBondContact OD1-CE 3.05Å; L358-M362 HydrophobicContact CD1-CE 4.4Å; L358-M362 HydrophobicContact CD1-CG 4.34Å; L358-M362 HydrophobicContact CG-CE 4.49Å; L358-M362 HydrophobicContact CG-CG 4.35Å; L358-M362 HydrophobicContact CG-SD 4.28Å; L358-M362 VanDerWaalsContact O-CB 3.31Å; L358-M362 WeakPolarHBondContact O-CB 3.34Å; L358-M362 VanDerWaalsContact O-CG 3.29Å; L358-M362 WeakPolarHBondContact O-CG 3.39Å; L358-M362 PolarHBondContact O-N 3.46Å; E359-M362 PolarHBondContact O-N 3.31Å; I360-M362 PolarHBondContact O-N 2.97Å; M362-Q364 VanDerWaalsContact C-N 3.28Å; M362-Q364 PolarHBondContact O-N 3.13Å; M362-L365 PolarHBondContact O-N 3.03Å; M362-F366 WeakPolarHBondContact O-CB 3.37Å; M362-F366 PolarHBondContact O-N 2.87Å
363	K	88.8	Confident	89.1	Confident	102 Å²	102	68.3 Å²	68.3	44%	0.443	31%	0.312	S	S	.	.	H	α-helix	trans	-57.8	-42.6	176.5	-77.2	173.9	-177.4	168.1	0	111.3	E359 I360 F366 L367	E359-K363 HydrophobicContact CG-CD 4.43Å; E359-K363 WeakPolarHBondContact O-CB 3.05Å; E359-K363 VanDerWaalsContact O-CG 3.32Å; E359-K363 WeakPolarHBondContact O-CG 3.43Å; E359-K363 PolarHBondContact O-N 3.42Å; E359-K363 WeakPolarHBondContact OE1-CE 3.41Å; E359-K363 IonicContact OE1-NZ 3.01Å; E359-K363 PolarHBondContact OE1-NZ 3.03Å; I360-K363 PolarHBondContact O-N 3.36Å; K363-F366 PolarHBondContact O-N 3.38Å; K363-L367 WeakPolarHBondContact O-CG 3.47Å; K363-L367 PolarHBondContact O-N 3.09Å
364	Q	89.4	Confident	88.8	Confident	111 Å²	111	66.3 Å²	66.3	52%	0.519	31%	0.309	S	S	.	.	H	α-helix	trans	-63.8	-43.5	176.6	-70.9	177.4	4.1	0	0	112.7	I360 S361 M362 K368	I360-Q364 WeakPolarHBondContact O-CG 3.21Å; I360-Q364 PolarHBondContact O-N 3.18Å; S361-Q364 PolarHBondContact O-N 3.36Å; M362-Q364 VanDerWaalsContact C-N 3.28Å; M362-Q364 PolarHBondContact O-N 3.13Å; Q364-K368 WeakPolarHBondContact O-CG 3.33Å; Q364-K368 PolarHBondContact O-N 3.46Å; Q364-K368 VanDerWaalsContact O-N 3.09Å
365	L	88.4	Confident	88.5	Confident	16 Å²	16	66.2 Å²	66.2	8%	0.084	31%	0.311	C	S	.	.	H	α-helix	trans	-64.8	-40.6	176.3	-74.9	179.9	0	0	0	112	I306 W310 Y313 S361 M362 K368 A369	I306-L365 HydrophobicContact CG2-CB 4.41Å; W310-L365 HydrophobicContact CE3-CB 3.9Å; W310-L365 HydrophobicContact CE3-CD1 4.11Å; W310-L365 HydrophobicContact CZ3-CB 4.02Å; Y313-L365 HydrophobicContact CD2-CD1 3.61Å; Y313-L365 HydrophobicContact CE2-CD1 3.61Å; Y313-L365 HydrophobicContact CE2-CG 4.3Å; S361-L365 WeakPolarHBondContact O-CG 3.44Å; S361-L365 PolarHBondContact O-N 3.21Å; M362-L365 PolarHBondContact O-N 3.03Å; L365-K368 WeakPolarHBondContact O-CB 3.42Å; L365-K368 PolarHBondContact O-N 3.49Å; L365-A369 WeakPolarHBondContact O-CB 3.46Å; L365-A369 PolarHBondContact O-N 2.96Å
366	F	87.9	Confident	88.2	Confident	71 Å²	71	65 Å²	65	31%	0.311	31%	0.306	S	S	.	.	H	α-helix	trans	-63.2	-46	177.9	-176.3	-96.6	0	0	0	111.6	W310 M362 K363 K368 A369 Q370	W310-F366 HydrophobicContact CZ3-CB 4.2Å; M362-F366 WeakPolarHBondContact O-CB 3.37Å; M362-F366 PolarHBondContact O-N 2.87Å; K363-F366 PolarHBondContact O-N 3.38Å; F366-K368 VanDerWaalsContact C-N 3.3Å; F366-K368 PolarHBondContact O-N 2.73Å; F366-A369 PolarHBondContact O-N 2.83Å; F366-Q370 WeakPolarHBondContact O-CB 3.28Å; F366-Q370 PolarHBondContact O-N 3.26Å
367	L	88.7	Confident	87.8	Confident	98 Å²	98	66.5 Å²	66.5	51%	0.513	31%	0.311	S	S	.	.	H	α-helix	trans	-61	-38.4	175.2	-70.9	172.9	0	0	0	112	K363 K371	K363-L367 WeakPolarHBondContact O-CG 3.47Å; K363-L367 PolarHBondContact O-N 3.09Å; L367-K371 WeakPolarHBondContact O-CG 3.37Å; L367-K371 PolarHBondContact O-N 3.45Å; L367-K371 VanDerWaalsContact O-N 3.07Å
368	K	89.2	Confident	87.3	Confident	119 Å²	119	65.2 Å²	65.2	52%	0.517	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-45.6	173.7	-74.1	173.8	-178.3	175.9	0	111.7	I306 Q364 L365 F366 Q370 K371 I372	I306-K368 HydrophobicContact CD1-CB 4.39Å; Q364-K368 WeakPolarHBondContact O-CG 3.33Å; Q364-K368 PolarHBondContact O-N 3.46Å; Q364-K368 VanDerWaalsContact O-N 3.09Å; L365-K368 WeakPolarHBondContact O-CB 3.42Å; L365-K368 PolarHBondContact O-N 3.49Å; F366-K368 VanDerWaalsContact C-N 3.3Å; F366-K368 PolarHBondContact O-N 2.73Å; K368-Q370 VanDerWaalsContact C-N 3.35Å; K368-Q370 PolarHBondContact O-N 3.41Å; K368-K371 PolarHBondContact O-N 3.07Å; K368-I372 WeakPolarHBondContact O-CG1 3.42Å; K368-I372 PolarHBondContact O-N 3.3Å
369	A	88.2	Confident	86.7	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.008	32%	0.323	C	S	.	.	H	α-helix	trans	-61.4	-44.1	177.6	0	0	0	0	0	111.4	L303 I306 L365 F366 K371 I372 V373 L391	L303-A369 HydrophobicContact CD2-CB 4.21Å; I306-A369 HydrophobicContact CD1-CB 4.28Å; I306-A369 HydrophobicContact CG2-CB 4.24Å; L365-A369 WeakPolarHBondContact O-CB 3.46Å; L365-A369 PolarHBondContact O-N 2.96Å; F366-A369 PolarHBondContact O-N 2.83Å; A369-K371 PolarHBondContact O-N 3.04Å; A369-I372 PolarHBondContact O-N 2.98Å; A369-V373 WeakPolarHBondContact O-CG2 3.46Å; A369-V373 PolarHBondContact O-N 3.49Å; A369-L391 HydrophobicContact CB-CD2 3.75Å
370	Q	87.4	Confident	86.3	Confident	82 Å²	82	64.7 Å²	64.7	38%	0.383	32%	0.315	S	S	.	.	H	α-helix	trans	-59.3	-45.2	176.3	-172.1	178	1.9	0	0	111.3	F366 K368 I372 V373 H374	F366-Q370 WeakPolarHBondContact O-CB 3.28Å; F366-Q370 PolarHBondContact O-N 3.26Å; K368-Q370 VanDerWaalsContact C-N 3.35Å; K368-Q370 PolarHBondContact O-N 3.41Å; Q370-I372 VanDerWaalsContact C-N 3.35Å; Q370-I372 PolarHBondContact O-N 2.74Å; Q370-V373 PolarHBondContact O-N 2.86Å; Q370-H374 PolarHBondContact O-N 3.19Å; Q370-H374 PolarHBondContact O-ND1 3.2Å
371	K	87.4	Confident	85.7	Confident	130 Å²	130	66.9 Å²	66.9	57%	0.565	32%	0.321	S	S	*	.	H	α-helix	trans	-59.8	-42.8	175.1	-73.1	-179.8	-178.4	-167.8	0	112.4	L367 K368 A369 H374 K375	L367-K371 WeakPolarHBondContact O-CG 3.37Å; L367-K371 PolarHBondContact O-N 3.45Å; L367-K371 VanDerWaalsContact O-N 3.07Å; K368-K371 PolarHBondContact O-N 3.07Å; A369-K371 PolarHBondContact O-N 3.04Å; K371-H374 PolarHBondContact O-N 3.38Å; K371-K375 PolarHBondContact O-N 3.35Å
372	I	86.1	Confident	85	Confident	30 Å²	30	69.7 Å²	69.7	15%	0.154	33%	0.327	C	S	.	.	H	α-helix	trans	-63.7	-44.2	177.6	-67.4	162	0	0	0	110.4	M299 N302 L303 I306 K368 A369 Q370 H374 K375 L376	M299-I372 HydrophobicContact CB-CG2 4.13Å; M299-I372 HydrophobicContact SD-CG2 4.06Å; N302-I372 HydrophobicContact CB-CD1 4.29Å; L303-I372 HydrophobicContact CD1-CG2 4.2Å; L303-I372 HydrophobicContact CD2-CB 3.97Å; L303-I372 HydrophobicContact CD2-CD1 4.5Å; L303-I372 HydrophobicContact CD2-CG2 3.78Å; L303-I372 HydrophobicContact CG-CB 4.45Å; L303-I372 HydrophobicContact CG-CG2 3.69Å; I306-I372 HydrophobicContact CD1-CD1 3.39Å; K368-I372 WeakPolarHBondContact O-CG1 3.42Å; K368-I372 PolarHBondContact O-N 3.3Å; A369-I372 PolarHBondContact O-N 2.98Å; Q370-I372 VanDerWaalsContact C-N 3.35Å; Q370-I372 PolarHBondContact O-N 2.74Å; I372-H374 VanDerWaalsContact C-N 3.34Å; I372-H374 PolarHBondContact O-N 3.4Å; I372-K375 CarbonylContact O-C 3.45Å; I372-K375 WeakPolarHBondContact O-CB 3.5Å; I372-K375 PolarHBondContact O-N 3.35Å; I372-K375 VanDerWaalsContact O-N 3.13Å; I372-L376 WeakPolarHBondContact O-CB 3.36Å; I372-L376 PolarHBondContact O-N 3.01Å
373	V	87.3	Confident	84.6	Confident	13 Å²	13	70.3 Å²	70.3	8%	0.079	33%	0.332	C	S	.	.	H	α-helix	trans	-58.7	-44.3	176.7	169.1	0	0	0	0	111.6	L303 A369 Q370 K375 L376 F377 I389 L391	L303-V373 HydrophobicContact CD1-CG2 4.13Å; L303-V373 HydrophobicContact CD2-CG2 4.18Å; A369-V373 WeakPolarHBondContact O-CG2 3.46Å; A369-V373 PolarHBondContact O-N 3.49Å; Q370-V373 PolarHBondContact O-N 2.86Å; V373-K375 VanDerWaalsContact C-N 3.35Å; V373-K375 PolarHBondContact O-N 3.32Å; V373-L376 WeakPolarHBondContact O-CB 3.35Å; V373-L376 PolarHBondContact O-N 3.01Å; V373-F377 HydrophobicContact CG1-CD2 3.63Å; V373-F377 HydrophobicContact CG1-CE2 3.41Å; V373-F377 VanDerWaalsContact CG1-CE2 3.41Å; V373-F377 WeakPolarHBondContact O-CD2 3.41Å; V373-F377 PolarHBondContact O-N 2.91Å; V373-I389 HydrophobicContact CG1-CD1 4.21Å; V373-I389 HydrophobicContact CG1-CG2 4.32Å; V373-I389 HydrophobicContact CG2-CG2 3.76Å; V373-L391 HydrophobicContact CG2-CD1 4.49Å; V373-L391 HydrophobicContact CG2-CD2 4Å; V373-L391 HydrophobicContact CG2-CG 4.36Å
374	H	85.1	Confident	83.7	Confident	117 Å²	117	72.7 Å²	72.7	54%	0.542	35%	0.345	S	S	.	.	H	α-helix	trans	-61.3	-42.5	175.1	-73.5	78.6	0	0	0	111.9	Q370 K371 I372 L376 F377 S378	Q370-H374 PolarHBondContact O-N 3.19Å; Q370-H374 PolarHBondContact O-ND1 3.2Å; K371-H374 PolarHBondContact O-N 3.38Å; I372-H374 VanDerWaalsContact C-N 3.34Å; I372-H374 PolarHBondContact O-N 3.4Å; H374-L376 VanDerWaalsContact C-N 3.3Å; H374-L376 PolarHBondContact O-N 2.86Å; H374-F377 PolarHBondContact O-N 3.48Å; H374-S378 PolarHBondContact O-N 2.93Å
375	K	83.1	Confident	82.9	Confident	76 Å²	76	71 Å²	71	33%	0.33	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-39.5	175.1	-171.4	164.2	-176.6	170.7	0	111.3	D45 M299 K371 I372 V373 S378 L379	D45-K375 IonicContact OD2-NZ 2.82Å; D45-K375 PolarHBondContact OD2-NZ 3.34Å; M299-K375 HydrophobicContact CE-CD 3.52Å; M299-K375 VanDerWaalsContact CE-CE 3.47Å; M299-K375 HydrophobicContact CE-CG 4.2Å; M299-K375 HydrophobicContact SD-CD 4.27Å; K371-K375 PolarHBondContact O-N 3.35Å; I372-K375 CarbonylContact O-C 3.45Å; I372-K375 WeakPolarHBondContact O-CB 3.5Å; I372-K375 PolarHBondContact O-N 3.35Å; I372-K375 VanDerWaalsContact O-N 3.13Å; V373-K375 VanDerWaalsContact C-N 3.35Å; V373-K375 PolarHBondContact O-N 3.32Å; K375-S378 WeakPolarHBondContact O-CB 3.23Å; K375-S378 PolarHBondContact O-N 3.28Å; K375-L379 HydrophobicContact CG-CD1 4.21Å; K375-L379 VanDerWaalsContact O-CG 3.31Å; K375-L379 WeakPolarHBondContact O-CG 3.31Å; K375-L379 PolarHBondContact O-N 2.84Å
376	L	84.4	Confident	82.1	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-66.2	-42.1	179	-141.6	168.4	0	0	0	111.5	I296 M299 E300 L303 I372 V373 H374 L379 S380 P387	I296-L376 HydrophobicContact CG2-CD2 4.28Å; M299-L376 HydrophobicContact CB-CD1 3.99Å; M299-L376 HydrophobicContact CB-CG 4.07Å; E300-L376 HydrophobicContact CG-CD1 4.17Å; L303-L376 HydrophobicContact CD1-CD1 3.87Å; I372-L376 WeakPolarHBondContact O-CB 3.36Å; I372-L376 PolarHBondContact O-N 3.01Å; V373-L376 WeakPolarHBondContact O-CB 3.35Å; V373-L376 PolarHBondContact O-N 3.01Å; H374-L376 VanDerWaalsContact C-N 3.3Å; H374-L376 PolarHBondContact O-N 2.86Å; L376-L379 PolarHBondContact O-N 3.31Å; L376-S380 WeakPolarHBondContact O-CB 3.33Å; L376-S380 PolarHBondContact O-N 3.08Å; L376-S380 PolarHBondContact O-OG 3.37Å; L376-P387 HydrophobicContact CD1-CB 4.39Å; L376-P387 HydrophobicContact CD2-CB 3.05Å; L376-P387 HydrophobicContact CD2-CG 3.61Å; L376-P387 HydrophobicContact CG-CB 4.31Å
377	F	82.9	Confident	81.5	Confident	117 Å²	117	76.5 Å²	76.5	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-61.8	-41	170.5	-80.9	-63.8	0	0	0	112.4	V373 H374 L379 S380 K381 I389	V373-F377 HydrophobicContact CG1-CD2 3.63Å; V373-F377 HydrophobicContact CG1-CE2 3.41Å; V373-F377 VanDerWaalsContact CG1-CE2 3.41Å; V373-F377 WeakPolarHBondContact O-CD2 3.41Å; V373-F377 PolarHBondContact O-N 2.91Å; H374-F377 PolarHBondContact O-N 3.48Å; F377-L379 PolarHBondContact O-N 3.48Å; F377-S380 WeakPolarHBondContact CA-OG 3.32Å; F377-S380 PolarHBondContact O-N 3.44Å; F377-S380 PolarHBondContact O-OG 2.95Å; F377-K381 PolarHBondContact O-N 3.39Å; F377-I389 HydrophobicContact CD2-CD1 4.43Å; F377-I389 HydrophobicContact CE1-CD1 4.14Å; F377-I389 HydrophobicContact CE2-CD1 3.68Å; F377-I389 HydrophobicContact CZ-CD1 3.5Å; F377-I389 VanDerWaalsContact CZ-CD1 3.5Å
378	S	80.6	Confident	80.8	Confident	87 Å²	87	78.7 Å²	78.7	61%	0.608	38%	0.376	S	S	*	.	H	α-helix	trans	-62.2	-42.7	175.7	-172.1	0	0	0	0	112.3	H374 K375	H374-S378 PolarHBondContact O-N 2.93Å; K375-S378 WeakPolarHBondContact O-CB 3.23Å; K375-S378 PolarHBondContact O-N 3.28Å
379	L	77.3	Confident	80.3	Confident	43 Å²	43	76 Å²	76	23%	0.225	37%	0.366	C	S	.	.	H	α-helix	trans	-71.2	-31.3	179	-68.5	170.5	0	0	0	112.5	P292 D295 I296 M299 K375 L376 F377	P292-L379 HydrophobicContact CG-CB 4.29Å; P292-L379 HydrophobicContact CG-CD2 3.93Å; D295-L379 HydrophobicContact CB-CD1 4.29Å; I296-L379 HydrophobicContact CG1-CB 4.24Å; M299-L379 HydrophobicContact CG-CD1 4.29Å; K375-L379 HydrophobicContact CG-CD1 4.21Å; K375-L379 VanDerWaalsContact O-CG 3.31Å; K375-L379 WeakPolarHBondContact O-CG 3.31Å; K375-L379 PolarHBondContact O-N 2.84Å; L376-L379 PolarHBondContact O-N 3.31Å; F377-L379 PolarHBondContact O-N 3.48Å
380	S	80.6	Confident	79.6	Confident	15 Å²	15	79.8 Å²	79.8	11%	0.105	39%	0.393	C	S	.	.	H	α-helix	trans	-90.9	-4.5	-178.3	57	0	0	0	0	114.5	L376 F377 R382 C383	L376-S380 WeakPolarHBondContact O-CB 3.33Å; L376-S380 PolarHBondContact O-N 3.08Å; L376-S380 PolarHBondContact O-OG 3.37Å; F377-S380 WeakPolarHBondContact CA-OG 3.32Å; F377-S380 PolarHBondContact O-N 3.44Å; F377-S380 PolarHBondContact O-OG 2.95Å; S380-R382 PolarHBondContact O-N 3.44Å; S380-C383 PolarHBondContact O-N 2.98Å
381	K	77.6	Confident	79.2	Confident	144 Å²	144	79.6 Å²	79.6	63%	0.626	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.3	-34.4	-176.9	-172.5	-175.4	-179.3	-169.7	0	114.3	D277 F377	D277-K381 IonicContact OD2-NZ 3.84Å; D277-K381 PolarHBondContact OD2-NZ 3.43Å; F377-K381 PolarHBondContact O-N 3.39Å
382	R	76.4	Confident	78.7	Confident	85 Å²	85	74.1 Å²	74.1	32%	0.321	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	15.8	-177	-60.8	175.2	-179.5	-96.4	5.7	112.9	D277 W279 N290 S380	D277-R382 IonicContact OD1-CZ 2.92Å; D277-R382 IonicContact OD1-NE 3.49Å; D277-R382 IonicContact OD1-NH2 3.83Å; D277-R382 PolarHBondContact OD1-NH2 3.47Å; D277-R382 IonicContact OD2-CZ 2.62Å; D277-R382 IonicContact OD2-NH2 3.67Å; D277-R382 PolarHBondContact OD2-NH2 3.16Å; W279-R382 VanDerWaalsContact CD1-NH1 3.34Å; W279-R382 VanDerWaalsContact CG-CZ 3.43Å; W279-R382 VanDerWaalsContact CZ3-NH2 3.35Å; N290-R382 HydrophobicContact CB-CB 4.05Å; S380-R382 PolarHBondContact O-N 3.44Å
383	C	78.8	Confident	78.4	Confident	19 Å²	19	83.5 Å²	83.5	13%	0.128	41%	0.405	C	S	.	.			trans	-102.1	144.8	176.9	-173.5	0	0	0	0	110.4	C291 S380 K385	C291-C383 HydrophobicContact CB-CB 3.68Å; C291-C383 WeakPolarHBondContact CB-SG 3.35Å; C291-C383 WeakPolarHBondContact SG-CB 3.45Å; C291-C383 CovalentContact SG-SG 2.03Å; C291-C383 PolarHBondContact SG-SG 3.2Å; S380-C383 PolarHBondContact O-N 2.98Å; C383-K385 VanDerWaalsContact C-N 3.31Å; C383-K385 VanDerWaalsContact SG-CB 3.51Å; C383-K385 PolarHBondContact SG-N 3.36Å
384	H	71.9	Confident	77.7	Confident	152 Å²	152	87 Å²	87	70%	0.704	42%	0.421	S	S	*	.	S	Bend	trans	-77.8	-18.2	173.7	-67.2	-61.8	0	0	0	112.9	Q386	H384-Q386 PolarHBondContact O-N 3.25Å
385	K	71.8	Confident	77.5	Confident	76 Å²	76	84.9 Å²	84.9	33%	0.33	41%	0.408	S	S	.	.	S	Bend	trans	-73.4	120.6	178.5	-167	-177.8	177.8	-162.6	0	110.3	E300 C383	E300-K385 IonicContact OE2-NZ 2.86Å; C383-K385 VanDerWaalsContact C-N 3.31Å; C383-K385 VanDerWaalsContact SG-CB 3.51Å; C383-K385 PolarHBondContact SG-N 3.36Å
386	Q	72.3	Confident	77.5	Confident	173 Å²	173	84.9 Å²	84.9	81%	0.808	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-77.9	125.8	171.3	-68.5	-178.5	-6.1	0	0	109.6	H384	H384-Q386 PolarHBondContact O-N 3.25Å
387	P	73.9	Confident	77.4	Confident	30 Å²	30	86.9 Å²	86.9	20%	0.195	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-78.2	143.2	-179.1	31.5	-35.6	0	0	0	112.6	L376 I389	L376-P387 HydrophobicContact CD1-CB 4.39Å; L376-P387 HydrophobicContact CD2-CB 3.05Å; L376-P387 HydrophobicContact CD2-CG 3.61Å; L376-P387 HydrophobicContact CG-CB 4.31Å; P387-I389 HydrophobicContact CB-CG1 4.45Å; P387-I389 HydrophobicContact CG-CD1 4.1Å; P387-I389 HydrophobicContact CG-CG1 4.38Å; P387-I389 PolarHBondContact O-N 3.01Å
388	L	75.1	Confident	77.5	Confident	143 Å²	143	85.3 Å²	85.3	75%	0.749	43%	0.429	S	S	*	.			trans	-80.9	102.9	175.7	-72.4	167.1	0	0	0	109.9	E300	E300-L388 PolarHBondContact OE1-N 3.29Å; E300-L388 VanDerWaalsContact OE1-N 3.11Å
389	I	77.4	Confident	77.9	Confident	62 Å²	62	84.5 Å²	84.5	32%	0.318	41%	0.413	S	S	.	.			trans	-107.4	109	179.7	-58.8	166.5	0	0	0	109.2	V373 F377 P387 L391	V373-I389 HydrophobicContact CG1-CD1 4.21Å; V373-I389 HydrophobicContact CG1-CG2 4.32Å; V373-I389 HydrophobicContact CG2-CG2 3.76Å; F377-I389 HydrophobicContact CD2-CD1 4.43Å; F377-I389 HydrophobicContact CE1-CD1 4.14Å; F377-I389 HydrophobicContact CE2-CD1 3.68Å; F377-I389 HydrophobicContact CZ-CD1 3.5Å; F377-I389 VanDerWaalsContact CZ-CD1 3.5Å; P387-I389 HydrophobicContact CB-CG1 4.45Å; P387-I389 HydrophobicContact CG-CD1 4.1Å; P387-I389 HydrophobicContact CG-CG1 4.38Å; P387-I389 PolarHBondContact O-N 3.01Å; I389-L391 HydrophobicContact CG2-CD1 4.49Å; I389-L391 HydrophobicContact CG2-CG 4.28Å
390	S	75.4	Confident	78.4	Confident	81 Å²	81	82.4 Å²	82.4	57%	0.566	40%	0.402	S	S	*	.			trans	-119.3	108.1	169.7	-176.2	0	0	0	0	109.1
391	L	78.2	Confident	78.8	Confident	78 Å²	78	82.2 Å²	82.2	41%	0.408	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-92.4	134.2	177.3	-76.4	164.3	0	0	0	109.9	A369 V373 I389 R393	A369-L391 HydrophobicContact CB-CD2 3.75Å; V373-L391 HydrophobicContact CG2-CD1 4.49Å; V373-L391 HydrophobicContact CG2-CD2 4Å; V373-L391 HydrophobicContact CG2-CG 4.36Å; I389-L391 HydrophobicContact CG2-CD1 4.49Å; I389-L391 HydrophobicContact CG2-CG 4.28Å; L391-R393 PolarHBondContact O-N 3.38Å
392	P	77.2	Confident	79.3	Confident	15 Å²	15	77.9 Å²	77.9	10%	0.097	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-65	132.2	174	26.8	-31.7	0	0	0	109.8	W310	W310-P392 HydrophobicContact CB-CB 4.33Å; W310-P392 HydrophobicContact CD2-CB 3.67Å; W310-P392 HydrophobicContact CD2-CG 3.88Å; W310-P392 HydrophobicContact CE3-CB 4.12Å; W310-P392 HydrophobicContact CE3-CG 3.79Å; W310-P392 HydrophobicContact CG-CB 3.74Å; W310-P392 HydrophobicContact CG-CG 4.24Å; W310-P392 HydrophobicContact CZ3-CG 4.26Å
393	R	78.7	Confident	79.8	Confident	227 Å²	227	77 Å²	77	86%	0.857	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-76.9	129.1	175.6	-170.2	174.5	-179.3	178.5	-0.1	109.7	L391 R395	L391-R393 PolarHBondContact O-N 3.38Å; R393-R395 PolarHBondContact O-N 3.42Å
394	Q	73.8	Confident	80.3	Confident	87 Å²	87	76.1 Å²	76.1	41%	0.407	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-64.8	126.7	175.9	-166.8	174.6	-3.2	0	0	110.4
395	R	80.2	Confident	81	Confident	72 Å²	72	68.9 Å²	68.9	27%	0.272	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-83.7	118.2	173.6	-71.9	171.8	173.9	-172.4	1.5	108.1	N314 R393 Y399	N314-R395 WeakPolarHBondContact OD1-CD 3.38Å; N314-R395 PolarHBondContact OD1-NH1 3.31Å; R393-R395 PolarHBondContact O-N 3.42Å; R395-Y399 HydrophobicContact CB-CD1 3.79Å; R395-Y399 HydrophobicContact CB-CE1 4.44Å; R395-Y399 HydrophobicContact CB-CG 4.05Å; R395-Y399 HydrophobicContact CG-CD1 3.71Å; R395-Y399 HydrophobicContact CG-CD2 4.35Å; R395-Y399 HydrophobicContact CG-CE1 3.95Å; R395-Y399 HydrophobicContact CG-CG 3.95Å; R395-Y399 PolarHBondContact NH2-OH 3.34Å
396	T	82.3	Confident	81.7	Confident	76 Å²	76	65.4 Å²	65.4	47%	0.466	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-76.1	166.8	176.4	47.2	0	0	0	0	110.9	T398 Y399 W400	T396-T398 PolarHBondContact O-N 2.83Å; T396-T398 PolarHBondContact OG1-OG1 3.24Å; T396-Y399 WeakPolarHBondContact O-CB 3.5Å; T396-Y399 PolarHBondContact O-N 2.74Å; T396-W400 PolarHBondContact O-N 2.02Å
397	S	82.8	Confident	82.3	Confident	43 Å²	43	59.6 Å²	59.6	30%	0.301	30%	0.3	S	S	.	.	H	α-helix	trans	-54.8	-37.3	172.1	52	0	0	0	0	111.7	Y355 Y399 W400 L401	Y355-S397 PolarHBondContact OH-N 2.01Å; S397-Y399 VanDerWaalsContact C-N 3.32Å; S397-Y399 PolarHBondContact O-N 3.46Å; S397-W400 PolarHBondContact O-N 2.03Å; S397-W400 VanDerWaalsContact O-N 3.09Å; S397-L401 WeakPolarHBondContact O-CG 3.25Å; S397-L401 PolarHBondContact O-N 3.21Å
398	T	86.2	Confident	82.7	Confident	84 Å²	84	58.8 Å²	58.8	52%	0.515	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-39.8	175.6	54.4	0	0	0	0	113.1	T396 W400 L401 T402	T396-T398 PolarHBondContact O-N 2.83Å; T396-T398 PolarHBondContact OG1-OG1 3.24Å; T398-W400 VanDerWaalsContact C-N 3.32Å; T398-W400 PolarHBondContact O-N 2.99Å; T398-L401 PolarHBondContact O-N 3.22Å; T398-T402 WeakPolarHBondContact O-CG2 3.48Å; T398-T402 PolarHBondContact O-N 2.96Å; T398-T402 PolarHBondContact O-OG1 2.74Å
399	Y	87.9	Confident	83.1	Confident	69 Å²	69	52.1 Å²	52.1	27%	0.271	26%	0.259	S	S	.	.	H	α-helix	trans	-59.5	-45.1	174.8	171.3	-85.9	0	0	0	110.9	R395 T396 S397 T402 R403	R395-Y399 HydrophobicContact CB-CD1 3.79Å; R395-Y399 HydrophobicContact CB-CE1 4.44Å; R395-Y399 HydrophobicContact CB-CG 4.05Å; R395-Y399 HydrophobicContact CG-CD1 3.71Å; R395-Y399 HydrophobicContact CG-CD2 4.35Å; R395-Y399 HydrophobicContact CG-CE1 3.95Å; R395-Y399 HydrophobicContact CG-CG 3.95Å; R395-Y399 PolarHBondContact NH2-OH 3.34Å; T396-Y399 WeakPolarHBondContact O-CB 3.5Å; T396-Y399 PolarHBondContact O-N 2.74Å; S397-Y399 VanDerWaalsContact C-N 3.32Å; S397-Y399 PolarHBondContact O-N 3.46Å; Y399-T402 WeakPolarHBondContact CA-OG1 3.49Å; Y399-T402 PolarHBondContact O-N 3.11Å; Y399-T402 PolarHBondContact O-OG1 3.25Å; Y399-R403 HydrophobicContact CE1-CB 4.48Å; Y399-R403 WeakPolarHBondContact O-CB 2.96Å; Y399-R403 PolarHBondContact O-N 3.48Å
400	W	89	Confident	83.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.1	-36.4	179.6	-70.6	110.4	0	0	0	112.8	N314 F317 W345 Y355 L358 T396 S397 T398 R403 I404	N314-W400 HydrophobicContact CB-CH2 4.43Å; N314-W400 VanDerWaalsContact OD1-CZ2 3.27Å; N314-W400 WeakPolarHBondContact OD1-CZ2 3.17Å; F317-W400 HydrophobicContact CD1-CD2 4.27Å; F317-W400 HydrophobicContact CD1-CE3 4.04Å; F317-W400 AromaticContact CD1-CH2 3.54Å; F317-W400 HydrophobicContact CD1-CH2 3.54Å; F317-W400 AromaticContact CD1-CZ2 3.79Å; F317-W400 HydrophobicContact CD1-CZ2 3.79Å; F317-W400 AromaticContact CD1-CZ3 3.69Å; F317-W400 HydrophobicContact CD1-CZ3 3.69Å; F317-W400 AromaticContact CE1-CD2 3.98Å; F317-W400 HydrophobicContact CE1-CD2 3.98Å; F317-W400 AromaticContact CE1-CE3 3.89Å; F317-W400 HydrophobicContact CE1-CE3 3.89Å; F317-W400 HydrophobicContact CE1-CH2 4.22Å; F317-W400 HydrophobicContact CE1-CZ2 4.3Å; F317-W400 HydrophobicContact CE1-CZ3 4.03Å; F317-W400 HydrophobicContact CG-CH2 4.47Å; W345-W400 HydrophobicContact CH2-CB 3.73Å; W345-W400 HydrophobicContact CH2-CG 4.38Å; W345-W400 HydrophobicContact CZ3-CB 3.88Å; Y355-W400 AromaticContact CE2-CD1 3.63Å; Y355-W400 HydrophobicContact CE2-CG 4.45Å; Y355-W400 AromaticContact CE2-NE1 3.96Å; L358-W400 HydrophobicContact CD2-CZ2 3.8Å; T396-W400 PolarHBondContact O-N 2.02Å; S397-W400 PolarHBondContact O-N 2.03Å; S397-W400 VanDerWaalsContact O-N 3.09Å; T398-W400 VanDerWaalsContact C-N 3.32Å; T398-W400 PolarHBondContact O-N 2.99Å; W400-R403 HydrophobicContact CE3-CB 4.36Å; W400-R403 HydrophobicContact CE3-CG 4.32Å; W400-R403 HydrophobicContact CZ3-CG 4.47Å; W400-R403 WeakPolarHBondContact O-CB 3.02Å; W400-R403 PolarHBondContact O-N 2.89Å; W400-I404 WeakPolarHBondContact O-CB 3.25Å; W400-I404 WeakPolarHBondContact O-CD1 3.38Å; W400-I404 VanDerWaalsContact O-CG1 3.28Å; W400-I404 WeakPolarHBondContact O-CG1 3.43Å; W400-I404 PolarHBondContact O-N 3.33Å
401	L	88.5	Confident	83.5	Confident	10 Å²	10	48.8 Å²	48.8	5%	0.052	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-46.6	172.6	-67	170	0	0	0	111.2	T338 I341 M342 W345 S397 T398 R403 I404 Q405	T338-L401 HydrophobicContact CG2-CB 4.1Å; I341-L401 HydrophobicContact CB-CD2 4.07Å; I341-L401 HydrophobicContact CG2-CD2 3.62Å; M342-L401 HydrophobicContact CB-CD1 4.2Å; M342-L401 HydrophobicContact CB-CD2 4.2Å; M342-L401 HydrophobicContact SD-CD1 4.17Å; M342-L401 HydrophobicContact SD-CD2 4.42Å; W345-L401 HydrophobicContact CE3-CD2 3.75Å; W345-L401 HydrophobicContact CE3-CG 4.5Å; W345-L401 HydrophobicContact CZ3-CD2 4.08Å; W345-L401 HydrophobicContact CZ3-CG 4.4Å; S397-L401 WeakPolarHBondContact O-CG 3.25Å; S397-L401 PolarHBondContact O-N 3.21Å; T398-L401 PolarHBondContact O-N 3.22Å; L401-R403 VanDerWaalsContact C-N 3.27Å; L401-R403 PolarHBondContact O-N 2.85Å; L401-I404 PolarHBondContact O-N 2.94Å; L401-Q405 PolarHBondContact O-N 2.75Å
402	T	87.1	Confident	83.1	Confident	53 Å²	53	48.2 Å²	48.2	33%	0.325	23%	0.231	S	C	.	.	H	α-helix	trans	-64.4	-33.4	174.9	56.8	0	0	0	0	112.3	T398 Y399 Q405 S406	T398-T402 WeakPolarHBondContact O-CG2 3.48Å; T398-T402 PolarHBondContact O-N 2.96Å; T398-T402 PolarHBondContact O-OG1 2.74Å; Y399-T402 WeakPolarHBondContact CA-OG1 3.49Å; Y399-T402 PolarHBondContact O-N 3.11Å; Y399-T402 PolarHBondContact O-OG1 3.25Å; T402-Q405 PolarHBondContact O-N 2.83Å; T402-S406 WeakPolarHBondContact O-CB 3.21Å; T402-S406 PolarHBondContact O-N 3.45Å; T402-S406 PolarHBondContact O-OG 3.5Å
403	R	88	Confident	82.6	Confident	67 Å²	67	54.6 Å²	54.6	25%	0.253	26%	0.264	S	S	.	.	H	α-helix	trans	-67.3	-42.5	175.5	-170.4	67.3	168.3	-171.9	0.9	111.2	E318 Y399 W400 L401 S406 F407	E318-R403 IonicContact OE1-CZ 2.86Å; E318-R403 VanDerWaalsContact OE1-CZ 3.28Å; E318-R403 IonicContact OE1-NE 3.65Å; E318-R403 PolarHBondContact OE1-NE 2.88Å; E318-R403 IonicContact OE1-NH2 2.76Å; E318-R403 PolarHBondContact OE1-NH2 2.99Å; E318-R403 IonicContact OE2-NE 3.8Å; E318-R403 IonicContact OE2-NH2 2.66Å; Y399-R403 HydrophobicContact CE1-CB 4.48Å; Y399-R403 WeakPolarHBondContact O-CB 2.96Å; Y399-R403 PolarHBondContact O-N 3.48Å; W400-R403 HydrophobicContact CE3-CB 4.36Å; W400-R403 HydrophobicContact CE3-CG 4.32Å; W400-R403 HydrophobicContact CZ3-CG 4.47Å; W400-R403 WeakPolarHBondContact O-CB 3.02Å; W400-R403 PolarHBondContact O-N 2.89Å; L401-R403 VanDerWaalsContact C-N 3.27Å; L401-R403 PolarHBondContact O-N 2.85Å; R403-S406 WeakPolarHBondContact O-CB 3.09Å; R403-S406 PolarHBondContact O-N 3.21Å; R403-F407 HydrophobicContact CG-CD2 4.2Å; R403-F407 HydrophobicContact CG-CE2 3.98Å; R403-F407 VanDerWaalsContact O-CD2 3.22Å; R403-F407 WeakPolarHBondContact O-CD2 3.07Å; R403-F407 PolarHBondContact O-N 2.98Å
404	I	88.6	Confident	82	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.3	-48.7	174.1	-72.7	158.9	0	0	0	110.2	F323 F326 M327 L330 I341 W345 F351 W400 L401 S406 F407 L408	F323-I404 HydrophobicContact CE2-CD1 4.32Å; F323-I404 HydrophobicContact CE2-CG1 3.83Å; F323-I404 HydrophobicContact CZ-CG1 3.93Å; F326-I404 HydrophobicContact CE1-CD1 4.04Å; M327-I404 HydrophobicContact SD-CB 4.32Å; M327-I404 HydrophobicContact SD-CG1 4.23Å; M327-I404 HydrophobicContact SD-CG2 3.74Å; L330-I404 HydrophobicContact CD1-CG2 3.82Å; I341-I404 HydrophobicContact CD1-CG2 4.24Å; I341-I404 HydrophobicContact CG2-CD1 4.34Å; I341-I404 HydrophobicContact CG2-CG2 3.95Å; W345-I404 HydrophobicContact CE3-CD1 3.98Å; W345-I404 HydrophobicContact CZ3-CD1 3.7Å; F351-I404 HydrophobicContact CZ-CD1 4.49Å; W400-I404 WeakPolarHBondContact O-CB 3.25Å; W400-I404 WeakPolarHBondContact O-CD1 3.38Å; W400-I404 VanDerWaalsContact O-CG1 3.28Å; W400-I404 WeakPolarHBondContact O-CG1 3.43Å; W400-I404 PolarHBondContact O-N 3.33Å; L401-I404 PolarHBondContact O-N 2.94Å; I404-S406 VanDerWaalsContact C-N 3.26Å; I404-S406 PolarHBondContact O-N 3.4Å; I404-F407 WeakPolarHBondContact O-CB 3.4Å; I404-F407 PolarHBondContact O-N 2.94Å; I404-L408 HydrophobicContact CG2-CD1 4.11Å; I404-L408 HydrophobicContact CG2-CG 4.49Å; I404-L408 WeakPolarHBondContact O-CG 3.16Å; I404-L408 PolarHBondContact O-N 3.34Å
405	Q	86.8	Confident	81.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-39.2	175.1	-73	-180	-41	0	0	112.2	L336 I341 L401 T402 F407 L408 Y409 F419	L336-Q405 PolarHBondContact O-NE2 3.19Å; L336-Q405 VanDerWaalsContact O-NE2 3.16Å; I341-Q405 HydrophobicContact CD1-CG 3.46Å; I341-Q405 VanDerWaalsContact CD1-CG 3.46Å; L401-Q405 PolarHBondContact O-N 2.75Å; T402-Q405 PolarHBondContact O-N 2.83Å; Q405-F407 VanDerWaalsContact C-N 3.31Å; Q405-F407 PolarHBondContact O-N 3.09Å; Q405-L408 PolarHBondContact O-N 3.16Å; Q405-L408 VanDerWaalsContact O-N 3.17Å; Q405-Y409 HydrophobicContact CB-CD2 4.22Å; Q405-Y409 HydrophobicContact CB-CE2 4.43Å; Q405-Y409 HydrophobicContact CG-CE2 4.4Å; Q405-Y409 WeakPolarHBondContact O-CD2 3.01Å; Q405-Y409 PolarHBondContact O-N 2.85Å; Q405-F419 HydrophobicContact CB-CB 4.27Å; Q405-F419 HydrophobicContact CB-CD1 3.68Å; Q405-F419 HydrophobicContact CB-CE1 4.44Å; Q405-F419 HydrophobicContact CB-CG 4.27Å; Q405-F419 HydrophobicContact CG-CD1 4.35Å
406	S	86.8	Confident	81.6	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.028	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-38.4	174.6	-59.1	0	0	0	0	112.2	T402 R403 I404 C410 L416 G417 F419	T402-S406 WeakPolarHBondContact O-CB 3.21Å; T402-S406 PolarHBondContact O-N 3.45Å; T402-S406 PolarHBondContact O-OG 3.5Å; R403-S406 WeakPolarHBondContact O-CB 3.09Å; R403-S406 PolarHBondContact O-N 3.21Å; I404-S406 VanDerWaalsContact C-N 3.26Å; I404-S406 PolarHBondContact O-N 3.4Å; S406-C410 CarbonylContact O-C 3.36Å; S406-C410 WeakPolarHBondContact O-CA 2.99Å; S406-C410 WeakPolarHBondContact O-CB 3.4Å; S406-C410 PolarHBondContact O-N 2.94Å; S406-L416 WeakPolarHBondContact O-CD1 3.21Å; S406-G417 VanDerWaalsContact CB-O 3.26Å; S406-G417 WeakPolarHBondContact CB-O 3.06Å; S406-F419 PolarHBondContact OG-N 3.44Å
407	F	84.8	Confident	81.5	Confident	50 Å²	50	41.8 Å²	41.8	22%	0.219	23%	0.234	C	C	.	.	H	α-helix	trans	-68.4	-32.3	173.4	-85.5	-68.8	0	0	0	113.7	E318 F323 M327 R403 I404 Q405 N411 L416	E318-F407 HydrophobicContact CG-CE2 3.98Å; E318-F407 HydrophobicContact CG-CZ 3.94Å; E318-F407 WeakPolarHBondContact OE1-CE2 3.18Å; E318-F407 WeakPolarHBondContact OE1-CZ 3.22Å; F323-F407 HydrophobicContact CE1-CD2 4.14Å; F323-F407 HydrophobicContact CE1-CE2 4.09Å; F323-F407 HydrophobicContact CZ-CD2 4.02Å; F323-F407 HydrophobicContact CZ-CE2 4.11Å; M327-F407 HydrophobicContact CE-CB 3.48Å; M327-F407 VanDerWaalsContact CE-CB 3.48Å; M327-F407 HydrophobicContact CE-CG 4.47Å; M327-F407 HydrophobicContact SD-CB 4.38Å; R403-F407 HydrophobicContact CG-CD2 4.2Å; R403-F407 HydrophobicContact CG-CE2 3.98Å; R403-F407 VanDerWaalsContact O-CD2 3.22Å; R403-F407 WeakPolarHBondContact O-CD2 3.07Å; R403-F407 PolarHBondContact O-N 2.98Å; I404-F407 WeakPolarHBondContact O-CB 3.4Å; I404-F407 PolarHBondContact O-N 2.94Å; Q405-F407 VanDerWaalsContact C-N 3.31Å; Q405-F407 PolarHBondContact O-N 3.09Å; F407-N411 WeakPolarHBondContact O-CB 2.96Å; F407-L416 HydrophobicContact CB-CD1 4.42Å; F407-L416 HydrophobicContact CD1-CD1 3.61Å; F407-L416 HydrophobicContact CD1-CD2 4.41Å; F407-L416 HydrophobicContact CD2-CD1 4.38Å; F407-L416 HydrophobicContact CD2-CD2 4.42Å; F407-L416 HydrophobicContact CE1-CD1 3.9Å; F407-L416 HydrophobicContact CE1-CD2 3.96Å; F407-L416 HydrophobicContact CE2-CD2 3.98Å; F407-L416 HydrophobicContact CG-CD1 3.87Å; F407-L416 HydrophobicContact CZ-CD1 4.41Å; F407-L416 HydrophobicContact CZ-CD2 3.73Å
408	L	82.9	Confident	81.4	Confident	13 Å²	13	42.8 Å²	42.8	7%	0.068	24%	0.242	C	C	.	.	H	α-helix	trans	-76.4	-42.1	179.2	-65.4	171.9	0	0	0	112.2	M327 L330 M332 L336 I341 I404 Q405	M327-L408 HydrophobicContact CE-CD2 3.51Å; M327-L408 HydrophobicContact CE-CG 3.84Å; L330-L408 HydrophobicContact CD1-CD1 4.07Å; L330-L408 HydrophobicContact CD1-CD2 4.26Å; M332-L408 HydrophobicContact CE-CD2 3.95Å; M332-L408 HydrophobicContact SD-CD2 3.59Å; M332-L408 VanDerWaalsContact SD-CD2 3.59Å; L336-L408 HydrophobicContact CD1-CD1 4.42Å; I341-L408 HydrophobicContact CD1-CD1 4.33Å; I404-L408 HydrophobicContact CG2-CD1 4.11Å; I404-L408 HydrophobicContact CG2-CG 4.49Å; I404-L408 WeakPolarHBondContact O-CG 3.16Å; I404-L408 PolarHBondContact O-N 3.34Å; Q405-L408 PolarHBondContact O-N 3.16Å; Q405-L408 VanDerWaalsContact O-N 3.17Å
409	Y	83.1	Confident	81.3	Confident	4 Å²	4	39 Å²	39	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-116.1	-20.1	-166.4	-53.6	-50.4	0	0	0	114.4	F335 L336 Q405 F419 C426 A437 L439 P440	F335-Y409 HydrophobicContact CD2-CD2 4.44Å; F335-Y409 HydrophobicContact CD2-CE1 4.16Å; F335-Y409 AromaticContact CD2-CE2 3.74Å; F335-Y409 HydrophobicContact CD2-CE2 3.74Å; F335-Y409 AromaticContact CD2-CZ 3.59Å; F335-Y409 AromaticContact CE2-CD2 3.92Å; F335-Y409 HydrophobicContact CE2-CD2 3.92Å; F335-Y409 AromaticContact CE2-CE2 3.43Å; F335-Y409 HydrophobicContact CE2-CE2 3.43Å; F335-Y409 VanDerWaalsContact CE2-CE2 3.43Å; F335-Y409 AromaticContact CE2-CZ 3.83Å; F335-Y409 HydrophobicContact CZ-CE2 4.32Å; L336-Y409 PolarHBondContact N-OH 3.49Å; Q405-Y409 HydrophobicContact CB-CD2 4.22Å; Q405-Y409 HydrophobicContact CB-CE2 4.43Å; Q405-Y409 HydrophobicContact CG-CE2 4.4Å; Q405-Y409 WeakPolarHBondContact O-CD2 3.01Å; Q405-Y409 PolarHBondContact O-N 2.85Å; Y409-F419 HydrophobicContact CD2-CD1 4.26Å; Y409-F419 HydrophobicContact CD2-CD2 4.36Å; Y409-F419 HydrophobicContact CD2-CE1 4.11Å; Y409-F419 HydrophobicContact CD2-CE2 4.24Å; Y409-F419 HydrophobicContact CD2-CG 4.37Å; Y409-F419 HydrophobicContact CD2-CZ 4.11Å; Y409-C426 PolarHBondContact O-SG 3.09Å; Y409-C426 VanDerWaalsContact O-SG 3.35Å; Y409-A437 WeakPolarHBondContact O-CB 3.49Å; Y409-A437 PolarHBondContact O-N 3.02Å; Y409-L439 HydrophobicContact CD1-CD2 3.88Å; Y409-L439 HydrophobicContact CD2-CD2 4.18Å; Y409-L439 HydrophobicContact CG-CD2 3.71Å; Y409-P440 HydrophobicContact CE1-CG 4.15Å
410	C	81.2	Confident	81	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-122.1	41.4	-175.3	-52.4	0	0	0	0	112.4	S406 G417 F419 C426 C435	S406-C410 CarbonylContact O-C 3.36Å; S406-C410 WeakPolarHBondContact O-CA 2.99Å; S406-C410 WeakPolarHBondContact O-CB 3.4Å; S406-C410 PolarHBondContact O-N 2.94Å; C410-G417 PolarHBondContact O-N 2.81Å; C410-F419 VanDerWaalsContact SG-CA 3.56Å; C410-F419 WeakPolarHBondContact SG-CB 3.45Å; C410-C426 WeakPolarHBondContact CA-SG 3.48Å; C410-C426 HydrophobicContact CB-CB 3.68Å; C410-C426 WeakPolarHBondContact CB-SG 3.48Å; C410-C426 VanDerWaalsContact SG-CA 3.52Å; C410-C426 WeakPolarHBondContact SG-CB 3.35Å; C410-C426 CovalentContact SG-SG 2.02Å; C410-C426 PolarHBondContact SG-SG 3.27Å; C410-C435 CarbonylContact C-O 3.49Å; C410-C435 VanDerWaalsContact CA-O 3.22Å; C410-C435 WeakPolarHBondContact CA-O 3.39Å
411	N	79.8	Confident	80.6	Confident	73 Å²	73	40.3 Å²	40.3	39%	0.39	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	73.9	-178.3	-175.3	22.3	0	0	0	110.1	F407 L416	F407-N411 WeakPolarHBondContact O-CB 2.96Å; N411-L416 HydrophobicContact CB-CD1 4.26Å
412	E	70.4	Confident	80.1	Confident	65 Å²	65	48.9 Å²	48.9	30%	0.304	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	143.7	167.2	-76.9	-167.4	158.6	0	0	109.8	G414 L415 T436 A437	E412-G414 PolarHBondContact O-N 3.26Å; E412-L415 PolarHBondContact O-N 3.47Å; E412-T436 VanDerWaalsContact OE2-O 3.12Å; E412-A437 HydrophobicContact CG-CB 4.18Å
413	N	65.8	Low	79.5	Confident	149 Å²	149	50.6 Å²	50.6	80%	0.797	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	18.1	179	-53.9	-41.6	0	0	0	116.1	L415	N413-L415 VanDerWaalsContact C-N 3.29Å; N413-L415 PolarHBondContact O-N 2.92Å
414	G	66.3	Low	79	Confident	68 Å²	68	51.9 Å²	51.9	70%	0.701	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	8.8	178	0	0	0	0	0	114.6	E412	E412-G414 PolarHBondContact O-N 3.26Å
415	L	69.2	Low	78.5	Confident	83 Å²	83	54 Å²	54	44%	0.435	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.1	173.6	-67.8	171.8	0	0	0	109.3	E412 N413 G417	E412-L415 PolarHBondContact O-N 3.47Å; N413-L415 VanDerWaalsContact C-N 3.29Å; N413-L415 PolarHBondContact O-N 2.92Å; L415-G417 PolarHBondContact O-N 3.29Å
416	L	76.1	Confident	78.3	Confident	37 Å²	37	54.9 Å²	54.9	19%	0.194	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	113.8	179.2	-172	71.2	0	0	0	110.4	S406 F407 N411	S406-L416 WeakPolarHBondContact O-CD1 3.21Å; F407-L416 HydrophobicContact CB-CD1 4.42Å; F407-L416 HydrophobicContact CD1-CD1 3.61Å; F407-L416 HydrophobicContact CD1-CD2 4.41Å; F407-L416 HydrophobicContact CD2-CD1 4.38Å; F407-L416 HydrophobicContact CD2-CD2 4.42Å; F407-L416 HydrophobicContact CE1-CD1 3.9Å; F407-L416 HydrophobicContact CE1-CD2 3.96Å; F407-L416 HydrophobicContact CE2-CD2 3.98Å; F407-L416 HydrophobicContact CG-CD1 3.87Å; F407-L416 HydrophobicContact CZ-CD1 4.41Å; F407-L416 HydrophobicContact CZ-CD2 3.73Å; N411-L416 HydrophobicContact CB-CD1 4.26Å
417	G	80.3	Confident	78	Confident	5 Å²	5	58.7 Å²	58.7	5%	0.052	33%	0.334	C	S	.	.			trans	-82.3	179	169.6	0	0	0	0	0	112.9	S406 C410 L415 T427	S406-G417 VanDerWaalsContact CB-O 3.26Å; S406-G417 WeakPolarHBondContact CB-O 3.06Å; C410-G417 PolarHBondContact O-N 2.81Å; L415-G417 PolarHBondContact O-N 3.29Å; G417-T427 CarbonylContact C-O 3.5Å; G417-T427 WeakPolarHBondContact CA-O 3.49Å
418	S	81.3	Confident	77.7	Confident	65 Å²	65	58.3 Å²	58.3	46%	0.455	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.9	169	177.8	0	0	0	0	109.9	T427	S418-T427 WeakPolarHBondContact CB-OG1 3.46Å; S418-T427 PolarHBondContact N-O 2.89Å; S418-T427 PolarHBondContact O-N 3.33Å; S418-T427 PolarHBondContact O-OG1 2.83Å
419	F	83.6	Confident	77	Confident	5 Å²	5	61 Å²	61	2%	0.022	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135	176.9	-172.6	-109.9	0	0	0	111.3	F335 Q405 S406 Y409 C410 E421 L439	F335-F419 AromaticContact CE2-CE1 3.95Å; F335-F419 HydrophobicContact CE2-CE1 3.95Å; F335-F419 AromaticContact CE2-CZ 3.62Å; F335-F419 HydrophobicContact CE2-CZ 3.62Å; F335-F419 AromaticContact CZ-CE1 3.87Å; F335-F419 HydrophobicContact CZ-CE1 3.87Å; F335-F419 AromaticContact CZ-CZ 3.86Å; F335-F419 HydrophobicContact CZ-CZ 3.86Å; Q405-F419 HydrophobicContact CB-CB 4.27Å; Q405-F419 HydrophobicContact CB-CD1 3.68Å; Q405-F419 HydrophobicContact CB-CE1 4.44Å; Q405-F419 HydrophobicContact CB-CG 4.27Å; Q405-F419 HydrophobicContact CG-CD1 4.35Å; S406-F419 PolarHBondContact OG-N 3.44Å; Y409-F419 HydrophobicContact CD2-CD1 4.26Å; Y409-F419 HydrophobicContact CD2-CD2 4.36Å; Y409-F419 HydrophobicContact CD2-CE1 4.11Å; Y409-F419 HydrophobicContact CD2-CE2 4.24Å; Y409-F419 HydrophobicContact CD2-CG 4.37Å; Y409-F419 HydrophobicContact CD2-CZ 4.11Å; C410-F419 VanDerWaalsContact SG-CA 3.56Å; C410-F419 WeakPolarHBondContact SG-CB 3.45Å; F419-E421 HydrophobicContact CE1-CB 4.28Å; F419-L439 HydrophobicContact CE2-CD1 4.34Å; F419-L439 HydrophobicContact CE2-CD2 3.65Å; F419-L439 HydrophobicContact CZ-CD2 3.93Å
420	S	82.3	Confident	76	Confident	40 Å²	40	67.8 Å²	67.8	28%	0.28	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.5	169.2	173.8	0	0	0	0	109.6	E422 T423 H424 S425	S420-E422 VanDerWaalsContact C-N 3.33Å; S420-T423 WeakPolarHBondContact CB-OG1 3.38Å; S420-T423 PolarHBondContact OG-OG1 3.39Å; S420-H424 VanDerWaalsContact O-CA 3.3Å; S420-H424 WeakPolarHBondContact O-CA 3.32Å; S420-H424 PolarHBondContact O-N 3.18Å; S420-S425 PolarHBondContact N-O 3.03Å; S420-S425 PolarHBondContact O-N 3.27Å
421	E	79.6	Confident	74.7	Confident	56 Å²	56	76.2 Å²	76.2	26%	0.262	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-29.1	177.1	-171.1	171.5	-156.9	0	0	111.8	N337 T338 F419 H424	N337-E421 VanDerWaalsContact CA-OE1 3.23Å; N337-E421 WeakPolarHBondContact CA-OE1 3.35Å; N337-E421 VanDerWaalsContact CB-OE1 3.31Å; N337-E421 WeakPolarHBondContact CB-OE1 3.5Å; T338-E421 WeakPolarHBondContact CB-OE2 3.34Å; T338-E421 WeakPolarHBondContact CG2-OE2 3.2Å; T338-E421 PolarHBondContact N-OE1 2.75Å; T338-E421 VanDerWaalsContact N-OE1 3.08Å; T338-E421 PolarHBondContact OG1-OE2 3.25Å; F419-E421 HydrophobicContact CE1-CB 4.28Å; E421-H424 PolarHBondContact O-CD2 2.94Å; E421-H424 PolarHBondContact O-NE2 2.96Å
422	E	77.8	Confident	73.4	Confident	189 Å²	189	79.2 Å²	79.2	88%	0.883	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-35.8	179.9	-65.5	178.8	-177.6	0	0	112.7	S420	S420-E422 VanDerWaalsContact C-N 3.33Å
423	T	75.1	Confident	72.8	Confident	90 Å²	90	82.8 Å²	82.8	55%	0.552	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-1.1	-175.3	55	0	0	0	0	112.9	S420 S425	S420-T423 WeakPolarHBondContact CB-OG1 3.38Å; S420-T423 PolarHBondContact OG-OG1 3.39Å; T423-S425 WeakPolarHBondContact CB-OG 3.34Å; T423-S425 PolarHBondContact O-N 2.88Å; T423-S425 VanDerWaalsContact O-N 3.14Å; T423-S425 PolarHBondContact OG1-OG 2.87Å
424	H	77.8	Confident	72.6	Confident	93 Å²	93	79.6 Å²	79.6	43%	0.431	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.2	43	-172.9	-69.6	177.6	0	0	0	112.4	S420 E421 L439	S420-H424 VanDerWaalsContact O-CA 3.3Å; S420-H424 WeakPolarHBondContact O-CA 3.32Å; S420-H424 PolarHBondContact O-N 3.18Å; E421-H424 PolarHBondContact O-CD2 2.94Å; E421-H424 PolarHBondContact O-NE2 2.96Å; H424-L439 HydrophobicContact CB-CD1 4.21Å; H424-L439 WeakPolarHBondContact O-CD1 3.31Å
425	S	78.8	Confident	72.6	Confident	46 Å²	46	76.6 Å²	76.6	32%	0.322	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	145.6	-172.6	67.1	0	0	0	0	111.5	S420 T423	S420-S425 PolarHBondContact N-O 3.03Å; S420-S425 PolarHBondContact O-N 3.27Å; T423-S425 WeakPolarHBondContact CB-OG 3.34Å; T423-S425 PolarHBondContact O-N 2.88Å; T423-S425 VanDerWaalsContact O-N 3.14Å; T423-S425 PolarHBondContact OG1-OG 2.87Å
426	C	81.8	Confident	72.3	Confident	18 Å²	18	75.5 Å²	75.5	12%	0.122	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.2	171.8	-61.1	0	0	0	0	110.9	Y409 C410 T436	Y409-C426 PolarHBondContact O-SG 3.09Å; Y409-C426 VanDerWaalsContact O-SG 3.35Å; C410-C426 WeakPolarHBondContact CA-SG 3.48Å; C410-C426 HydrophobicContact CB-CB 3.68Å; C410-C426 WeakPolarHBondContact CB-SG 3.48Å; C410-C426 VanDerWaalsContact SG-CA 3.52Å; C410-C426 WeakPolarHBondContact SG-CB 3.35Å; C410-C426 CovalentContact SG-SG 2.02Å; C410-C426 PolarHBondContact SG-SG 3.27Å; C426-T436 HydrophobicContact CB-CG2 3.63Å
427	T	80.6	Confident	71.8	Confident	84 Å²	84	74.7 Å²	74.7	52%	0.515	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116.8	168	49.7	0	0	0	0	108.9	G417 S418	G417-T427 CarbonylContact C-O 3.5Å; G417-T427 WeakPolarHBondContact CA-O 3.49Å; S418-T427 WeakPolarHBondContact CB-OG1 3.46Å; S418-T427 PolarHBondContact N-O 2.89Å; S418-T427 PolarHBondContact O-N 3.33Å; S418-T427 PolarHBondContact O-OG1 2.83Å
428	C	77.9	Confident	71.2	Confident	41 Å²	41	82.9 Å²	82.9	28%	0.277	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-93.9	136.9	-174.7	-43.6	0	0	0	0	110.5	C435	C428-C435 WeakPolarHBondContact CA-SG 3.24Å; C428-C435 HydrophobicContact CB-CB 3.76Å; C428-C435 WeakPolarHBondContact CB-SG 3.42Å; C428-C435 WeakPolarHBondContact SG-CB 3.31Å; C428-C435 PolarHBondContact SG-N 2.69Å; C428-C435 CovalentContact SG-SG 2.01Å; C428-C435 PolarHBondContact SG-SG 3.24Å
429	P	69.3	Low	70.7	Confident	70 Å²	70	82.3 Å²	82.3	46%	0.455	45%	0.45	S	S	.	.	S	Bend	trans	-68	133	170.3	24.9	-29	0	0	0	110.4
430	N	60.5	Low	70.2	Confident	147 Å²	147	83 Å²	83	79%	0.786	46%	0.455	S	S	*	.	S	Bend	trans	64.3	77.3	-179.1	-63.1	-18.1	0	0	0	116.1	Q432	N430-Q432 WeakPolarHBondContact O-CG 3.13Å; N430-Q432 PolarHBondContact O-N 2.96Å
431	D	54.7	Low	69.8	Low	177 Å²	177	81.7 Å²	81.7	95%	0.947	45%	0.446	S	S	*	.	S	Bend	trans	35.7	22.9	156.2	-91.8	-2.6	0	0	0	118.8
432	Q	53.4	Low	69.5	Low	135 Å²	135	81.4 Å²	81.4	63%	0.631	45%	0.448	S	S	*	.			trans	-98.5	140.2	178.5	-78.1	-162.1	-9.8	0	0	109.4	N430 V434	N430-Q432 WeakPolarHBondContact O-CG 3.13Å; N430-Q432 PolarHBondContact O-N 2.96Å; Q432-V434 PolarHBondContact O-N 2.86Å
433	V	56.6	Low	69.1	Low	141 Å²	141	75.2 Å²	75.2	86%	0.855	42%	0.423	S	S	*	.	S	Bend	trans	-75.6	-19.7	-152.8	-176.7	0	0	0	0	113.8
434	V	62.6	Low	68.6	Low	82 Å²	82	72.4 Å²	72.4	50%	0.497	41%	0.412	S	S	.	.			trans	-151.6	106.3	-177	-161.4	0	0	0	0	111.9	Q432 T436	Q432-V434 PolarHBondContact O-N 2.86Å; V434-T436 WeakPolarHBondContact CG1-OG1 3.22Å
435	C	64.8	Low	67.6	Low	5 Å²	5	75.6 Å²	75.6	3%	0.034	43%	0.432	C	S	.	.			trans	-110.6	13.2	160.8	65.1	0	0	0	0	111.7	C410 C428	C410-C435 CarbonylContact C-O 3.49Å; C410-C435 VanDerWaalsContact CA-O 3.22Å; C410-C435 WeakPolarHBondContact CA-O 3.39Å; C428-C435 WeakPolarHBondContact CA-SG 3.24Å; C428-C435 HydrophobicContact CB-CB 3.76Å; C428-C435 WeakPolarHBondContact CB-SG 3.42Å; C428-C435 WeakPolarHBondContact SG-CB 3.31Å; C428-C435 PolarHBondContact SG-N 2.69Å; C428-C435 CovalentContact SG-SG 2.01Å; C428-C435 PolarHBondContact SG-SG 3.24Å
436	T	64	Low	66.5	Low	59 Å²	59	77.5 Å²	77.5	36%	0.362	45%	0.451	S	S	.	.			trans	-87.7	113.7	-175.8	53.4	0	0	0	0	110.7	E412 C426 V434	E412-T436 VanDerWaalsContact OE2-O 3.12Å; C426-T436 HydrophobicContact CB-CG2 3.63Å; V434-T436 WeakPolarHBondContact CG1-OG1 3.22Å
437	A	64.7	Low	65.7	Low	21 Å²	21	77.7 Å²	77.7	17%	0.174	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-70.1	150.5	159.9	0	0	0	0	0	109.6	Y409 E412 L439	Y409-A437 WeakPolarHBondContact O-CB 3.49Å; Y409-A437 PolarHBondContact O-N 3.02Å; E412-A437 HydrophobicContact CG-CB 4.18Å; A437-L439 PolarHBondContact O-N 3.33Å; A437-L439 VanDerWaalsContact O-N 3.11Å
438	F	68.4	Low	65.2	Low	177 Å²	177	75.2 Å²	75.2	78%	0.776	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-57.6	118	175.6	-70.7	-79	0	0	0	110.9	P440 T458	F438-P440 WeakPolarHBondContact O-CD 3.49Å; F438-T458 HydrophobicContact CB-CG2 3.77Å; F438-T458 HydrophobicContact CD1-CG2 4.11Å; F438-T458 HydrophobicContact CG-CG2 4.31Å
439	L	71	Confident	65.1	Low	52 Å²	52	73.6 Å²	73.6	27%	0.272	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-70.8	123	-179.9	-77	156	0	0	0	110.5	F335 Y409 F419 H424 A437	F335-L439 HydrophobicContact CD2-CD2 4.05Å; F335-L439 HydrophobicContact CE2-CD2 3.91Å; Y409-L439 HydrophobicContact CD1-CD2 3.88Å; Y409-L439 HydrophobicContact CD2-CD2 4.18Å; Y409-L439 HydrophobicContact CG-CD2 3.71Å; F419-L439 HydrophobicContact CE2-CD1 4.34Å; F419-L439 HydrophobicContact CE2-CD2 3.65Å; F419-L439 HydrophobicContact CZ-CD2 3.93Å; H424-L439 HydrophobicContact CB-CD1 4.21Å; H424-L439 WeakPolarHBondContact O-CD1 3.31Å; A437-L439 PolarHBondContact O-N 3.33Å; A437-L439 VanDerWaalsContact O-N 3.11Å
440	P	72.8	Confident	65.4	Low	20 Å²	20	74.4 Å²	74.4	13%	0.13	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-65.5	162	175.7	-17.4	30.2	0	0	0	112.1	Y409 F438 R457	Y409-P440 HydrophobicContact CE1-CG 4.15Å; F438-P440 WeakPolarHBondContact O-CD 3.49Å; P440-R457 CarbonylContact C-O 3.58Å; P440-R457 WeakPolarHBondContact CA-O 3.34Å
441	C	74.4	Confident	66.2	Low	12 Å²	12	70.6 Å²	70.6	8%	0.081	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-65.5	146	176.6	99.5	0	0	0	0	112	F335 C449 C452 R457	F335-C441 PolarHBondContact N-O 3.34Å; C441-C449 PolarHBondContact SG-SG 3.36Å; C441-C452 HydrophobicContact CB-CB 4Å; C441-C452 WeakPolarHBondContact CB-SG 3.48Å; C441-C452 PolarHBondContact O-SG 3.26Å; C441-C452 WeakPolarHBondContact SG-CA 2.99Å; C441-C452 WeakPolarHBondContact SG-CB 3.29Å; C441-C452 PolarHBondContact SG-N 2.85Å; C441-C452 CovalentContact SG-SG 2.02Å; C441-C452 PolarHBondContact SG-SG 3.25Å; C441-R457 PolarHBondContact N-O 3.07Å
442	T	72.7	Confident	67.4	Low	51 Å²	51	63.3 Å²	63.3	31%	0.313	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-85.4	116.8	177.8	54.3	0	0	0	0	110.5	F335 S447 C449	F335-T442 HydrophobicContact CB-CG2 3.87Å; F335-T442 HydrophobicContact CD1-CG2 3.71Å; F335-T442 HydrophobicContact CG-CG2 3.97Å; T442-S447 VanDerWaalsContact O-CB 3.3Å; T442-S447 WeakPolarHBondContact O-CB 3.48Å; T442-S447 PolarHBondContact O-OG 3.17Å; T442-C449 WeakPolarHBondContact O-CB 3.32Å
443	V	70.1	Confident	68.6	Low	58 Å²	58	57.7 Å²	57.7	35%	0.352	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-109.2	129.8	178.7	177.4	0	0	0	0	110.3	L450	V443-L450 WeakPolarHBondContact CG1-O 3.27Å
444	G	64.6	Low	69.3	Low	31 Å²	31	56.6 Å²	56.6	32%	0.32	35%	0.347	S	S	.	.	S	Bend	trans	167	167	175.7	0	0	0	0	0	112.5	A446 S447 N464	G444-A446 PolarHBondContact O-N 3.07Å; G444-A446 VanDerWaalsContact O-N 3.08Å; G444-S447 PolarHBondContact N-OG 3.27Å; G444-S447 PolarHBondContact O-N 3.5Å; G444-S447 VanDerWaalsContact O-N 3.09Å; G444-S447 PolarHBondContact O-OG 2.99Å; G444-S447 VanDerWaalsContact O-OG 3.11Å; G444-N464 PolarHBondContact O-ND2 3.18Å
445	D	56.2	Low	69.8	Low	160 Å²	160	60.5 Å²	60.5	86%	0.856	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-23.9	-175.9	-62	-30.6	0	0	0	113.6
446	A	55.7	Low	70	Confident	87 Å²	87	63.3 Å²	63.3	72%	0.719	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-7.5	179.6	0	0	0	0	0	114.5	G444	G444-A446 PolarHBondContact O-N 3.07Å; G444-A446 VanDerWaalsContact O-N 3.08Å
447	S	65.3	Low	70.3	Confident	21 Å²	21	66.9 Å²	66.9	15%	0.147	39%	0.386	C	S	.	.	S	Bend	trans	-90.1	158.5	177	67.4	0	0	0	0	110.7	T442 G444 C449 N464	T442-S447 VanDerWaalsContact O-CB 3.3Å; T442-S447 WeakPolarHBondContact O-CB 3.48Å; T442-S447 PolarHBondContact O-OG 3.17Å; G444-S447 PolarHBondContact N-OG 3.27Å; G444-S447 PolarHBondContact O-N 3.5Å; G444-S447 VanDerWaalsContact O-N 3.09Å; G444-S447 PolarHBondContact O-OG 2.99Å; G444-S447 VanDerWaalsContact O-OG 3.11Å; S447-C449 PolarHBondContact O-N 2.94Å; S447-C449 PolarHBondContact OG-O 3.48Å; S447-N464 PolarHBondContact O-ND2 3.28Å
448	A	68.8	Low	70.5	Confident	32 Å²	32	68.3 Å²	68.3	26%	0.264	39%	0.393	S	S	.	.	S	Bend	trans	-70.5	-17.7	179.1	0	0	0	0	0	112.8	C463 N464 Y467 C474	A448-C463 WeakPolarHBondContact O-CA 3.37Å; A448-N464 PolarHBondContact O-N 3.15Å; A448-Y467 HydrophobicContact CB-CD1 3.59Å; A448-Y467 HydrophobicContact CB-CE1 3.75Å; A448-Y467 HydrophobicContact CB-CG 4.11Å; A448-C474 HydrophobicContact CB-CB 3.55Å; A448-C474 WeakPolarHBondContact O-CB 3.28Å; A448-C474 PolarHBondContact O-SG 3.02Å
449	C	75.8	Confident	70.7	Confident	8 Å²	8	66.3 Å²	66.3	5%	0.054	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	125.1	-171.3	-174	0	0	0	0	112.5	C441 T442 S447 T451 C460	C441-C449 PolarHBondContact SG-SG 3.36Å; T442-C449 WeakPolarHBondContact O-CB 3.32Å; S447-C449 PolarHBondContact O-N 2.94Å; S447-C449 PolarHBondContact OG-O 3.48Å; C449-T451 PolarHBondContact SG-O 3.46Å; C449-C460 WeakPolarHBondContact CA-SG 3.29Å; C449-C460 HydrophobicContact CB-CB 3.76Å; C449-C460 WeakPolarHBondContact CB-SG 3.48Å; C449-C460 WeakPolarHBondContact SG-CA 3.44Å; C449-C460 WeakPolarHBondContact SG-CB 3.46Å; C449-C460 CovalentContact SG-SG 2.01Å; C449-C460 PolarHBondContact SG-SG 3.09Å
450	L	75.9	Confident	71	Confident	87 Å²	87	64.2 Å²	64.2	46%	0.455	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-41.9	178.5	-179.3	66.4	0	0	0	112.3	V443 T462 N464	V443-L450 WeakPolarHBondContact CG1-O 3.27Å; L450-T462 WeakPolarHBondContact CA-O 3.34Å; L450-T462 VanDerWaalsContact CB-O 3.32Å; L450-T462 WeakPolarHBondContact CB-O 3.36Å; L450-T462 PolarHBondContact N-O 2.91Å; L450-N464 VanDerWaalsContact CB-OD1 3.31Å; L450-N464 WeakPolarHBondContact CB-OD1 3.44Å; L450-N464 VanDerWaalsContact CD1-OD1 3.24Å; L450-N464 WeakPolarHBondContact CD1-OD1 3.38Å
451	T	77.3	Confident	71.2	Confident	66 Å²	66	64.4 Å²	64.4	41%	0.405	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	142.4	175.4	64.4	0	0	0	0	111.4	C449 C460 G461 T462	C449-T451 PolarHBondContact SG-O 3.46Å; T451-C460 PolarHBondContact O-SG 3.1Å; T451-G461 WeakPolarHBondContact O-CA 3.5Å; T451-G461 PolarHBondContact O-N 3.12Å; T451-T462 PolarHBondContact N-O 3.38Å; T451-T462 PolarHBondContact N-OG1 3.45Å; T451-T462 PolarHBondContact O-N 3.21Å; T451-T462 PolarHBondContact OG1-N 3.11Å; T451-T462 PolarHBondContact OG1-OG1 2.99Å
452	C	80.2	Confident	71.3	Confident	24 Å²	24	66.8 Å²	66.8	16%	0.162	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	144.4	172.7	-55	0	0	0	0	111.1	N333 C441	N333-C452 PolarHBondContact O-SG 3.07Å; N333-C452 VanDerWaalsContact O-SG 3.34Å; C441-C452 HydrophobicContact CB-CB 4Å; C441-C452 WeakPolarHBondContact CB-SG 3.48Å; C441-C452 PolarHBondContact O-SG 3.26Å; C441-C452 WeakPolarHBondContact SG-CA 2.99Å; C441-C452 WeakPolarHBondContact SG-CB 3.29Å; C441-C452 PolarHBondContact SG-N 2.85Å; C441-C452 CovalentContact SG-SG 2.02Å; C441-C452 PolarHBondContact SG-SG 3.25Å
453	A	78.3	Confident	71.5	Confident	18 Å²	18	65.5 Å²	65.5	15%	0.149	38%	0.383	C	S	.	.			trans	-66	135.6	176.5	0	0	0	0	0	110.6	D455 N456 R459	A453-D455 VanDerWaalsContact C-N 3.3Å; A453-D455 PolarHBondContact O-N 3.06Å; A453-N456 CarbonylContact O-C 3.47Å; A453-R459 HydrophobicContact CB-CB 4.34Å; A453-R459 PolarHBondContact N-O 2.97Å
454	P	71.3	Confident	71.6	Confident	118 Å²	118	63.7 Å²	63.7	77%	0.766	37%	0.371	S	S	*	.	S	Bend	trans	-66.9	-32.4	-178.4	26.1	-33.5	0	0	0	112.5
455	D	73.3	Confident	71.6	Confident	163 Å²	163	65.9 Å²	65.9	87%	0.872	38%	0.378	S	S	*	.	S	Bend	trans	-78.3	-32.4	-177	-58.4	-29.2	0	0	0	113	A453	A453-D455 VanDerWaalsContact C-N 3.3Å; A453-D455 PolarHBondContact O-N 3.06Å
456	N	69.9	Low	71.8	Confident	64 Å²	64	58.7 Å²	58.7	34%	0.342	34%	0.342	S	S	.	.			trans	-145.9	103.2	178.3	-169.8	-13	0	0	0	110.3	A453 T458 R459	A453-N456 CarbonylContact O-C 3.47Å; N456-T458 VanDerWaalsContact CG-OG1 3.3Å; N456-T458 PolarHBondContact ND2-OG1 2.8Å; N456-T458 PolarHBondContact O-N 3.14Å; N456-T458 PolarHBondContact OD1-N 3.25Å; N456-T458 PolarHBondContact OD1-OG1 3.08Å; N456-R459 HydrophobicContact CB-CG 4.46Å; N456-R459 PolarHBondContact O-N 2.59Å
457	R	69.2	Low	72.3	Confident	134 Å²	134	57.6 Å²	57.6	51%	0.506	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-11.7	-173.8	-61.6	-178.2	-175.4	175.1	2.2	114.4	P440 C441 R459	P440-R457 CarbonylContact C-O 3.58Å; P440-R457 WeakPolarHBondContact CA-O 3.34Å; C441-R457 PolarHBondContact N-O 3.07Å; R457-R459 VanDerWaalsContact C-N 3.33Å
458	T	69.9	Low	72.6	Confident	52 Å²	52	61.6 Å²	61.6	32%	0.319	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-16.3	172.8	63.2	0	0	0	0	113.1	F438 N456	F438-T458 HydrophobicContact CB-CG2 3.77Å; F438-T458 HydrophobicContact CD1-CG2 4.11Å; F438-T458 HydrophobicContact CG-CG2 4.31Å; N456-T458 VanDerWaalsContact CG-OG1 3.3Å; N456-T458 PolarHBondContact ND2-OG1 2.8Å; N456-T458 PolarHBondContact O-N 3.14Å; N456-T458 PolarHBondContact OD1-N 3.25Å; N456-T458 PolarHBondContact OD1-OG1 3.08Å
459	R	72.5	Confident	72.7	Confident	134 Å²	134	64.1 Å²	64.1	51%	0.506	35%	0.346	S	S	.	.	S	Bend	trans	-103.7	146.7	-178.1	-64.9	-178.2	-177.5	-177.6	-0.8	110.6	A453 N456 R457 G472	A453-R459 HydrophobicContact CB-CB 4.34Å; A453-R459 PolarHBondContact N-O 2.97Å; N456-R459 HydrophobicContact CB-CG 4.46Å; N456-R459 PolarHBondContact O-N 2.59Å; R457-R459 VanDerWaalsContact C-N 3.33Å; R459-G472 WeakPolarHBondContact CA-O 3.39Å
460	C	78	Confident	72.2	Confident	9 Å²	9	65.6 Å²	65.6	6%	0.061	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	137.9	168.5	-163.3	0	0	0	0	110.8	C449 T451 T462 L469 G472 C474	C449-C460 WeakPolarHBondContact CA-SG 3.29Å; C449-C460 HydrophobicContact CB-CB 3.76Å; C449-C460 WeakPolarHBondContact CB-SG 3.48Å; C449-C460 WeakPolarHBondContact SG-CA 3.44Å; C449-C460 WeakPolarHBondContact SG-CB 3.46Å; C449-C460 CovalentContact SG-SG 2.01Å; C449-C460 PolarHBondContact SG-SG 3.09Å; T451-C460 PolarHBondContact O-SG 3.1Å; C460-T462 PolarHBondContact SG-O 3.48Å; C460-L469 HydrophobicContact CB-CD1 3.95Å; C460-L469 VanDerWaalsContact O-CD1 3.3Å; C460-L469 WeakPolarHBondContact O-CD1 3.32Å; C460-G472 PolarHBondContact N-O 3.18Å; C460-C474 PolarHBondContact SG-SG 3.4Å
461	G	75.9	Confident	71.8	Confident	24 Å²	24	70.1 Å²	70.1	25%	0.247	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-41.5	173.7	0	0	0	0	0	112.6	T451 L469	T451-G461 WeakPolarHBondContact O-CA 3.5Å; T451-G461 PolarHBondContact O-N 3.12Å; G461-L469 WeakPolarHBondContact O-CD2 3.25Å
462	T	76.1	Confident	71.2	Confident	61 Å²	61	67.5 Å²	67.5	37%	0.374	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	143.8	174.6	59.9	0	0	0	0	111	L450 T451 C460	L450-T462 WeakPolarHBondContact CA-O 3.34Å; L450-T462 VanDerWaalsContact CB-O 3.32Å; L450-T462 WeakPolarHBondContact CB-O 3.36Å; L450-T462 PolarHBondContact N-O 2.91Å; T451-T462 PolarHBondContact N-O 3.38Å; T451-T462 PolarHBondContact N-OG1 3.45Å; T451-T462 PolarHBondContact O-N 3.21Å; T451-T462 PolarHBondContact OG1-N 3.11Å; T451-T462 PolarHBondContact OG1-OG1 2.99Å; C460-T462 PolarHBondContact SG-O 3.48Å
463	C	77.8	Confident	70.5	Confident	24 Å²	24	71.8 Å²	71.8	16%	0.162	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	155.9	-177.1	-57.3	0	0	0	0	112.6	A448 Y467 L469 C474	A448-C463 WeakPolarHBondContact O-CA 3.37Å; C463-Y467 WeakPolarHBondContact CB-O 3.3Å; C463-L469 VanDerWaalsContact SG-CA 3.58Å; C463-C474 WeakPolarHBondContact CA-SG 3.45Å; C463-C474 HydrophobicContact CB-CB 3.77Å; C463-C474 WeakPolarHBondContact CB-SG 3.38Å; C463-C474 WeakPolarHBondContact SG-CA 3.33Å; C463-C474 WeakPolarHBondContact SG-CB 3.24Å; C463-C474 CovalentContact SG-SG 2.02Å; C463-C474 PolarHBondContact SG-SG 2.85Å
464	N	71.1	Confident	70.2	Confident	21 Å²	21	72 Å²	72	11%	0.112	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-69.2	157.3	169.7	-78.6	-23.3	0	0	0	110.8	G444 S447 A448 L450 G466 Y467	G444-N464 PolarHBondContact O-ND2 3.18Å; S447-N464 PolarHBondContact O-ND2 3.28Å; A448-N464 PolarHBondContact O-N 3.15Å; L450-N464 VanDerWaalsContact CB-OD1 3.31Å; L450-N464 WeakPolarHBondContact CB-OD1 3.44Å; L450-N464 VanDerWaalsContact CD1-OD1 3.24Å; L450-N464 WeakPolarHBondContact CD1-OD1 3.38Å; N464-G466 PolarHBondContact O-N 2.98Å; N464-Y467 PolarHBondContact O-N 2.89Å; N464-Y467 VanDerWaalsContact O-N 3.09Å
465	T	65.4	Low	69.8	Low	76 Å²	76	71.8 Å²	71.8	47%	0.466	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	129.8	-178.8	46.9	0	0	0	0	111.4	K752	T465-K752 PolarHBondContact OG1-O 3.48Å
466	G	61.2	Low	69.1	Low	10 Å²	10	67.6 Å²	67.6	10%	0.103	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.3	4.2	-173.7	0	0	0	0	0	115.3	N464 E477	N464-G466 PolarHBondContact O-N 2.98Å; G466-E477 PolarHBondContact O-N 3.27Å
467	Y	66.3	Low	68.7	Low	64 Å²	64	67.5 Å²	67.5	25%	0.251	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	135.5	175.3	-65.9	-101.4	0	0	0	110.9	A448 C463 N464 K475 P476 P754	A448-Y467 HydrophobicContact CB-CD1 3.59Å; A448-Y467 HydrophobicContact CB-CE1 3.75Å; A448-Y467 HydrophobicContact CB-CG 4.11Å; C463-Y467 WeakPolarHBondContact CB-O 3.3Å; N464-Y467 PolarHBondContact O-N 2.89Å; N464-Y467 VanDerWaalsContact O-N 3.09Å; Y467-K475 CarbonylContact C-O 3.56Å; Y467-K475 WeakPolarHBondContact CA-O 2.95Å; Y467-K475 WeakPolarHBondContact CB-O 3.39Å; Y467-P476 HydrophobicContact CD1-CB 4.31Å; Y467-P476 HydrophobicContact CD1-CG 4.2Å; Y467-P476 HydrophobicContact CE1-CB 4.12Å; Y467-P476 HydrophobicContact CE1-CG 3.8Å; Y467-P754 HydrophobicContact CE2-CG 3.86Å
468	M	71	Confident	68	Low	105 Å²	105	67.1 Å²	67.1	52%	0.517	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	142	175.9	68.7	174.2	-59.3	0	0	111.8	S470 K475	M468-S470 PolarHBondContact O-N 3.46Å; M468-K475 PolarHBondContact N-O 2.76Å; M468-K475 PolarHBondContact O-N 3.45Å
469	L	71.4	Confident	67.1	Low	84 Å²	84	65.4 Å²	65.4	44%	0.44	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	111.8	177.8	-169.8	74.6	0	0	0	110.2	C460 G461 C463	C460-L469 HydrophobicContact CB-CD1 3.95Å; C460-L469 VanDerWaalsContact O-CD1 3.3Å; C460-L469 WeakPolarHBondContact O-CD1 3.32Å; G461-L469 WeakPolarHBondContact O-CD2 3.25Å; C463-L469 VanDerWaalsContact SG-CA 3.58Å
470	S	65.1	Low	66.3	Low	40 Å²	40	66.7 Å²	66.7	28%	0.28	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	116.8	175.7	-170.9	0	0	0	0	109.7	M468 G472 L473	M468-S470 PolarHBondContact O-N 3.46Å; S470-G472 PolarHBondContact O-N 3.42Å; S470-G472 VanDerWaalsContact O-N 3.15Å; S470-L473 PolarHBondContact N-O 3.38Å; S470-L473 PolarHBondContact O-N 3.01Å; S470-L473 VanDerWaalsContact O-O 3.04Å
471	Q	66.9	Low	65.4	Low	182 Å²	182	70.2 Å²	70.2	85%	0.85	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	33.7	178.6	-58.3	-178.4	-8.7	0	0	114.7	L473	Q471-L473 VanDerWaalsContact C-N 3.34Å
472	G	65.6	Low	64.9	Low	11 Å²	11	69.1 Å²	69.1	11%	0.113	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	10.5	-180	0	0	0	0	0	114.8	R459 C460 S470	R459-G472 WeakPolarHBondContact CA-O 3.39Å; C460-G472 PolarHBondContact N-O 3.18Å; S470-G472 PolarHBondContact O-N 3.42Å; S470-G472 VanDerWaalsContact O-N 3.15Å
473	L	65.5	Low	64.5	Low	114 Å²	114	69 Å²	69	60%	0.597	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.1	171	-67.7	167.9	0	0	0	109.4	S470 Q471 K475	S470-L473 PolarHBondContact N-O 3.38Å; S470-L473 PolarHBondContact O-N 3.01Å; S470-L473 VanDerWaalsContact O-O 3.04Å; Q471-L473 VanDerWaalsContact C-N 3.34Å; L473-K475 PolarHBondContact O-N 3.28Å
474	C	71	Confident	64.3	Low	21 Å²	21	73.6 Å²	73.6	14%	0.142	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	113.3	174	-67	0	0	0	0	109.1	A448 C460 C463	A448-C474 HydrophobicContact CB-CB 3.55Å; A448-C474 WeakPolarHBondContact O-CB 3.28Å; A448-C474 PolarHBondContact O-SG 3.02Å; C460-C474 PolarHBondContact SG-SG 3.4Å; C463-C474 WeakPolarHBondContact CA-SG 3.45Å; C463-C474 HydrophobicContact CB-CB 3.77Å; C463-C474 WeakPolarHBondContact CB-SG 3.38Å; C463-C474 WeakPolarHBondContact SG-CA 3.33Å; C463-C474 WeakPolarHBondContact SG-CB 3.24Å; C463-C474 CovalentContact SG-SG 2.02Å; C463-C474 PolarHBondContact SG-SG 2.85Å
475	K	61.8	Low	64.6	Low	114 Å²	114	74.2 Å²	74.2	50%	0.496	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	143.8	174.3	-71.1	-173.4	177.1	179.8	0	109.3	Y467 M468 L473 E477	Y467-K475 CarbonylContact C-O 3.56Å; Y467-K475 WeakPolarHBondContact CA-O 2.95Å; Y467-K475 WeakPolarHBondContact CB-O 3.39Å; M468-K475 PolarHBondContact N-O 2.76Å; M468-K475 PolarHBondContact O-N 3.45Å; L473-K475 PolarHBondContact O-N 3.28Å; K475-E477 PolarHBondContact O-N 3.26Å
476	P	59.5	Low	65.3	Low	76 Å²	76	70.8 Å²	70.8	49%	0.494	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54	134.6	170.8	-16.6	26.8	0	0	0	108.6	Y467 V478	Y467-P476 HydrophobicContact CD1-CB 4.31Å; Y467-P476 HydrophobicContact CD1-CG 4.2Å; Y467-P476 HydrophobicContact CE1-CB 4.12Å; Y467-P476 HydrophobicContact CE1-CG 3.8Å; P476-V478 HydrophobicContact CB-CG2 4.37Å; P476-V478 PolarHBondContact O-N 3.02Å
477	E	62.4	Low	66	Low	61 Å²	61	71.3 Å²	71.3	29%	0.285	38%	0.379	S	S	.	.			trans	-71.2	86.2	169.6	-165.7	171.4	-176.1	0	0	107	G466 K475 A479 L701	G466-E477 PolarHBondContact O-N 3.27Å; K475-E477 PolarHBondContact O-N 3.26Å; E477-A479 PolarHBondContact O-N 2.01Å; E477-L701 WeakPolarHBondContact O-CD1 3.27Å
478	V	54.1	Low	66.1	Low	126 Å²	126	70 Å²	70	76%	0.764	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-70.3	117.6	177.4	-177.3	0	0	0	0	106.8	P476 E480	P476-V478 HydrophobicContact CB-CG2 4.37Å; P476-V478 PolarHBondContact O-N 3.02Å; V478-E480 PolarHBondContact O-N 2.6Å
479	A	51.4	Low	65.6	Low	16 Å²	16	72.8 Å²	72.8	13%	0.132	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-53.2	139	168.7	0	0	0	0	0	109.6	E477 L701 Q702	E477-A479 PolarHBondContact O-N 2.01Å; A479-L701 HydrophobicContact CB-CD2 3.43Å; A479-L701 VanDerWaalsContact CB-CD2 3.43Å; A479-Q702 HydrophobicContact CB-CG 3.66Å
480	E	53.9	Low	65	Low	161 Å²	161	71.5 Å²	71.5	75%	0.752	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-51.4	151.6	164.7	-68.9	-172.1	155.5	0	0	110.1	V478 T482	V478-E480 PolarHBondContact O-N 2.6Å; E480-T482 PolarHBondContact O-N 3.21Å; E480-T482 VanDerWaalsContact O-N 3.1Å
481	S	59.3	Low	64.6	Low	84 Å²	84	77.3 Å²	77.3	59%	0.587	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-48	119.4	-177.7	53.9	0	0	0	0	111.6	D483	S481-D483 PolarHBondContact O-N 3.49Å
482	T	65.7	Low	64.5	Low	1 Å²	1	71.3 Å²	71.3	1%	0.006	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-69.9	3.8	180	51.8	0	0	0	0	114.3	E480 H484 Y485 I486 E705 I706 R709	E480-T482 PolarHBondContact O-N 3.21Å; E480-T482 VanDerWaalsContact O-N 3.1Å; T482-H484 PolarHBondContact O-N 3.46Å; T482-Y485 HydrophobicContact CG2-CD2 4.48Å; T482-Y485 PolarHBondContact O-N 2.9Å; T482-I486 PolarHBondContact O-N 3.34Å; T482-E705 HydrophobicContact CG2-CB 4.11Å; T482-E705 HydrophobicContact CG2-CG 4.03Å; T482-E705 WeakPolarHBondContact CG2-OE1 3.45Å; T482-E705 WeakPolarHBondContact CG2-OE2 3.27Å; T482-E705 PolarHBondContact OG1-OE1 3.03Å; T482-I706 HydrophobicContact CG2-CG1 4.18Å; T482-R709 PolarHBondContact OG1-NH1 3.19Å
483	D	67.6	Low	64.7	Low	59 Å²	59	77.8 Å²	77.8	32%	0.316	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-68.6	-18.3	-176	-56.9	-36.5	0	0	0	113.1	S481 Y485 R709	S481-D483 PolarHBondContact O-N 3.49Å; D483-Y485 VanDerWaalsContact C-N 3.29Å; D483-Y485 PolarHBondContact O-N 3.29Å; D483-R709 IonicContact OD1-CZ 3.08Å; D483-R709 IonicContact OD1-NH1 3.25Å; D483-R709 PolarHBondContact OD1-NH1 3.1Å; D483-R709 IonicContact OD1-NH2 3.85Å; D483-R709 PolarHBondContact OD1-NH2 3.46Å
484	H	73.9	Confident	64.9	Low	120 Å²	120	76.7 Å²	76.7	56%	0.556	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-68.3	-26.9	170.5	-173.6	48.5	0	0	0	112.7	T482	T482-H484 PolarHBondContact O-N 3.46Å
485	Y	77.8	Confident	65	Low	34 Å²	34	82.7 Å²	82.7	13%	0.133	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-48.9	-179.2	-56.6	-72.2	0	0	0	112.3	T482 D483 D676 A679 I680 L683 Q702 I706	T482-Y485 HydrophobicContact CG2-CD2 4.48Å; T482-Y485 PolarHBondContact O-N 2.9Å; D483-Y485 VanDerWaalsContact C-N 3.29Å; D483-Y485 PolarHBondContact O-N 3.29Å; Y485-D676 PolarHBondContact O-N 3.37Å; Y485-D676 VanDerWaalsContact O-N 3.09Å; Y485-A679 HydrophobicContact CD1-CB 3.64Å; Y485-A679 HydrophobicContact CE1-CB 3.73Å; Y485-A679 WeakPolarHBondContact CE1-O 3.46Å; Y485-I680 HydrophobicContact CD1-CG1 3.83Å; Y485-I680 HydrophobicContact CG-CG1 4.26Å; Y485-L683 HydrophobicContact CD1-CD1 3.77Å; Y485-L683 HydrophobicContact CD1-CG 4.5Å; Y485-L683 HydrophobicContact CD2-CD1 4.27Å; Y485-L683 HydrophobicContact CE1-CD1 3.25Å; Y485-L683 HydrophobicContact CE1-CD2 4.44Å; Y485-L683 HydrophobicContact CE1-CG 3.63Å; Y485-L683 HydrophobicContact CE2-CD1 3.82Å; Y485-L683 HydrophobicContact CG-CD1 4.26Å; Y485-Q702 PolarHBondContact OH-OE1 3.41Å; Y485-Q702 VanDerWaalsContact OH-OE1 3.1Å; Y485-I706 HydrophobicContact CD2-CD1 3.94Å; Y485-I706 HydrophobicContact CG-CD1 3.89Å
486	I	79.1	Confident	65.8	Low	3 Å²	3	81.5 Å²	81.5	2%	0.015	43%	0.431	C	S	.	.	B	Isolated β-bridge	trans	-141.4	117.3	178.8	-48.2	-172.2	0	0	0	109.1	T482 F488 H674 F675 I680 I706 V710 L727	T482-I486 PolarHBondContact O-N 3.34Å; I486-F488 HydrophobicContact CB-CD2 4.28Å; I486-F488 HydrophobicContact CB-CE2 3.65Å; I486-F488 HydrophobicContact CB-CZ 3.84Å; I486-F488 HydrophobicContact CD1-CZ 4.24Å; I486-F488 HydrophobicContact CG2-CD1 4.39Å; I486-F488 HydrophobicContact CG2-CD2 4.31Å; I486-F488 HydrophobicContact CG2-CE1 3.92Å; I486-F488 HydrophobicContact CG2-CE2 3.85Å; I486-F488 HydrophobicContact CG2-CZ 3.62Å; I486-F488 WeakPolarHBondContact O-CD2 3.37Å; I486-F488 PolarHBondContact O-N 3.04Å; I486-H674 WeakPolarHBondContact CA-O 3.45Å; I486-F675 HydrophobicContact CD1-CD2 4.07Å; I486-F675 HydrophobicContact CD1-CE2 4.16Å; I486-F675 HydrophobicContact CG1-CD2 3.93Å; I486-F675 HydrophobicContact CG1-CE2 4.32Å; I486-I680 HydrophobicContact CD1-CD1 4.47Å; I486-I680 HydrophobicContact CG1-CD1 4.33Å; I486-I706 HydrophobicContact CD1-CG2 4.01Å; I486-V710 HydrophobicContact CD1-CG2 3.82Å; I486-L727 HydrophobicContact CD1-CD1 3.97Å
487	G	76.4	Confident	66.5	Low	22 Å²	22	78 Å²	78	23%	0.227	41%	0.409	C	S	.	.			trans	-77.5	100.9	178.5	0	0	0	0	0	111.8	M673 H674	G487-M673 WeakPolarHBondContact O-CB 3.42Å; G487-M673 VanDerWaalsContact O-CG 3.3Å; G487-M673 WeakPolarHBondContact O-CG 3.38Å; G487-H674 PolarHBondContact N-O 2.87Å; G487-H674 VanDerWaalsContact N-O 3.07Å
488	F	69.6	Low	67	Low	35 Å²	35	80.5 Å²	80.5	15%	0.154	42%	0.418	C	S	.	.			trans	-89.4	-6	178.3	-65.2	-78	0	0	0	114.2	I486 T490 F621 M673 R709 V710 L713	I486-F488 HydrophobicContact CB-CD2 4.28Å; I486-F488 HydrophobicContact CB-CE2 3.65Å; I486-F488 HydrophobicContact CB-CZ 3.84Å; I486-F488 HydrophobicContact CD1-CZ 4.24Å; I486-F488 HydrophobicContact CG2-CD1 4.39Å; I486-F488 HydrophobicContact CG2-CD2 4.31Å; I486-F488 HydrophobicContact CG2-CE1 3.92Å; I486-F488 HydrophobicContact CG2-CE2 3.85Å; I486-F488 HydrophobicContact CG2-CZ 3.62Å; I486-F488 WeakPolarHBondContact O-CD2 3.37Å; I486-F488 PolarHBondContact O-N 3.04Å; F488-T490 PolarHBondContact O-N 3.41Å; F488-F621 HydrophobicContact CE1-CZ 4.36Å; F488-M673 HydrophobicContact CD1-SD 4.48Å; F488-R709 HydrophobicContact CD2-CB 4.39Å; F488-R709 HydrophobicContact CE1-CB 4.29Å; F488-R709 HydrophobicContact CE2-CB 3.71Å; F488-R709 HydrophobicContact CE2-CG 4.35Å; F488-R709 HydrophobicContact CZ-CB 3.65Å; F488-V710 HydrophobicContact CZ-CG2 4.11Å; F488-L713 HydrophobicContact CD1-CD1 4.11Å; F488-L713 HydrophobicContact CE1-CD1 3.9Å
489	E	59.2	Low	68.3	Low	165 Å²	165	81.1 Å²	81.1	77%	0.771	41%	0.408	S	S	*	.			trans	-67.9	121.6	-177.8	-71.2	-169.2	150.7	0	0	112.2
490	T	60.2	Low	69.7	Low	56 Å²	56	80.6 Å²	80.6	34%	0.344	40%	0.403	S	S	.	.			trans	-146.7	118.4	163.5	37.9	0	0	0	0	110.2	F488 L492 Y671	F488-T490 PolarHBondContact O-N 3.41Å; T490-L492 PolarHBondContact O-N 3.17Å; T490-Y671 HydrophobicContact CG2-CD2 3.59Å; T490-Y671 HydrophobicContact CG2-CE1 4.48Å; T490-Y671 HydrophobicContact CG2-CE2 3.5Å; T490-Y671 VanDerWaalsContact CG2-CE2 3.5Å; T490-Y671 HydrophobicContact CG2-CG 4.12Å
491	D	55.3	Low	70.8	Confident	163 Å²	163	73.4 Å²	73.4	87%	0.872	37%	0.369	S	S	*	.			trans	-83.7	28.7	-179.4	-75.7	-26.2	0	0	0	114
492	L	64.8	Low	71.5	Confident	56 Å²	56	74.9 Å²	74.9	29%	0.293	37%	0.367	S	S	.	.			trans	-94.4	109	-178.3	-75.2	166.1	0	0	0	111.2	T490 E496 L500 N616	T490-L492 PolarHBondContact O-N 3.17Å; L492-E496 HydrophobicContact CD2-CG 4.33Å; L492-L500 HydrophobicContact CD2-CD1 4.45Å; L492-N616 PolarHBondContact O-ND2 3.01Å
493	Q	70.8	Confident	72.1	Confident	146 Å²	146	81 Å²	81	68%	0.682	39%	0.394	S	S	*	.			trans	-66.7	146.7	173.9	-63	-175.6	5	0	0	111.2	L495 E496 M497	Q493-L495 PolarHBondContact O-N 3.45Å; Q493-L495 VanDerWaalsContact O-N 3.14Å; Q493-E496 PolarHBondContact O-N 2.93Å; Q493-E496 VanDerWaalsContact O-N 3.12Å; Q493-M497 PolarHBondContact O-N 3.38Å
494	D	68.3	Low	72.4	Confident	92 Å²	92	81.2 Å²	81.2	49%	0.492	40%	0.397	S	S	.	.	H	α-helix	trans	-57	-33.3	-175.1	-82.2	-27.7	0	0	0	114.4	M497 K498 N616	D494-M497 VanDerWaalsContact OD1-CE 3.3Å; D494-M497 WeakPolarHBondContact OD1-CE 3.46Å; D494-K498 WeakPolarHBondContact O-CB 3.22Å; D494-K498 PolarHBondContact O-N 2.82Å; D494-N616 WeakPolarHBondContact OD1-CB 3.47Å; D494-N616 VanDerWaalsContact OD1-CG 3.3Å; D494-N616 PolarHBondContact OD1-N 2.85Å; D494-N616 PolarHBondContact OD1-ND2 3.16Å
495	L	74.1	Confident	72.7	Confident	147 Å²	147	77.5 Å²	77.5	77%	0.77	38%	0.382	S	S	*	.	H	α-helix	trans	-67.8	-45.3	177.8	-80.3	154.3	0	0	0	112.1	Q493 K498 Y499	Q493-L495 PolarHBondContact O-N 3.45Å; Q493-L495 VanDerWaalsContact O-N 3.14Å; L495-K498 PolarHBondContact O-N 2.88Å; L495-Y499 PolarHBondContact O-N 2.79Å; L495-Y499 VanDerWaalsContact O-N 3.15Å
496	E	78.6	Confident	72.8	Confident	89 Å²	89	86 Å²	86	42%	0.416	41%	0.413	S	S	.	.	H	α-helix	trans	-64	-44.9	177	-175.7	176.3	-174.2	0	0	110.2	L492 Q493 K498 Y499 L500	L492-E496 HydrophobicContact CD2-CG 4.33Å; Q493-E496 PolarHBondContact O-N 2.93Å; Q493-E496 VanDerWaalsContact O-N 3.12Å; E496-K498 PolarHBondContact O-N 2.87Å; E496-Y499 WeakPolarHBondContact O-CB 3.35Å; E496-Y499 PolarHBondContact O-N 3.47Å; E496-L500 HydrophobicContact CG-CD1 4.14Å; E496-L500 HydrophobicContact CG-CG 4.45Å; E496-L500 VanDerWaalsContact O-CG 3.3Å; E496-L500 WeakPolarHBondContact O-CG 3.27Å; E496-L500 PolarHBondContact O-N 3.41Å
497	M	74	Confident	72.8	Confident	3 Å²	3	94.3 Å²	94.3	2%	0.015	45%	0.445	C	S	.	.	H	α-helix	trans	-63	-41.8	179.2	-175	173.1	48.2	0	0	113	Q493 D494 Y499 L500 L501 L551 N616	Q493-M497 PolarHBondContact O-N 3.38Å; D494-M497 VanDerWaalsContact OD1-CE 3.3Å; D494-M497 WeakPolarHBondContact OD1-CE 3.46Å; M497-Y499 VanDerWaalsContact C-N 3.3Å; M497-Y499 PolarHBondContact O-N 3.33Å; M497-L500 PolarHBondContact O-N 2.82Å; M497-L501 HydrophobicContact CG-CD1 4.08Å; M497-L501 WeakPolarHBondContact O-CB 3.36Å; M497-L501 WeakPolarHBondContact O-CG 3.22Å; M497-L501 PolarHBondContact O-N 2.9Å; M497-L551 HydrophobicContact CG-CD1 4.27Å; M497-L551 HydrophobicContact SD-CB 4.36Å; M497-L551 HydrophobicContact SD-CD1 3.45Å; M497-L551 WeakPolarHBondContact SD-CD1 3.36Å; M497-L551 HydrophobicContact SD-CD2 3.58Å; M497-L551 VanDerWaalsContact SD-CD2 3.58Å; M497-L551 HydrophobicContact SD-CG 3.98Å; M497-N616 HydrophobicContact CE-CB 4.04Å; M497-N616 VanDerWaalsContact CE-CG 3.46Å; M497-N616 VanDerWaalsContact CE-ND2 3.33Å; M497-N616 WeakPolarHBondContact CE-ND2 3.27Å
498	K	74.1	Confident	73.1	Confident	113 Å²	113	93.7 Å²	93.7	49%	0.491	44%	0.436	S	S	.	.	H	α-helix	trans	-61.4	-41.1	175.4	-173.6	175.7	-178.2	176.8	0	111.4	D494 L495 E496 L501 Q502	D494-K498 WeakPolarHBondContact O-CB 3.22Å; D494-K498 PolarHBondContact O-N 2.82Å; L495-K498 PolarHBondContact O-N 2.88Å; E496-K498 PolarHBondContact O-N 2.87Å; K498-L501 PolarHBondContact O-N 3.25Å; K498-Q502 WeakPolarHBondContact O-CB 3.3Å; K498-Q502 WeakPolarHBondContact O-CG 3.47Å; K498-Q502 PolarHBondContact O-N 3.17Å
499	Y	80.8	Confident	73.9	Confident	138 Å²	138	95.6 Å²	95.6	54%	0.541	45%	0.445	S	S	.	.	H	α-helix	trans	-63.5	-44.6	176.2	179.3	-98.3	0	0	0	112.1	L495 E496 M497 Q502 K503	L495-Y499 PolarHBondContact O-N 2.79Å; L495-Y499 VanDerWaalsContact O-N 3.15Å; E496-Y499 WeakPolarHBondContact O-CB 3.35Å; E496-Y499 PolarHBondContact O-N 3.47Å; M497-Y499 VanDerWaalsContact C-N 3.3Å; M497-Y499 PolarHBondContact O-N 3.33Å; Y499-Q502 PolarHBondContact O-N 2.8Å; Y499-K503 HydrophobicContact CE1-CG 4.18Å; Y499-K503 HydrophobicContact CE2-CG 4.21Å; Y499-K503 WeakPolarHBondContact O-CB 3.23Å; Y499-K503 WeakPolarHBondContact O-CG 3.34Å; Y499-K503 PolarHBondContact O-N 2.95Å
500	L	81.4	Confident	75.2	Confident	6 Å²	6	88.1 Å²	88.1	3%	0.031	41%	0.411	C	S	.	.	H	α-helix	trans	-64.2	-40.4	177.8	-64.9	174.6	0	0	0	112.4	L492 E496 M497 K503 T504 D505 I508	L492-L500 HydrophobicContact CD2-CD1 4.45Å; E496-L500 HydrophobicContact CG-CD1 4.14Å; E496-L500 HydrophobicContact CG-CG 4.45Å; E496-L500 VanDerWaalsContact O-CG 3.3Å; E496-L500 WeakPolarHBondContact O-CG 3.27Å; E496-L500 PolarHBondContact O-N 3.41Å; M497-L500 PolarHBondContact O-N 2.82Å; L500-K503 PolarHBondContact O-N 3.21Å; L500-T504 PolarHBondContact O-N 3.47Å; L500-T504 VanDerWaalsContact O-N 3.1Å; L500-D505 HydrophobicContact CB-CB 4.36Å; L500-D505 HydrophobicContact CD2-CB 3.96Å; L500-D505 WeakPolarHBondContact CD2-OD2 3.47Å; L500-D505 PolarHBondContact O-N 3.46Å; L500-D505 VanDerWaalsContact O-N 3.09Å; L500-I508 HydrophobicContact CB-CD1 3.68Å; L500-I508 HydrophobicContact CB-CG1 4.23Å; L500-I508 HydrophobicContact CB-CG2 4.34Å; L500-I508 HydrophobicContact CD1-CG2 3.94Å
501	L	75.6	Confident	76.3	Confident	9 Å²	9	91.6 Å²	91.6	5%	0.047	42%	0.423	C	S	.	.	H	α-helix	trans	-64.7	-44.3	175.9	-75.9	168.3	0	0	0	111.8	M497 K498 K503 T504 I508 T613 F669	M497-L501 HydrophobicContact CG-CD1 4.08Å; M497-L501 WeakPolarHBondContact O-CB 3.36Å; M497-L501 WeakPolarHBondContact O-CG 3.22Å; M497-L501 PolarHBondContact O-N 2.9Å; K498-L501 PolarHBondContact O-N 3.25Å; L501-K503 VanDerWaalsContact C-N 3.3Å; L501-K503 PolarHBondContact O-N 2.97Å; L501-T504 PolarHBondContact O-N 2.96Å; L501-T504 VanDerWaalsContact O-N 3.16Å; L501-I508 HydrophobicContact CB-CD1 4.33Å; L501-I508 HydrophobicContact CD2-CD1 3.61Å; L501-I508 HydrophobicContact CG-CD1 3.73Å; L501-T613 HydrophobicContact CB-CG2 4.26Å; L501-T613 HydrophobicContact CD1-CG2 4.39Å; L501-F669 HydrophobicContact CD2-CB 3.34Å; L501-F669 HydrophobicContact CD2-CD2 3.93Å; L501-F669 HydrophobicContact CD2-CG 3.75Å
502	Q	74.6	Confident	77.8	Confident	115 Å²	115	85 Å²	85	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-64.7	-33.2	176.9	-76.4	-178.2	-17.4	0	0	112.9	K498 Y499 T504	K498-Q502 WeakPolarHBondContact O-CB 3.3Å; K498-Q502 WeakPolarHBondContact O-CG 3.47Å; K498-Q502 PolarHBondContact O-N 3.17Å; Y499-Q502 PolarHBondContact O-N 2.8Å; Q502-T504 VanDerWaalsContact C-N 3.31Å
503	K	77.8	Confident	78.8	Confident	131 Å²	131	85.7 Å²	85.7	57%	0.57	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-2.4	176.7	-70	-68.5	-177.6	-179	0	113.7	Y499 L500 L501 D505	Y499-K503 HydrophobicContact CE1-CG 4.18Å; Y499-K503 HydrophobicContact CE2-CG 4.21Å; Y499-K503 WeakPolarHBondContact O-CB 3.23Å; Y499-K503 WeakPolarHBondContact O-CG 3.34Å; Y499-K503 PolarHBondContact O-N 2.95Å; L500-K503 PolarHBondContact O-N 3.21Å; L501-K503 VanDerWaalsContact C-N 3.3Å; L501-K503 PolarHBondContact O-N 2.97Å; K503-D505 PolarHBondContact O-N 2.98Å
504	T	74.3	Confident	79.6	Confident	63 Å²	63	81 Å²	81	39%	0.387	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	46.2	-175	56	0	0	0	0	111.6	L500 L501 Q502 F669	L500-T504 PolarHBondContact O-N 3.47Å; L500-T504 VanDerWaalsContact O-N 3.1Å; L501-T504 PolarHBondContact O-N 2.96Å; L501-T504 VanDerWaalsContact O-N 3.16Å; Q502-T504 VanDerWaalsContact C-N 3.31Å; T504-F669 HydrophobicContact CG2-CE2 4.28Å; T504-F669 HydrophobicContact CG2-CZ 3.84Å
505	D	80.3	Confident	80.5	Confident	42 Å²	42	80.5 Å²	80.5	23%	0.225	37%	0.368	C	S	.	.			trans	-68.4	133.2	-176.7	-167.1	-37.5	0	0	0	110.4	L500 K503 R507 I508	L500-D505 HydrophobicContact CB-CB 4.36Å; L500-D505 HydrophobicContact CD2-CB 3.96Å; L500-D505 WeakPolarHBondContact CD2-OD2 3.47Å; L500-D505 PolarHBondContact O-N 3.46Å; L500-D505 VanDerWaalsContact O-N 3.09Å; K503-D505 PolarHBondContact O-N 2.98Å; D505-R507 PolarHBondContact O-N 3.06Å; D505-R507 WeakPolarHBondContact OD1-CB 3.33Å; D505-R507 WeakPolarHBondContact OD1-CG 3.35Å; D505-R507 PolarHBondContact OD1-N 2.91Å; D505-R507 IonicContact OD1-NE 3.65Å; D505-R507 PolarHBondContact OD1-NE 3.38Å; D505-R507 IonicContact OD2-CZ 3.8Å; D505-R507 VanDerWaalsContact OD2-CZ 3.31Å; D505-R507 IonicContact OD2-NE 3.04Å; D505-R507 PolarHBondContact OD2-NE 3.35Å; D505-R507 IonicContact OD2-NH2 3.5Å; D505-R507 PolarHBondContact OD2-NH2 2.95Å; D505-I508 WeakPolarHBondContact O-CG1 3.35Å; D505-I508 PolarHBondContact O-N 3.1Å
506	R	79.6	Confident	81	Confident	211 Å²	211	74.8 Å²	74.8	80%	0.796	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-63.8	-19.7	180	-68.5	-175.2	175.5	173.1	-0.6	113.3	I508 E509	R506-I508 PolarHBondContact O-N 3.07Å; R506-E509 WeakPolarHBondContact O-CB 3.36Å; R506-E509 PolarHBondContact O-N 3.1Å; R506-E509 VanDerWaalsContact O-N 3.17Å
507	R	79.2	Confident	81.1	Confident	179 Å²	179	78.5 Å²	78.5	68%	0.675	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-62.8	-28.1	178.3	-71.1	-177.5	-71.1	164	-3.9	113.6	D505	D505-R507 PolarHBondContact O-N 3.06Å; D505-R507 WeakPolarHBondContact OD1-CB 3.33Å; D505-R507 WeakPolarHBondContact OD1-CG 3.35Å; D505-R507 PolarHBondContact OD1-N 2.91Å; D505-R507 IonicContact OD1-NE 3.65Å; D505-R507 PolarHBondContact OD1-NE 3.38Å; D505-R507 IonicContact OD2-CZ 3.8Å; D505-R507 VanDerWaalsContact OD2-CZ 3.31Å; D505-R507 IonicContact OD2-NE 3.04Å; D505-R507 PolarHBondContact OD2-NE 3.35Å; D505-R507 IonicContact OD2-NH2 3.5Å; D505-R507 PolarHBondContact OD2-NH2 2.95Å
508	I	83.4	Confident	81.3	Confident	9 Å²	9	80.7 Å²	80.7	5%	0.046	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-106.4	12.6	178.4	57.6	161.4	0	0	0	111.6	L500 L501 D505 R506 F669 G670	L500-I508 HydrophobicContact CB-CD1 3.68Å; L500-I508 HydrophobicContact CB-CG1 4.23Å; L500-I508 HydrophobicContact CB-CG2 4.34Å; L500-I508 HydrophobicContact CD1-CG2 3.94Å; L501-I508 HydrophobicContact CB-CD1 4.33Å; L501-I508 HydrophobicContact CD2-CD1 3.61Å; L501-I508 HydrophobicContact CG-CD1 3.73Å; D505-I508 WeakPolarHBondContact O-CG1 3.35Å; D505-I508 PolarHBondContact O-N 3.1Å; R506-I508 PolarHBondContact O-N 3.07Å; I508-F669 HydrophobicContact CD1-CB 4.26Å; I508-F669 HydrophobicContact CD1-CD1 4.14Å; I508-F669 HydrophobicContact CD1-CG 4.37Å; I508-F669 HydrophobicContact CG1-CD1 3.98Å; I508-F669 CarbonylContact O-C 3.55Å; I508-F669 WeakPolarHBondContact O-CA 3.48Å; I508-G670 CarbonylContact C-O 3.58Å; I508-G670 PolarHBondContact O-N 2.87Å; I508-G670 VanDerWaalsContact O-O 3.07Å
509	E	84.8	Confident	81.7	Confident	74 Å²	74	75.9 Å²	75.9	35%	0.346	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	121.4	177.4	-173.8	175	-167.6	0	0	109.8	R506 Q667 F669	R506-E509 WeakPolarHBondContact O-CB 3.36Å; R506-E509 PolarHBondContact O-N 3.1Å; R506-E509 VanDerWaalsContact O-N 3.17Å; E509-Q667 PolarHBondContact OE1-NE2 3.26Å; E509-F669 HydrophobicContact CB-CD1 4.4Å; E509-F669 HydrophobicContact CB-CE1 4.44Å
510	V	87.2	Confident	81.9	Confident	8 Å²	8	79.1 Å²	79.1	5%	0.048	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	124.7	172.2	-178.3	0	0	0	0	108.4	A512 H548 F622 V668	V510-A512 PolarHBondContact O-N 3.43Å; V510-H548 HydrophobicContact CG1-CB 4.24Å; V510-F622 HydrophobicContact CB-CZ 3.92Å; V510-F622 HydrophobicContact CG1-CE1 4.37Å; V510-F622 HydrophobicContact CG1-CZ 3.67Å; V510-F622 HydrophobicContact CG2-CE1 4.48Å; V510-F622 HydrophobicContact CG2-CZ 4.36Å; V510-V668 PolarHBondContact N-O 3.36Å
511	H	83.9	Confident	82.2	Confident	130 Å²	130	81.4 Å²	81.4	60%	0.602	38%	0.378	S	S	*	.			trans	-64.8	109.1	179.6	-171.4	71.3	0	0	0	111.1
512	A	85.4	Confident	82.7	Confident	24 Å²	24	85.7 Å²	85.7	20%	0.198	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.6	175.7	0	0	0	0	0	110.6	V510 L537 K538 V668	V510-A512 PolarHBondContact O-N 3.43Å; A512-L537 HydrophobicContact CB-CB 4.2Å; A512-K538 CarbonylContact C-O 3.18Å; A512-K538 WeakPolarHBondContact CA-O 3.47Å; A512-V668 HydrophobicContact CB-CG2 3.95Å
513	I	86.8	Confident	83.4	Confident	71 Å²	71	82.4 Å²	82.4	36%	0.364	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	125.2	179.6	-57.8	170.5	0	0	0	108.5	I515 L537 K538	I513-I515 HydrophobicContact CG2-CG1 4.2Å; I513-L537 WeakPolarHBondContact O-CA 3.42Å; I513-K538 PolarHBondContact N-O 2.85Å; I513-K538 PolarHBondContact O-N 2.94Å
514	F	88.2	Confident	83.8	Confident	46 Å²	46	81 Å²	81	20%	0.202	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	126	173.3	176.6	-96.2	0	0	0	111.4	M519 L521 L535 L537 I666	F514-M519 HydrophobicContact CE2-CE 3.96Å; F514-M519 HydrophobicContact CZ-CE 3.63Å; F514-M519 HydrophobicContact CZ-CG 4.47Å; F514-M519 HydrophobicContact CZ-SD 4.27Å; F514-L521 HydrophobicContact CB-CD1 3.84Å; F514-L521 HydrophobicContact CD1-CD1 3.91Å; F514-L521 HydrophobicContact CD1-CD2 4.27Å; F514-L521 HydrophobicContact CD1-CG 3.68Å; F514-L521 HydrophobicContact CD2-CD1 4.34Å; F514-L521 HydrophobicContact CD2-CD2 4.12Å; F514-L521 HydrophobicContact CD2-CG 4.32Å; F514-L521 HydrophobicContact CE1-CD2 4.22Å; F514-L521 HydrophobicContact CE1-CG 3.9Å; F514-L521 HydrophobicContact CE2-CD2 4.06Å; F514-L521 HydrophobicContact CG-CD1 3.76Å; F514-L521 HydrophobicContact CG-CD2 4.22Å; F514-L521 HydrophobicContact CG-CG 3.9Å; F514-L521 HydrophobicContact CZ-CD2 4.12Å; F514-L521 HydrophobicContact CZ-CG 4.31Å; F514-L535 HydrophobicContact CE2-CB 4.02Å; F514-L535 HydrophobicContact CE2-CD2 4.1Å; F514-L535 HydrophobicContact CZ-CD2 4.1Å; F514-L537 HydrophobicContact CB-CD2 4.12Å; F514-L537 HydrophobicContact CD2-CD2 4.14Å; F514-I666 HydrophobicContact CD2-CD1 3.68Å; F514-I666 HydrophobicContact CD2-CG1 4.37Å; F514-I666 HydrophobicContact CE2-CD1 3.61Å
515	I	86.1	Confident	84.3	Confident	82 Å²	82	79.1 Å²	79.1	42%	0.421	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	115.8	179	-54	174.3	0	0	0	107.5	I513 T536 K538	I513-I515 HydrophobicContact CG2-CG1 4.2Å; I515-T536 PolarHBondContact N-O 2.87Å; I515-T536 WeakPolarHBondContact O-CA 3.45Å; I515-T536 VanDerWaalsContact O-CB 3.29Å; I515-T536 WeakPolarHBondContact O-CB 3.4Å; I515-T536 PolarHBondContact O-N 3.29Å; I515-T536 VanDerWaalsContact O-O 3.11Å; I515-K538 HydrophobicContact CD1-CB 4.02Å; I515-K538 HydrophobicContact CD1-CD 4.42Å
516	S	84.4	Confident	84.2	Confident	28 Å²	28	79.5 Å²	79.5	20%	0.196	37%	0.37	C	S	.	.			trans	-147.9	139.5	170.8	-176.2	0	0	0	0	110.1	D518 M519 L534	S516-D518 PolarHBondContact OG-N 3.38Å; S516-M519 PolarHBondContact OG-N 2.87Å; S516-L534 PolarHBondContact OG-O 3.23Å
517	N	81.1	Confident	84	Confident	167 Å²	167	69.7 Å²	69.7	89%	0.893	33%	0.334	S	S	*	.	S	Bend	trans	-87	-17.9	171.2	-67.6	-22.5	0	0	0	112
518	D	78.1	Confident	83.4	Confident	49 Å²	49	63.7 Å²	63.7	26%	0.262	32%	0.319	S	S	.	.	S	Bend	trans	-91	-33	-171	-64.6	-45.7	0	0	0	112.4	S516 R530 M533 L534	S516-D518 PolarHBondContact OG-N 3.38Å; D518-R530 IonicContact OD1-CZ 3.59Å; D518-R530 IonicContact OD1-NE 3.93Å; D518-R530 IonicContact OD1-NH1 2.72Å; D518-R530 PolarHBondContact OD1-NH1 3.15Å; D518-M533 HydrophobicContact CB-CB 4.37Å; D518-M533 HydrophobicContact CB-CG 4.4Å; D518-L534 PolarHBondContact OD2-N 3.35Å
519	M	82.4	Confident	82.7	Confident	11 Å²	11	74 Å²	74	5%	0.054	36%	0.358	C	S	.	.			trans	-152	160	-176.4	75.1	105.2	176	0	0	113.4	F514 S516 L521 F525 L535 I663	F514-M519 HydrophobicContact CE2-CE 3.96Å; F514-M519 HydrophobicContact CZ-CE 3.63Å; F514-M519 HydrophobicContact CZ-CG 4.47Å; F514-M519 HydrophobicContact CZ-SD 4.27Å; S516-M519 PolarHBondContact OG-N 2.87Å; M519-L521 HydrophobicContact CE-CD2 4.04Å; M519-F525 HydrophobicContact CB-CD1 4.14Å; M519-F525 HydrophobicContact CB-CE1 4.39Å; M519-F525 HydrophobicContact CG-CE1 4.35Å; M519-F525 HydrophobicContact SD-CD1 4.37Å; M519-F525 HydrophobicContact SD-CE1 3.97Å; M519-L535 HydrophobicContact CE-CD1 3.81Å; M519-L535 HydrophobicContact CE-CD2 3.28Å; M519-L535 HydrophobicContact CE-CG 4.15Å; M519-L535 HydrophobicContact CG-CD2 3.74Å; M519-L535 HydrophobicContact SD-CD2 4.36Å; M519-I663 HydrophobicContact CE-CB 3.71Å; M519-I663 HydrophobicContact CE-CD1 3.38Å; M519-I663 HydrophobicContact CE-CG1 4.07Å; M519-I663 HydrophobicContact CE-CG2 3.93Å; M519-I663 HydrophobicContact SD-CB 4.3Å; M519-I663 HydrophobicContact SD-CD1 4.39Å
520	R	85.4	Confident	81.8	Confident	206 Å²	206	77.6 Å²	77.6	78%	0.777	37%	0.368	S	S	*	.			trans	-110.9	140.6	173.1	-64.3	-176.7	-179.4	-174.3	0.5	109.9	S523	R520-S523 PolarHBondContact O-N 3.49Å; R520-S523 PolarHBondContact O-OG 2.83Å
521	L	87.4	Confident	80.7	Confident	54 Å²	54	82.2 Å²	82.2	28%	0.283	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	147.8	173.2	-61.9	177.5	0	0	0	110.4	F514 M519 S523 I663 I666	F514-L521 HydrophobicContact CB-CD1 3.84Å; F514-L521 HydrophobicContact CD1-CD1 3.91Å; F514-L521 HydrophobicContact CD1-CD2 4.27Å; F514-L521 HydrophobicContact CD1-CG 3.68Å; F514-L521 HydrophobicContact CD2-CD1 4.34Å; F514-L521 HydrophobicContact CD2-CD2 4.12Å; F514-L521 HydrophobicContact CD2-CG 4.32Å; F514-L521 HydrophobicContact CE1-CD2 4.22Å; F514-L521 HydrophobicContact CE1-CG 3.9Å; F514-L521 HydrophobicContact CE2-CD2 4.06Å; F514-L521 HydrophobicContact CG-CD1 3.76Å; F514-L521 HydrophobicContact CG-CD2 4.22Å; F514-L521 HydrophobicContact CG-CG 3.9Å; F514-L521 HydrophobicContact CZ-CD2 4.12Å; F514-L521 HydrophobicContact CZ-CG 4.31Å; M519-L521 HydrophobicContact CE-CD2 4.04Å; L521-S523 PolarHBondContact O-N 3.04Å; L521-I663 HydrophobicContact CD2-CG2 3.77Å; L521-I666 HydrophobicContact CD2-CD1 4.05Å; L521-I666 HydrophobicContact CD2-CG1 3.77Å
522	N	86.9	Confident	80	Confident	99 Å²	99	83 Å²	83	53%	0.529	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	61	18.7	-176.3	-69.2	-51.6	0	0	0	116.1	K662 I663 N664	N522-K662 VanDerWaalsContact CA-CE 3.44Å; N522-K662 WeakPolarHBondContact O-CE 3.43Å; N522-I663 PolarHBondContact N-O 3.47Å; N522-N664 PolarHBondContact ND2-O 3.1Å; N522-N664 VanDerWaalsContact OD1-CA 3.23Å; N522-N664 WeakPolarHBondContact OD1-CA 3.34Å; N522-N664 WeakPolarHBondContact OD1-CB 3.38Å; N522-N664 PolarHBondContact OD1-O 3.42Å; N522-N664 PolarHBondContact OD1-OD1 3.42Å
523	S	88.3	Confident	79.9	Confident	46 Å²	46	82.5 Å²	82.5	32%	0.322	38%	0.379	S	S	.	.			trans	-112.8	144.4	171.9	69.9	0	0	0	0	112.3	R520 L521	R520-S523 PolarHBondContact O-N 3.49Å; R520-S523 PolarHBondContact O-OG 2.83Å; L521-S523 PolarHBondContact O-N 3.04Å
524	W	85.8	Confident	79.9	Confident	101 Å²	101	81.4 Å²	81.4	38%	0.383	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	134.7	172.3	-71.7	100.6	0	0	0	109.5	C558 T560 L605 Y660 M661 K662	W524-C558 HydrophobicContact CH2-CB 4.1Å; W524-T560 HydrophobicContact CE3-CG2 4.2Å; W524-T560 HydrophobicContact CH2-CG2 4.13Å; W524-T560 HydrophobicContact CZ3-CG2 3.78Å; W524-L605 HydrophobicContact CH2-CD1 4.38Å; W524-L605 HydrophobicContact CH2-CD2 4.02Å; W524-L605 HydrophobicContact CZ2-CD1 3.83Å; W524-L605 HydrophobicContact CZ2-CD2 3.94Å; W524-L605 HydrophobicContact CZ2-CG 4.48Å; W524-Y660 WeakPolarHBondContact CZ3-O 3.05Å; W524-M661 WeakPolarHBondContact CA-O 3.28Å; W524-M661 VanDerWaalsContact CE3-C 3.5Å; W524-K662 HydrophobicContact CD2-CB 3.58Å; W524-K662 HydrophobicContact CD2-CD 4.23Å; W524-K662 HydrophobicContact CD2-CG 4.42Å; W524-K662 HydrophobicContact CE3-CB 3.52Å; W524-K662 HydrophobicContact CG-CB 4.13Å; W524-K662 HydrophobicContact CG-CD 4.44Å; W524-K662 HydrophobicContact CH2-CB 4.12Å; W524-K662 HydrophobicContact CZ2-CB 4.18Å; W524-K662 HydrophobicContact CZ2-CD 4.19Å; W524-K662 HydrophobicContact CZ3-CB 3.79Å
525	F	84.6	Confident	79.9	Confident	24 Å²	24	79.2 Å²	79.2	11%	0.105	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	158.2	176.8	64.6	-93	0	0	0	110.8	M519 P527 M533 L629 M661 I663	M519-F525 HydrophobicContact CB-CD1 4.14Å; M519-F525 HydrophobicContact CB-CE1 4.39Å; M519-F525 HydrophobicContact CG-CE1 4.35Å; M519-F525 HydrophobicContact SD-CD1 4.37Å; M519-F525 HydrophobicContact SD-CE1 3.97Å; F525-P527 HydrophobicContact CE2-CB 4.17Å; F525-P527 WeakPolarHBondContact O-CD 3.03Å; F525-M533 HydrophobicContact CD2-CE 3.71Å; F525-M533 HydrophobicContact CD2-SD 3.67Å; F525-M533 HydrophobicContact CE2-CE 3.88Å; F525-M533 HydrophobicContact CE2-SD 3.32Å; F525-M533 WeakPolarHBondContact CE2-SD 3.41Å; F525-M533 HydrophobicContact CZ-SD 4.11Å; F525-L629 HydrophobicContact CE2-CD2 4.28Å; F525-L629 HydrophobicContact CZ-CD2 3.87Å; F525-M661 WeakPolarHBondContact CD1-O 3.31Å; F525-M661 HydrophobicContact CE2-CB 4.14Å; F525-M661 HydrophobicContact CE2-SD 4.42Å; F525-M661 HydrophobicContact CZ-CB 4.04Å; F525-M661 HydrophobicContact CZ-CG 4.09Å; F525-M661 HydrophobicContact CZ-SD 3.98Å; F525-M661 PolarHBondContact N-O 3.05Å; F525-M661 PolarHBondContact O-N 3.23Å; F525-I663 HydrophobicContact CE1-CD1 4.37Å; F525-I663 HydrophobicContact CE1-CG1 4.36Å; F525-I663 HydrophobicContact CZ-CD1 4.28Å
526	D	79.6	Confident	80.1	Confident	50 Å²	50	76.3 Å²	76.3	27%	0.267	35%	0.35	S	S	.	.			trans	-91.5	114	174.3	-171.6	-19.6	0	0	0	109.5	S528 W529 Y660	D526-S528 PolarHBondContact O-N 2.89Å; D526-S528 VanDerWaalsContact OD1-CB 3.26Å; D526-S528 WeakPolarHBondContact OD1-CB 3.36Å; D526-S528 PolarHBondContact OD1-N 3.34Å; D526-S528 PolarHBondContact OD1-OG 3.29Å; D526-S528 PolarHBondContact OD2-OG 2.96Å; D526-W529 PolarHBondContact O-N 3.06Å; D526-Y660 HydrophobicContact CB-CD1 4.09Å; D526-Y660 HydrophobicContact CB-CE1 3.98Å
527	P	74	Confident	80.4	Confident	5 Å²	5	75.1 Å²	75.1	3%	0.032	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-8.4	-179.4	30.6	-33.3	0	0	0	113.5	F525 L565 M661	F525-P527 HydrophobicContact CE2-CB 4.17Å; F525-P527 WeakPolarHBondContact O-CD 3.03Å; P527-L565 HydrophobicContact CG-CD1 3.41Å; P527-L565 VanDerWaalsContact CG-CD1 3.41Å; P527-L565 HydrophobicContact CG-CD2 4.41Å; P527-L565 HydrophobicContact CG-CG 4.47Å; P527-M661 HydrophobicContact CG-CB 4.39Å
528	S	68.6	Low	80.8	Confident	54 Å²	54	69.8 Å²	69.8	38%	0.378	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-21.7	177.4	71.4	0	0	0	0	113.4	D526 R530	D526-S528 PolarHBondContact O-N 2.89Å; D526-S528 VanDerWaalsContact OD1-CB 3.26Å; D526-S528 WeakPolarHBondContact OD1-CB 3.36Å; D526-S528 PolarHBondContact OD1-N 3.34Å; D526-S528 PolarHBondContact OD1-OG 3.29Å; D526-S528 PolarHBondContact OD2-OG 2.96Å; S528-R530 VanDerWaalsContact C-N 3.28Å; S528-R530 PolarHBondContact O-N 2.99Å
529	W	66.7	Low	81.1	Confident	226 Å²	226	67.5 Å²	67.5	86%	0.856	30%	0.298	S	S	*	.	S	Bend	trans	-68.6	-25.2	-174.4	-169.6	11.8	0	0	0	113.4	D526	D526-W529 PolarHBondContact O-N 3.06Å
530	R	66.4	Low	80.4	Confident	148 Å²	148	69.1 Å²	69.1	56%	0.558	31%	0.307	S	S	*	.			trans	-137.9	131.7	175.6	-74.2	-169.6	174.3	-158.7	-6	111.4	D518 S528 R532	D518-R530 IonicContact OD1-CZ 3.59Å; D518-R530 IonicContact OD1-NE 3.93Å; D518-R530 IonicContact OD1-NH1 2.72Å; D518-R530 PolarHBondContact OD1-NH1 3.15Å; S528-R530 VanDerWaalsContact C-N 3.28Å; S528-R530 PolarHBondContact O-N 2.99Å; R530-R532 PolarHBondContact O-N 3.26Å; R530-R532 VanDerWaalsContact O-N 3.13Å
531	K	64.2	Low	79.1	Confident	105 Å²	105	66.2 Å²	66.2	46%	0.457	30%	0.3	S	S	.	.	S	Bend	trans	-58.2	-26.9	179.3	-68.1	-177.8	-179.7	175.6	0	113.8	E650	K531-E650 IonicContact NZ-OE1 2.64Å; K531-E650 PolarHBondContact NZ-OE1 3Å
532	R	70	Confident	77.8	Confident	147 Å²	147	72.8 Å²	72.8	56%	0.555	32%	0.323	S	S	*	.			trans	-147.4	124.4	-180	-57.8	-178.4	-175.1	-178.5	0.2	108.8	R530 Y628 R630	R530-R532 PolarHBondContact O-N 3.26Å; R530-R532 VanDerWaalsContact O-N 3.13Å; R532-Y628 HydrophobicContact CB-CD1 4.3Å; R532-R630 HydrophobicContact CG-CG 4.28Å; R532-R630 VanDerWaalsContact NE-NH2 3.12Å
533	M	82.5	Confident	76.6	Confident	13 Å²	13	73.6 Å²	73.6	6%	0.064	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	133.5	171.2	-64.8	-178.1	-178.8	0	0	109.3	D518 F525 Y628 L629	D518-M533 HydrophobicContact CB-CB 4.37Å; D518-M533 HydrophobicContact CB-CG 4.4Å; F525-M533 HydrophobicContact CD2-CE 3.71Å; F525-M533 HydrophobicContact CD2-SD 3.67Å; F525-M533 HydrophobicContact CE2-CE 3.88Å; F525-M533 HydrophobicContact CE2-SD 3.32Å; F525-M533 WeakPolarHBondContact CE2-SD 3.41Å; F525-M533 HydrophobicContact CZ-SD 4.11Å; M533-Y628 WeakPolarHBondContact O-CA 3.23Å; M533-L629 HydrophobicContact CB-CB 4.39Å; M533-L629 PolarHBondContact N-O 3.38Å; M533-L629 PolarHBondContact O-N 3.07Å
534	L	87.1	Confident	75.5	Confident	49 Å²	49	75.1 Å²	75.1	26%	0.257	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	119.9	-179.2	177.8	61.5	0	0	0	110.6	S516 D518 H626 Y628	S516-L534 PolarHBondContact OG-O 3.23Å; D518-L534 PolarHBondContact OD2-N 3.35Å; L534-H626 HydrophobicContact CD1-CB 3.88Å; L534-Y628 HydrophobicContact CB-CD1 4.46Å; L534-Y628 HydrophobicContact CB-CE1 4.18Å; L534-Y628 HydrophobicContact CD1-CD1 4.2Å; L534-Y628 HydrophobicContact CD1-CD2 4.49Å; L534-Y628 HydrophobicContact CD1-CE1 3.84Å; L534-Y628 HydrophobicContact CD1-CE2 4.16Å; L534-Y628 HydrophobicContact CG-CE1 4.44Å
535	L	89.1	Confident	75.2	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.8	175.6	-49	-176.7	0	0	0	107.8	F514 M519 H626 I627 L629 I663 I666	F514-L535 HydrophobicContact CE2-CB 4.02Å; F514-L535 HydrophobicContact CE2-CD2 4.1Å; F514-L535 HydrophobicContact CZ-CD2 4.1Å; M519-L535 HydrophobicContact CE-CD1 3.81Å; M519-L535 HydrophobicContact CE-CD2 3.28Å; M519-L535 HydrophobicContact CE-CG 4.15Å; M519-L535 HydrophobicContact CG-CD2 3.74Å; M519-L535 HydrophobicContact SD-CD2 4.36Å; L535-H626 CarbonylContact O-C 3.32Å; L535-H626 WeakPolarHBondContact O-CA 3.49Å; L535-I627 HydrophobicContact CB-CB 4.17Å; L535-I627 WeakPolarHBondContact CB-O 3.48Å; L535-I627 PolarHBondContact N-O 3.12Å; L535-I627 PolarHBondContact O-N 2.99Å; L535-L629 HydrophobicContact CD1-CB 4.5Å; L535-I663 HydrophobicContact CD1-CD1 3.73Å; L535-I666 HydrophobicContact CD1-CD1 4.08Å
536	T	90.1	Very high	75.2	Confident	21 Å²	21	73.6 Å²	73.6	13%	0.129	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	128.6	179.2	-57.1	0	0	0	0	110	I515 V625 H626	I515-T536 PolarHBondContact N-O 2.87Å; I515-T536 WeakPolarHBondContact O-CA 3.45Å; I515-T536 VanDerWaalsContact O-CB 3.29Å; I515-T536 WeakPolarHBondContact O-CB 3.4Å; I515-T536 PolarHBondContact O-N 3.29Å; I515-T536 VanDerWaalsContact O-O 3.11Å; T536-V625 CarbonylContact C-O 3.6Å; T536-V625 WeakPolarHBondContact CA-O 3.46Å; T536-H626 VanDerWaalsContact CG2-CE1 3.46Å; T536-H626 WeakPolarHBondContact CG2-CE1 3.48Å; T536-H626 WeakPolarHBondContact CG2-ND1 3.39Å; T536-H626 PolarHBondContact OG1-ND1 3.41Å
537	L	90.3	Very high	75.6	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.4	168.8	-64	165.2	0	0	0	107.6	A512 I513 F514 T624 V625 I627 I666 V668	A512-L537 HydrophobicContact CB-CB 4.2Å; I513-L537 WeakPolarHBondContact O-CA 3.42Å; F514-L537 HydrophobicContact CB-CD2 4.12Å; F514-L537 HydrophobicContact CD2-CD2 4.14Å; L537-T624 CarbonylContact O-C 3.57Å; L537-T624 VanDerWaalsContact O-CA 3.25Å; L537-T624 WeakPolarHBondContact O-CA 3.36Å; L537-V625 HydrophobicContact CB-CB 4.29Å; L537-V625 PolarHBondContact N-O 3.17Å; L537-V625 PolarHBondContact O-N 3.21Å; L537-I627 HydrophobicContact CD1-CD1 4.24Å; L537-I666 HydrophobicContact CD1-CB 4.28Å; L537-I666 HydrophobicContact CD1-CG2 3.63Å; L537-I666 HydrophobicContact CD2-CB 4.2Å; L537-I666 HydrophobicContact CD2-CG2 4.45Å; L537-V668 HydrophobicContact CB-CG2 4.39Å; L537-V668 HydrophobicContact CD1-CG2 3.64Å
538	K	89.1	Confident	76.3	Confident	56 Å²	56	71.5 Å²	71.5	24%	0.243	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.8	178.4	-178.6	159	-176.8	165	0	110	A512 I513 I515 E623 T624	A512-K538 CarbonylContact C-O 3.18Å; A512-K538 WeakPolarHBondContact CA-O 3.47Å; I513-K538 PolarHBondContact N-O 2.85Å; I513-K538 PolarHBondContact O-N 2.94Å; I515-K538 HydrophobicContact CD1-CB 4.02Å; I515-K538 HydrophobicContact CD1-CD 4.42Å; K538-E623 WeakPolarHBondContact CA-O 3.37Å; K538-T624 HydrophobicContact CB-CG2 4.01Å; K538-T624 HydrophobicContact CD-CG2 3.96Å; K538-T624 HydrophobicContact CG-CG2 3.83Å
539	S	85.1	Confident	77.2	Confident	0 Å²	0	69 Å²	69	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	157.6	170.8	63.7	0	0	0	0	110.3	K541 H548 E623	S539-K541 PolarHBondContact O-N 2.8Å; S539-H548 WeakPolarHBondContact CB-CD2 3.43Å; S539-E623 PolarHBondContact N-O 3.23Å; S539-E623 WeakPolarHBondContact OG-CA 3.26Å; S539-E623 PolarHBondContact OG-O 3.2Å; S539-E623 PolarHBondContact OG-OE2 3.1Å
540	N	67.7	Low	78.3	Confident	46 Å²	46	58.2 Å²	58.2	25%	0.246	27%	0.266	C	S	.	.			trans	-54.5	113.9	-167.2	-171.6	-8.4	0	0	0	113.5	Y542	N540-Y542 PolarHBondContact O-N 3Å; N540-Y542 PolarHBondContact OD1-N 3.11Å
541	K	58.5	Low	79.4	Confident	144 Å²	144	51.2 Å²	51.2	63%	0.626	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-16.3	-175.9	-168.4	180	176.7	-174.2	0	114.7	S539	S539-K541 PolarHBondContact O-N 2.8Å
542	Y	59	Low	80.6	Confident	193 Å²	193	46.2 Å²	46.2	76%	0.757	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-1.6	-165.7	-64.1	-80.5	0	0	0	115.7	N540	N540-Y542 PolarHBondContact O-N 3Å; N540-Y542 PolarHBondContact OD1-N 3.11Å
543	K	62.6	Low	81.5	Confident	115 Å²	115	39.3 Å²	39.3	50%	0.5	19%	0.192	S	C	.	.			trans	-121.8	91.7	177.9	-67.8	-170.9	178.4	-174.7	0	111	S545 L546	K543-S545 PolarHBondContact O-N 3.07Å; K543-L546 HydrophobicContact CB-CD1 4.29Å; K543-L546 HydrophobicContact CD-CD1 3.74Å
544	S	65.3	Low	81.9	Confident	79 Å²	79	39 Å²	39	55%	0.552	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.7	175.6	53.4	0	0	0	0	113.6	L546	S544-L546 PolarHBondContact O-N 3.39Å
545	S	79.3	Confident	82	Confident	50 Å²	50	36.8 Å²	36.8	35%	0.35	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	7.3	-179.3	57.9	0	0	0	0	114.6	K543 H674 F675	K543-S545 PolarHBondContact O-N 3.07Å; S545-H674 PolarHBondContact O-ND1 3.19Å; S545-F675 CarbonylContact C-O 3.55Å; S545-F675 WeakPolarHBondContact CA-O 3.33Å; S545-F675 PolarHBondContact O-N 3.28Å; S545-F675 VanDerWaalsContact O-O 3.11Å
546	L	84.3	Confident	82.1	Confident	42 Å²	42	38.8 Å²	38.8	22%	0.22	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.5	177.5	-66.7	174.2	0	0	0	110.1	K543 S544 M673 R731	K543-L546 HydrophobicContact CB-CD1 4.29Å; K543-L546 HydrophobicContact CD-CD1 3.74Å; S544-L546 PolarHBondContact O-N 3.39Å; L546-M673 VanDerWaalsContact CA-O 3.31Å; L546-M673 WeakPolarHBondContact CA-O 3.42Å; L546-M673 WeakPolarHBondContact CD2-O 3.44Å; L546-R731 PolarHBondContact O-NH2 2.82Å
547	V	87.3	Confident	82.1	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	139.3	172.2	173.3	0	0	0	0	108.2	F576 F621 M673 F675	V547-F576 HydrophobicContact CG1-CD1 4.43Å; V547-F576 HydrophobicContact CG1-CE1 3.75Å; V547-F576 HydrophobicContact CG2-CE1 4.44Å; V547-F621 HydrophobicContact CB-CE1 4.46Å; V547-F621 HydrophobicContact CG1-CD1 3.21Å; V547-F621 HydrophobicContact CG1-CE1 3.34Å; V547-F621 HydrophobicContact CG1-CG 4.39Å; V547-M673 PolarHBondContact N-O 3.45Å; V547-M673 PolarHBondContact O-N 3.31Å; V547-F675 HydrophobicContact CB-CB 4.36Å; V547-F675 HydrophobicContact CG2-CB 3.6Å; V547-F675 HydrophobicContact CG2-CD1 4.17Å; V547-F675 HydrophobicContact CG2-CD2 4.15Å; V547-F675 HydrophobicContact CG2-CG 3.71Å
548	H	88.4	Confident	82	Confident	10 Å²	10	37.9 Å²	37.9	5%	0.046	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	141.2	-171.5	-53.9	-73.1	0	0	0	112	V510 S539 F621 F622 Y671 S672	V510-H548 HydrophobicContact CG1-CB 4.24Å; S539-H548 WeakPolarHBondContact CB-CD2 3.43Å; H548-F621 WeakPolarHBondContact O-CA 3.19Å; H548-F622 HydrophobicContact CB-CD1 3.81Å; H548-F622 HydrophobicContact CB-CE1 3.38Å; H548-F622 HydrophobicContact CB-CE2 4.49Å; H548-F622 HydrophobicContact CB-CZ 3.78Å; H548-F622 PolarHBondContact O-N 3.43Å; H548-Y671 WeakPolarHBondContact CA-O 3.31Å; H548-S672 PolarHBondContact CE1-OG 3.25Å; H548-S672 VanDerWaalsContact CE1-OG 3.22Å; H548-S672 PolarHBondContact ND1-OG 2.66Å
549	M	88.8	Confident	81.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	133	173.9	-69.9	-62.6	-66.9	0	0	110	K619 T620 F621 G670 Y671 M673 L713	M549-K619 HydrophobicContact CE-CB 3.9Å; M549-K619 HydrophobicContact CE-CD 4.02Å; M549-K619 HydrophobicContact CE-CG 3.64Å; M549-T620 WeakPolarHBondContact CA-O 3.27Å; M549-T620 VanDerWaalsContact CE-C 3.43Å; M549-T620 VanDerWaalsContact SD-C 3.56Å; M549-F621 HydrophobicContact SD-CB 4.41Å; M549-F621 HydrophobicContact SD-CD1 3.47Å; M549-F621 WeakPolarHBondContact SD-CD1 3.13Å; M549-F621 HydrophobicContact SD-CD2 4.26Å; M549-F621 HydrophobicContact SD-CE1 3.73Å; M549-F621 HydrophobicContact SD-CE2 4.46Å; M549-F621 HydrophobicContact SD-CG 3.8Å; M549-F621 HydrophobicContact SD-CZ 4.23Å; M549-G670 WeakPolarHBondContact O-CA 3.3Å; M549-Y671 HydrophobicContact CB-CD1 4.01Å; M549-Y671 HydrophobicContact CB-CD2 4.38Å; M549-Y671 HydrophobicContact CB-CE1 3.67Å; M549-Y671 HydrophobicContact CB-CE2 4.09Å; M549-Y671 HydrophobicContact CB-CG 4.35Å; M549-Y671 HydrophobicContact CG-CD2 4.46Å; M549-Y671 HydrophobicContact CG-CE1 4.17Å; M549-Y671 HydrophobicContact CG-CE2 3.85Å; M549-Y671 PolarHBondContact N-O 2.96Å; M549-Y671 PolarHBondContact O-N 2.84Å; M549-M673 HydrophobicContact CG-CE 3.26Å; M549-M673 HydrophobicContact CG-SD 3.92Å; M549-M673 HydrophobicContact SD-CE 3.64Å; M549-L713 HydrophobicContact CE-CD1 4.11Å; M549-L713 HydrophobicContact CE-CD2 4.16Å; M549-L713 HydrophobicContact SD-CD1 4.3Å
550	I	89.4	Confident	81.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	130.5	176.6	-166.1	166.6	0	0	0	110.1	L553 L614 K619 T620 F622 V625 V668	I550-L553 HydrophobicContact CD1-CD1 4.17Å; I550-L553 HydrophobicContact CD1-CD2 3.81Å; I550-L553 HydrophobicContact CD1-CG 3.85Å; I550-L614 HydrophobicContact CG1-CD1 4.3Å; I550-L614 HydrophobicContact CG2-CD1 3.99Å; I550-K619 WeakPolarHBondContact O-CA 3.39Å; I550-T620 WeakPolarHBondContact CG2-O 3.37Å; I550-T620 PolarHBondContact N-O 3.37Å; I550-F622 HydrophobicContact CB-CB 4.3Å; I550-F622 HydrophobicContact CB-CD1 3.57Å; I550-F622 HydrophobicContact CB-CE1 4.07Å; I550-F622 HydrophobicContact CB-CG 4.07Å; I550-F622 HydrophobicContact CG1-CD1 4.49Å; I550-F622 HydrophobicContact CG2-CB 4.47Å; I550-F622 HydrophobicContact CG2-CD1 4.46Å; I550-V625 HydrophobicContact CD1-CG2 4.04Å; I550-V668 HydrophobicContact CD1-CG1 3.78Å; I550-V668 HydrophobicContact CG1-CG1 3.78Å
551	L	89	Confident	81.8	Confident	1 Å²	1	42 Å²	42	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	-20.7	177.4	-66.4	175.1	0	0	0	112.3	M497 L614 G615 K619 F669 Y671	M497-L551 HydrophobicContact CG-CD1 4.27Å; M497-L551 HydrophobicContact SD-CB 4.36Å; M497-L551 HydrophobicContact SD-CD1 3.45Å; M497-L551 WeakPolarHBondContact SD-CD1 3.36Å; M497-L551 HydrophobicContact SD-CD2 3.58Å; M497-L551 VanDerWaalsContact SD-CD2 3.58Å; M497-L551 HydrophobicContact SD-CG 3.98Å; L551-L614 VanDerWaalsContact O-CB 3.3Å; L551-L614 WeakPolarHBondContact O-CB 3.47Å; L551-L614 PolarHBondContact O-N 3.48Å; L551-G615 PolarHBondContact O-N 3.24Å; L551-K619 HydrophobicContact CD2-CB 3.71Å; L551-K619 HydrophobicContact CD2-CD 4.22Å; L551-F669 PolarHBondContact N-O 3.42Å; L551-Y671 HydrophobicContact CD1-CD1 3.72Å; L551-Y671 HydrophobicContact CD1-CE1 4.13Å; L551-Y671 HydrophobicContact CD2-CE1 4.25Å; L551-Y671 HydrophobicContact CG-CD1 4.22Å; L551-Y671 HydrophobicContact CG-CE1 4.32Å
552	G	89.1	Confident	82.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	169.9	174.5	0	0	0	0	0	113.7	L612 F669	G552-L612 CarbonylContact C-O 3.57Å; G552-L612 WeakPolarHBondContact CA-O 3.21Å; G552-F669 PolarHBondContact N-O 2.66Å; G552-F669 VanDerWaalsContact N-O 3.11Å; G552-F669 PolarHBondContact O-N 3.35Å
553	L	90.6	Very high	82.9	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	141.2	177.6	-70	168.5	0	0	0	109.4	I550 V571 W596 T611 L612 V625 V668	I550-L553 HydrophobicContact CD1-CD1 4.17Å; I550-L553 HydrophobicContact CD1-CD2 3.81Å; I550-L553 HydrophobicContact CD1-CG 3.85Å; L553-V571 HydrophobicContact CD1-CG1 3.92Å; L553-V571 HydrophobicContact CD1-CG2 4.38Å; L553-W596 HydrophobicContact CB-CH2 4.16Å; L553-W596 HydrophobicContact CB-CZ3 4.47Å; L553-T611 CarbonylContact O-C 3.51Å; L553-T611 WeakPolarHBondContact O-CA 3.5Å; L553-L612 HydrophobicContact CB-CB 4.39Å; L553-L612 HydrophobicContact CD1-CD2 4.5Å; L553-L612 PolarHBondContact N-O 3.27Å; L553-L612 PolarHBondContact O-N 3Å; L553-V625 HydrophobicContact CD1-CG1 4.14Å; L553-V625 HydrophobicContact CD2-CG1 4.44Å; L553-V668 HydrophobicContact CD2-CB 4.19Å; L553-V668 HydrophobicContact CD2-CG1 4.02Å; L553-V668 HydrophobicContact CD2-CG2 3.74Å
554	S	89.6	Confident	83.4	Confident	8 Å²	8	31.2 Å²	31.2	6%	0.056	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.9	170.5	177.3	0	0	0	0	110.9	W610 I666 Q667	S554-W610 CarbonylContact C-O 3.55Å; S554-W610 VanDerWaalsContact CA-O 3.28Å; S554-W610 WeakPolarHBondContact CA-O 3.37Å; S554-I666 CarbonylContact O-C 3.58Å; S554-I666 WeakPolarHBondContact O-CA 3.36Å; S554-Q667 PolarHBondContact N-O 2.88Å; S554-Q667 PolarHBondContact O-N 3.25Å
555	L	90.4	Very high	83.9	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	126.8	-179.3	-178.6	72.8	0	0	0	109.4	I557 L569 W610 I663 I666	L555-I557 HydrophobicContact CD2-CD1 3.59Å; L555-I557 HydrophobicContact CD2-CG1 3.66Å; L555-I557 HydrophobicContact CG-CD1 4.27Å; L555-I557 HydrophobicContact CG-CG1 3.78Å; L555-L569 HydrophobicContact CD2-CD1 3.87Å; L555-L569 HydrophobicContact CD2-CD2 3.89Å; L555-W610 HydrophobicContact CB-CB 4.32Å; L555-W610 PolarHBondContact N-O 2.87Å; L555-W610 WeakPolarHBondContact O-CB 3.44Å; L555-W610 PolarHBondContact O-N 3.48Å; L555-I663 HydrophobicContact CD1-CG2 3.51Å; L555-I663 HydrophobicContact CG-CG2 4.46Å; L555-I666 HydrophobicContact CB-CG2 4.43Å; L555-I666 HydrophobicContact CD1-CB 3.89Å; L555-I666 HydrophobicContact CD1-CD1 3.54Å; L555-I666 HydrophobicContact CD1-CG1 3.36Å; L555-I666 HydrophobicContact CD1-CG2 3.64Å
556	Q	90.4	Very high	83.7	Confident	42 Å²	42	28 Å²	28	20%	0.196	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	110.2	175.3	-175.1	-179.8	17.5	0	0	110.2	L601 N609 I663 N664 N665	Q556-L601 HydrophobicContact CG-CD1 4.03Å; Q556-N609 WeakPolarHBondContact CB-OD1 3.13Å; Q556-N609 VanDerWaalsContact CG-OD1 3.27Å; Q556-N609 WeakPolarHBondContact CG-OD1 3.28Å; Q556-I663 WeakPolarHBondContact O-CA 3.32Å; Q556-N664 HydrophobicContact CB-CB 4.13Å; Q556-N664 VanDerWaalsContact CD-ND2 3.3Å; Q556-N664 HydrophobicContact CG-CB 4.01Å; Q556-N664 PolarHBondContact NE2-ND2 3.37Å; Q556-N664 PolarHBondContact O-N 2.89Å; Q556-N664 VanDerWaalsContact OE1-CB 3.29Å; Q556-N664 PolarHBondContact OE1-ND2 2.91Å; Q556-N665 PolarHBondContact N-O 3.24Å
557	I	89.5	Confident	83.6	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.2	179.6	-50	-178.1	0	0	0	109.8	L555 P567 C607 Y608 W610 M661 I663	L555-I557 HydrophobicContact CD2-CD1 3.59Å; L555-I557 HydrophobicContact CD2-CG1 3.66Å; L555-I557 HydrophobicContact CG-CD1 4.27Å; L555-I557 HydrophobicContact CG-CG1 3.78Å; I557-P567 HydrophobicContact CD1-CB 3.92Å; I557-P567 HydrophobicContact CD1-CG 3.85Å; I557-C607 WeakPolarHBondContact O-CA 3.33Å; I557-Y608 PolarHBondContact N-O 3.31Å; I557-Y608 PolarHBondContact O-N 3.06Å; I557-W610 HydrophobicContact CD1-CD2 4.42Å; I557-W610 HydrophobicContact CD1-CG 4.35Å; I557-M661 HydrophobicContact CG2-CG 3.58Å; I557-M661 HydrophobicContact CG2-SD 3.7Å; I557-I663 HydrophobicContact CG1-CG1 4.34Å
558	C	88.3	Confident	83.4	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.02	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	136.8	173.8	-66.7	0	0	0	0	111.1	W524 C607 M661 K662 N664	W524-C558 HydrophobicContact CH2-CB 4.1Å; C558-C607 HydrophobicContact CB-CB 4.13Å; C558-C607 WeakPolarHBondContact CB-SG 3.14Å; C558-C607 WeakPolarHBondContact SG-CB 3.49Å; C558-C607 CovalentContact SG-SG 2.04Å; C558-C607 PolarHBondContact SG-SG 2.96Å; C558-M661 CarbonylContact O-C 3.46Å; C558-M661 WeakPolarHBondContact O-CA 3.39Å; C558-K662 HydrophobicContact CB-CB 4.26Å; C558-K662 PolarHBondContact N-O 3.07Å; C558-K662 PolarHBondContact O-N 3.27Å; C558-N664 PolarHBondContact SG-ND2 2.79Å; C558-N664 VanDerWaalsContact SG-ND2 3.42Å
559	L	85.7	Confident	83.3	Confident	12 Å²	12	28.1 Å²	28.1	6%	0.063	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	149.9	176.6	-63.1	168.1	0	0	0	110.4	Q606 M661	L559-Q606 HydrophobicContact CB-CB 4.35Å; L559-Q606 PolarHBondContact N-O 3Å; L559-Q606 PolarHBondContact O-N 3.38Å; L559-M661 HydrophobicContact CD2-CB 4.06Å; L559-M661 HydrophobicContact CD2-CE 3.88Å; L559-M661 HydrophobicContact CD2-CG 3.88Å
560	T	82.8	Confident	83.3	Confident	33 Å²	33	29.1 Å²	29.1	20%	0.202	16%	0.155	C	C	.	.			trans	-67	149	170.4	47	0	0	0	0	111.2	W524 N562 S563 G659 Y660	W524-T560 HydrophobicContact CE3-CG2 4.2Å; W524-T560 HydrophobicContact CH2-CG2 4.13Å; W524-T560 HydrophobicContact CZ3-CG2 3.78Å; T560-N562 PolarHBondContact O-N 3.38Å; T560-S563 WeakPolarHBondContact O-CB 3.49Å; T560-S563 PolarHBondContact O-N 3.32Å; T560-G659 WeakPolarHBondContact OG1-CA 3.45Å; T560-Y660 HydrophobicContact CG2-CD2 4.36Å; T560-Y660 PolarHBondContact N-O 3.44Å; T560-Y660 PolarHBondContact OG1-N 2.93Å; T560-Y660 PolarHBondContact OG1-O 3.16Å
561	K	70.7	Confident	83.4	Confident	144 Å²	144	29.1 Å²	29.1	63%	0.626	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	133.4	177.2	-68.1	-173.1	-177.6	-177.4	0	109.4	P604	K561-P604 WeakPolarHBondContact CE-O 3.45Å
562	N	68.7	Low	83.5	Confident	152 Å²	152	31.8 Å²	31.8	81%	0.813	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.5	18.1	-175.3	-57.7	-13.9	0	0	0	116.3	T560 T564	T560-N562 PolarHBondContact O-N 3.38Å; N562-T564 PolarHBondContact O-N 3.24Å
563	S	71.4	Confident	83.7	Confident	14 Å²	14	31.8 Å²	31.8	10%	0.098	17%	0.165	C	C	.	.			trans	-65.4	133.4	169.9	-177.7	0	0	0	0	111.4	T560 L565 L658	T560-S563 WeakPolarHBondContact O-CB 3.49Å; T560-S563 PolarHBondContact O-N 3.32Å; S563-L565 VanDerWaalsContact C-N 3.25Å; S563-L565 WeakPolarHBondContact OG-CB 3.35Å; S563-L565 PolarHBondContact OG-N 2.88Å; S563-L658 PolarHBondContact OG-O 2.8Å
564	T	72.1	Confident	83.7	Confident	59 Å²	59	31.7 Å²	31.7	36%	0.362	17%	0.165	S	C	.	.			trans	-87.9	6.7	173	55.9	0	0	0	0	112.4	N562 I633 K634 L658	N562-T564 PolarHBondContact O-N 3.24Å; T564-I633 CarbonylContact O-C 3.58Å; T564-I633 WeakPolarHBondContact O-CA 3.3Å; T564-K634 PolarHBondContact O-N 3.33Å; T564-L658 PolarHBondContact N-O 3.36Å
565	L	75.6	Confident	83.7	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.016	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	136.5	-174.2	-63.3	160.6	0	0	0	111.6	P527 S563 R632 L658 G659	P527-L565 HydrophobicContact CG-CD1 3.41Å; P527-L565 VanDerWaalsContact CG-CD1 3.41Å; P527-L565 HydrophobicContact CG-CD2 4.41Å; P527-L565 HydrophobicContact CG-CG 4.47Å; S563-L565 VanDerWaalsContact C-N 3.25Å; S563-L565 WeakPolarHBondContact OG-CB 3.35Å; S563-L565 PolarHBondContact OG-N 2.88Å; L565-R632 CarbonylContact C-O 3.59Å; L565-R632 WeakPolarHBondContact CA-O 3.42Å; L565-L658 HydrophobicContact CD1-CB 4Å; L565-L658 WeakPolarHBondContact CD1-O 3.42Å; L565-L658 HydrophobicContact CD2-CB 4.01Å; L565-L658 HydrophobicContact CG-CB 4.03Å; L565-L658 VanDerWaalsContact CG-O 3.32Å; L565-L658 WeakPolarHBondContact CG-O 3.21Å; L565-G659 WeakPolarHBondContact CD1-O 3.32Å
566	E	76.3	Confident	83.6	Confident	59 Å²	59	31.5 Å²	31.5	28%	0.276	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	121.1	169	-175.5	167.2	-168.4	0	0	109.7	R598 S631 R632 K634	E566-R598 IonicContact OE1-CZ 3.36Å; E566-R598 IonicContact OE1-NH1 2.77Å; E566-R598 PolarHBondContact OE1-NH1 3.04Å; E566-R598 IonicContact OE1-NH2 2.99Å; E566-R598 PolarHBondContact OE1-NH2 2.8Å; E566-S631 WeakPolarHBondContact O-CA 3.31Å; E566-R632 PolarHBondContact N-O 3.41Å; E566-R632 PolarHBondContact O-N 3.41Å; E566-K634 HydrophobicContact CB-CG 4.37Å
567	P	81.5	Confident	83.2	Confident	5 Å²	5	29.9 Å²	29.9	3%	0.032	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	134.3	176.6	28.8	-32	0	0	0	110.8	I557 W610 L629 R630 M661	I557-P567 HydrophobicContact CD1-CB 3.92Å; I557-P567 HydrophobicContact CD1-CG 3.85Å; P567-W610 HydrophobicContact CG-CH2 3.87Å; P567-W610 HydrophobicContact CG-CZ2 3.46Å; P567-W610 VanDerWaalsContact CG-CZ2 3.46Å; P567-W610 WeakPolarHBondContact O-CH2 3.31Å; P567-L629 HydrophobicContact CB-CD1 3.67Å; P567-R630 CarbonylContact C-O 3.32Å; P567-R630 WeakPolarHBondContact CA-O 3.33Å; P567-M661 HydrophobicContact CB-CE 3.79Å; P567-M661 HydrophobicContact CB-SD 4.42Å; P567-M661 HydrophobicContact CG-CE 4.34Å
568	V	82.9	Confident	82.7	Confident	36 Å²	36	31.8 Å²	31.8	22%	0.218	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.5	172.2	-179.6	0	0	0	0	107.5	R630 R632	V568-R630 HydrophobicContact CB-CB 4.48Å; V568-R630 PolarHBondContact N-O 3.46Å; V568-R630 PolarHBondContact O-N 2.89Å; V568-R632 HydrophobicContact CG2-CB 4.45Å; V568-R632 HydrophobicContact CG2-CG 3.92Å
569	L	87.4	Confident	82.5	Confident	15 Å²	15	33.9 Å²	33.9	8%	0.079	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.5	-175.6	-58.8	171.5	0	0	0	109.4	L555 W596 W610 I627 Y628 L629	L555-L569 HydrophobicContact CD2-CD1 3.87Å; L555-L569 HydrophobicContact CD2-CD2 3.89Å; L569-W596 HydrophobicContact CB-CZ2 4.02Å; L569-W596 HydrophobicContact CD1-CD2 4.06Å; L569-W596 HydrophobicContact CD1-CE3 4.3Å; L569-W596 HydrophobicContact CD1-CH2 3.92Å; L569-W596 HydrophobicContact CD1-CZ2 3.66Å; L569-W596 HydrophobicContact CD1-CZ3 4.23Å; L569-W596 HydrophobicContact CG-CZ2 4.49Å; L569-W610 HydrophobicContact CD1-CD2 4.31Å; L569-W610 HydrophobicContact CD1-CE3 3.79Å; L569-W610 HydrophobicContact CD1-CZ3 4.31Å; L569-I627 HydrophobicContact CB-CG2 4.37Å; L569-I627 HydrophobicContact CD2-CG2 3.91Å; L569-Y628 WeakPolarHBondContact CA-O 3.28Å; L569-L629 HydrophobicContact CD2-CB 4.43Å; L569-L629 HydrophobicContact CD2-CD1 3.54Å
570	A	88.8	Confident	82.2	Confident	21 Å²	21	36.6 Å²	36.6	17%	0.174	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.1	169.7	0	0	0	0	0	109	Y572 F585 I627 Y628	A570-Y572 HydrophobicContact CB-CE2 4.29Å; A570-F585 HydrophobicContact CB-CE2 4.05Å; A570-I627 CarbonylContact O-C 3.54Å; A570-I627 WeakPolarHBondContact O-CA 3.44Å; A570-Y628 PolarHBondContact N-O 3.29Å; A570-Y628 PolarHBondContact O-N 3.37Å
571	V	91.1	Very high	82.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.6	-173	-174.3	0	0	0	0	109.7	L553 V573 M586 W596 V625 I627	L553-V571 HydrophobicContact CD1-CG1 3.92Å; L553-V571 HydrophobicContact CD1-CG2 4.38Å; V571-V573 HydrophobicContact CG1-CG2 4.05Å; V571-M586 HydrophobicContact CB-CB 4.14Å; V571-M586 HydrophobicContact CB-SD 4.48Å; V571-M586 HydrophobicContact CG1-SD 4.44Å; V571-M586 WeakPolarHBondContact O-CB 3.43Å; V571-M586 PolarHBondContact O-N 2.98Å; V571-W596 HydrophobicContact CG2-CZ2 3.86Å; V571-V625 HydrophobicContact CG1-CG1 3.65Å; V571-I627 HydrophobicContact CG1-CG1 4.47Å; V571-I627 HydrophobicContact CG2-CG1 4.36Å; V571-I627 HydrophobicContact CG2-CG2 4.43Å
572	Y	91.8	Very high	83	Confident	57 Å²	57	33.9 Å²	33.9	22%	0.224	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132	172.3	-65.2	-101.3	0	0	0	108.7	A570 H580 W584 F585 H626 Y628	A570-Y572 HydrophobicContact CB-CE2 4.29Å; Y572-H580 AromaticContact CG-NE2 3.83Å; Y572-W584 CarbonylContact C-O 3.58Å; Y572-W584 VanDerWaalsContact CA-O 3.23Å; Y572-W584 WeakPolarHBondContact CA-O 3.46Å; Y572-F585 HydrophobicContact CD1-CB 3.95Å; Y572-F585 HydrophobicContact CD1-CD2 4.2Å; Y572-F585 HydrophobicContact CD2-CD2 4.33Å; Y572-F585 HydrophobicContact CE1-CB 3.68Å; Y572-F585 AromaticContact CE1-CD2 3.7Å; Y572-F585 HydrophobicContact CE1-CD2 3.7Å; Y572-F585 HydrophobicContact CE1-CG 4.11Å; Y572-F585 AromaticContact CE2-CD2 3.85Å; Y572-F585 HydrophobicContact CE2-CD2 3.85Å; Y572-F585 HydrophobicContact CE2-CE2 4.35Å; Y572-F585 HydrophobicContact CG-CD2 4.49Å; Y572-F585 AromaticContact CZ-CD2 3.51Å; Y572-H626 PolarHBondContact N-O 2.87Å; Y572-H626 PolarHBondContact O-N 3.49Å; Y572-Y628 AromaticContact CD2-CD2 3.53Å; Y572-Y628 HydrophobicContact CD2-CD2 3.53Å; Y572-Y628 AromaticContact CD2-CE2 3.61Å; Y572-Y628 HydrophobicContact CD2-CE2 3.61Å; Y572-Y628 AromaticContact CE2-CD2 3.43Å; Y572-Y628 HydrophobicContact CE2-CD2 3.43Å; Y572-Y628 VanDerWaalsContact CE2-CD2 3.43Å; Y572-Y628 AromaticContact CE2-CE2 3.63Å; Y572-Y628 HydrophobicContact CE2-CE2 3.63Å; Y572-Y628 HydrophobicContact CG-CE2 4.5Å
573	V	91.4	Very high	84	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.2	-175.6	-178.4	0	0	0	0	109.2	V571 S583 W584 M586 F622 V625	V571-V573 HydrophobicContact CG1-CG2 4.05Å; V573-S583 WeakPolarHBondContact O-CA 3.45Å; V573-W584 HydrophobicContact CB-CZ2 4.24Å; V573-W584 HydrophobicContact CG2-CZ2 4.37Å; V573-W584 PolarHBondContact N-O 3.19Å; V573-W584 PolarHBondContact O-N 3.48Å; V573-W584 PolarHBondContact O-NE1 3.49Å; V573-M586 HydrophobicContact CG2-CE 4.13Å; V573-F622 HydrophobicContact CG1-CB 3.7Å; V573-V625 HydrophobicContact CG2-CG1 4.39Å; V573-V625 HydrophobicContact CG2-CG2 4.46Å
574	N	91.1	Very high	84.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	123	168.5	-165.9	-47.3	0	0	0	108.7	F576 G577 S579 E582 E623 T624	N574-F576 PolarHBondContact OD1-N 3.48Å; N574-G577 WeakPolarHBondContact OD1-CA 3.44Å; N574-G577 PolarHBondContact OD1-N 2.95Å; N574-S579 PolarHBondContact ND2-N 3.17Å; N574-S579 PolarHBondContact ND2-O 3.09Å; N574-E582 PolarHBondContact ND2-O 3.39Å; N574-E623 PolarHBondContact O-N 3.03Å; N574-T624 VanDerWaalsContact CB-OG1 3.25Å; N574-T624 WeakPolarHBondContact CB-OG1 3.42Å; N574-T624 PolarHBondContact N-O 2.84Å; N574-T624 PolarHBondContact O-N 3.2Å
575	P	89.2	Confident	85.6	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.006	17%	0.17	C	C	.	.	S	Bend	trans	-72.1	-32.8	-174.6	27.6	-35.2	0	0	0	114.6	F621 F622 E623 L723 L764	P575-F621 HydrophobicContact CB-CB 3.63Å; P575-F622 CarbonylContact O-C 3.48Å; P575-E623 PolarHBondContact O-N 3.41Å; P575-L723 HydrophobicContact CB-CD2 4.21Å; P575-L723 HydrophobicContact CG-CD2 3.8Å; P575-L764 HydrophobicContact CG-CD2 3.87Å
576	F	87.9	Confident	86.3	Confident	5 Å²	5	29 Å²	29	2%	0.022	17%	0.169	C	C	.	.	S	Bend	trans	-140.8	-15.9	-170.3	-60	-65.4	0	0	0	115.2	V547 N574 F621 L723 C726 L727 H730 R731	V547-F576 HydrophobicContact CG1-CD1 4.43Å; V547-F576 HydrophobicContact CG1-CE1 3.75Å; V547-F576 HydrophobicContact CG2-CE1 4.44Å; N574-F576 PolarHBondContact OD1-N 3.48Å; F576-F621 HydrophobicContact CE1-CB 4.29Å; F576-F621 AromaticContact CE1-CD1 3.99Å; F576-F621 HydrophobicContact CE1-CD1 3.99Å; F576-F621 HydrophobicContact CE1-CE1 4.41Å; F576-F621 HydrophobicContact CE1-CG 4.07Å; F576-F621 HydrophobicContact CZ-CB 4.03Å; F576-F621 AromaticContact CZ-CD1 3.99Å; F576-F621 HydrophobicContact CZ-CD1 3.99Å; F576-F621 AromaticContact CZ-CD2 3.85Å; F576-F621 HydrophobicContact CZ-CD2 3.85Å; F576-F621 HydrophobicContact CZ-CE1 4.35Å; F576-F621 HydrophobicContact CZ-CE2 4.23Å; F576-F621 AromaticContact CZ-CG 3.69Å; F576-F621 HydrophobicContact CZ-CG 3.69Å; F576-F621 HydrophobicContact CZ-CZ 4.46Å; F576-L723 HydrophobicContact CE2-CB 4.26Å; F576-L723 WeakPolarHBondContact CE2-O 3.18Å; F576-C726 HydrophobicContact CD2-CB 3.79Å; F576-C726 HydrophobicContact CE2-CB 4.45Å; F576-L727 HydrophobicContact CD2-CB 4.04Å; F576-L727 HydrophobicContact CE1-CB 4.32Å; F576-L727 HydrophobicContact CE1-CD1 3.99Å; F576-L727 HydrophobicContact CE1-CG 4.29Å; F576-L727 HydrophobicContact CE2-CB 3.78Å; F576-L727 HydrophobicContact CE2-CD1 4.49Å; F576-L727 HydrophobicContact CG-CB 4.43Å; F576-L727 HydrophobicContact CZ-CB 3.94Å; F576-L727 HydrophobicContact CZ-CD1 3.82Å; F576-L727 HydrophobicContact CZ-CG 4.25Å; F576-H730 HydrophobicContact CB-CB 3.99Å; F576-R731 HydrophobicContact CB-CG 4.28Å; F576-R731 HydrophobicContact CD1-CG 3.87Å; F576-R731 HydrophobicContact CG-CG 4.35Å
577	G	83.3	Confident	86.7	Confident	8 Å²	8	27.3 Å²	27.3	8%	0.082	16%	0.163	C	C	.	.	S	Bend	trans	-110.8	-162.8	-178.2	0	0	0	0	0	112.6	N574 E623 T624	N574-G577 WeakPolarHBondContact OD1-CA 3.44Å; N574-G577 PolarHBondContact OD1-N 2.95Å; G577-E623 WeakPolarHBondContact O-CB 3.26Å; G577-E623 WeakPolarHBondContact O-CG 3.31Å; G577-T624 PolarHBondContact O-OG1 3.29Å
578	G	79.4	Confident	86.8	Confident	40 Å²	40	28.4 Å²	28.4	41%	0.412	17%	0.17	S	C	.	.			trans	-129.1	7	174.6	0	0	0	0	0	114.4
579	S	82.7	Confident	86.4	Confident	48 Å²	48	32.3 Å²	32.3	34%	0.336	19%	0.189	S	C	.	.			trans	-84.8	132.9	-177.6	-172.6	0	0	0	0	110.9	N574 S581 E582 S583	N574-S579 PolarHBondContact ND2-N 3.17Å; N574-S579 PolarHBondContact ND2-O 3.09Å; S579-S581 VanDerWaalsContact C-N 3.27Å; S579-S581 PolarHBondContact O-N 3.39Å; S579-S581 PolarHBondContact OG-N 3.22Å; S579-S581 PolarHBondContact OG-OG 3.15Å; S579-E582 PolarHBondContact O-N 3.34Å; S579-S583 PolarHBondContact O-OG 2.75Å
580	H	81.2	Confident	86	Confident	69 Å²	69	36.7 Å²	36.7	32%	0.319	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-63.6	-33.5	171.8	-177.6	-91.7	0	0	0	112.2	Y572 E582 S583 Y628	Y572-H580 AromaticContact CG-NE2 3.83Å; H580-E582 PolarHBondContact O-N 2.85Å; H580-S583 WeakPolarHBondContact O-CB 3.36Å; H580-S583 PolarHBondContact O-N 3.47Å; H580-S583 PolarHBondContact O-OG 2.88Å; H580-Y628 AromaticContact CD2-CE2 3.87Å; H580-Y628 AromaticContact CD2-CZ 3.99Å; H580-Y628 PolarHBondContact CD2-OH 2.89Å; H580-Y628 VanDerWaalsContact CD2-OH 3.29Å; H580-Y628 AromaticContact CE1-CE2 3.98Å; H580-Y628 PolarHBondContact CE1-OH 3Å; H580-Y628 VanDerWaalsContact CE1-OH 3.25Å; H580-Y628 AromaticContact NE2-CE2 3.2Å; H580-Y628 WeakPolarHBondContact NE2-CE2 3.37Å; H580-Y628 AromaticContact NE2-CZ 3.55Å; H580-Y628 PolarHBondContact NE2-OH 3Å
581	S	83.3	Confident	84.9	Confident	102 Å²	102	42.8 Å²	42.8	71%	0.713	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-68.5	-23.3	-178.5	62.3	0	0	0	0	113.8	S579	S579-S581 VanDerWaalsContact C-N 3.27Å; S579-S581 PolarHBondContact O-N 3.39Å; S579-S581 PolarHBondContact OG-N 3.22Å; S579-S581 PolarHBondContact OG-OG 3.15Å
582	E	86.6	Confident	84.1	Confident	17 Å²	17	47.1 Å²	47.1	8%	0.079	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-103.9	21.4	178.9	-58.5	179.5	143.1	0	0	111.2	N574 S579 H580 H730	N574-E582 PolarHBondContact ND2-O 3.39Å; S579-E582 PolarHBondContact O-N 3.34Å; H580-E582 PolarHBondContact O-N 2.85Å; E582-H730 IonicContact OE1-NE2 2.65Å; E582-H730 IonicContact OE2-CD2 3.52Å; E582-H730 IonicContact OE2-CE1 3.3Å; E582-H730 PolarHBondContact OE2-CE1 3.48Å; E582-H730 IonicContact OE2-NE2 3.26Å; E582-H730 PolarHBondContact OE2-NE2 2.98Å
583	S	88.6	Confident	83.7	Confident	15 Å²	15	45 Å²	45	11%	0.105	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-99.4	140.3	177.3	-56.8	0	0	0	0	110.3	V573 S579 H580 H626	V573-S583 WeakPolarHBondContact O-CA 3.45Å; S579-S583 PolarHBondContact O-OG 2.75Å; H580-S583 WeakPolarHBondContact O-CB 3.36Å; H580-S583 PolarHBondContact O-N 3.47Å; H580-S583 PolarHBondContact O-OG 2.88Å; S583-H626 PolarHBondContact OG-CD2 2.7Å
584	W	88.9	Confident	83.4	Confident	20 Å²	20	46.3 Å²	46.3	8%	0.076	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	150.4	172.8	71	-85.9	0	0	0	110.3	Y572 V573 M586 T620 P715 L721 L764	Y572-W584 CarbonylContact C-O 3.58Å; Y572-W584 VanDerWaalsContact CA-O 3.23Å; Y572-W584 WeakPolarHBondContact CA-O 3.46Å; V573-W584 HydrophobicContact CB-CZ2 4.24Å; V573-W584 HydrophobicContact CG2-CZ2 4.37Å; V573-W584 PolarHBondContact N-O 3.19Å; V573-W584 PolarHBondContact O-N 3.48Å; V573-W584 PolarHBondContact O-NE1 3.49Å; W584-M586 HydrophobicContact CH2-CB 4.08Å; W584-M586 HydrophobicContact CH2-CE 3.73Å; W584-M586 HydrophobicContact CH2-CG 4.04Å; W584-M586 HydrophobicContact CZ2-CE 3.93Å; W584-M586 HydrophobicContact CZ3-CB 4.08Å; W584-M586 HydrophobicContact CZ3-CG 4.34Å; W584-T620 HydrophobicContact CZ2-CG2 4.03Å; W584-P715 HydrophobicContact CD2-CB 3.65Å; W584-P715 HydrophobicContact CD2-CG 3.52Å; W584-P715 HydrophobicContact CE3-CB 3.49Å; W584-P715 VanDerWaalsContact CE3-CB 3.49Å; W584-P715 HydrophobicContact CE3-CG 3.74Å; W584-P715 HydrophobicContact CG-CB 4.49Å; W584-P715 HydrophobicContact CG-CG 3.85Å; W584-P715 HydrophobicContact CH2-CB 3.5Å; W584-P715 VanDerWaalsContact CH2-CB 3.5Å; W584-P715 HydrophobicContact CH2-CG 4.45Å; W584-P715 HydrophobicContact CZ2-CB 3.63Å; W584-P715 HydrophobicContact CZ2-CG 4.25Å; W584-P715 HydrophobicContact CZ3-CB 3.4Å; W584-P715 HydrophobicContact CZ3-CG 4.18Å; W584-L721 HydrophobicContact CB-CD1 3.78Å; W584-L721 HydrophobicContact CG-CD1 4.07Å; W584-L764 HydrophobicContact CB-CD1 4.21Å
585	F	88.8	Confident	83.1	Confident	92 Å²	92	50 Å²	50	40%	0.404	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	127.3	-180	174.5	-108.8	0	0	0	111	A570 Y572 P587	A570-F585 HydrophobicContact CB-CE2 4.05Å; Y572-F585 HydrophobicContact CD1-CB 3.95Å; Y572-F585 HydrophobicContact CD1-CD2 4.2Å; Y572-F585 HydrophobicContact CD2-CD2 4.33Å; Y572-F585 HydrophobicContact CE1-CB 3.68Å; Y572-F585 AromaticContact CE1-CD2 3.7Å; Y572-F585 HydrophobicContact CE1-CD2 3.7Å; Y572-F585 HydrophobicContact CE1-CG 4.11Å; Y572-F585 AromaticContact CE2-CD2 3.85Å; Y572-F585 HydrophobicContact CE2-CD2 3.85Å; Y572-F585 HydrophobicContact CE2-CE2 4.35Å; Y572-F585 HydrophobicContact CG-CD2 4.49Å; Y572-F585 AromaticContact CZ-CD2 3.51Å; F585-P587 WeakPolarHBondContact O-CD 3.41Å
586	M	89.4	Confident	83.1	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.293	C	S	.	.			trans	-81.7	114.9	177	-171.5	172.1	-85.7	0	0	110.6	V571 V573 W584 V588 F593 L612 L614	V571-M586 HydrophobicContact CB-CB 4.14Å; V571-M586 HydrophobicContact CB-SD 4.48Å; V571-M586 HydrophobicContact CG1-SD 4.44Å; V571-M586 WeakPolarHBondContact O-CB 3.43Å; V571-M586 PolarHBondContact O-N 2.98Å; V573-M586 HydrophobicContact CG2-CE 4.13Å; W584-M586 HydrophobicContact CH2-CB 4.08Å; W584-M586 HydrophobicContact CH2-CE 3.73Å; W584-M586 HydrophobicContact CH2-CG 4.04Å; W584-M586 HydrophobicContact CZ2-CE 3.93Å; W584-M586 HydrophobicContact CZ3-CB 4.08Å; W584-M586 HydrophobicContact CZ3-CG 4.34Å; M586-V588 HydrophobicContact CG-CG2 4.08Å; M586-V588 PolarHBondContact O-N 3.5Å; M586-V588 HydrophobicContact SD-CG2 4.5Å; M586-F593 HydrophobicContact CE-CZ 4.11Å; M586-F593 HydrophobicContact CG-CD1 4.37Å; M586-F593 HydrophobicContact CG-CE1 3.33Å; M586-F593 HydrophobicContact CG-CZ 3.44Å; M586-F593 VanDerWaalsContact CG-CZ 3.44Å; M586-F593 HydrophobicContact SD-CE1 3.8Å; M586-F593 HydrophobicContact SD-CZ 3.93Å; M586-L612 HydrophobicContact SD-CD2 3.6Å; M586-L612 VanDerWaalsContact SD-CD2 3.6Å; M586-L614 HydrophobicContact CE-CD1 3.7Å; M586-L614 HydrophobicContact CE-CD2 4.03Å; M586-L614 HydrophobicContact SD-CD2 4.05Å
587	P	86.3	Confident	83	Confident	23 Å²	23	55 Å²	55	15%	0.149	31%	0.312	C	S	.	.			trans	-83.3	66.3	-172.7	36.8	-37.2	0	0	0	111	F585 N589 E590 F593	F585-P587 WeakPolarHBondContact O-CD 3.41Å; P587-N589 PolarHBondContact O-N 2.93Å; P587-E590 HydrophobicContact CB-CB 4.17Å; P587-E590 PolarHBondContact O-N 2.98Å; P587-F593 HydrophobicContact CG-CD2 4.23Å; P587-F593 HydrophobicContact CG-CG 4.3Å; P587-F593 VanDerWaalsContact O-CB 3.3Å; P587-F593 WeakPolarHBondContact O-CB 3.3Å
588	V	82.3	Confident	83.1	Confident	28 Å²	28	60.8 Å²	60.8	17%	0.17	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	129.8	179.6	-175.9	0	0	0	0	109.8	M586 E590 L612	M586-V588 HydrophobicContact CG-CG2 4.08Å; M586-V588 PolarHBondContact O-N 3.5Å; M586-V588 HydrophobicContact SD-CG2 4.5Å; V588-E590 VanDerWaalsContact C-N 3.32Å; V588-E590 PolarHBondContact O-N 3.04Å; V588-L612 HydrophobicContact CG1-CD1 4.28Å; V588-L612 HydrophobicContact CG2-CD2 4.28Å
589	N	75.4	Confident	83.4	Confident	117 Å²	117	62.3 Å²	62.3	63%	0.626	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	16.6	-178	-162.1	25.5	0	0	0	116.1	P587 D595	P587-N589 PolarHBondContact O-N 2.93Å; N589-D595 HydrophobicContact CB-CB 4.26Å
590	E	77.8	Confident	83.3	Confident	108 Å²	108	66.4 Å²	66.4	51%	0.505	35%	0.345	S	S	.	.	S	Bend	trans	-114.9	147.4	173.3	-61.8	179.3	180	0	0	111.3	P587 V588 S592 F593	P587-E590 HydrophobicContact CB-CB 4.17Å; P587-E590 PolarHBondContact O-N 2.98Å; V588-E590 VanDerWaalsContact C-N 3.32Å; V588-E590 PolarHBondContact O-N 3.04Å; E590-S592 PolarHBondContact O-N 3.1Å; E590-F593 WeakPolarHBondContact O-CB 3.26Å; E590-F593 PolarHBondContact O-N 3.12Å
591	N	65.8	Low	83.3	Confident	148 Å²	148	65.2 Å²	65.2	79%	0.791	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	47.7	167.6	-61.4	-30.8	0	0	0	116	F593	N591-F593 PolarHBondContact O-N 3.49Å
592	S	75.6	Confident	82.1	Confident	92 Å²	92	67.9 Å²	67.9	64%	0.643	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	12.7	-177.4	77	0	0	0	0	115.9	E590	E590-S592 PolarHBondContact O-N 3.1Å
593	F	83.1	Confident	80.9	Confident	12 Å²	12	72 Å²	72	5%	0.053	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-74.9	144.6	174	-156.1	-91.4	0	0	0	111.1	M586 P587 E590 N591 L614 W618 P716	M586-F593 HydrophobicContact CE-CZ 4.11Å; M586-F593 HydrophobicContact CG-CD1 4.37Å; M586-F593 HydrophobicContact CG-CE1 3.33Å; M586-F593 HydrophobicContact CG-CZ 3.44Å; M586-F593 VanDerWaalsContact CG-CZ 3.44Å; M586-F593 HydrophobicContact SD-CE1 3.8Å; M586-F593 HydrophobicContact SD-CZ 3.93Å; P587-F593 HydrophobicContact CG-CD2 4.23Å; P587-F593 HydrophobicContact CG-CG 4.3Å; P587-F593 VanDerWaalsContact O-CB 3.3Å; P587-F593 WeakPolarHBondContact O-CB 3.3Å; E590-F593 WeakPolarHBondContact O-CB 3.26Å; E590-F593 PolarHBondContact O-N 3.12Å; N591-F593 PolarHBondContact O-N 3.49Å; F593-L614 HydrophobicContact CE1-CD2 3.65Å; F593-L614 HydrophobicContact CZ-CD2 3.52Å; F593-W618 HydrophobicContact CD2-CD2 4.02Å; F593-W618 HydrophobicContact CD2-CE3 4.28Å; F593-W618 HydrophobicContact CD2-CG 4.27Å; F593-W618 HydrophobicContact CE2-CB 4.01Å; F593-W618 HydrophobicContact CE2-CD2 4.12Å; F593-W618 HydrophobicContact CE2-CE3 4.34Å; F593-W618 HydrophobicContact CE2-CG 4.06Å; F593-W618 HydrophobicContact CZ-CB 4.43Å; F593-P716 HydrophobicContact CD2-CG 3.92Å; F593-P716 HydrophobicContact CE2-CG 3.84Å
594	P	84.8	Confident	79.6	Confident	27 Å²	27	75.9 Å²	75.9	18%	0.175	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-61.1	146	-178.1	-24.3	35.9	0	0	0	113	L612 T613 W618	P594-L612 HydrophobicContact CB-CD1 4.16Å; P594-L612 WeakPolarHBondContact O-CD1 3.25Å; P594-T613 WeakPolarHBondContact CB-O 3.43Å; P594-T613 WeakPolarHBondContact CG-O 3.25Å; P594-W618 VanDerWaalsContact CD-CD1 3.47Å
595	D	85.6	Confident	78.5	Confident	78 Å²	78	78.1 Å²	78.1	42%	0.417	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-103.6	168	173.3	-165.4	16.8	0	0	0	111.3	N589 E597	N589-D595 HydrophobicContact CB-CB 4.26Å; D595-E597 PolarHBondContact O-N 2.9Å
596	W	87.5	Confident	77.9	Confident	22 Å²	22	76.7 Å²	76.7	8%	0.083	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-71.2	116.6	177.1	-70.1	97.8	0	0	0	112	L553 L569 V571 W610 L612	L553-W596 HydrophobicContact CB-CH2 4.16Å; L553-W596 HydrophobicContact CB-CZ3 4.47Å; L569-W596 HydrophobicContact CB-CZ2 4.02Å; L569-W596 HydrophobicContact CD1-CD2 4.06Å; L569-W596 HydrophobicContact CD1-CE3 4.3Å; L569-W596 HydrophobicContact CD1-CH2 3.92Å; L569-W596 HydrophobicContact CD1-CZ2 3.66Å; L569-W596 HydrophobicContact CD1-CZ3 4.23Å; L569-W596 HydrophobicContact CG-CZ2 4.49Å; V571-W596 HydrophobicContact CG2-CZ2 3.86Å; W596-W610 HydrophobicContact CB-CE3 3.76Å; W596-W610 HydrophobicContact CB-CZ3 4.18Å; W596-W610 HydrophobicContact CD2-CE3 4.1Å; W596-W610 HydrophobicContact CE3-CB 3.74Å; W596-W610 HydrophobicContact CE3-CE3 4.33Å; W596-W610 AromaticContact CG-CE3 3.86Å; W596-W610 HydrophobicContact CG-CE3 3.86Å; W596-W610 HydrophobicContact CG-CZ3 4.31Å; W596-W610 HydrophobicContact CZ3-CB 4.07Å; W596-L612 HydrophobicContact CD2-CB 4.14Å; W596-L612 HydrophobicContact CE3-CB 3.79Å; W596-L612 HydrophobicContact CH2-CB 4.04Å; W596-L612 HydrophobicContact CZ2-CB 4.35Å; W596-L612 HydrophobicContact CZ2-CD2 4.25Å; W596-L612 HydrophobicContact CZ3-CB 3.75Å
597	E	86.6	Confident	77.8	Confident	88 Å²	88	76.8 Å²	76.8	41%	0.411	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	125.9	169.2	-66.5	-177.4	175.1	0	0	109.9	D595 W610 T611	D595-E597 PolarHBondContact O-N 2.9Å; E597-W610 WeakPolarHBondContact O-CA 3.28Å; E597-T611 PolarHBondContact N-O 3.08Å; E597-T611 PolarHBondContact O-N 3.23Å; E597-T611 PolarHBondContact O-OG1 3.18Å
598	R	86.5	Confident	77.8	Confident	130 Å²	130	78.8 Å²	78.8	49%	0.491	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	113.3	-178.6	-57.5	178.5	-168.1	-179.3	-0.8	110	E566 N609 W610	E566-R598 IonicContact OE1-CZ 3.36Å; E566-R598 IonicContact OE1-NH1 2.77Å; E566-R598 PolarHBondContact OE1-NH1 3.04Å; E566-R598 IonicContact OE1-NH2 2.99Å; E566-R598 PolarHBondContact OE1-NH2 2.8Å; R598-N609 WeakPolarHBondContact CA-O 3.33Å; R598-W610 HydrophobicContact CG-CD2 4.1Å; R598-W610 HydrophobicContact CG-CE3 4.26Å; R598-W610 HydrophobicContact CG-CH2 4.43Å; R598-W610 HydrophobicContact CG-CZ2 4.19Å; R598-W610 HydrophobicContact CG-CZ3 4.44Å; R598-W610 VanDerWaalsContact NH2-CH2 3.26Å
599	T	84.2	Confident	78.1	Confident	72 Å²	72	79.3 Å²	79.3	44%	0.442	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.3	174.8	52.1	0	0	0	0	110.5	Y608 N609	T599-Y608 CarbonylContact O-C 3.53Å; T599-Y608 VanDerWaalsContact O-CA 3.3Å; T599-Y608 WeakPolarHBondContact O-CA 3.19Å; T599-N609 PolarHBondContact N-O 2.88Å; T599-N609 PolarHBondContact O-N 3.1Å; T599-N609 WeakPolarHBondContact OG1-CB 3.31Å
600	K	81.3	Confident	78.7	Confident	135 Å²	135	74.1 Å²	74.1	59%	0.587	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	134.4	-179.3	-170.6	-176.7	176.6	-167.6	0	109.9	Y608	K600-Y608 HydrophobicContact CB-CD1 3.98Å; K600-Y608 HydrophobicContact CB-CE1 3.81Å; K600-Y608 HydrophobicContact CD-CE1 4.36Å; K600-Y608 HydrophobicContact CG-CD1 4.27Å; K600-Y608 HydrophobicContact CG-CE1 3.85Å
601	L	80.3	Confident	79.2	Confident	44 Å²	44	70.1 Å²	70.1	23%	0.23	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	133.1	173.8	-65	169.1	0	0	0	110	Q556 L603 C607	Q556-L601 HydrophobicContact CG-CD1 4.03Å; L601-L603 VanDerWaalsContact C-N 3.29Å; L601-L603 PolarHBondContact O-N 3.42Å; L601-C607 HydrophobicContact CB-CB 4.2Å; L601-C607 HydrophobicContact CD1-CB 4.24Å; L601-C607 PolarHBondContact N-O 2.87Å
602	D	59.3	Low	80.3	Confident	158 Å²	158	63.2 Å²	63.2	85%	0.845	33%	0.326	S	S	*	.			trans	-75.5	79.6	178.9	-75.1	-30.2	0	0	0	111.1
603	L	61	Low	80.9	Confident	102 Å²	102	60.4 Å²	60.4	53%	0.534	31%	0.306	S	S	.	.	S	Bend	trans	-131.2	160.1	172.4	-76.2	164.8	0	0	0	108.7	L601 L605	L601-L603 VanDerWaalsContact C-N 3.29Å; L601-L603 PolarHBondContact O-N 3.42Å; L603-L605 PolarHBondContact O-N 3.3Å; L603-L605 VanDerWaalsContact O-O 3.07Å
604	P	60.6	Low	80.9	Confident	97 Å²	97	60.1 Å²	60.1	63%	0.63	30%	0.304	S	S	*	.	S	Bend	trans	-61	-11.3	176.9	23.8	-33.9	0	0	0	113.5	K561	K561-P604 WeakPolarHBondContact CE-O 3.45Å
605	L	66.3	Low	80.7	Confident	67 Å²	67	59.7 Å²	59.7	35%	0.351	31%	0.305	S	S	.	.	S	Bend	trans	-101.2	152.6	175.8	-65.4	160.3	0	0	0	110	W524 L603 C607	W524-L605 HydrophobicContact CH2-CD1 4.38Å; W524-L605 HydrophobicContact CH2-CD2 4.02Å; W524-L605 HydrophobicContact CZ2-CD1 3.83Å; W524-L605 HydrophobicContact CZ2-CD2 3.94Å; W524-L605 HydrophobicContact CZ2-CG 4.48Å; L603-L605 PolarHBondContact O-N 3.3Å; L603-L605 VanDerWaalsContact O-O 3.07Å; L605-C607 PolarHBondContact O-N 3.3Å
606	Q	77.1	Confident	80.4	Confident	62 Å²	62	58.1 Å²	58.1	29%	0.29	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	76.7	173.5	-70	-172.7	2	0	0	109.6	L559 Y608	L559-Q606 HydrophobicContact CB-CB 4.35Å; L559-Q606 PolarHBondContact N-O 3Å; L559-Q606 PolarHBondContact O-N 3.38Å; Q606-Y608 HydrophobicContact CB-CE2 4Å
607	C	86.3	Confident	80	Confident	2 Å²	2	64 Å²	64	1%	0.014	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	132.7	177.2	-65	0	0	0	0	111	I557 C558 L601 L605	I557-C607 WeakPolarHBondContact O-CA 3.33Å; C558-C607 HydrophobicContact CB-CB 4.13Å; C558-C607 WeakPolarHBondContact CB-SG 3.14Å; C558-C607 WeakPolarHBondContact SG-CB 3.49Å; C558-C607 CovalentContact SG-SG 2.04Å; C558-C607 PolarHBondContact SG-SG 2.96Å; L601-C607 HydrophobicContact CB-CB 4.2Å; L601-C607 HydrophobicContact CD1-CB 4.24Å; L601-C607 PolarHBondContact N-O 2.87Å; L605-C607 PolarHBondContact O-N 3.3Å
608	Y	86.6	Confident	79.9	Confident	65 Å²	65	61.7 Å²	61.7	26%	0.255	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136.4	178.6	-61.6	-87	0	0	0	109.9	I557 T599 K600 Q606	I557-Y608 PolarHBondContact N-O 3.31Å; I557-Y608 PolarHBondContact O-N 3.06Å; T599-Y608 CarbonylContact O-C 3.53Å; T599-Y608 VanDerWaalsContact O-CA 3.3Å; T599-Y608 WeakPolarHBondContact O-CA 3.19Å; K600-Y608 HydrophobicContact CB-CD1 3.98Å; K600-Y608 HydrophobicContact CB-CE1 3.81Å; K600-Y608 HydrophobicContact CD-CE1 4.36Å; K600-Y608 HydrophobicContact CG-CD1 4.27Å; K600-Y608 HydrophobicContact CG-CE1 3.85Å; Q606-Y608 HydrophobicContact CB-CE2 4Å
609	N	88.3	Confident	80	Confident	39 Å²	39	57.3 Å²	57.3	21%	0.209	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.1	163.5	-80.4	-11.7	0	0	0	108.4	Q556 R598 T599	Q556-N609 WeakPolarHBondContact CB-OD1 3.13Å; Q556-N609 VanDerWaalsContact CG-OD1 3.27Å; Q556-N609 WeakPolarHBondContact CG-OD1 3.28Å; R598-N609 WeakPolarHBondContact CA-O 3.33Å; T599-N609 PolarHBondContact N-O 2.88Å; T599-N609 PolarHBondContact O-N 3.1Å; T599-N609 WeakPolarHBondContact OG1-CB 3.31Å
610	W	89.1	Confident	80.2	Confident	9 Å²	9	54 Å²	54	3%	0.034	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.9	176.7	-70.5	64.8	0	0	0	107.4	S554 L555 I557 P567 L569 W596 E597 R598	S554-W610 CarbonylContact C-O 3.55Å; S554-W610 VanDerWaalsContact CA-O 3.28Å; S554-W610 WeakPolarHBondContact CA-O 3.37Å; L555-W610 HydrophobicContact CB-CB 4.32Å; L555-W610 PolarHBondContact N-O 2.87Å; L555-W610 WeakPolarHBondContact O-CB 3.44Å; L555-W610 PolarHBondContact O-N 3.48Å; I557-W610 HydrophobicContact CD1-CD2 4.42Å; I557-W610 HydrophobicContact CD1-CG 4.35Å; P567-W610 HydrophobicContact CG-CH2 3.87Å; P567-W610 HydrophobicContact CG-CZ2 3.46Å; P567-W610 VanDerWaalsContact CG-CZ2 3.46Å; P567-W610 WeakPolarHBondContact O-CH2 3.31Å; L569-W610 HydrophobicContact CD1-CD2 4.31Å; L569-W610 HydrophobicContact CD1-CE3 3.79Å; L569-W610 HydrophobicContact CD1-CZ3 4.31Å; W596-W610 HydrophobicContact CB-CE3 3.76Å; W596-W610 HydrophobicContact CB-CZ3 4.18Å; W596-W610 HydrophobicContact CD2-CE3 4.1Å; W596-W610 HydrophobicContact CE3-CB 3.74Å; W596-W610 HydrophobicContact CE3-CE3 4.33Å; W596-W610 AromaticContact CG-CE3 3.86Å; W596-W610 HydrophobicContact CG-CE3 3.86Å; W596-W610 HydrophobicContact CG-CZ3 4.31Å; W596-W610 HydrophobicContact CZ3-CB 4.07Å; E597-W610 WeakPolarHBondContact O-CA 3.28Å; R598-W610 HydrophobicContact CG-CD2 4.1Å; R598-W610 HydrophobicContact CG-CE3 4.26Å; R598-W610 HydrophobicContact CG-CH2 4.43Å; R598-W610 HydrophobicContact CG-CZ2 4.19Å; R598-W610 HydrophobicContact CG-CZ3 4.44Å; R598-W610 VanDerWaalsContact NH2-CH2 3.26Å
611	T	88.2	Confident	80.6	Confident	24 Å²	24	47.6 Å²	47.6	15%	0.147	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.6	-178.3	48.2	0	0	0	0	110.4	L553 E597	L553-T611 CarbonylContact O-C 3.51Å; L553-T611 WeakPolarHBondContact O-CA 3.5Å; E597-T611 PolarHBondContact N-O 3.08Å; E597-T611 PolarHBondContact O-N 3.23Å; E597-T611 PolarHBondContact O-OG1 3.18Å
612	L	88.9	Confident	81.1	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	115.3	174.4	-178.5	68.5	0	0	0	108.7	G552 L553 M586 V588 P594 W596 L614	G552-L612 CarbonylContact C-O 3.57Å; G552-L612 WeakPolarHBondContact CA-O 3.21Å; L553-L612 HydrophobicContact CB-CB 4.39Å; L553-L612 HydrophobicContact CD1-CD2 4.5Å; L553-L612 PolarHBondContact N-O 3.27Å; L553-L612 PolarHBondContact O-N 3Å; M586-L612 HydrophobicContact SD-CD2 3.6Å; M586-L612 VanDerWaalsContact SD-CD2 3.6Å; V588-L612 HydrophobicContact CG1-CD1 4.28Å; V588-L612 HydrophobicContact CG2-CD2 4.28Å; P594-L612 HydrophobicContact CB-CD1 4.16Å; P594-L612 WeakPolarHBondContact O-CD1 3.25Å; W596-L612 HydrophobicContact CD2-CB 4.14Å; W596-L612 HydrophobicContact CE3-CB 3.79Å; W596-L612 HydrophobicContact CH2-CB 4.04Å; W596-L612 HydrophobicContact CZ2-CB 4.35Å; W596-L612 HydrophobicContact CZ2-CD2 4.25Å; W596-L612 HydrophobicContact CZ3-CB 3.75Å; L612-L614 HydrophobicContact CD2-CD2 4.3Å; L612-L614 HydrophobicContact CG-CD2 4.27Å
613	T	86.7	Confident	82.6	Confident	34 Å²	34	38.7 Å²	38.7	21%	0.209	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	111.1	-177.4	57.5	0	0	0	0	111.1	L501 P594	L501-T613 HydrophobicContact CB-CG2 4.26Å; L501-T613 HydrophobicContact CD1-CG2 4.39Å; P594-T613 WeakPolarHBondContact CB-O 3.43Å; P594-T613 WeakPolarHBondContact CG-O 3.25Å
614	L	84.8	Confident	84	Confident	5 Å²	5	34 Å²	34	3%	0.026	17%	0.174	C	C	.	.			trans	-87.5	-37.7	-177.2	-58.7	175.3	0	0	0	112.7	I550 L551 M586 F593 L612 W618	I550-L614 HydrophobicContact CG1-CD1 4.3Å; I550-L614 HydrophobicContact CG2-CD1 3.99Å; L551-L614 VanDerWaalsContact O-CB 3.3Å; L551-L614 WeakPolarHBondContact O-CB 3.47Å; L551-L614 PolarHBondContact O-N 3.48Å; M586-L614 HydrophobicContact CE-CD1 3.7Å; M586-L614 HydrophobicContact CE-CD2 4.03Å; M586-L614 HydrophobicContact SD-CD2 4.05Å; F593-L614 HydrophobicContact CE1-CD2 3.65Å; F593-L614 HydrophobicContact CZ-CD2 3.52Å; L612-L614 HydrophobicContact CD2-CD2 4.3Å; L612-L614 HydrophobicContact CG-CD2 4.27Å; L614-W618 HydrophobicContact CB-CB 4.04Å; L614-W618 HydrophobicContact CD2-CB 4.38Å; L614-W618 VanDerWaalsContact O-CD1 3.23Å
615	G	79.4	Confident	85.5	Confident	18 Å²	18	29.3 Å²	29.3	19%	0.186	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	-168.9	-176.5	0	0	0	0	0	113.7	L551 K617 K619	L551-G615 PolarHBondContact O-N 3.24Å; G615-K617 VanDerWaalsContact C-N 3.3Å; G615-K617 PolarHBondContact O-N 3.39Å; G615-K619 PolarHBondContact O-N 3.04Å
616	N	79.7	Confident	86.7	Confident	45 Å²	45	26.5 Å²	26.5	24%	0.241	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-22.3	-177	-80.7	-50.6	0	0	0	112	L492 D494 M497 K619	L492-N616 PolarHBondContact O-ND2 3.01Å; D494-N616 WeakPolarHBondContact OD1-CB 3.47Å; D494-N616 VanDerWaalsContact OD1-CG 3.3Å; D494-N616 PolarHBondContact OD1-N 2.85Å; D494-N616 PolarHBondContact OD1-ND2 3.16Å; M497-N616 HydrophobicContact CE-CB 4.04Å; M497-N616 VanDerWaalsContact CE-CG 3.46Å; M497-N616 VanDerWaalsContact CE-ND2 3.33Å; M497-N616 WeakPolarHBondContact CE-ND2 3.27Å; N616-K619 WeakPolarHBondContact O-CG 3.4Å; N616-K619 PolarHBondContact OD1-NZ 3.25Å
617	K	80.1	Confident	87.4	Confident	145 Å²	145	23.6 Å²	23.6	63%	0.63	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-36.9	179.1	-172.3	-179.2	176.9	-171.4	0	112.5	G615	G615-K617 VanDerWaalsContact C-N 3.3Å; G615-K617 PolarHBondContact O-N 3.39Å
618	W	84.2	Confident	87.5	Confident	40 Å²	40	25.3 Å²	25.3	15%	0.152	12%	0.122	C	C	.	.	S	Bend	trans	-117.2	17.8	-172.7	-50.6	120.3	0	0	0	113.3	F593 P594 L614 P716	F593-W618 HydrophobicContact CD2-CD2 4.02Å; F593-W618 HydrophobicContact CD2-CE3 4.28Å; F593-W618 HydrophobicContact CD2-CG 4.27Å; F593-W618 HydrophobicContact CE2-CB 4.01Å; F593-W618 HydrophobicContact CE2-CD2 4.12Å; F593-W618 HydrophobicContact CE2-CE3 4.34Å; F593-W618 HydrophobicContact CE2-CG 4.06Å; F593-W618 HydrophobicContact CZ-CB 4.43Å; P594-W618 VanDerWaalsContact CD-CD1 3.47Å; L614-W618 HydrophobicContact CB-CB 4.04Å; L614-W618 HydrophobicContact CD2-CB 4.38Å; L614-W618 VanDerWaalsContact O-CD1 3.23Å; W618-P716 HydrophobicContact CE3-CB 4.02Å; W618-P716 HydrophobicContact CE3-CG 3.61Å; W618-P716 HydrophobicContact CH2-CB 4.37Å; W618-P716 HydrophobicContact CZ3-CB 3.51Å; W618-P716 HydrophobicContact CZ3-CG 3.6Å
619	K	87.1	Confident	87.4	Confident	38 Å²	38	22.5 Å²	22.5	17%	0.165	11%	0.111	C	C	.	.			trans	-70.2	137.8	178.9	70.4	-178.4	173.2	-175.5	0	111.2	M549 I550 L551 G615 N616 Y671 L713	M549-K619 HydrophobicContact CE-CB 3.9Å; M549-K619 HydrophobicContact CE-CD 4.02Å; M549-K619 HydrophobicContact CE-CG 3.64Å; I550-K619 WeakPolarHBondContact O-CA 3.39Å; L551-K619 HydrophobicContact CD2-CB 3.71Å; L551-K619 HydrophobicContact CD2-CD 4.22Å; G615-K619 PolarHBondContact O-N 3.04Å; N616-K619 WeakPolarHBondContact O-CG 3.4Å; N616-K619 PolarHBondContact OD1-NZ 3.25Å; K619-Y671 HydrophobicContact CD-CE1 4.36Å; K619-Y671 PolarHBondContact NZ-OH 2.89Å; K619-Y671 VanDerWaalsContact NZ-OH 3.13Å; K619-L713 HydrophobicContact CG-CD2 4.48Å
620	T	89.3	Confident	87.1	Confident	2 Å²	2	23 Å²	23	1%	0.012	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	163.9	178.8	65.8	0	0	0	0	111	M549 I550 W584 P715	M549-T620 WeakPolarHBondContact CA-O 3.27Å; M549-T620 VanDerWaalsContact CE-C 3.43Å; M549-T620 VanDerWaalsContact SD-C 3.56Å; I550-T620 WeakPolarHBondContact CG2-O 3.37Å; I550-T620 PolarHBondContact N-O 3.37Å; W584-T620 HydrophobicContact CZ2-CG2 4.03Å; T620-P715 HydrophobicContact CG2-CB 4.03Å
621	F	90.4	Very high	86.3	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.009	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	145.8	169.9	-70.5	-72.6	0	0	0	111.6	F488 V547 H548 M549 P575 F576 M673 V710 L713 L723	F488-F621 HydrophobicContact CE1-CZ 4.36Å; V547-F621 HydrophobicContact CB-CE1 4.46Å; V547-F621 HydrophobicContact CG1-CD1 3.21Å; V547-F621 HydrophobicContact CG1-CE1 3.34Å; V547-F621 HydrophobicContact CG1-CG 4.39Å; H548-F621 WeakPolarHBondContact O-CA 3.19Å; M549-F621 HydrophobicContact SD-CB 4.41Å; M549-F621 HydrophobicContact SD-CD1 3.47Å; M549-F621 WeakPolarHBondContact SD-CD1 3.13Å; M549-F621 HydrophobicContact SD-CD2 4.26Å; M549-F621 HydrophobicContact SD-CE1 3.73Å; M549-F621 HydrophobicContact SD-CE2 4.46Å; M549-F621 HydrophobicContact SD-CG 3.8Å; M549-F621 HydrophobicContact SD-CZ 4.23Å; P575-F621 HydrophobicContact CB-CB 3.63Å; F576-F621 HydrophobicContact CE1-CB 4.29Å; F576-F621 AromaticContact CE1-CD1 3.99Å; F576-F621 HydrophobicContact CE1-CD1 3.99Å; F576-F621 HydrophobicContact CE1-CE1 4.41Å; F576-F621 HydrophobicContact CE1-CG 4.07Å; F576-F621 HydrophobicContact CZ-CB 4.03Å; F576-F621 AromaticContact CZ-CD1 3.99Å; F576-F621 HydrophobicContact CZ-CD1 3.99Å; F576-F621 AromaticContact CZ-CD2 3.85Å; F576-F621 HydrophobicContact CZ-CD2 3.85Å; F576-F621 HydrophobicContact CZ-CE1 4.35Å; F576-F621 HydrophobicContact CZ-CE2 4.23Å; F576-F621 AromaticContact CZ-CG 3.69Å; F576-F621 HydrophobicContact CZ-CG 3.69Å; F576-F621 HydrophobicContact CZ-CZ 4.46Å; F621-M673 HydrophobicContact CD1-CE 4.09Å; F621-M673 HydrophobicContact CE1-CE 3.27Å; F621-M673 HydrophobicContact CZ-CE 3.93Å; F621-V710 HydrophobicContact CE2-CG1 4.11Å; F621-L713 HydrophobicContact CD2-CB 4.14Å; F621-L713 HydrophobicContact CD2-CD1 4.4Å; F621-L713 HydrophobicContact CE2-CB 3.83Å; F621-L713 HydrophobicContact CE2-CD1 3.53Å; F621-L713 HydrophobicContact CE2-CG 4.31Å; F621-L713 HydrophobicContact CZ-CD1 3.64Å; F621-L723 HydrophobicContact CD2-CD1 3.92Å
622	F	90.6	Very high	85.5	Confident	1 Å²	1	28.3 Å²	28.3	0%	0.004	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	142.2	168.7	84.3	-78.1	0	0	0	112.4	V510 H548 I550 V573 P575 V625 V668	V510-F622 HydrophobicContact CB-CZ 3.92Å; V510-F622 HydrophobicContact CG1-CE1 4.37Å; V510-F622 HydrophobicContact CG1-CZ 3.67Å; V510-F622 HydrophobicContact CG2-CE1 4.48Å; V510-F622 HydrophobicContact CG2-CZ 4.36Å; H548-F622 HydrophobicContact CB-CD1 3.81Å; H548-F622 HydrophobicContact CB-CE1 3.38Å; H548-F622 HydrophobicContact CB-CE2 4.49Å; H548-F622 HydrophobicContact CB-CZ 3.78Å; H548-F622 PolarHBondContact O-N 3.43Å; I550-F622 HydrophobicContact CB-CB 4.3Å; I550-F622 HydrophobicContact CB-CD1 3.57Å; I550-F622 HydrophobicContact CB-CE1 4.07Å; I550-F622 HydrophobicContact CB-CG 4.07Å; I550-F622 HydrophobicContact CG1-CD1 4.49Å; I550-F622 HydrophobicContact CG2-CB 4.47Å; I550-F622 HydrophobicContact CG2-CD1 4.46Å; V573-F622 HydrophobicContact CG1-CB 3.7Å; P575-F622 CarbonylContact O-C 3.48Å; F622-V625 HydrophobicContact CB-CG2 4.34Å; F622-V625 HydrophobicContact CD2-CG2 3.9Å; F622-V625 HydrophobicContact CG-CG2 4.41Å; F622-V668 HydrophobicContact CD2-CG1 4.49Å; F622-V668 HydrophobicContact CE1-CG1 4.07Å; F622-V668 HydrophobicContact CE2-CB 4.44Å; F622-V668 HydrophobicContact CE2-CG1 3.81Å; F622-V668 HydrophobicContact CZ-CB 4.32Å; F622-V668 HydrophobicContact CZ-CG1 3.55Å
623	E	89.5	Confident	84.5	Confident	14 Å²	14	31.8 Å²	31.8	7%	0.065	15%	0.148	C	C	.	.	S	Bend	trans	-122.6	-44.1	166.5	-175.5	79.1	161.9	0	0	109.7	K538 S539 N574 P575 G577 R731	K538-E623 WeakPolarHBondContact CA-O 3.37Å; S539-E623 PolarHBondContact N-O 3.23Å; S539-E623 WeakPolarHBondContact OG-CA 3.26Å; S539-E623 PolarHBondContact OG-O 3.2Å; S539-E623 PolarHBondContact OG-OE2 3.1Å; N574-E623 PolarHBondContact O-N 3.03Å; P575-E623 PolarHBondContact O-N 3.41Å; G577-E623 WeakPolarHBondContact O-CB 3.26Å; G577-E623 WeakPolarHBondContact O-CG 3.31Å; E623-R731 VanDerWaalsContact CD-NH1 3.27Å; E623-R731 IonicContact OE1-CZ 3.31Å; E623-R731 IonicContact OE1-NH1 3.01Å; E623-R731 PolarHBondContact OE1-NH1 3.1Å; E623-R731 IonicContact OE1-NH2 2.75Å; E623-R731 IonicContact OE2-CZ 3.83Å; E623-R731 VanDerWaalsContact OE2-CZ 3.26Å; E623-R731 IonicContact OE2-NH1 2.84Å; E623-R731 PolarHBondContact OE2-NH1 2.93Å; E623-R731 IonicContact OE2-NH2 3.81Å; E623-R731 PolarHBondContact OE2-NH2 3.38Å
624	T	90.7	Very high	83.3	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.012	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.2	170.6	61.5	0	0	0	0	112.3	L537 K538 N574 G577 H626	L537-T624 CarbonylContact O-C 3.57Å; L537-T624 VanDerWaalsContact O-CA 3.25Å; L537-T624 WeakPolarHBondContact O-CA 3.36Å; K538-T624 HydrophobicContact CB-CG2 4.01Å; K538-T624 HydrophobicContact CD-CG2 3.96Å; K538-T624 HydrophobicContact CG-CG2 3.83Å; N574-T624 VanDerWaalsContact CB-OG1 3.25Å; N574-T624 WeakPolarHBondContact CB-OG1 3.42Å; N574-T624 PolarHBondContact N-O 2.84Å; N574-T624 PolarHBondContact O-N 3.2Å; G577-T624 PolarHBondContact O-OG1 3.29Å; T624-H626 PolarHBondContact OG1-NE2 3.38Å
625	V	92.7	Very high	81.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	117.3	172.4	-176.7	0	0	0	0	107.9	T536 L537 I550 L553 V571 V573 F622 I627	T536-V625 CarbonylContact C-O 3.6Å; T536-V625 WeakPolarHBondContact CA-O 3.46Å; L537-V625 HydrophobicContact CB-CB 4.29Å; L537-V625 PolarHBondContact N-O 3.17Å; L537-V625 PolarHBondContact O-N 3.21Å; I550-V625 HydrophobicContact CD1-CG2 4.04Å; L553-V625 HydrophobicContact CD1-CG1 4.14Å; L553-V625 HydrophobicContact CD2-CG1 4.44Å; V571-V625 HydrophobicContact CG1-CG1 3.65Å; V573-V625 HydrophobicContact CG2-CG1 4.39Å; V573-V625 HydrophobicContact CG2-CG2 4.46Å; F622-V625 HydrophobicContact CB-CG2 4.34Å; F622-V625 HydrophobicContact CD2-CG2 3.9Å; F622-V625 HydrophobicContact CG-CG2 4.41Å; V625-I627 HydrophobicContact CG1-CD1 4.45Å; V625-I627 HydrophobicContact CG1-CG1 3.99Å
626	H	91.7	Very high	80.2	Confident	8 Å²	8	47.9 Å²	47.9	4%	0.037	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	114.8	176.8	-62	-66.4	0	0	0	108.9	L534 L535 T536 Y572 S583 T624	L534-H626 HydrophobicContact CD1-CB 3.88Å; L535-H626 CarbonylContact O-C 3.32Å; L535-H626 WeakPolarHBondContact O-CA 3.49Å; T536-H626 VanDerWaalsContact CG2-CE1 3.46Å; T536-H626 WeakPolarHBondContact CG2-CE1 3.48Å; T536-H626 WeakPolarHBondContact CG2-ND1 3.39Å; T536-H626 PolarHBondContact OG1-ND1 3.41Å; Y572-H626 PolarHBondContact N-O 2.87Å; Y572-H626 PolarHBondContact O-N 3.49Å; S583-H626 PolarHBondContact OG-CD2 2.7Å; T624-H626 PolarHBondContact OG1-NE2 3.38Å
627	I	90.9	Very high	78.3	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	113	178.7	-51	172.9	0	0	0	107.6	L535 L537 L569 A570 V571 V625 I666	L535-I627 HydrophobicContact CB-CB 4.17Å; L535-I627 WeakPolarHBondContact CB-O 3.48Å; L535-I627 PolarHBondContact N-O 3.12Å; L535-I627 PolarHBondContact O-N 2.99Å; L537-I627 HydrophobicContact CD1-CD1 4.24Å; L569-I627 HydrophobicContact CB-CG2 4.37Å; L569-I627 HydrophobicContact CD2-CG2 3.91Å; A570-I627 CarbonylContact O-C 3.54Å; A570-I627 WeakPolarHBondContact O-CA 3.44Å; V571-I627 HydrophobicContact CG1-CG1 4.47Å; V571-I627 HydrophobicContact CG2-CG1 4.36Å; V571-I627 HydrophobicContact CG2-CG2 4.43Å; V625-I627 HydrophobicContact CG1-CD1 4.45Å; V625-I627 HydrophobicContact CG1-CG1 3.99Å; I627-I666 HydrophobicContact CD1-CG2 4.28Å
628	Y	88.4	Confident	76.6	Confident	38 Å²	38	47.4 Å²	47.4	15%	0.149	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	118.2	168.3	-72.3	-79.9	0	0	0	109.8	R532 M533 L534 L569 A570 Y572 H580	R532-Y628 HydrophobicContact CB-CD1 4.3Å; M533-Y628 WeakPolarHBondContact O-CA 3.23Å; L534-Y628 HydrophobicContact CB-CD1 4.46Å; L534-Y628 HydrophobicContact CB-CE1 4.18Å; L534-Y628 HydrophobicContact CD1-CD1 4.2Å; L534-Y628 HydrophobicContact CD1-CD2 4.49Å; L534-Y628 HydrophobicContact CD1-CE1 3.84Å; L534-Y628 HydrophobicContact CD1-CE2 4.16Å; L534-Y628 HydrophobicContact CG-CE1 4.44Å; L569-Y628 WeakPolarHBondContact CA-O 3.28Å; A570-Y628 PolarHBondContact N-O 3.29Å; A570-Y628 PolarHBondContact O-N 3.37Å; Y572-Y628 AromaticContact CD2-CD2 3.53Å; Y572-Y628 HydrophobicContact CD2-CD2 3.53Å; Y572-Y628 AromaticContact CD2-CE2 3.61Å; Y572-Y628 HydrophobicContact CD2-CE2 3.61Å; Y572-Y628 AromaticContact CE2-CD2 3.43Å; Y572-Y628 HydrophobicContact CE2-CD2 3.43Å; Y572-Y628 VanDerWaalsContact CE2-CD2 3.43Å; Y572-Y628 AromaticContact CE2-CE2 3.63Å; Y572-Y628 HydrophobicContact CE2-CE2 3.63Å; Y572-Y628 HydrophobicContact CG-CE2 4.5Å; H580-Y628 AromaticContact CD2-CE2 3.87Å; H580-Y628 AromaticContact CD2-CZ 3.99Å; H580-Y628 PolarHBondContact CD2-OH 2.89Å; H580-Y628 VanDerWaalsContact CD2-OH 3.29Å; H580-Y628 AromaticContact CE1-CE2 3.98Å; H580-Y628 PolarHBondContact CE1-OH 3Å; H580-Y628 VanDerWaalsContact CE1-OH 3.25Å; H580-Y628 AromaticContact NE2-CE2 3.2Å; H580-Y628 WeakPolarHBondContact NE2-CE2 3.37Å; H580-Y628 AromaticContact NE2-CZ 3.55Å; H580-Y628 PolarHBondContact NE2-OH 3Å
629	L	85.7	Confident	74.6	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.5	170.5	178.6	69.4	0	0	0	108.9	F525 M533 L535 P567 L569 M661 I663	F525-L629 HydrophobicContact CE2-CD2 4.28Å; F525-L629 HydrophobicContact CZ-CD2 3.87Å; M533-L629 HydrophobicContact CB-CB 4.39Å; M533-L629 PolarHBondContact N-O 3.38Å; M533-L629 PolarHBondContact O-N 3.07Å; L535-L629 HydrophobicContact CD1-CB 4.5Å; P567-L629 HydrophobicContact CB-CD1 3.67Å; L569-L629 HydrophobicContact CD2-CB 4.43Å; L569-L629 HydrophobicContact CD2-CD1 3.54Å; L629-M661 HydrophobicContact CD1-SD 4.25Å; L629-M661 HydrophobicContact CD2-SD 3.76Å; L629-M661 HydrophobicContact CG-SD 4.48Å; L629-I663 HydrophobicContact CD2-CD1 3.85Å
630	R	80.8	Confident	72.4	Confident	50 Å²	50	54.5 Å²	54.5	19%	0.189	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	150	167.6	-60.8	-173.2	-170.3	169.2	9.9	108.8	R532 P567 V568 Y646	R532-R630 HydrophobicContact CG-CG 4.28Å; R532-R630 VanDerWaalsContact NE-NH2 3.12Å; P567-R630 CarbonylContact C-O 3.32Å; P567-R630 WeakPolarHBondContact CA-O 3.33Å; V568-R630 HydrophobicContact CB-CB 4.48Å; V568-R630 PolarHBondContact N-O 3.46Å; V568-R630 PolarHBondContact O-N 2.89Å; R630-Y646 VanDerWaalsContact NH1-CE1 3.32Å
631	S	71.9	Confident	69.7	Low	21 Å²	21	61.7 Å²	61.7	15%	0.147	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.2	171.8	54.8	0	0	0	0	110.1	E566	E566-S631 WeakPolarHBondContact O-CA 3.31Å
632	R	71.4	Confident	67.4	Low	124 Å²	124	71.1 Å²	71.1	47%	0.468	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	150.6	168.1	-79	-175.4	176	173.3	-2	109.7	L565 E566 V568	L565-R632 CarbonylContact C-O 3.59Å; L565-R632 WeakPolarHBondContact CA-O 3.42Å; E566-R632 PolarHBondContact N-O 3.41Å; E566-R632 PolarHBondContact O-N 3.41Å; V568-R632 HydrophobicContact CG2-CB 4.45Å; V568-R632 HydrophobicContact CG2-CG 3.92Å
633	I	67.9	Low	64.6	Low	75 Å²	75	75.2 Å²	75.2	39%	0.385	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	127.7	171.3	-57.8	171.6	0	0	0	107.4	T564 S635 L649 I652 L658	T564-I633 CarbonylContact O-C 3.58Å; T564-I633 WeakPolarHBondContact O-CA 3.3Å; I633-S635 PolarHBondContact O-N 2.81Å; I633-L649 HydrophobicContact CD1-CD2 4.25Å; I633-I652 HydrophobicContact CD1-CD1 3.73Å; I633-L658 HydrophobicContact CD1-CD2 3.98Å; I633-L658 HydrophobicContact CG1-CD2 4.23Å
634	K	62.5	Low	62.4	Low	112 Å²	112	81.6 Å²	81.6	49%	0.487	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-63	117.8	174.6	-71.4	-176.7	177.7	179.6	0	109.8	T564 E566	T564-K634 PolarHBondContact O-N 3.33Å; E566-K634 HydrophobicContact CB-CG 4.37Å
635	S	52.5	Low	59.7	Low	113 Å²	113	91.5 Å²	91.5	79%	0.79	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-80.2	117.6	172.4	179.2	0	0	0	0	109.4	I633 G637	I633-S635 PolarHBondContact O-N 2.81Å; S635-G637 PolarHBondContact O-N 3.04Å
636	N	45.3	Very low	57.4	Low	170 Å²	170	97.8 Å²	97.8	91%	0.909	52%	0.52	S	S	*	.			trans	-84.8	88.6	170.5	-88.4	6.6	0	0	0	109.1
637	G	39.8	Very low	54.8	Low	44 Å²	44	105.4 Å²	105.4	45%	0.454	56%	0.556	S	S	.	*			trans	-161.2	127	171.8	0	0	0	0	0	112.2	S635 N639	S635-G637 PolarHBondContact O-N 3.04Å; G637-N639 PolarHBondContact O-N 3.1Å
638	P	44.7	Very low	52.4	Low	136 Å²	136	109.1 Å²	109.1	88%	0.883	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	3.1	-174.4	31.3	-33.7	0	0	0	114.8
639	N	43.2	Very low	50.6	Low	163 Å²	163	110.8 Å²	110.8	87%	0.872	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.5	49.8	-177.6	-78.5	-11.8	0	0	0	112.5	G637	G637-N639 PolarHBondContact O-N 3.1Å
640	G	40.9	Very low	48.8	Very low	64 Å²	64	116.6 Å²	116.6	66%	0.66	62%	0.618	S	S	*	*			trans	-105.8	110.3	170.6	0	0	0	0	0	110.6	E642	G640-E642 PolarHBondContact O-N 2.84Å
641	N	32.7	Very low	47.2	Very low	153 Å²	153	123.8 Å²	123.8	82%	0.818	65%	0.651	S	S	*	*			trans	-55.7	128.9	169.3	-74.7	-20.4	0	0	0	109.6	S643	N641-S643 PolarHBondContact O-N 3.44Å
642	E	40.7	Very low	46.3	Very low	200 Å²	200	126.4 Å²	126.4	94%	0.935	66%	0.662	S	S	*	*			trans	-69.8	51.7	172.8	-71	-174.4	145.3	0	0	112.1	G640 I644	G640-E642 PolarHBondContact O-N 2.84Å; E642-I644 PolarHBondContact O-N 2.96Å
643	S	32.6	Very low	45.2	Very low	86 Å²	86	126 Å²	126	60%	0.601	67%	0.669	S	S	*	*			trans	-89.8	99	168.4	59.6	0	0	0	0	109.5	N641 Y645	N641-S643 PolarHBondContact O-N 3.44Å; S643-Y645 PolarHBondContact O-N 2.77Å
644	I	42.2	Very low	44.4	Very low	149 Å²	149	129.1 Å²	129.1	76%	0.764	70%	0.695	S	S	*	*			trans	3.2	91.3	145	-52.1	167.9	0	0	0	113.8	E642	E642-I644 PolarHBondContact O-N 2.96Å
645	Y	33.9	Very low	43.9	Very low	209 Å²	209	128.5 Å²	128.5	82%	0.82	70%	0.704	S	S	*	*			trans	-140.9	107.1	153.8	-105.9	-89.6	0	0	0	108.5	S643 E647	S643-Y645 PolarHBondContact O-N 2.77Å; Y645-E647 VanDerWaalsContact C-N 3.32Å; Y645-E647 PolarHBondContact O-N 3.23Å; Y645-E647 VanDerWaalsContact O-N 3.13Å
646	Y	44.5	Very low	44.2	Very low	132 Å²	132	132 Å²	132	52%	0.518	70%	0.7	S	S	.	*			trans	-76.7	85.7	167.6	-89.7	-86.6	0	0	0	107.8	R630	R630-Y646 VanDerWaalsContact NH1-CE1 3.32Å
647	E	38.6	Very low	45	Very low	169 Å²	169	129.9 Å²	129.9	79%	0.79	69%	0.689	S	S	*	*			trans	-82.9	129.5	174.8	-148	162.4	-156.6	0	0	109.9	Y645	Y645-E647 VanDerWaalsContact C-N 3.32Å; Y645-E647 PolarHBondContact O-N 3.23Å; Y645-E647 VanDerWaalsContact O-N 3.13Å
648	P	40.1	Very low	46.4	Very low	78 Å²	78	128.9 Å²	128.9	51%	0.506	67%	0.673	S	S	.	*			trans	-62	138.9	179.8	-18.7	30.3	0	0	0	111.5	E650	P648-E650 HydrophobicContact CB-CG 4.38Å; P648-E650 PolarHBondContact O-N 2.86Å
649	L	50.9	Low	47.8	Very low	74 Å²	74	122.7 Å²	122.7	39%	0.387	63%	0.634	S	S	.	*			trans	-66.8	68.4	166.3	-71.7	162.5	0	0	0	110.4	I633 I652	I633-L649 HydrophobicContact CD1-CD2 4.25Å; L649-I652 HydrophobicContact CD2-CD1 3.66Å
650	E	47.3	Very low	49.7	Very low	126 Å²	126	120 Å²	120	59%	0.589	61%	0.612	S	S	*	*			trans	-108.8	118.4	166.8	-74.9	173.7	-161.7	0	0	106.1	K531 P648	K531-E650 IonicContact NZ-OE1 2.64Å; K531-E650 PolarHBondContact NZ-OE1 3Å; P648-E650 HydrophobicContact CB-CG 4.38Å; P648-E650 PolarHBondContact O-N 2.86Å
651	F	48.2	Very low	51.9	Low	202 Å²	202	117 Å²	117	89%	0.886	58%	0.581	S	S	*	*			trans	82.5	81.5	-176	-57.3	-86.2	0	0	0	116.5
652	I	52.3	Low	54.5	Low	75 Å²	75	111.9 Å²	111.9	39%	0.385	55%	0.552	S	S	.	*			trans	-128.7	132.6	152.3	-58.4	-179.9	0	0	0	108.8	I633 L649 R656	I633-I652 HydrophobicContact CD1-CD1 3.73Å; L649-I652 HydrophobicContact CD2-CD1 3.66Å; I652-R656 HydrophobicContact CG2-CB 4.23Å
653	D	47.4	Very low	56.8	Low	116 Å²	116	102.3 Å²	102.3	62%	0.62	51%	0.507	S	S	*	.			trans	-49.1	134.7	172.1	-86.8	-40.8	0	0	0	111.9	S655 R656	D653-S655 PolarHBondContact O-N 2.96Å; D653-R656 PolarHBondContact O-N 2.93Å
654	P	52.5	Low	59.5	Low	141 Å²	141	99.4 Å²	99.4	92%	0.916	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	0.4	177.3	25.5	-32.9	0	0	0	114.4
655	S	50.8	Low	61.6	Low	99 Å²	99	95.4 Å²	95.4	69%	0.692	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-10.1	-179.9	62	0	0	0	0	114.5	D653 N657	D653-S655 PolarHBondContact O-N 2.96Å; S655-N657 PolarHBondContact O-N 3.47Å
656	R	59.5	Low	64.3	Low	186 Å²	186	86.1 Å²	86.1	70%	0.702	43%	0.429	S	S	*	.			trans	-90.1	101.7	176.7	-75.7	-172.9	173	-168.8	-0.7	110.8	I652 D653 L658	I652-R656 HydrophobicContact CG2-CB 4.23Å; D653-R656 PolarHBondContact O-N 2.93Å; R656-L658 PolarHBondContact O-N 3.21Å
657	N	61.8	Low	66.4	Low	126 Å²	126	81.9 Å²	81.9	67%	0.674	41%	0.414	S	S	*	.			trans	-73.5	94.3	175.4	-157.2	-2.8	0	0	0	110.1	S655 G659	S655-N657 PolarHBondContact O-N 3.47Å; N657-G659 PolarHBondContact O-N 3.49Å
658	L	69.3	Low	68.9	Low	23 Å²	23	73.9 Å²	73.9	12%	0.12	38%	0.377	C	S	.	.			trans	-71.3	-16.7	-178.1	-63.2	170.2	0	0	0	112.6	S563 T564 L565 I633 R656	S563-L658 PolarHBondContact OG-O 2.8Å; T564-L658 PolarHBondContact N-O 3.36Å; L565-L658 HydrophobicContact CD1-CB 4Å; L565-L658 WeakPolarHBondContact CD1-O 3.42Å; L565-L658 HydrophobicContact CD2-CB 4.01Å; L565-L658 HydrophobicContact CG-CB 4.03Å; L565-L658 VanDerWaalsContact CG-O 3.32Å; L565-L658 WeakPolarHBondContact CG-O 3.21Å; I633-L658 HydrophobicContact CD1-CD2 3.98Å; I633-L658 HydrophobicContact CG1-CD2 4.23Å; R656-L658 PolarHBondContact O-N 3.21Å
659	G	75.1	Confident	71.2	Confident	6 Å²	6	70.3 Å²	70.3	6%	0.062	35%	0.353	C	S	.	.			trans	102.8	153.5	178.8	0	0	0	0	0	113	T560 L565 N657	T560-G659 WeakPolarHBondContact OG1-CA 3.45Å; L565-G659 WeakPolarHBondContact CD1-O 3.32Å; N657-G659 PolarHBondContact O-N 3.49Å
660	Y	83.4	Confident	73	Confident	106 Å²	106	67 Å²	67	42%	0.416	34%	0.337	S	S	.	.			trans	-90.2	151.7	176.5	-60.9	-85.7	0	0	0	111.5	W524 D526 T560	W524-Y660 WeakPolarHBondContact CZ3-O 3.05Å; D526-Y660 HydrophobicContact CB-CD1 4.09Å; D526-Y660 HydrophobicContact CB-CE1 3.98Å; T560-Y660 HydrophobicContact CG2-CD2 4.36Å; T560-Y660 PolarHBondContact N-O 3.44Å; T560-Y660 PolarHBondContact OG1-N 2.93Å; T560-Y660 PolarHBondContact OG1-O 3.16Å
661	M	85.6	Confident	74.9	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	146.3	174.3	-170.5	-176.8	-64.2	0	0	110	W524 F525 P527 I557 C558 L559 P567 L629	W524-M661 WeakPolarHBondContact CA-O 3.28Å; W524-M661 VanDerWaalsContact CE3-C 3.5Å; F525-M661 WeakPolarHBondContact CD1-O 3.31Å; F525-M661 HydrophobicContact CE2-CB 4.14Å; F525-M661 HydrophobicContact CE2-SD 4.42Å; F525-M661 HydrophobicContact CZ-CB 4.04Å; F525-M661 HydrophobicContact CZ-CG 4.09Å; F525-M661 HydrophobicContact CZ-SD 3.98Å; F525-M661 PolarHBondContact N-O 3.05Å; F525-M661 PolarHBondContact O-N 3.23Å; P527-M661 HydrophobicContact CG-CB 4.39Å; I557-M661 HydrophobicContact CG2-CG 3.58Å; I557-M661 HydrophobicContact CG2-SD 3.7Å; C558-M661 CarbonylContact O-C 3.46Å; C558-M661 WeakPolarHBondContact O-CA 3.39Å; L559-M661 HydrophobicContact CD2-CB 4.06Å; L559-M661 HydrophobicContact CD2-CE 3.88Å; L559-M661 HydrophobicContact CD2-CG 3.88Å; P567-M661 HydrophobicContact CB-CE 3.79Å; P567-M661 HydrophobicContact CB-SD 4.42Å; P567-M661 HydrophobicContact CG-CE 4.34Å; L629-M661 HydrophobicContact CD1-SD 4.25Å; L629-M661 HydrophobicContact CD2-SD 3.76Å; L629-M661 HydrophobicContact CG-SD 4.48Å
662	K	88.1	Confident	76.7	Confident	46 Å²	46	55.8 Å²	55.8	20%	0.2	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	132.5	173.8	175.1	-175.8	-174.2	-168.2	0	109.1	N522 W524 C558 N664	N522-K662 VanDerWaalsContact CA-CE 3.44Å; N522-K662 WeakPolarHBondContact O-CE 3.43Å; W524-K662 HydrophobicContact CD2-CB 3.58Å; W524-K662 HydrophobicContact CD2-CD 4.23Å; W524-K662 HydrophobicContact CD2-CG 4.42Å; W524-K662 HydrophobicContact CE3-CB 3.52Å; W524-K662 HydrophobicContact CG-CB 4.13Å; W524-K662 HydrophobicContact CG-CD 4.44Å; W524-K662 HydrophobicContact CH2-CB 4.12Å; W524-K662 HydrophobicContact CZ2-CB 4.18Å; W524-K662 HydrophobicContact CZ2-CD 4.19Å; W524-K662 HydrophobicContact CZ3-CB 3.79Å; C558-K662 HydrophobicContact CB-CB 4.26Å; C558-K662 PolarHBondContact N-O 3.07Å; C558-K662 PolarHBondContact O-N 3.27Å; K662-N664 VanDerWaalsContact CD-OD1 3.31Å; K662-N664 WeakPolarHBondContact CD-OD1 3.35Å; K662-N664 WeakPolarHBondContact CE-OD1 3.43Å; K662-N664 WeakPolarHBondContact CG-OD1 3.48Å; K662-N664 PolarHBondContact NZ-OD1 2.98Å
663	I	89	Confident	78.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.9	171.7	-68.4	170.3	0	0	0	107.9	M519 L521 N522 F525 L535 L555 Q556 I557 L629 I666	M519-I663 HydrophobicContact CE-CB 3.71Å; M519-I663 HydrophobicContact CE-CD1 3.38Å; M519-I663 HydrophobicContact CE-CG1 4.07Å; M519-I663 HydrophobicContact CE-CG2 3.93Å; M519-I663 HydrophobicContact SD-CB 4.3Å; M519-I663 HydrophobicContact SD-CD1 4.39Å; L521-I663 HydrophobicContact CD2-CG2 3.77Å; N522-I663 PolarHBondContact N-O 3.47Å; F525-I663 HydrophobicContact CE1-CD1 4.37Å; F525-I663 HydrophobicContact CE1-CG1 4.36Å; F525-I663 HydrophobicContact CZ-CD1 4.28Å; L535-I663 HydrophobicContact CD1-CD1 3.73Å; L555-I663 HydrophobicContact CD1-CG2 3.51Å; L555-I663 HydrophobicContact CG-CG2 4.46Å; Q556-I663 WeakPolarHBondContact O-CA 3.32Å; I557-I663 HydrophobicContact CG1-CG1 4.34Å; L629-I663 HydrophobicContact CD2-CD1 3.85Å; I663-I666 HydrophobicContact CG2-CD1 4.19Å; I663-I666 HydrophobicContact CG2-CG1 3.98Å
664	N	88.1	Confident	80.2	Confident	25 Å²	25	51.6 Å²	51.6	13%	0.134	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-50.8	-175.6	-71.8	-13.7	0	0	0	111.8	N522 Q556 C558 K662	N522-N664 PolarHBondContact ND2-O 3.1Å; N522-N664 VanDerWaalsContact OD1-CA 3.23Å; N522-N664 WeakPolarHBondContact OD1-CA 3.34Å; N522-N664 WeakPolarHBondContact OD1-CB 3.38Å; N522-N664 PolarHBondContact OD1-O 3.42Å; N522-N664 PolarHBondContact OD1-OD1 3.42Å; Q556-N664 HydrophobicContact CB-CB 4.13Å; Q556-N664 VanDerWaalsContact CD-ND2 3.3Å; Q556-N664 HydrophobicContact CG-CB 4.01Å; Q556-N664 PolarHBondContact NE2-ND2 3.37Å; Q556-N664 PolarHBondContact O-N 2.89Å; Q556-N664 VanDerWaalsContact OE1-CB 3.29Å; Q556-N664 PolarHBondContact OE1-ND2 2.91Å; C558-N664 PolarHBondContact SG-ND2 2.79Å; C558-N664 VanDerWaalsContact SG-ND2 3.42Å; K662-N664 VanDerWaalsContact CD-OD1 3.31Å; K662-N664 WeakPolarHBondContact CD-OD1 3.35Å; K662-N664 WeakPolarHBondContact CE-OD1 3.43Å; K662-N664 WeakPolarHBondContact CG-OD1 3.48Å; K662-N664 PolarHBondContact NZ-OD1 2.98Å
665	N	87.7	Confident	81.8	Confident	65 Å²	65	45 Å²	45	35%	0.348	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	150.8	-175.9	-168.4	17.7	0	0	0	110.7	Q556 Q667	Q556-N665 PolarHBondContact N-O 3.24Å; N665-Q667 VanDerWaalsContact ND2-CD 3.32Å; N665-Q667 WeakPolarHBondContact ND2-CG 3.29Å; N665-Q667 PolarHBondContact ND2-NE2 3.2Å
666	I	89.4	Confident	83.6	Confident	13 Å²	13	42.2 Å²	42.2	7%	0.067	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	126.8	170.2	-28.3	-168.3	0	0	0	108.3	F514 L521 L535 L537 S554 L555 I627 I663	F514-I666 HydrophobicContact CD2-CD1 3.68Å; F514-I666 HydrophobicContact CD2-CG1 4.37Å; F514-I666 HydrophobicContact CE2-CD1 3.61Å; L521-I666 HydrophobicContact CD2-CD1 4.05Å; L521-I666 HydrophobicContact CD2-CG1 3.77Å; L535-I666 HydrophobicContact CD1-CD1 4.08Å; L537-I666 HydrophobicContact CD1-CB 4.28Å; L537-I666 HydrophobicContact CD1-CG2 3.63Å; L537-I666 HydrophobicContact CD2-CB 4.2Å; L537-I666 HydrophobicContact CD2-CG2 4.45Å; S554-I666 CarbonylContact O-C 3.58Å; S554-I666 WeakPolarHBondContact O-CA 3.36Å; L555-I666 HydrophobicContact CB-CG2 4.43Å; L555-I666 HydrophobicContact CD1-CB 3.89Å; L555-I666 HydrophobicContact CD1-CD1 3.54Å; L555-I666 HydrophobicContact CD1-CG1 3.36Å; L555-I666 HydrophobicContact CD1-CG2 3.64Å; I627-I666 HydrophobicContact CD1-CG2 4.28Å; I663-I666 HydrophobicContact CG2-CD1 4.19Å; I663-I666 HydrophobicContact CG2-CG1 3.98Å
667	Q	89.1	Confident	84.8	Confident	43 Å²	43	34 Å²	34	20%	0.201	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.6	-178	-67.5	179.3	-52.5	0	0	110.6	E509 S554 N665 F669	E509-Q667 PolarHBondContact OE1-NE2 3.26Å; S554-Q667 PolarHBondContact N-O 2.88Å; S554-Q667 PolarHBondContact O-N 3.25Å; N665-Q667 VanDerWaalsContact ND2-CD 3.32Å; N665-Q667 WeakPolarHBondContact ND2-CG 3.29Å; N665-Q667 PolarHBondContact ND2-NE2 3.2Å; Q667-F669 HydrophobicContact CB-CE2 4.39Å; Q667-F669 HydrophobicContact CB-CZ 4.16Å
668	V	91	Very high	86	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	126.9	172.6	-170.5	0	0	0	0	108.2	V510 A512 L537 I550 L553 F622	V510-V668 PolarHBondContact N-O 3.36Å; A512-V668 HydrophobicContact CB-CG2 3.95Å; L537-V668 HydrophobicContact CB-CG2 4.39Å; L537-V668 HydrophobicContact CD1-CG2 3.64Å; I550-V668 HydrophobicContact CD1-CG1 3.78Å; I550-V668 HydrophobicContact CG1-CG1 3.78Å; L553-V668 HydrophobicContact CD2-CB 4.19Å; L553-V668 HydrophobicContact CD2-CG1 4.02Å; L553-V668 HydrophobicContact CD2-CG2 3.74Å; F622-V668 HydrophobicContact CD2-CG1 4.49Å; F622-V668 HydrophobicContact CE1-CG1 4.07Å; F622-V668 HydrophobicContact CE2-CB 4.44Å; F622-V668 HydrophobicContact CE2-CG1 3.81Å; F622-V668 HydrophobicContact CZ-CB 4.32Å; F622-V668 HydrophobicContact CZ-CG1 3.55Å
669	F	89.4	Confident	86.7	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.018	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	139.6	175.5	-60.2	-69.9	0	0	0	110.3	L501 T504 I508 E509 L551 G552 Q667	L501-F669 HydrophobicContact CD2-CB 3.34Å; L501-F669 HydrophobicContact CD2-CD2 3.93Å; L501-F669 HydrophobicContact CD2-CG 3.75Å; T504-F669 HydrophobicContact CG2-CE2 4.28Å; T504-F669 HydrophobicContact CG2-CZ 3.84Å; I508-F669 HydrophobicContact CD1-CB 4.26Å; I508-F669 HydrophobicContact CD1-CD1 4.14Å; I508-F669 HydrophobicContact CD1-CG 4.37Å; I508-F669 HydrophobicContact CG1-CD1 3.98Å; I508-F669 CarbonylContact O-C 3.55Å; I508-F669 WeakPolarHBondContact O-CA 3.48Å; E509-F669 HydrophobicContact CB-CD1 4.4Å; E509-F669 HydrophobicContact CB-CE1 4.44Å; L551-F669 PolarHBondContact N-O 3.42Å; G552-F669 PolarHBondContact N-O 2.66Å; G552-F669 VanDerWaalsContact N-O 3.11Å; G552-F669 PolarHBondContact O-N 3.35Å; Q667-F669 HydrophobicContact CB-CE2 4.39Å; Q667-F669 HydrophobicContact CB-CZ 4.16Å
670	G	88.4	Confident	87.3	Confident	4 Å²	4	32 Å²	32	4%	0.041	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.1	-168.8	-166.8	0	0	0	0	0	113.7	I508 M549	I508-G670 CarbonylContact C-O 3.58Å; I508-G670 PolarHBondContact O-N 2.87Å; I508-G670 VanDerWaalsContact O-O 3.07Å; M549-G670 WeakPolarHBondContact O-CA 3.3Å
671	Y	86	Confident	87.4	Confident	32 Å²	32	30.6 Å²	30.6	13%	0.125	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	161.2	171.8	60.5	-85.9	0	0	0	110.7	T490 H548 M549 L551 K619 M673	T490-Y671 HydrophobicContact CG2-CD2 3.59Å; T490-Y671 HydrophobicContact CG2-CE1 4.48Å; T490-Y671 HydrophobicContact CG2-CE2 3.5Å; T490-Y671 VanDerWaalsContact CG2-CE2 3.5Å; T490-Y671 HydrophobicContact CG2-CG 4.12Å; H548-Y671 WeakPolarHBondContact CA-O 3.31Å; M549-Y671 HydrophobicContact CB-CD1 4.01Å; M549-Y671 HydrophobicContact CB-CD2 4.38Å; M549-Y671 HydrophobicContact CB-CE1 3.67Å; M549-Y671 HydrophobicContact CB-CE2 4.09Å; M549-Y671 HydrophobicContact CB-CG 4.35Å; M549-Y671 HydrophobicContact CG-CD2 4.46Å; M549-Y671 HydrophobicContact CG-CE1 4.17Å; M549-Y671 HydrophobicContact CG-CE2 3.85Å; M549-Y671 PolarHBondContact N-O 2.96Å; M549-Y671 PolarHBondContact O-N 2.84Å; L551-Y671 HydrophobicContact CD1-CD1 3.72Å; L551-Y671 HydrophobicContact CD1-CE1 4.13Å; L551-Y671 HydrophobicContact CD2-CE1 4.25Å; L551-Y671 HydrophobicContact CG-CD1 4.22Å; L551-Y671 HydrophobicContact CG-CE1 4.32Å; K619-Y671 HydrophobicContact CD-CE1 4.36Å; K619-Y671 PolarHBondContact NZ-OH 2.89Å; K619-Y671 VanDerWaalsContact NZ-OH 3.13Å; Y671-M673 HydrophobicContact CD2-CG 3.75Å; Y671-M673 HydrophobicContact CD2-SD 4.38Å; Y671-M673 HydrophobicContact CE2-CG 3.5Å; Y671-M673 HydrophobicContact CE2-SD 3.54Å; Y671-M673 VanDerWaalsContact CE2-SD 3.54Å
672	S	86.3	Confident	87.4	Confident	61 Å²	61	34 Å²	34	43%	0.427	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.7	178.4	-50.6	0	0	0	0	109.1	H548	H548-S672 PolarHBondContact CE1-OG 3.25Å; H548-S672 VanDerWaalsContact CE1-OG 3.22Å; H548-S672 PolarHBondContact ND1-OG 2.66Å
673	M	86.1	Confident	87.1	Confident	7 Å²	7	31.8 Å²	31.8	3%	0.034	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	146.4	177	-65.7	179.4	-57.3	0	0	109.5	G487 F488 L546 V547 M549 F621 Y671	G487-M673 WeakPolarHBondContact O-CB 3.42Å; G487-M673 VanDerWaalsContact O-CG 3.3Å; G487-M673 WeakPolarHBondContact O-CG 3.38Å; F488-M673 HydrophobicContact CD1-SD 4.48Å; L546-M673 VanDerWaalsContact CA-O 3.31Å; L546-M673 WeakPolarHBondContact CA-O 3.42Å; L546-M673 WeakPolarHBondContact CD2-O 3.44Å; V547-M673 PolarHBondContact N-O 3.45Å; V547-M673 PolarHBondContact O-N 3.31Å; M549-M673 HydrophobicContact CG-CE 3.26Å; M549-M673 HydrophobicContact CG-SD 3.92Å; M549-M673 HydrophobicContact SD-CE 3.64Å; F621-M673 HydrophobicContact CD1-CE 4.09Å; F621-M673 HydrophobicContact CE1-CE 3.27Å; F621-M673 HydrophobicContact CZ-CE 3.93Å; Y671-M673 HydrophobicContact CD2-CG 3.75Å; Y671-M673 HydrophobicContact CD2-SD 4.38Å; Y671-M673 HydrophobicContact CE2-CG 3.5Å; Y671-M673 HydrophobicContact CE2-SD 3.54Å; Y671-M673 VanDerWaalsContact CE2-SD 3.54Å
674	H	86.7	Confident	87	Confident	96 Å²	96	32.4 Å²	32.4	44%	0.444	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	135.2	171.8	-172.8	49.7	0	0	0	110	I486 G487 S545	I486-H674 WeakPolarHBondContact CA-O 3.45Å; G487-H674 PolarHBondContact N-O 2.87Å; G487-H674 VanDerWaalsContact N-O 3.07Å; S545-H674 PolarHBondContact O-ND1 3.19Å
675	F	87.6	Confident	86.7	Confident	1 Å²	1	34.9 Å²	34.9	0%	0.004	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-133.8	117.7	177.2	174.4	-105.3	0	0	0	107.6	I486 S545 V547 P677 I680 L727 R731 L732	I486-F675 HydrophobicContact CD1-CD2 4.07Å; I486-F675 HydrophobicContact CD1-CE2 4.16Å; I486-F675 HydrophobicContact CG1-CD2 3.93Å; I486-F675 HydrophobicContact CG1-CE2 4.32Å; S545-F675 CarbonylContact C-O 3.55Å; S545-F675 WeakPolarHBondContact CA-O 3.33Å; S545-F675 PolarHBondContact O-N 3.28Å; S545-F675 VanDerWaalsContact O-O 3.11Å; V547-F675 HydrophobicContact CB-CB 4.36Å; V547-F675 HydrophobicContact CG2-CB 3.6Å; V547-F675 HydrophobicContact CG2-CD1 4.17Å; V547-F675 HydrophobicContact CG2-CD2 4.15Å; V547-F675 HydrophobicContact CG2-CG 3.71Å; F675-P677 HydrophobicContact CD1-CB 4.42Å; F675-P677 HydrophobicContact CE1-CB 3.8Å; F675-P677 HydrophobicContact CE1-CG 4.47Å; F675-P677 HydrophobicContact CZ-CB 4.49Å; F675-P677 WeakPolarHBondContact O-CD 3.44Å; F675-I680 HydrophobicContact CD2-CD1 4.3Å; F675-I680 HydrophobicContact CE2-CD1 3.46Å; F675-I680 VanDerWaalsContact CE2-CD1 3.46Å; F675-I680 HydrophobicContact CZ-CD1 4.01Å; F675-L727 HydrophobicContact CE2-CD1 4Å; F675-L727 HydrophobicContact CE2-CD2 3.77Å; F675-L727 HydrophobicContact CE2-CG 4.12Å; F675-L727 HydrophobicContact CZ-CD2 3.84Å; F675-L727 HydrophobicContact CZ-CG 4.29Å; F675-R731 HydrophobicContact CE1-CB 3.74Å; F675-R731 HydrophobicContact CE1-CG 4.37Å; F675-R731 HydrophobicContact CZ-CB 3.96Å; F675-L732 HydrophobicContact CZ-CD1 4.41Å; F675-L732 HydrophobicContact CZ-CG 4.36Å
676	D	87.6	Confident	86.4	Confident	41 Å²	41	33.2 Å²	33.2	22%	0.219	17%	0.168	C	C	.	.			trans	-99	100.6	175.5	-165.7	-23.1	0	0	0	110.3	Y485 E678 A679 I680	Y485-D676 PolarHBondContact O-N 3.37Å; Y485-D676 VanDerWaalsContact O-N 3.09Å; D676-E678 VanDerWaalsContact C-N 3.3Å; D676-E678 PolarHBondContact O-N 3.04Å; D676-E678 PolarHBondContact OD1-N 3.41Å; D676-A679 HydrophobicContact CB-CB 3.91Å; D676-A679 PolarHBondContact OD1-N 2.96Å; D676-I680 PolarHBondContact O-N 3.21Å
677	P	85.9	Confident	85.9	Confident	15 Å²	15	33.6 Å²	33.6	10%	0.097	17%	0.17	C	C	.	.	H	α-helix	trans	-67.7	-29.2	178.7	27	-33.4	0	0	0	112.9	F675 R681 L732	F675-P677 HydrophobicContact CD1-CB 4.42Å; F675-P677 HydrophobicContact CE1-CB 3.8Å; F675-P677 HydrophobicContact CE1-CG 4.47Å; F675-P677 HydrophobicContact CZ-CB 4.49Å; F675-P677 WeakPolarHBondContact O-CD 3.44Å; P677-R681 WeakPolarHBondContact O-CG 3.33Å; P677-R681 PolarHBondContact O-N 2.8Å; P677-R681 VanDerWaalsContact O-N 3.15Å; P677-L732 HydrophobicContact CB-CD2 4.36Å; P677-L732 WeakPolarHBondContact O-CD2 3.48Å
678	E	85.8	Confident	85.3	Confident	98 Å²	98	34.6 Å²	34.6	46%	0.458	18%	0.177	S	C	.	.	H	α-helix	trans	-77.9	-39.4	-176.4	-57.8	-51.1	143.8	0	0	110.4	D676 I680 R681 D682	D676-E678 VanDerWaalsContact C-N 3.3Å; D676-E678 PolarHBondContact O-N 3.04Å; D676-E678 PolarHBondContact OD1-N 3.41Å; E678-I680 VanDerWaalsContact C-N 3.31Å; E678-I680 PolarHBondContact O-N 3.09Å; E678-R681 VanDerWaalsContact CD-NH1 3.3Å; E678-R681 WeakPolarHBondContact O-CA 3.3Å; E678-R681 WeakPolarHBondContact O-CB 3.48Å; E678-R681 PolarHBondContact O-N 3.26Å; E678-R681 IonicContact OE1-CZ 2.78Å; E678-R681 IonicContact OE1-NH1 2.68Å; E678-R681 PolarHBondContact OE1-NH1 2.95Å; E678-R681 IonicContact OE2-NH1 2.76Å; E678-R681 PolarHBondContact OE2-NH1 3.02Å; E678-R681 VanDerWaalsContact OE2-NH1 3.08Å; E678-D682 PolarHBondContact O-N 3.37Å
679	A	85.4	Confident	84.4	Confident	12 Å²	12	41.9 Å²	41.9	10%	0.099	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-39.4	175	0	0	0	0	0	112.8	Y485 D676 D682 L683	Y485-A679 HydrophobicContact CD1-CB 3.64Å; Y485-A679 HydrophobicContact CE1-CB 3.73Å; Y485-A679 WeakPolarHBondContact CE1-O 3.46Å; D676-A679 HydrophobicContact CB-CB 3.91Å; D676-A679 PolarHBondContact OD1-N 2.96Å; A679-D682 PolarHBondContact O-N 2.98Å; A679-L683 PolarHBondContact O-N 3.34Å; A679-L683 VanDerWaalsContact O-N 3.12Å
680	I	86.4	Confident	83.1	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-72.1	-32.7	175.4	-61	173.8	0	0	0	111.3	Y485 I486 F675 D676 E678 L683 I684 L732	Y485-I680 HydrophobicContact CD1-CG1 3.83Å; Y485-I680 HydrophobicContact CG-CG1 4.26Å; I486-I680 HydrophobicContact CD1-CD1 4.47Å; I486-I680 HydrophobicContact CG1-CD1 4.33Å; F675-I680 HydrophobicContact CD2-CD1 4.3Å; F675-I680 HydrophobicContact CE2-CD1 3.46Å; F675-I680 VanDerWaalsContact CE2-CD1 3.46Å; F675-I680 HydrophobicContact CZ-CD1 4.01Å; D676-I680 PolarHBondContact O-N 3.21Å; E678-I680 VanDerWaalsContact C-N 3.31Å; E678-I680 PolarHBondContact O-N 3.09Å; I680-L683 PolarHBondContact O-N 2.93Å; I680-I684 HydrophobicContact CG2-CD1 4.18Å; I680-I684 VanDerWaalsContact O-CG1 3.32Å; I680-I684 WeakPolarHBondContact O-CG1 3.42Å; I680-I684 PolarHBondContact O-N 3.1Å; I680-L732 HydrophobicContact CB-CD1 4.31Å; I680-L732 HydrophobicContact CB-CD2 4.12Å; I680-L732 HydrophobicContact CG2-CD1 3.67Å; I680-L732 HydrophobicContact CG2-CD2 4.15Å
681	R	86.2	Confident	81.6	Confident	78 Å²	78	54.3 Å²	54.3	29%	0.294	26%	0.258	S	S	.	.	H	α-helix	trans	-64.6	-41.3	171.9	-78	178.8	-178.8	150.2	5.8	111.7	P677 E678 L683 I684 L685 L732	P677-R681 WeakPolarHBondContact O-CG 3.33Å; P677-R681 PolarHBondContact O-N 2.8Å; P677-R681 VanDerWaalsContact O-N 3.15Å; E678-R681 VanDerWaalsContact CD-NH1 3.3Å; E678-R681 WeakPolarHBondContact O-CA 3.3Å; E678-R681 WeakPolarHBondContact O-CB 3.48Å; E678-R681 PolarHBondContact O-N 3.26Å; E678-R681 IonicContact OE1-CZ 2.78Å; E678-R681 IonicContact OE1-NH1 2.68Å; E678-R681 PolarHBondContact OE1-NH1 2.95Å; E678-R681 IonicContact OE2-NH1 2.76Å; E678-R681 PolarHBondContact OE2-NH1 3.02Å; E678-R681 VanDerWaalsContact OE2-NH1 3.08Å; R681-L683 VanDerWaalsContact C-N 3.3Å; R681-L683 PolarHBondContact O-N 3.15Å; R681-I684 CarbonylContact O-C 3.6Å; R681-I684 PolarHBondContact O-N 3.41Å; R681-I684 VanDerWaalsContact O-N 3.08Å; R681-L685 WeakPolarHBondContact O-CG 3.31Å; R681-L685 PolarHBondContact O-N 3.17Å; R681-L732 HydrophobicContact CG-CD2 3.55Å; R681-L732 PolarHBondContact NH2-O 3.01Å
682	D	84.6	Confident	80	Confident	70 Å²	70	58 Å²	58	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-40.4	176.2	-71.7	-18.7	0	0	0	111.1	E678 A679 I684 L685 Q686	E678-D682 PolarHBondContact O-N 3.37Å; A679-D682 PolarHBondContact O-N 2.98Å; D682-I684 VanDerWaalsContact C-N 3.32Å; D682-I684 PolarHBondContact O-N 2.78Å; D682-L685 PolarHBondContact O-N 3.08Å; D682-Q686 WeakPolarHBondContact O-CG 3.23Å; D682-Q686 PolarHBondContact O-N 3.45Å
683	L	82.9	Confident	78.4	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-39.2	171.2	-76.8	178.1	0	0	0	113.7	Y485 A679 I680 R681 Q686 A699 Q702 L703 I706	Y485-L683 HydrophobicContact CD1-CD1 3.77Å; Y485-L683 HydrophobicContact CD1-CG 4.5Å; Y485-L683 HydrophobicContact CD2-CD1 4.27Å; Y485-L683 HydrophobicContact CE1-CD1 3.25Å; Y485-L683 HydrophobicContact CE1-CD2 4.44Å; Y485-L683 HydrophobicContact CE1-CG 3.63Å; Y485-L683 HydrophobicContact CE2-CD1 3.82Å; Y485-L683 HydrophobicContact CG-CD1 4.26Å; A679-L683 PolarHBondContact O-N 3.34Å; A679-L683 VanDerWaalsContact O-N 3.12Å; I680-L683 PolarHBondContact O-N 2.93Å; R681-L683 VanDerWaalsContact C-N 3.3Å; R681-L683 PolarHBondContact O-N 3.15Å; L683-Q686 WeakPolarHBondContact O-CB 3.45Å; L683-Q686 PolarHBondContact O-N 3.06Å; L683-A699 HydrophobicContact CD2-CB 4.44Å; L683-Q702 HydrophobicContact CD1-CB 4.34Å; L683-L703 HydrophobicContact CB-CD2 4.45Å; L683-L703 HydrophobicContact CD1-CD2 4.49Å; L683-I706 HydrophobicContact CD1-CD1 4.09Å
684	I	85.9	Confident	77.2	Confident	12 Å²	12	61.3 Å²	61.3	6%	0.062	30%	0.302	C	S	.	.	H	α-helix	trans	-70.2	-37.5	176.9	-66.5	167.3	0	0	0	110.2	I680 R681 D682 Q686 L687 L703 L728 L734 I742	I680-I684 HydrophobicContact CG2-CD1 4.18Å; I680-I684 VanDerWaalsContact O-CG1 3.32Å; I680-I684 WeakPolarHBondContact O-CG1 3.42Å; I680-I684 PolarHBondContact O-N 3.1Å; R681-I684 CarbonylContact O-C 3.6Å; R681-I684 PolarHBondContact O-N 3.41Å; R681-I684 VanDerWaalsContact O-N 3.08Å; D682-I684 VanDerWaalsContact C-N 3.32Å; D682-I684 PolarHBondContact O-N 2.78Å; I684-Q686 VanDerWaalsContact C-N 3.31Å; I684-Q686 PolarHBondContact O-N 3.22Å; I684-L687 VanDerWaalsContact O-CB 3.27Å; I684-L687 WeakPolarHBondContact O-CB 3.46Å; I684-L687 PolarHBondContact O-N 3.05Å; I684-L687 VanDerWaalsContact O-N 3.13Å; I684-L703 HydrophobicContact CG1-CD2 4.46Å; I684-L728 HydrophobicContact CD1-CD2 4.12Å; I684-L734 HydrophobicContact CD1-CD1 3.75Å; I684-I742 HydrophobicContact CD1-CD1 3.91Å; I684-I742 HydrophobicContact CG1-CD1 4.14Å; I684-I742 HydrophobicContact CG2-CD1 3.89Å
685	L	82.4	Confident	76.3	Confident	77 Å²	77	59.3 Å²	59.3	40%	0.403	30%	0.299	S	S	.	.	H	α-helix	trans	-65.5	-32.7	175.2	-72	171.8	0	0	0	112.3	R681 D682 L687 D688 Y689	R681-L685 WeakPolarHBondContact O-CG 3.31Å; R681-L685 PolarHBondContact O-N 3.17Å; D682-L685 PolarHBondContact O-N 3.08Å; L685-L687 PolarHBondContact O-N 3.08Å; L685-D688 PolarHBondContact O-N 3.24Å; L685-Y689 PolarHBondContact O-N 3.19Å
686	Q	80.4	Confident	75.7	Confident	30 Å²	30	63.7 Å²	63.7	14%	0.14	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-28.5	172.1	-76.2	173.5	17.4	0	0	113	D682 L683 I684 D688 Y689 P690 Q693 A699	D682-Q686 WeakPolarHBondContact O-CG 3.23Å; D682-Q686 PolarHBondContact O-N 3.45Å; L683-Q686 WeakPolarHBondContact O-CB 3.45Å; L683-Q686 PolarHBondContact O-N 3.06Å; I684-Q686 VanDerWaalsContact C-N 3.31Å; I684-Q686 PolarHBondContact O-N 3.22Å; Q686-D688 VanDerWaalsContact C-N 3.31Å; Q686-Y689 CarbonylContact O-C 3.49Å; Q686-P690 WeakPolarHBondContact O-CA 3.33Å; Q686-Q693 HydrophobicContact CG-CB 3.49Å; Q686-Q693 VanDerWaalsContact CG-CB 3.49Å; Q686-Q693 PolarHBondContact NE2-O 3.22Å; Q686-A699 HydrophobicContact CB-CB 4.03Å
687	L	79.4	Confident	75	Confident	22 Å²	22	65 Å²	65	12%	0.115	33%	0.327	C	S	.	.	H	α-helix	trans	-68.7	-32.4	173.1	-57.7	176.2	0	0	0	112.2	I684 L685 Q696 A699 L700 L703	I684-L687 VanDerWaalsContact O-CB 3.27Å; I684-L687 WeakPolarHBondContact O-CB 3.46Å; I684-L687 PolarHBondContact O-N 3.05Å; I684-L687 VanDerWaalsContact O-N 3.13Å; L685-L687 PolarHBondContact O-N 3.08Å; L687-Q696 HydrophobicContact CD2-CG 4.34Å; L687-A699 HydrophobicContact CD2-CB 4.12Å; L687-L700 HydrophobicContact CD1-CD2 4.48Å; L687-L700 HydrophobicContact CD2-CD1 4.48Å; L687-L700 HydrophobicContact CD2-CD2 3.59Å; L687-L700 HydrophobicContact CD2-CG 3.6Å; L687-L703 HydrophobicContact CD1-CD1 3.68Å; L687-L703 HydrophobicContact CD2-CD1 4.46Å; L687-L703 HydrophobicContact CG-CD1 4.28Å
688	D	75.9	Confident	74.6	Confident	63 Å²	63	65.8 Å²	65.8	34%	0.337	33%	0.332	S	S	.	.	H	α-helix	trans	-86.9	-30.6	-177.6	-69.3	-28.8	0	0	0	112.3	L685 Q686 R741	L685-D688 PolarHBondContact O-N 3.24Å; Q686-D688 VanDerWaalsContact C-N 3.31Å; D688-R741 IonicContact OD1-CZ 3.59Å; D688-R741 VanDerWaalsContact OD1-CZ 3.25Å; D688-R741 IonicContact OD1-NH1 3.81Å; D688-R741 PolarHBondContact OD1-NH1 3Å; D688-R741 IonicContact OD1-NH2 3.96Å; D688-R741 PolarHBondContact OD1-NH2 3.19Å; D688-R741 IonicContact OD2-CZ 3.11Å; D688-R741 IonicContact OD2-NH1 2.73Å; D688-R741 IonicContact OD2-NH2 3.38Å; D688-R741 PolarHBondContact OD2-NH2 3.33Å
689	Y	73.4	Confident	74.3	Confident	154 Å²	154	61.1 Å²	61.1	60%	0.604	31%	0.31	S	S	*	.			trans	-133.4	71.7	-177.6	-58.6	-76.1	0	0	0	111.9	L685 Q686 Y691 T692	L685-Y689 PolarHBondContact O-N 3.19Å; Q686-Y689 CarbonylContact O-C 3.49Å; Y689-Y691 PolarHBondContact O-N 2.84Å; Y689-Y691 VanDerWaalsContact O-N 3.08Å; Y689-T692 PolarHBondContact O-N 2.96Å; Y689-T692 PolarHBondContact O-OG1 3.25Å
690	P	62.5	Low	74.2	Confident	42 Å²	42	61 Å²	61	27%	0.273	31%	0.308	S	S	.	.	H	α-helix	trans	-64.7	-16.3	-176.6	24.5	-33.9	0	0	0	114.1	Q686 Q696	Q686-P690 WeakPolarHBondContact O-CA 3.33Å; P690-Q696 HydrophobicContact CB-CB 4.27Å
691	Y	55.2	Low	73.9	Confident	227 Å²	227	62.5 Å²	62.5	89%	0.89	32%	0.316	S	S	*	.	H	α-helix	trans	-81.5	-12.1	-176.7	-61.6	-75.2	0	0	0	114.8	Y689	Y689-Y691 PolarHBondContact O-N 2.84Å; Y689-Y691 VanDerWaalsContact O-N 3.08Å
692	T	52.5	Low	73.7	Confident	109 Å²	109	59.7 Å²	59.7	67%	0.669	31%	0.306	S	S	*	.	H	α-helix	trans	-111.2	-19.5	-171	51.9	0	0	0	0	114.7	Y689	Y689-T692 PolarHBondContact O-N 2.96Å; Y689-T692 PolarHBondContact O-OG1 3.25Å
693	Q	53	Low	73.8	Confident	101 Å²	101	56.3 Å²	56.3	47%	0.472	29%	0.288	S	S	.	.	H	α-helix	trans	-143	0.1	-167.3	-74.5	-168.8	-5.8	0	0	117.2	Q686	Q686-Q693 HydrophobicContact CG-CB 3.49Å; Q686-Q693 VanDerWaalsContact CG-CB 3.49Å; Q686-Q693 PolarHBondContact NE2-O 3.22Å
694	G	60.5	Low	74	Confident	37 Å²	37	56.7 Å²	56.7	38%	0.381	29%	0.29	S	S	.	.	S	Bend	trans	148.5	178.2	176.9	0	0	0	0	0	113.4
695	S	68.7	Low	73.9	Confident	54 Å²	54	59.1 Å²	59.1	38%	0.378	30%	0.301	S	S	.	.			trans	-74.4	141.2	176	86.7	0	0	0	0	111.1	D697 S698 A699	S695-D697 PolarHBondContact O-N 2.98Å; S695-S698 PolarHBondContact O-N 3.29Å; S695-S698 PolarHBondContact O-OG 2.62Å; S695-S698 VanDerWaalsContact OG-CB 3.24Å; S695-S698 WeakPolarHBondContact OG-CB 3.24Å; S695-S698 PolarHBondContact OG-N 3.17Å; S695-S698 PolarHBondContact OG-OG 2.84Å; S695-A699 PolarHBondContact O-N 2.78Å
696	Q	74.1	Confident	74.1	Confident	93 Å²	93	55.5 Å²	55.5	44%	0.435	28%	0.283	S	S	.	.	H	α-helix	trans	-60.6	-36.2	178.2	-171.5	177.8	5.8	0	0	111.8	L687 P690 A699 L700	L687-Q696 HydrophobicContact CD2-CG 4.34Å; P690-Q696 HydrophobicContact CB-CB 4.27Å; Q696-A699 PolarHBondContact O-N 3.19Å; Q696-L700 HydrophobicContact CG-CD1 4.17Å; Q696-L700 WeakPolarHBondContact O-CG 3.3Å; Q696-L700 PolarHBondContact O-N 3.1Å
697	D	74.3	Confident	74.4	Confident	70 Å²	70	55.6 Å²	55.6	37%	0.374	28%	0.282	S	S	.	.	H	α-helix	trans	-70.3	-38.1	-178.4	-67.2	-21.9	0	0	0	111.7	S695 A699 L700 L701 F749	S695-D697 PolarHBondContact O-N 2.98Å; D697-A699 PolarHBondContact O-N 2.68Å; D697-L700 PolarHBondContact O-N 3.23Å; D697-L701 WeakPolarHBondContact O-CB 3.5Å; D697-L701 PolarHBondContact O-N 3.38Å; D697-F749 HydrophobicContact CB-CE2 3.9Å; D697-F749 HydrophobicContact CB-CZ 4.19Å; D697-F749 WeakPolarHBondContact OD1-CE2 3.46Å
698	S	76.9	Confident	74.7	Confident	30 Å²	30	57.6 Å²	57.6	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-39.1	174.7	58.4	0	0	0	0	112.4	S695 L701 Q702	S695-S698 PolarHBondContact O-N 3.29Å; S695-S698 PolarHBondContact O-OG 2.62Å; S695-S698 VanDerWaalsContact OG-CB 3.24Å; S695-S698 WeakPolarHBondContact OG-CB 3.24Å; S695-S698 PolarHBondContact OG-N 3.17Å; S695-S698 PolarHBondContact OG-OG 2.84Å; S698-L701 PolarHBondContact O-N 3.24Å; S698-Q702 WeakPolarHBondContact O-CG 3.39Å; S698-Q702 PolarHBondContact O-N 3.02Å; S698-Q702 VanDerWaalsContact O-N 3.08Å
699	A	78.9	Confident	75.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67	-41.1	176.4	0	0	0	0	0	111.8	L683 Q686 L687 S695 Q696 D697 Q702 L703	L683-A699 HydrophobicContact CD2-CB 4.44Å; Q686-A699 HydrophobicContact CB-CB 4.03Å; L687-A699 HydrophobicContact CD2-CB 4.12Å; S695-A699 PolarHBondContact O-N 2.78Å; Q696-A699 PolarHBondContact O-N 3.19Å; D697-A699 PolarHBondContact O-N 2.68Å; A699-Q702 PolarHBondContact O-N 2.76Å; A699-L703 WeakPolarHBondContact O-CB 3.29Å; A699-L703 WeakPolarHBondContact O-CG 3.49Å; A699-L703 PolarHBondContact O-N 3.13Å
700	L	84.1	Confident	75.8	Confident	10 Å²	10	51.1 Å²	51.1	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-39.5	175.1	-73.8	167.3	0	0	0	112	L687 Q696 D697 L703 L704 A745 L746 F749	L687-L700 HydrophobicContact CD1-CD2 4.48Å; L687-L700 HydrophobicContact CD2-CD1 4.48Å; L687-L700 HydrophobicContact CD2-CD2 3.59Å; L687-L700 HydrophobicContact CD2-CG 3.6Å; Q696-L700 HydrophobicContact CG-CD1 4.17Å; Q696-L700 WeakPolarHBondContact O-CG 3.3Å; Q696-L700 PolarHBondContact O-N 3.1Å; D697-L700 PolarHBondContact O-N 3.23Å; L700-L703 PolarHBondContact O-N 2.81Å; L700-L704 WeakPolarHBondContact O-CB 3.18Å; L700-L704 WeakPolarHBondContact O-CG 3.47Å; L700-L704 PolarHBondContact O-N 2.83Å; L700-A745 HydrophobicContact CD2-CB 4.17Å; L700-L746 HydrophobicContact CD2-CD2 3.93Å; L700-F749 HydrophobicContact CB-CB 4.46Å; L700-F749 HydrophobicContact CB-CD1 3.75Å; L700-F749 HydrophobicContact CB-CD2 4.24Å; L700-F749 HydrophobicContact CB-CE1 3.97Å; L700-F749 HydrophobicContact CB-CE2 4.44Å; L700-F749 HydrophobicContact CB-CG 3.9Å; L700-F749 HydrophobicContact CB-CZ 4.32Å; L700-F749 HydrophobicContact CD1-CB 4.06Å; L700-F749 HydrophobicContact CD1-CD2 3.81Å; L700-F749 HydrophobicContact CD1-CE2 4.43Å; L700-F749 HydrophobicContact CD1-CG 3.93Å; L700-F749 HydrophobicContact CG-CG 4.46Å
701	L	80.9	Confident	77.1	Confident	32 Å²	32	49.2 Å²	49.2	17%	0.168	25%	0.249	C	C	.	.	H	α-helix	trans	-65.8	-42.6	178.2	-162	146.5	0	0	0	111.8	E477 A479 D697 S698 L704 E705 F749	E477-L701 WeakPolarHBondContact O-CD1 3.27Å; A479-L701 HydrophobicContact CB-CD2 3.43Å; A479-L701 VanDerWaalsContact CB-CD2 3.43Å; D697-L701 WeakPolarHBondContact O-CB 3.5Å; D697-L701 PolarHBondContact O-N 3.38Å; S698-L701 PolarHBondContact O-N 3.24Å; L701-L704 PolarHBondContact O-N 2.85Å; L701-E705 PolarHBondContact O-N 2.84Å; L701-F749 HydrophobicContact CB-CE1 4.23Å
702	Q	81.4	Confident	78.5	Confident	19 Å²	19	46.1 Å²	46.1	9%	0.089	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-42.1	174.5	-71.1	177.7	10.5	0	0	112.4	A479 Y485 L683 S698 A699 L704 E705 I706	A479-Q702 HydrophobicContact CB-CG 3.66Å; Y485-Q702 PolarHBondContact OH-OE1 3.41Å; Y485-Q702 VanDerWaalsContact OH-OE1 3.1Å; L683-Q702 HydrophobicContact CD1-CB 4.34Å; S698-Q702 WeakPolarHBondContact O-CG 3.39Å; S698-Q702 PolarHBondContact O-N 3.02Å; S698-Q702 VanDerWaalsContact O-N 3.08Å; A699-Q702 PolarHBondContact O-N 2.76Å; Q702-L704 VanDerWaalsContact C-N 3.35Å; Q702-L704 PolarHBondContact O-N 3.35Å; Q702-E705 PolarHBondContact O-N 2.86Å; Q702-I706 VanDerWaalsContact O-CG1 3.3Å; Q702-I706 WeakPolarHBondContact O-CG1 3.12Å; Q702-I706 PolarHBondContact O-N 3.16Å
703	L	86.9	Confident	80.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.8	-35.5	176	-74.3	170.9	0	0	0	112.6	L683 I684 L687 A699 L700 R707 F724 L746	L683-L703 HydrophobicContact CB-CD2 4.45Å; L683-L703 HydrophobicContact CD1-CD2 4.49Å; I684-L703 HydrophobicContact CG1-CD2 4.46Å; L687-L703 HydrophobicContact CD1-CD1 3.68Å; L687-L703 HydrophobicContact CD2-CD1 4.46Å; L687-L703 HydrophobicContact CG-CD1 4.28Å; A699-L703 WeakPolarHBondContact O-CB 3.29Å; A699-L703 WeakPolarHBondContact O-CG 3.49Å; A699-L703 PolarHBondContact O-N 3.13Å; L700-L703 PolarHBondContact O-N 2.81Å; L703-R707 VanDerWaalsContact O-CB 3.32Å; L703-R707 WeakPolarHBondContact O-CB 3.44Å; L703-R707 PolarHBondContact O-N 2.96Å; L703-F724 HydrophobicContact CD2-CZ 4.31Å; L703-L746 HydrophobicContact CB-CD1 4.48Å; L703-L746 HydrophobicContact CB-CD2 3.73Å
704	L	85.8	Confident	81.7	Confident	9 Å²	9	38.4 Å²	38.4	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-44.5	171.9	-78.8	-177.8	0	0	0	111.6	L700 L701 Q702 R707 D708 L746 F749 N750 L753	L700-L704 WeakPolarHBondContact O-CB 3.18Å; L700-L704 WeakPolarHBondContact O-CG 3.47Å; L700-L704 PolarHBondContact O-N 2.83Å; L701-L704 PolarHBondContact O-N 2.85Å; Q702-L704 VanDerWaalsContact C-N 3.35Å; Q702-L704 PolarHBondContact O-N 3.35Å; L704-R707 WeakPolarHBondContact O-CB 3.33Å; L704-R707 PolarHBondContact O-N 2.84Å; L704-D708 PolarHBondContact O-N 2.76Å; L704-L746 HydrophobicContact CD2-CB 3.89Å; L704-L746 HydrophobicContact CD2-CD2 3.82Å; L704-L746 HydrophobicContact CD2-CG 4.33Å; L704-L746 HydrophobicContact CG-CD2 3.78Å; L704-F749 HydrophobicContact CD1-CD1 3.56Å; L704-F749 HydrophobicContact CD1-CE1 3.97Å; L704-F749 HydrophobicContact CG-CD1 4.43Å; L704-N750 HydrophobicContact CD1-CB 4.5Å; L704-N750 HydrophobicContact CD2-CB 4.44Å; L704-L753 HydrophobicContact CD1-CD1 3.76Å
705	E	83.8	Confident	82.6	Confident	62 Å²	62	37 Å²	37	29%	0.29	18%	0.184	S	C	.	.	H	α-helix	trans	-63.9	-44.7	178.2	-170.4	-172.1	145.6	0	0	111.7	T482 L701 Q702 R707 D708 R709	T482-E705 HydrophobicContact CG2-CB 4.11Å; T482-E705 HydrophobicContact CG2-CG 4.03Å; T482-E705 WeakPolarHBondContact CG2-OE1 3.45Å; T482-E705 WeakPolarHBondContact CG2-OE2 3.27Å; T482-E705 PolarHBondContact OG1-OE1 3.03Å; L701-E705 PolarHBondContact O-N 2.84Å; Q702-E705 PolarHBondContact O-N 2.86Å; E705-R707 VanDerWaalsContact C-N 3.34Å; E705-R707 PolarHBondContact O-N 3.31Å; E705-D708 PolarHBondContact O-N 3.39Å; E705-R709 WeakPolarHBondContact O-CG 3.18Å; E705-R709 PolarHBondContact O-N 2.88Å
706	I	86.6	Confident	82.8	Confident	2 Å²	2	37 Å²	37	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-60	-45.8	175.6	-65.5	166.2	0	0	0	110.2	T482 Y485 I486 L683 Q702 D708 R709 V710 F724	T482-I706 HydrophobicContact CG2-CG1 4.18Å; Y485-I706 HydrophobicContact CD2-CD1 3.94Å; Y485-I706 HydrophobicContact CG-CD1 3.89Å; I486-I706 HydrophobicContact CD1-CG2 4.01Å; L683-I706 HydrophobicContact CD1-CD1 4.09Å; Q702-I706 VanDerWaalsContact O-CG1 3.3Å; Q702-I706 WeakPolarHBondContact O-CG1 3.12Å; Q702-I706 PolarHBondContact O-N 3.16Å; I706-D708 VanDerWaalsContact C-N 3.32Å; I706-D708 PolarHBondContact O-N 2.79Å; I706-R709 PolarHBondContact O-N 3.4Å; I706-V710 HydrophobicContact CG2-CG2 4.17Å; I706-V710 WeakPolarHBondContact O-CB 3.22Å; I706-V710 VanDerWaalsContact O-CG2 3.23Å; I706-V710 WeakPolarHBondContact O-CG2 3.19Å; I706-V710 PolarHBondContact O-N 2.9Å; I706-F724 HydrophobicContact CB-CE2 4.39Å; I706-F724 HydrophobicContact CG2-CD2 4.22Å; I706-F724 HydrophobicContact CG2-CE2 3.84Å
707	R	87.4	Confident	82.6	Confident	32 Å²	32	35.6 Å²	35.6	12%	0.121	19%	0.193	C	C	.	.	H	α-helix	trans	-55.5	-47.8	176.6	179.3	-166	74.2	178.2	2.9	111.2	L703 L704 E705 V710 N711 F724	L703-R707 VanDerWaalsContact O-CB 3.32Å; L703-R707 WeakPolarHBondContact O-CB 3.44Å; L703-R707 PolarHBondContact O-N 2.96Å; L704-R707 WeakPolarHBondContact O-CB 3.33Å; L704-R707 PolarHBondContact O-N 2.84Å; E705-R707 VanDerWaalsContact C-N 3.34Å; E705-R707 PolarHBondContact O-N 3.31Å; R707-V710 PolarHBondContact O-N 3.3Å; R707-N711 VanDerWaalsContact O-CB 3.25Å; R707-N711 WeakPolarHBondContact O-CB 2.92Å; R707-N711 PolarHBondContact O-N 3.39Å; R707-F724 HydrophobicContact CB-CB 4.28Å; R707-F724 HydrophobicContact CB-CD1 3.9Å; R707-F724 HydrophobicContact CB-CD2 4.02Å; R707-F724 HydrophobicContact CB-CE1 4.17Å; R707-F724 HydrophobicContact CB-CE2 4.3Å; R707-F724 HydrophobicContact CB-CG 3.8Å; R707-F724 HydrophobicContact CB-CZ 4.37Å; R707-F724 HydrophobicContact CG-CB 3.91Å; R707-F724 HydrophobicContact CG-CD1 3.79Å; R707-F724 HydrophobicContact CG-CE1 4.44Å; R707-F724 HydrophobicContact CG-CG 3.83Å
708	D	85.1	Confident	82.5	Confident	63 Å²	63	42.3 Å²	42.3	34%	0.337	22%	0.222	S	C	.	.	H	α-helix	trans	-69.3	-41.4	-177.1	-74.5	-7.5	0	0	0	112.3	L704 E705 I706 K712 Y759	L704-D708 PolarHBondContact O-N 2.76Å; E705-D708 PolarHBondContact O-N 3.39Å; I706-D708 VanDerWaalsContact C-N 3.32Å; I706-D708 PolarHBondContact O-N 2.79Å; D708-K712 VanDerWaalsContact O-CB 3.25Å; D708-K712 WeakPolarHBondContact O-CB 3.3Å; D708-K712 PolarHBondContact O-N 3.1Å; D708-Y759 PolarHBondContact OD1-OH 3.45Å
709	R	85.6	Confident	82.6	Confident	81 Å²	81	47.5 Å²	47.5	31%	0.306	24%	0.237	S	C	.	.	H	α-helix	trans	-63.2	-43.1	175	-69.6	-179.2	110.7	-169.7	0	111.7	T482 D483 F488 E705 I706	T482-R709 PolarHBondContact OG1-NH1 3.19Å; D483-R709 IonicContact OD1-CZ 3.08Å; D483-R709 IonicContact OD1-NH1 3.25Å; D483-R709 PolarHBondContact OD1-NH1 3.1Å; D483-R709 IonicContact OD1-NH2 3.85Å; D483-R709 PolarHBondContact OD1-NH2 3.46Å; F488-R709 HydrophobicContact CD2-CB 4.39Å; F488-R709 HydrophobicContact CE1-CB 4.29Å; F488-R709 HydrophobicContact CE2-CB 3.71Å; F488-R709 HydrophobicContact CE2-CG 4.35Å; F488-R709 HydrophobicContact CZ-CB 3.65Å; E705-R709 WeakPolarHBondContact O-CG 3.18Å; E705-R709 PolarHBondContact O-N 2.88Å; I706-R709 PolarHBondContact O-N 3.4Å
710	V	87.9	Confident	82.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.8	-47.3	178.5	171.6	0	0	0	0	111.6	I486 F488 F621 I706 R707 K712 L713 L723 F724 L727	I486-V710 HydrophobicContact CD1-CG2 3.82Å; F488-V710 HydrophobicContact CZ-CG2 4.11Å; F621-V710 HydrophobicContact CE2-CG1 4.11Å; I706-V710 HydrophobicContact CG2-CG2 4.17Å; I706-V710 WeakPolarHBondContact O-CB 3.22Å; I706-V710 VanDerWaalsContact O-CG2 3.23Å; I706-V710 WeakPolarHBondContact O-CG2 3.19Å; I706-V710 PolarHBondContact O-N 2.9Å; R707-V710 PolarHBondContact O-N 3.3Å; V710-K712 VanDerWaalsContact C-N 3.29Å; V710-K712 PolarHBondContact O-N 3.3Å; V710-L713 PolarHBondContact O-N 3.39Å; V710-L713 VanDerWaalsContact O-N 3.16Å; V710-L723 HydrophobicContact CG1-CB 3.76Å; V710-F724 HydrophobicContact CG1-CB 4.44Å; V710-L727 HydrophobicContact CG1-CD1 4.42Å; V710-L727 HydrophobicContact CG2-CD1 4.19Å
711	N	89.1	Confident	83.1	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.011	26%	0.26	C	S	.	.	H	α-helix	trans	-72	-21.7	-178.4	-73.1	-15.4	0	0	0	113.1	R707 L713 S714 L721 L723 F724 Y759	R707-N711 VanDerWaalsContact O-CB 3.25Å; R707-N711 WeakPolarHBondContact O-CB 2.92Å; R707-N711 PolarHBondContact O-N 3.39Å; N711-L713 PolarHBondContact O-N 3.23Å; N711-S714 WeakPolarHBondContact O-CB 3.42Å; N711-S714 PolarHBondContact O-N 2.68Å; N711-S714 VanDerWaalsContact O-N 3.11Å; N711-S714 PolarHBondContact O-OG 3.14Å; N711-L721 PolarHBondContact OD1-O 3.48Å; N711-L723 PolarHBondContact OD1-N 3.14Å; N711-F724 PolarHBondContact OD1-N 2.99Å; N711-Y759 HydrophobicContact CB-CE2 4.16Å
712	K	85.1	Confident	83.4	Confident	162 Å²	162	52 Å²	52	70%	0.704	25%	0.253	S	S	*	.	H	α-helix	trans	-64.5	-25.7	170.8	-171.5	175.5	-178.3	179.8	0	112.8	D708 V710 S714	D708-K712 VanDerWaalsContact O-CB 3.25Å; D708-K712 WeakPolarHBondContact O-CB 3.3Å; D708-K712 PolarHBondContact O-N 3.1Å; V710-K712 VanDerWaalsContact C-N 3.29Å; V710-K712 PolarHBondContact O-N 3.3Å; K712-S714 PolarHBondContact O-N 3.07Å
713	L	86.6	Confident	83.8	Confident	29 Å²	29	51.2 Å²	51.2	15%	0.152	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	14.5	174.1	-61.7	173.3	0	0	0	112.8	F488 M549 K619 F621 V710 N711	F488-L713 HydrophobicContact CD1-CD1 4.11Å; F488-L713 HydrophobicContact CE1-CD1 3.9Å; M549-L713 HydrophobicContact CE-CD1 4.11Å; M549-L713 HydrophobicContact CE-CD2 4.16Å; M549-L713 HydrophobicContact SD-CD1 4.3Å; K619-L713 HydrophobicContact CG-CD2 4.48Å; F621-L713 HydrophobicContact CD2-CB 4.14Å; F621-L713 HydrophobicContact CD2-CD1 4.4Å; F621-L713 HydrophobicContact CE2-CB 3.83Å; F621-L713 HydrophobicContact CE2-CD1 3.53Å; F621-L713 HydrophobicContact CE2-CG 4.31Å; F621-L713 HydrophobicContact CZ-CD1 3.64Å; V710-L713 PolarHBondContact O-N 3.39Å; V710-L713 VanDerWaalsContact O-N 3.16Å; N711-L713 PolarHBondContact O-N 3.23Å
714	S	86.6	Confident	84	Confident	19 Å²	19	51.3 Å²	51.3	13%	0.133	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-66.1	145.9	172	58.7	0	0	0	0	111.4	N711 K712 R720	N711-S714 WeakPolarHBondContact O-CB 3.42Å; N711-S714 PolarHBondContact O-N 2.68Å; N711-S714 VanDerWaalsContact O-N 3.11Å; N711-S714 PolarHBondContact O-OG 3.14Å; K712-S714 PolarHBondContact O-N 3.07Å; S714-R720 WeakPolarHBondContact OG-CB 3.41Å; S714-R720 WeakPolarHBondContact OG-CG 3.42Å
715	P	79.1	Confident	84.2	Confident	9 Å²	9	51.4 Å²	51.4	6%	0.058	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-61.4	159	177.3	26.6	-36.2	0	0	0	112	W584 T620 G717 L721	W584-P715 HydrophobicContact CD2-CB 3.65Å; W584-P715 HydrophobicContact CD2-CG 3.52Å; W584-P715 HydrophobicContact CE3-CB 3.49Å; W584-P715 VanDerWaalsContact CE3-CB 3.49Å; W584-P715 HydrophobicContact CE3-CG 3.74Å; W584-P715 HydrophobicContact CG-CB 4.49Å; W584-P715 HydrophobicContact CG-CG 3.85Å; W584-P715 HydrophobicContact CH2-CB 3.5Å; W584-P715 VanDerWaalsContact CH2-CB 3.5Å; W584-P715 HydrophobicContact CH2-CG 4.45Å; W584-P715 HydrophobicContact CZ2-CB 3.63Å; W584-P715 HydrophobicContact CZ2-CG 4.25Å; W584-P715 HydrophobicContact CZ3-CB 3.4Å; W584-P715 HydrophobicContact CZ3-CG 4.18Å; T620-P715 HydrophobicContact CG2-CB 4.03Å; P715-G717 PolarHBondContact O-N 2.92Å; P715-L721 HydrophobicContact CG-CD1 3.34Å; P715-L721 HydrophobicContact CG-CG 3.96Å
716	P	72.3	Confident	84.4	Confident	54 Å²	54	48.4 Å²	48.4	35%	0.351	24%	0.237	S	C	.	.	S	Bend	trans	-61.2	130.3	176.4	23.9	-32.5	0	0	0	112.5	F593 W618	F593-P716 HydrophobicContact CD2-CG 3.92Å; F593-P716 HydrophobicContact CE2-CG 3.84Å; W618-P716 HydrophobicContact CE3-CB 4.02Å; W618-P716 HydrophobicContact CE3-CG 3.61Å; W618-P716 HydrophobicContact CH2-CB 4.37Å; W618-P716 HydrophobicContact CZ3-CB 3.51Å; W618-P716 HydrophobicContact CZ3-CG 3.6Å
717	G	71.1	Confident	84.6	Confident	62 Å²	62	48.4 Å²	48.4	64%	0.639	24%	0.237	S	C	*	.	S	Bend	trans	-169.8	171.4	177.4	0	0	0	0	0	111.3	P715 R719	P715-G717 PolarHBondContact O-N 2.92Å; G717-R719 PolarHBondContact O-N 2.88Å
718	Q	70.4	Confident	84.7	Confident	211 Å²	211	46.9 Å²	46.9	99%	0.986	23%	0.231	S	C	*	.	S	Bend	trans	-61.1	-30.2	176.7	-72.6	-179.6	-10.7	0	0	112.6
719	R	80.4	Confident	84.8	Confident	140 Å²	140	47.2 Å²	47.2	53%	0.528	23%	0.228	S	C	.	.	S	Bend	trans	-133.4	149	175.7	-69	-177.4	178.7	178.2	-5	109.3	G717 D760 T762	G717-R719 PolarHBondContact O-N 2.88Å; R719-D760 IonicContact NH2-OD2 2.74Å; R719-T762 HydrophobicContact CB-CG2 3.74Å; R719-T762 HydrophobicContact CG-CG2 4.42Å
720	R	85.3	Confident	84.9	Confident	108 Å²	108	46.1 Å²	46.1	41%	0.408	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	140.1	178.4	-68.9	-175.2	-175.1	162	2.5	110.1	S714 Y759 T761 T762	S714-R720 WeakPolarHBondContact OG-CB 3.41Å; S714-R720 WeakPolarHBondContact OG-CG 3.42Å; R720-Y759 HydrophobicContact CB-CD2 4.23Å; R720-Y759 HydrophobicContact CB-CE2 4.48Å; R720-Y759 HydrophobicContact CG-CD2 4.42Å; R720-T761 HydrophobicContact CB-CG2 4.39Å; R720-T761 CarbonylContact O-C 3.53Å; R720-T761 WeakPolarHBondContact O-CA 3.36Å; R720-T761 WeakPolarHBondContact O-CB 3.43Å; R720-T762 PolarHBondContact O-N 2.97Å; R720-T762 PolarHBondContact O-OG1 3.13Å
721	L	87.1	Confident	84.8	Confident	24 Å²	24	47.7 Å²	47.7	13%	0.126	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	140.3	172.7	-58.9	-174	0	0	0	110.2	W584 N711 P715 L723 T762 L764	W584-L721 HydrophobicContact CB-CD1 3.78Å; W584-L721 HydrophobicContact CG-CD1 4.07Å; N711-L721 PolarHBondContact OD1-O 3.48Å; P715-L721 HydrophobicContact CG-CD1 3.34Å; P715-L721 HydrophobicContact CG-CG 3.96Å; L721-L723 VanDerWaalsContact C-N 3.26Å; L721-L723 HydrophobicContact CB-CD2 4.07Å; L721-L723 HydrophobicContact CB-CG 4.34Å; L721-L723 PolarHBondContact O-N 2.87Å; L721-T762 WeakPolarHBondContact CD2-OG1 3.13Å; L721-L764 HydrophobicContact CD1-CD1 4.22Å; L721-L764 HydrophobicContact CD1-CD2 3.99Å; L721-L764 HydrophobicContact CD1-CG 4.48Å
722	D	88.8	Confident	84.6	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.027	23%	0.232	C	C	.	.			trans	-78.1	77	173.2	-173.8	13.1	0	0	0	110.9	F724 S725 Q743 T762	D722-F724 VanDerWaalsContact C-N 3.33Å; D722-S725 VanDerWaalsContact CG-OG 3.22Å; D722-S725 PolarHBondContact OD1-N 2.66Å; D722-S725 PolarHBondContact OD1-OG 3.46Å; D722-S725 WeakPolarHBondContact OD2-CB 3.26Å; D722-S725 PolarHBondContact OD2-OG 2.82Å; D722-Q743 PolarHBondContact OD2-NE2 2.89Å; D722-T762 PolarHBondContact N-O 3.22Å
723	L	89.6	Confident	84.7	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-71.7	-29.8	178.7	-65.8	-166.9	0	0	0	112.1	P575 F576 F621 V710 N711 L721 C726 L727 L764	P575-L723 HydrophobicContact CB-CD2 4.21Å; P575-L723 HydrophobicContact CG-CD2 3.8Å; F576-L723 HydrophobicContact CE2-CB 4.26Å; F576-L723 WeakPolarHBondContact CE2-O 3.18Å; F621-L723 HydrophobicContact CD2-CD1 3.92Å; V710-L723 HydrophobicContact CG1-CB 3.76Å; N711-L723 PolarHBondContact OD1-N 3.14Å; L721-L723 VanDerWaalsContact C-N 3.26Å; L721-L723 HydrophobicContact CB-CD2 4.07Å; L721-L723 HydrophobicContact CB-CG 4.34Å; L721-L723 PolarHBondContact O-N 2.87Å; L723-C726 WeakPolarHBondContact O-CB 3.38Å; L723-C726 PolarHBondContact O-N 2.88Å; L723-L727 WeakPolarHBondContact O-CB 3.44Å; L723-L727 PolarHBondContact O-N 3.11Å; L723-L764 HydrophobicContact CD2-CD2 4.11Å
724	F	90.6	Very high	84.8	Confident	2 Å²	2	48 Å²	48	1%	0.009	23%	0.234	C	C	.	.	H	α-helix	trans	-60.4	-46.7	178.1	-178.7	-110.4	0	0	0	111.9	L703 I706 R707 V710 N711 D722 C726 L727 L728 L746	L703-F724 HydrophobicContact CD2-CZ 4.31Å; I706-F724 HydrophobicContact CB-CE2 4.39Å; I706-F724 HydrophobicContact CG2-CD2 4.22Å; I706-F724 HydrophobicContact CG2-CE2 3.84Å; R707-F724 HydrophobicContact CB-CB 4.28Å; R707-F724 HydrophobicContact CB-CD1 3.9Å; R707-F724 HydrophobicContact CB-CD2 4.02Å; R707-F724 HydrophobicContact CB-CE1 4.17Å; R707-F724 HydrophobicContact CB-CE2 4.3Å; R707-F724 HydrophobicContact CB-CG 3.8Å; R707-F724 HydrophobicContact CB-CZ 4.37Å; R707-F724 HydrophobicContact CG-CB 3.91Å; R707-F724 HydrophobicContact CG-CD1 3.79Å; R707-F724 HydrophobicContact CG-CE1 4.44Å; R707-F724 HydrophobicContact CG-CG 3.83Å; V710-F724 HydrophobicContact CG1-CB 4.44Å; N711-F724 PolarHBondContact OD1-N 2.99Å; D722-F724 VanDerWaalsContact C-N 3.33Å; F724-C726 VanDerWaalsContact C-N 3.31Å; F724-C726 PolarHBondContact O-N 2.68Å; F724-L727 WeakPolarHBondContact O-CB 3.29Å; F724-L727 PolarHBondContact O-N 3.29Å; F724-L727 VanDerWaalsContact O-N 3.12Å; F724-L728 HydrophobicContact CD1-CD1 4.09Å; F724-L728 HydrophobicContact CD1-CG 4.42Å; F724-L728 HydrophobicContact CE1-CD1 3.59Å; F724-L728 HydrophobicContact CE1-CG 4.12Å; F724-L728 HydrophobicContact CE2-CD2 4.31Å; F724-L728 HydrophobicContact CE2-CG 4.45Å; F724-L728 HydrophobicContact CZ-CD1 3.95Å; F724-L728 HydrophobicContact CZ-CD2 4.07Å; F724-L728 HydrophobicContact CZ-CG 4.13Å; F724-L728 WeakPolarHBondContact O-CG 3.48Å; F724-L728 PolarHBondContact O-N 3.42Å; F724-L746 HydrophobicContact CE1-CD1 3.88Å; F724-L746 HydrophobicContact CZ-CD1 4.48Å
725	S	89.6	Confident	84.9	Confident	10 Å²	10	49.3 Å²	49.3	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-63.2	-36.7	175.5	-64.4	0	0	0	0	113.4	D722 L727 L728 R729 Q743	D722-S725 VanDerWaalsContact CG-OG 3.22Å; D722-S725 PolarHBondContact OD1-N 2.66Å; D722-S725 PolarHBondContact OD1-OG 3.46Å; D722-S725 WeakPolarHBondContact OD2-CB 3.26Å; D722-S725 PolarHBondContact OD2-OG 2.82Å; S725-L727 VanDerWaalsContact C-N 3.33Å; S725-L728 PolarHBondContact O-N 3.39Å; S725-R729 WeakPolarHBondContact O-CB 3.3Å; S725-R729 PolarHBondContact O-N 2.95Å; S725-Q743 PolarHBondContact OG-NE2 2.85Å
726	C	88.8	Confident	85.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-40.9	173.3	-71.6	0	0	0	0	111.8	F576 L723 F724 R729 H730 C765	F576-C726 HydrophobicContact CD2-CB 3.79Å; F576-C726 HydrophobicContact CE2-CB 4.45Å; L723-C726 WeakPolarHBondContact O-CB 3.38Å; L723-C726 PolarHBondContact O-N 2.88Å; F724-C726 VanDerWaalsContact C-N 3.31Å; F724-C726 PolarHBondContact O-N 2.68Å; C726-R729 PolarHBondContact O-N 2.83Å; C726-H730 WeakPolarHBondContact O-CB 3.44Å; C726-H730 PolarHBondContact O-CD2 2.81Å; C726-H730 PolarHBondContact O-N 2.86Å; C726-C765 HydrophobicContact CB-CB 3.98Å; C726-C765 WeakPolarHBondContact CB-SG 3.16Å; C726-C765 WeakPolarHBondContact SG-CB 3.33Å; C726-C765 PolarHBondContact SG-N 3.49Å; C726-C765 VanDerWaalsContact SG-N 3.38Å; C726-C765 CovalentContact SG-SG 2.03Å; C726-C765 PolarHBondContact SG-SG 2.93Å
727	L	89.6	Confident	86	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-47.9	176.9	-177.4	156.7	0	0	0	110.6	I486 F576 F675 V710 L723 F724 S725 R729 R731 L732	I486-L727 HydrophobicContact CD1-CD1 3.97Å; F576-L727 HydrophobicContact CD2-CB 4.04Å; F576-L727 HydrophobicContact CE1-CB 4.32Å; F576-L727 HydrophobicContact CE1-CD1 3.99Å; F576-L727 HydrophobicContact CE1-CG 4.29Å; F576-L727 HydrophobicContact CE2-CB 3.78Å; F576-L727 HydrophobicContact CE2-CD1 4.49Å; F576-L727 HydrophobicContact CG-CB 4.43Å; F576-L727 HydrophobicContact CZ-CB 3.94Å; F576-L727 HydrophobicContact CZ-CD1 3.82Å; F576-L727 HydrophobicContact CZ-CG 4.25Å; F675-L727 HydrophobicContact CE2-CD1 4Å; F675-L727 HydrophobicContact CE2-CD2 3.77Å; F675-L727 HydrophobicContact CE2-CG 4.12Å; F675-L727 HydrophobicContact CZ-CD2 3.84Å; F675-L727 HydrophobicContact CZ-CG 4.29Å; V710-L727 HydrophobicContact CG1-CD1 4.42Å; V710-L727 HydrophobicContact CG2-CD1 4.19Å; L723-L727 WeakPolarHBondContact O-CB 3.44Å; L723-L727 PolarHBondContact O-N 3.11Å; F724-L727 WeakPolarHBondContact O-CB 3.29Å; F724-L727 PolarHBondContact O-N 3.29Å; F724-L727 VanDerWaalsContact O-N 3.12Å; S725-L727 VanDerWaalsContact C-N 3.33Å; L727-R729 VanDerWaalsContact C-N 3.32Å; L727-R729 PolarHBondContact O-N 3.48Å; L727-R731 WeakPolarHBondContact O-CA 2.9Å; L727-R731 WeakPolarHBondContact O-CB 3.37Å; L727-R731 PolarHBondContact O-N 3.47Å; L727-L732 HydrophobicContact CD2-CD1 3.76Å; L727-L732 PolarHBondContact O-N 3.29Å
728	L	89.6	Confident	86.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.8	-43.8	175.1	-68.6	-172.1	0	0	0	112.4	I684 F724 S725 L732 K733 L734 V739 I742	I684-L728 HydrophobicContact CD1-CD2 4.12Å; F724-L728 HydrophobicContact CD1-CD1 4.09Å; F724-L728 HydrophobicContact CD1-CG 4.42Å; F724-L728 HydrophobicContact CE1-CD1 3.59Å; F724-L728 HydrophobicContact CE1-CG 4.12Å; F724-L728 HydrophobicContact CE2-CD2 4.31Å; F724-L728 HydrophobicContact CE2-CG 4.45Å; F724-L728 HydrophobicContact CZ-CD1 3.95Å; F724-L728 HydrophobicContact CZ-CD2 4.07Å; F724-L728 HydrophobicContact CZ-CG 4.13Å; F724-L728 WeakPolarHBondContact O-CG 3.48Å; F724-L728 PolarHBondContact O-N 3.42Å; S725-L728 PolarHBondContact O-N 3.39Å; L728-L732 HydrophobicContact CD2-CD1 3.44Å; L728-L732 VanDerWaalsContact CD2-CD1 3.44Å; L728-L732 VanDerWaalsContact O-CB 3.31Å; L728-L732 WeakPolarHBondContact O-CB 3.21Å; L728-K733 PolarHBondContact O-N 3.32Å; L728-L734 HydrophobicContact CB-CD1 4.2Å; L728-L734 HydrophobicContact CD2-CD1 4.27Å; L728-L734 PolarHBondContact O-N 3.04Å; L728-V739 HydrophobicContact CB-CG2 3.91Å; L728-V739 HydrophobicContact CD1-CG1 4.39Å; L728-I742 HydrophobicContact CD1-CD1 4.28Å; L728-I742 HydrophobicContact CD1-CG2 4.23Å
729	R	88	Confident	87.6	Confident	71 Å²	71	44.8 Å²	44.8	27%	0.268	21%	0.214	S	C	.	.	H	α-helix	trans	-72.4	-50.7	-178.6	-167.4	-161	-173.5	103.6	-13.6	112.9	S725 C726 L727 K733 S766	S725-R729 WeakPolarHBondContact O-CB 3.3Å; S725-R729 PolarHBondContact O-N 2.95Å; C726-R729 PolarHBondContact O-N 2.83Å; L727-R729 VanDerWaalsContact C-N 3.32Å; L727-R729 PolarHBondContact O-N 3.48Å; R729-K733 WeakPolarHBondContact O-CA 3.31Å; R729-K733 PolarHBondContact O-N 3.24Å; R729-S766 PolarHBondContact NH1-O 2.54Å; R729-S766 PolarHBondContact NH1-OXT 2.93Å; R729-S766 PolarHBondContact NH2-O 3.32Å
730	H	86.9	Confident	88	Confident	57 Å²	57	42.1 Å²	42.1	26%	0.264	21%	0.213	S	C	.	.	H	α-helix	trans	-90.6	-37.8	-168	-71.2	-65.7	0	0	0	113.4	F576 E582 C726	F576-H730 HydrophobicContact CB-CB 3.99Å; E582-H730 IonicContact OE1-NE2 2.65Å; E582-H730 IonicContact OE2-CD2 3.52Å; E582-H730 IonicContact OE2-CE1 3.3Å; E582-H730 PolarHBondContact OE2-CE1 3.48Å; E582-H730 IonicContact OE2-NE2 3.26Å; E582-H730 PolarHBondContact OE2-NE2 2.98Å; C726-H730 WeakPolarHBondContact O-CB 3.44Å; C726-H730 PolarHBondContact O-CD2 2.81Å; C726-H730 PolarHBondContact O-N 2.86Å
731	R	85.2	Confident	88.2	Confident	33 Å²	33	42 Å²	42	13%	0.125	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-45.7	179.8	-67.1	-58.5	-151.5	-172.1	3.4	112.4	L546 F576 E623 F675 L727 K733	L546-R731 PolarHBondContact O-NH2 2.82Å; F576-R731 HydrophobicContact CB-CG 4.28Å; F576-R731 HydrophobicContact CD1-CG 3.87Å; F576-R731 HydrophobicContact CG-CG 4.35Å; E623-R731 VanDerWaalsContact CD-NH1 3.27Å; E623-R731 IonicContact OE1-CZ 3.31Å; E623-R731 IonicContact OE1-NH1 3.01Å; E623-R731 PolarHBondContact OE1-NH1 3.1Å; E623-R731 IonicContact OE1-NH2 2.75Å; E623-R731 IonicContact OE2-CZ 3.83Å; E623-R731 VanDerWaalsContact OE2-CZ 3.26Å; E623-R731 IonicContact OE2-NH1 2.84Å; E623-R731 PolarHBondContact OE2-NH1 2.93Å; E623-R731 IonicContact OE2-NH2 3.81Å; E623-R731 PolarHBondContact OE2-NH2 3.38Å; F675-R731 HydrophobicContact CE1-CB 3.74Å; F675-R731 HydrophobicContact CE1-CG 4.37Å; F675-R731 HydrophobicContact CZ-CB 3.96Å; L727-R731 WeakPolarHBondContact O-CA 2.9Å; L727-R731 WeakPolarHBondContact O-CB 3.37Å; L727-R731 PolarHBondContact O-N 3.47Å; R731-K733 VanDerWaalsContact C-N 3.35Å
732	L	86.8	Confident	88.2	Confident	2 Å²	2	41 Å²	41	1%	0.01	21%	0.207	C	C	.	.	S	Bend	trans	-83.1	-13.9	179.1	-73	143.9	0	0	0	113.2	F675 P677 I680 R681 L727 L728 L734	F675-L732 HydrophobicContact CZ-CD1 4.41Å; F675-L732 HydrophobicContact CZ-CG 4.36Å; P677-L732 HydrophobicContact CB-CD2 4.36Å; P677-L732 WeakPolarHBondContact O-CD2 3.48Å; I680-L732 HydrophobicContact CB-CD1 4.31Å; I680-L732 HydrophobicContact CB-CD2 4.12Å; I680-L732 HydrophobicContact CG2-CD1 3.67Å; I680-L732 HydrophobicContact CG2-CD2 4.15Å; R681-L732 HydrophobicContact CG-CD2 3.55Å; R681-L732 PolarHBondContact NH2-O 3.01Å; L727-L732 HydrophobicContact CD2-CD1 3.76Å; L727-L732 PolarHBondContact O-N 3.29Å; L728-L732 HydrophobicContact CD2-CD1 3.44Å; L728-L732 VanDerWaalsContact CD2-CD1 3.44Å; L728-L732 VanDerWaalsContact O-CB 3.31Å; L728-L732 WeakPolarHBondContact O-CB 3.21Å; L732-L734 VanDerWaalsContact C-N 3.32Å; L732-L734 HydrophobicContact CB-CD1 4.36Å; L732-L734 HydrophobicContact CB-CG 4.05Å
733	K	87	Confident	88.1	Confident	173 Å²	173	42.6 Å²	42.6	75%	0.752	22%	0.215	S	C	*	.			trans	62.4	32.9	-179.4	-58.4	-178.4	-179.5	174.3	0	113.7	L728 R729 R731	L728-K733 PolarHBondContact O-N 3.32Å; R729-K733 WeakPolarHBondContact O-CA 3.31Å; R729-K733 PolarHBondContact O-N 3.24Å; R731-K733 VanDerWaalsContact C-N 3.35Å
734	L	87.7	Confident	88	Confident	26 Å²	26	45.4 Å²	45.4	14%	0.136	23%	0.234	C	C	.	.			trans	-75.6	148.9	176.3	-60.3	179.1	0	0	0	111.6	I684 L728 L732 E738 V739 I742	I684-L734 HydrophobicContact CD1-CD1 3.75Å; L728-L734 HydrophobicContact CB-CD1 4.2Å; L728-L734 HydrophobicContact CD2-CD1 4.27Å; L728-L734 PolarHBondContact O-N 3.04Å; L732-L734 VanDerWaalsContact C-N 3.32Å; L732-L734 HydrophobicContact CB-CD1 4.36Å; L732-L734 HydrophobicContact CB-CG 4.05Å; L734-E738 HydrophobicContact CB-CB 4.3Å; L734-V739 HydrophobicContact CB-CG2 4.03Å; L734-I742 HydrophobicContact CD1-CD1 3.91Å
735	S	88.7	Confident	87.8	Confident	46 Å²	46	47 Å²	47	32%	0.322	25%	0.248	S	C	.	.			trans	-69.6	158.2	173.8	66.3	0	0	0	0	111.8	S737 E738 V739	S735-S737 PolarHBondContact O-N 3.25Å; S735-S737 PolarHBondContact OG-OG 3.47Å; S735-E738 WeakPolarHBondContact CB-OE2 3.26Å; S735-E738 PolarHBondContact N-OE2 3Å; S735-E738 PolarHBondContact O-N 2.83Å; S735-E738 VanDerWaalsContact O-N 3.16Å; S735-E738 VanDerWaalsContact OG-CD 3.24Å; S735-E738 VanDerWaalsContact OG-CG 3.24Å; S735-E738 WeakPolarHBondContact OG-CG 3.47Å; S735-E738 PolarHBondContact OG-N 2.94Å; S735-E738 PolarHBondContact OG-OE2 3.27Å; S735-V739 WeakPolarHBondContact O-CG2 3.38Å; S735-V739 PolarHBondContact O-N 3.17Å; S735-V739 VanDerWaalsContact O-N 3.1Å
736	T	86.4	Confident	87.6	Confident	72 Å²	72	46.6 Å²	46.6	44%	0.442	25%	0.245	S	C	.	.	H	α-helix	trans	-52.8	-42.5	174	41.7	0	0	0	0	112.4	V739 V740	T736-V739 PolarHBondContact O-N 3.48Å; T736-V740 WeakPolarHBondContact O-CG2 3.44Å; T736-V740 PolarHBondContact O-N 3.37Å
737	S	87.7	Confident	87.3	Confident	81 Å²	81	52.5 Å²	52.5	57%	0.566	27%	0.273	S	S	*	.	H	α-helix	trans	-64	-40.9	179.2	40.1	0	0	0	0	112.8	S735 R741	S735-S737 PolarHBondContact O-N 3.25Å; S735-S737 PolarHBondContact OG-OG 3.47Å; S737-R741 WeakPolarHBondContact O-CB 3.48Å; S737-R741 PolarHBondContact O-N 2.92Å
738	E	88.3	Confident	87	Confident	77 Å²	77	55.3 Å²	55.3	36%	0.36	30%	0.296	S	S	.	.	H	α-helix	trans	-67.8	-41.5	178.6	-72.8	163.9	135.6	0	0	111.4	L734 S735 R741 I742	L734-E738 HydrophobicContact CB-CB 4.3Å; S735-E738 WeakPolarHBondContact CB-OE2 3.26Å; S735-E738 PolarHBondContact N-OE2 3Å; S735-E738 PolarHBondContact O-N 2.83Å; S735-E738 VanDerWaalsContact O-N 3.16Å; S735-E738 VanDerWaalsContact OG-CD 3.24Å; S735-E738 VanDerWaalsContact OG-CG 3.24Å; S735-E738 WeakPolarHBondContact OG-CG 3.47Å; S735-E738 PolarHBondContact OG-N 2.94Å; S735-E738 PolarHBondContact OG-OE2 3.27Å; E738-R741 WeakPolarHBondContact O-CB 3.42Å; E738-R741 PolarHBondContact O-N 3.41Å; E738-I742 VanDerWaalsContact O-CG1 3.29Å; E738-I742 WeakPolarHBondContact O-CG1 3.3Å; E738-I742 PolarHBondContact O-N 2.87Å
739	V	88.5	Confident	86.6	Confident	11 Å²	11	55.9 Å²	55.9	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-62.3	-47.6	177	176.8	0	0	0	0	110.9	L728 L734 S735 T736 R741 I742 Q743	L728-V739 HydrophobicContact CB-CG2 3.91Å; L728-V739 HydrophobicContact CD1-CG1 4.39Å; L734-V739 HydrophobicContact CB-CG2 4.03Å; S735-V739 WeakPolarHBondContact O-CG2 3.38Å; S735-V739 PolarHBondContact O-N 3.17Å; S735-V739 VanDerWaalsContact O-N 3.1Å; T736-V739 PolarHBondContact O-N 3.48Å; V739-R741 VanDerWaalsContact C-N 3.29Å; V739-R741 PolarHBondContact O-N 3Å; V739-I742 PolarHBondContact O-N 2.67Å; V739-Q743 HydrophobicContact CG1-CG 4.47Å; V739-Q743 WeakPolarHBondContact O-CG 3.32Å; V739-Q743 PolarHBondContact O-N 3.43Å
740	V	87.6	Confident	86	Confident	83 Å²	83	53.1 Å²	53.1	50%	0.503	29%	0.289	S	S	.	.	H	α-helix	trans	-60.7	-40.2	177.7	171.4	0	0	0	0	111.3	T736 Q743 S744	T736-V740 WeakPolarHBondContact O-CG2 3.44Å; T736-V740 PolarHBondContact O-N 3.37Å; V740-Q743 PolarHBondContact O-N 2.82Å; V740-S744 WeakPolarHBondContact O-CB 3.19Å; V740-S744 PolarHBondContact O-N 2.97Å; V740-S744 PolarHBondContact O-OG 2.86Å
741	R	89.4	Confident	85.5	Confident	106 Å²	106	54.2 Å²	54.2	40%	0.4	31%	0.308	S	S	.	.	H	α-helix	trans	-60.7	-49.7	176.2	-175	-175.7	74.4	126.3	-2.9	111.5	D688 S737 E738 V739 Q743 S744 A745	D688-R741 IonicContact OD1-CZ 3.59Å; D688-R741 VanDerWaalsContact OD1-CZ 3.25Å; D688-R741 IonicContact OD1-NH1 3.81Å; D688-R741 PolarHBondContact OD1-NH1 3Å; D688-R741 IonicContact OD1-NH2 3.96Å; D688-R741 PolarHBondContact OD1-NH2 3.19Å; D688-R741 IonicContact OD2-CZ 3.11Å; D688-R741 IonicContact OD2-NH1 2.73Å; D688-R741 IonicContact OD2-NH2 3.38Å; D688-R741 PolarHBondContact OD2-NH2 3.33Å; S737-R741 WeakPolarHBondContact O-CB 3.48Å; S737-R741 PolarHBondContact O-N 2.92Å; E738-R741 WeakPolarHBondContact O-CB 3.42Å; E738-R741 PolarHBondContact O-N 3.41Å; V739-R741 VanDerWaalsContact C-N 3.29Å; V739-R741 PolarHBondContact O-N 3Å; R741-Q743 VanDerWaalsContact C-N 3.34Å; R741-Q743 PolarHBondContact O-N 3.34Å; R741-S744 PolarHBondContact O-N 3.38Å; R741-S744 PolarHBondContact O-OG 2.89Å; R741-A745 PolarHBondContact O-N 2.66Å
742	I	88.2	Confident	85	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.015	33%	0.331	C	S	.	.	H	α-helix	trans	-60.9	-44.5	178	-66	163	0	0	0	110.4	I684 L728 L734 E738 V739 S744 A745 L746	I684-I742 HydrophobicContact CD1-CD1 3.91Å; I684-I742 HydrophobicContact CG1-CD1 4.14Å; I684-I742 HydrophobicContact CG2-CD1 3.89Å; L728-I742 HydrophobicContact CD1-CD1 4.28Å; L728-I742 HydrophobicContact CD1-CG2 4.23Å; L734-I742 HydrophobicContact CD1-CD1 3.91Å; E738-I742 VanDerWaalsContact O-CG1 3.29Å; E738-I742 WeakPolarHBondContact O-CG1 3.3Å; E738-I742 PolarHBondContact O-N 2.87Å; V739-I742 PolarHBondContact O-N 2.67Å; I742-S744 VanDerWaalsContact C-N 3.33Å; I742-S744 PolarHBondContact O-N 2.91Å; I742-A745 PolarHBondContact O-N 2.95Å; I742-L746 HydrophobicContact CG2-CD1 3.96Å; I742-L746 HydrophobicContact CG2-CG 4.39Å; I742-L746 WeakPolarHBondContact O-CG 3.35Å; I742-L746 PolarHBondContact O-N 3.2Å
743	Q	87.1	Confident	84.1	Confident	39 Å²	39	60.9 Å²	60.9	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-58.9	-43.7	176.2	-72.6	-168.9	-49.8	0	0	112.5	D722 S725 V739 V740 R741 L746 Q747	D722-Q743 PolarHBondContact OD2-NE2 2.89Å; S725-Q743 PolarHBondContact OG-NE2 2.85Å; V739-Q743 HydrophobicContact CG1-CG 4.47Å; V739-Q743 WeakPolarHBondContact O-CG 3.32Å; V739-Q743 PolarHBondContact O-N 3.43Å; V740-Q743 PolarHBondContact O-N 2.82Å; R741-Q743 VanDerWaalsContact C-N 3.34Å; R741-Q743 PolarHBondContact O-N 3.34Å; Q743-L746 PolarHBondContact O-N 3.3Å; Q743-Q747 WeakPolarHBondContact O-CB 3.27Å; Q743-Q747 VanDerWaalsContact O-CG 3.32Å; Q743-Q747 WeakPolarHBondContact O-CG 3.38Å; Q743-Q747 PolarHBondContact O-N 3Å
744	S	86.3	Confident	82.2	Confident	61 Å²	61	54.6 Å²	54.6	43%	0.427	32%	0.316	S	S	.	.	H	α-helix	trans	-65.1	-38.4	178.7	71.1	0	0	0	0	112.5	V740 R741 I742 Q747 A748	V740-S744 WeakPolarHBondContact O-CB 3.19Å; V740-S744 PolarHBondContact O-N 2.97Å; V740-S744 PolarHBondContact O-OG 2.86Å; R741-S744 PolarHBondContact O-N 3.38Å; R741-S744 PolarHBondContact O-OG 2.89Å; I742-S744 VanDerWaalsContact C-N 3.33Å; I742-S744 PolarHBondContact O-N 2.91Å; S744-Q747 PolarHBondContact O-N 3.41Å; S744-A748 WeakPolarHBondContact O-CB 3.39Å; S744-A748 PolarHBondContact O-N 3.4Å
745	A	85.8	Confident	80.3	Confident	35 Å²	35	61.4 Å²	61.4	29%	0.289	35%	0.352	S	S	.	.	H	α-helix	trans	-65.6	-43.5	175.8	0	0	0	0	0	111.4	L700 R741 I742 A748 F749	L700-A745 HydrophobicContact CD2-CB 4.17Å; R741-A745 PolarHBondContact O-N 2.66Å; I742-A745 PolarHBondContact O-N 2.95Å; A745-A748 PolarHBondContact O-N 2.93Å; A745-F749 WeakPolarHBondContact O-CB 3.44Å; A745-F749 PolarHBondContact O-N 3.38Å
746	L	85.6	Confident	78.4	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-64.1	-40.9	175.7	-68.7	172.8	0	0	0	112	L700 L703 L704 F724 I742 Q743 F749 N750	L700-L746 HydrophobicContact CD2-CD2 3.93Å; L703-L746 HydrophobicContact CB-CD1 4.48Å; L703-L746 HydrophobicContact CB-CD2 3.73Å; L704-L746 HydrophobicContact CD2-CB 3.89Å; L704-L746 HydrophobicContact CD2-CD2 3.82Å; L704-L746 HydrophobicContact CD2-CG 4.33Å; L704-L746 HydrophobicContact CG-CD2 3.78Å; F724-L746 HydrophobicContact CE1-CD1 3.88Å; F724-L746 HydrophobicContact CZ-CD1 4.48Å; I742-L746 HydrophobicContact CG2-CD1 3.96Å; I742-L746 HydrophobicContact CG2-CG 4.39Å; I742-L746 WeakPolarHBondContact O-CG 3.35Å; I742-L746 PolarHBondContact O-N 3.2Å; Q743-L746 PolarHBondContact O-N 3.3Å; L746-F749 PolarHBondContact O-N 2.82Å; L746-N750 VanDerWaalsContact O-CB 3.27Å; L746-N750 WeakPolarHBondContact O-CB 3.13Å; L746-N750 PolarHBondContact O-N 2.98Å
747	Q	83.7	Confident	76.6	Confident	125 Å²	125	66.6 Å²	66.6	58%	0.584	37%	0.373	S	S	*	.	H	α-helix	trans	-64.4	-44.9	176.1	-76	174.6	-12.4	0	0	112	Q743 S744 F749 N750 A751	Q743-Q747 WeakPolarHBondContact O-CB 3.27Å; Q743-Q747 VanDerWaalsContact O-CG 3.32Å; Q743-Q747 WeakPolarHBondContact O-CG 3.38Å; Q743-Q747 PolarHBondContact O-N 3Å; S744-Q747 PolarHBondContact O-N 3.41Å; Q747-F749 VanDerWaalsContact C-N 3.29Å; Q747-F749 PolarHBondContact O-N 3.38Å; Q747-N750 PolarHBondContact O-N 3.34Å; Q747-A751 PolarHBondContact O-N 3.23Å
748	A	82.4	Confident	75.2	Confident	60 Å²	60	68 Å²	68	50%	0.496	37%	0.374	S	S	.	.	H	α-helix	trans	-64.9	-33.4	177.8	0	0	0	0	0	112.7	S744 A745	S744-A748 WeakPolarHBondContact O-CB 3.39Å; S744-A748 PolarHBondContact O-N 3.4Å; A745-A748 PolarHBondContact O-N 2.93Å
749	F	80.6	Confident	74	Confident	12 Å²	12	67 Å²	67	5%	0.053	37%	0.367	C	S	.	.	H	α-helix	trans	-75.4	-43	174.5	-174.3	-106.2	0	0	0	111.9	D697 L700 L701 L704 A745 L746 Q747 A751 K752 L753	D697-F749 HydrophobicContact CB-CE2 3.9Å; D697-F749 HydrophobicContact CB-CZ 4.19Å; D697-F749 WeakPolarHBondContact OD1-CE2 3.46Å; L700-F749 HydrophobicContact CB-CB 4.46Å; L700-F749 HydrophobicContact CB-CD1 3.75Å; L700-F749 HydrophobicContact CB-CD2 4.24Å; L700-F749 HydrophobicContact CB-CE1 3.97Å; L700-F749 HydrophobicContact CB-CE2 4.44Å; L700-F749 HydrophobicContact CB-CG 3.9Å; L700-F749 HydrophobicContact CB-CZ 4.32Å; L700-F749 HydrophobicContact CD1-CB 4.06Å; L700-F749 HydrophobicContact CD1-CD2 3.81Å; L700-F749 HydrophobicContact CD1-CE2 4.43Å; L700-F749 HydrophobicContact CD1-CG 3.93Å; L700-F749 HydrophobicContact CG-CG 4.46Å; L701-F749 HydrophobicContact CB-CE1 4.23Å; L704-F749 HydrophobicContact CD1-CD1 3.56Å; L704-F749 HydrophobicContact CD1-CE1 3.97Å; L704-F749 HydrophobicContact CG-CD1 4.43Å; A745-F749 WeakPolarHBondContact O-CB 3.44Å; A745-F749 PolarHBondContact O-N 3.38Å; L746-F749 PolarHBondContact O-N 2.82Å; Q747-F749 VanDerWaalsContact C-N 3.29Å; Q747-F749 PolarHBondContact O-N 3.38Å; F749-A751 VanDerWaalsContact C-N 3.29Å; F749-A751 PolarHBondContact O-N 3.47Å; F749-K752 WeakPolarHBondContact O-CB 3.29Å; F749-K752 PolarHBondContact O-N 2.71Å; F749-L753 HydrophobicContact CD1-CD1 4.13Å; F749-L753 HydrophobicContact CE1-CD1 3.88Å; F749-L753 HydrophobicContact CE1-CD2 4.45Å; F749-L753 HydrophobicContact CE1-CG 4.38Å; F749-L753 HydrophobicContact CZ-CD2 4.48Å
750	N	76.2	Confident	73.1	Confident	13 Å²	13	72 Å²	72	7%	0.07	39%	0.393	C	S	.	.	H	α-helix	trans	-57.8	-43	177.5	-150.5	30.5	0	0	0	111	L704 L746 Q747 K752 L753 T756 D758	L704-N750 HydrophobicContact CD1-CB 4.5Å; L704-N750 HydrophobicContact CD2-CB 4.44Å; L746-N750 VanDerWaalsContact O-CB 3.27Å; L746-N750 WeakPolarHBondContact O-CB 3.13Å; L746-N750 PolarHBondContact O-N 2.98Å; Q747-N750 PolarHBondContact O-N 3.34Å; N750-K752 PolarHBondContact O-N 3.44Å; N750-L753 PolarHBondContact O-N 2.77Å; N750-T756 HydrophobicContact CB-CG2 4.27Å; N750-T756 VanDerWaalsContact CG-CG2 3.41Å; N750-T756 WeakPolarHBondContact O-CG2 3.04Å; N750-T756 WeakPolarHBondContact OD1-CG2 3.36Å; N750-D758 PolarHBondContact ND2-OD1 3.33Å
751	A	76.3	Confident	72.7	Confident	80 Å²	80	70.5 Å²	70.5	66%	0.661	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-16.1	177.4	0	0	0	0	0	114.9	Q747 F749	Q747-A751 PolarHBondContact O-N 3.23Å; F749-A751 VanDerWaalsContact C-N 3.29Å; F749-A751 PolarHBondContact O-N 3.47Å
752	K	74	Confident	72.4	Confident	139 Å²	139	67.9 Å²	67.9	60%	0.604	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-7.9	177.6	-61	176.8	-177.6	179	0	113.5	T465 F749 N750	T465-K752 PolarHBondContact OG1-O 3.48Å; F749-K752 WeakPolarHBondContact O-CB 3.29Å; F749-K752 PolarHBondContact O-N 2.71Å; N750-K752 PolarHBondContact O-N 3.44Å
753	L	68.7	Low	72.1	Confident	35 Å²	35	75.2 Å²	75.2	18%	0.183	41%	0.412	C	S	.	.	S	Bend	trans	-92.2	135.1	-178.3	-67.2	170.7	0	0	0	111.1	L704 F749 N750 T756	L704-L753 HydrophobicContact CD1-CD1 3.76Å; F749-L753 HydrophobicContact CD1-CD1 4.13Å; F749-L753 HydrophobicContact CE1-CD1 3.88Å; F749-L753 HydrophobicContact CE1-CD2 4.45Å; F749-L753 HydrophobicContact CE1-CG 4.38Å; F749-L753 HydrophobicContact CZ-CD2 4.48Å; N750-L753 PolarHBondContact O-N 2.77Å; L753-T756 HydrophobicContact CB-CG2 4.18Å
754	P	47.3	Very low	71.9	Confident	41 Å²	41	74.7 Å²	74.7	27%	0.266	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	134	173.3	28.1	-29.9	0	0	0	110.2	Y467	Y467-P754 HydrophobicContact CE2-CG 3.86Å
755	N	47.2	Very low	71.5	Confident	169 Å²	169	72.3 Å²	72.3	90%	0.904	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	50.3	-173	-81.4	-15	0	0	0	117	M757	N755-M757 PolarHBondContact O-N 2.94Å
756	T	49.5	Very low	70.4	Confident	54 Å²	54	76.3 Å²	76.3	33%	0.331	42%	0.42	S	S	.	.			trans	-77.5	111.6	168.2	48.2	0	0	0	0	112.5	N750 L753 D758	N750-T756 HydrophobicContact CB-CG2 4.27Å; N750-T756 VanDerWaalsContact CG-CG2 3.41Å; N750-T756 WeakPolarHBondContact O-CG2 3.04Å; N750-T756 WeakPolarHBondContact OD1-CG2 3.36Å; L753-T756 HydrophobicContact CB-CG2 4.18Å; T756-D758 VanDerWaalsContact C-N 3.25Å; T756-D758 PolarHBondContact O-N 3.02Å; T756-D758 VanDerWaalsContact O-N 3.14Å
757	M	48.7	Very low	69.6	Low	174 Å²	174	80.1 Å²	80.1	86%	0.857	44%	0.44	S	S	*	.			trans	-79.7	79.3	158.5	-71.5	-124.2	145.7	0	0	108.4	N755 Y759	N755-M757 PolarHBondContact O-N 2.94Å; M757-Y759 WeakPolarHBondContact O-CD1 3.43Å; M757-Y759 PolarHBondContact O-N 3.48Å
758	D	57.4	Low	68.9	Low	111 Å²	111	77.7 Å²	77.7	59%	0.594	43%	0.433	S	S	*	.			trans	-70.2	118.5	168.6	-89.5	-28.9	0	0	0	109	N750 T756	N750-D758 PolarHBondContact ND2-OD1 3.33Å; T756-D758 VanDerWaalsContact C-N 3.25Å; T756-D758 PolarHBondContact O-N 3.02Å; T756-D758 VanDerWaalsContact O-N 3.14Å
759	Y	63.2	Low	68.1	Low	56 Å²	56	78.7 Å²	78.7	22%	0.22	43%	0.429	C	S	.	.			trans	-109.5	126.2	171.9	50.2	-88.5	0	0	0	109	D708 N711 R720 M757 T761	D708-Y759 PolarHBondContact OD1-OH 3.45Å; N711-Y759 HydrophobicContact CB-CE2 4.16Å; R720-Y759 HydrophobicContact CB-CD2 4.23Å; R720-Y759 HydrophobicContact CB-CE2 4.48Å; R720-Y759 HydrophobicContact CG-CD2 4.42Å; M757-Y759 WeakPolarHBondContact O-CD1 3.43Å; M757-Y759 PolarHBondContact O-N 3.48Å; Y759-T761 HydrophobicContact CD2-CG2 3.64Å; Y759-T761 HydrophobicContact CE2-CG2 3.59Å; Y759-T761 PolarHBondContact O-N 3.07Å; Y759-T761 VanDerWaalsContact O-N 3.17Å
760	D	69.5	Low	67.4	Low	115 Å²	115	82.6 Å²	82.6	62%	0.615	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-59.8	120	173.8	-80.7	-19.5	0	0	0	109.8	R719	R719-D760 IonicContact NH2-OD2 2.74Å
761	T	80	Confident	66.9	Low	52 Å²	52	87 Å²	87	32%	0.319	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	144.7	174.8	55.9	0	0	0	0	111.3	R720 Y759	R720-T761 HydrophobicContact CB-CG2 4.39Å; R720-T761 CarbonylContact O-C 3.53Å; R720-T761 WeakPolarHBondContact O-CA 3.36Å; R720-T761 WeakPolarHBondContact O-CB 3.43Å; Y759-T761 HydrophobicContact CD2-CG2 3.64Å; Y759-T761 HydrophobicContact CE2-CG2 3.59Å; Y759-T761 PolarHBondContact O-N 3.07Å; Y759-T761 VanDerWaalsContact O-N 3.17Å
762	T	83.4	Confident	66.2	Low	50 Å²	50	87.5 Å²	87.5	31%	0.307	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.5	171.9	45.4	0	0	0	0	109.9	R719 R720 L721 D722 L764	R719-T762 HydrophobicContact CB-CG2 3.74Å; R719-T762 HydrophobicContact CG-CG2 4.42Å; R720-T762 PolarHBondContact O-N 2.97Å; R720-T762 PolarHBondContact O-OG1 3.13Å; L721-T762 WeakPolarHBondContact CD2-OG1 3.13Å; D722-T762 PolarHBondContact N-O 3.22Å; T762-L764 PolarHBondContact O-N 3.11Å
763	K	81.9	Confident	65.7	Low	157 Å²	157	83.8 Å²	83.8	68%	0.683	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-67	123	178.3	-65.8	-173.3	177.2	-173	0	110.5
764	L	82.1	Confident	65.4	Low	28 Å²	28	87.5 Å²	87.5	15%	0.147	47%	0.473	C	S	.	.	S	Bend	trans	-97.6	-42.3	173.3	-178.5	68.4	0	0	0	111.8	P575 W584 L721 L723 T762	P575-L764 HydrophobicContact CG-CD2 3.87Å; W584-L764 HydrophobicContact CB-CD1 4.21Å; L721-L764 HydrophobicContact CD1-CD1 4.22Å; L721-L764 HydrophobicContact CD1-CD2 3.99Å; L721-L764 HydrophobicContact CD1-CG 4.48Å; L723-L764 HydrophobicContact CD2-CD2 4.11Å; T762-L764 PolarHBondContact O-N 3.11Å
765	C	78.8	Confident	67	Low	11 Å²	11	91.4 Å²	91.4	7%	0.074	49%	0.491	C	S	.	.			trans	-104.1	134.3	175.8	-51.4	0	0	0	0	109.4	C726	C726-C765 HydrophobicContact CB-CB 3.98Å; C726-C765 WeakPolarHBondContact CB-SG 3.16Å; C726-C765 WeakPolarHBondContact SG-CB 3.33Å; C726-C765 PolarHBondContact SG-N 3.49Å; C726-C765 VanDerWaalsContact SG-N 3.38Å; C726-C765 CovalentContact SG-SG 2.03Å; C726-C765 PolarHBondContact SG-SG 2.93Å
766	S	62	Low	68.8	Low	120 Å²	120	84.4 Å²	84.4	84%	0.839	45%	0.453	S	S	*	.			trans	-109.3	0	-174.3	62	0	0	0	0	112.1	R729	R729-S766 PolarHBondContact NH1-O 2.54Å; R729-S766 PolarHBondContact NH1-OXT 2.93Å; R729-S766 PolarHBondContact NH2-O 3.32Å

Retrieved 766 of 766 residues in 227.2 ms (Link to these results)

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