A0A087YDU8_POEFO Loading...

Gamma-aminobutyric acid type A receptor subunit beta3

AlphaFold DB , UniProt , Accession A0A087YDU8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 507 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	35.1	Very low	42.8	Very low	227 Å²	227	170.6 Å²	170.6	100%	1.118	85%	0.846	S	S	*	*				0	105.9	0	-100.9	158.5	163.4	0	0	107
2	F	36.3	Very low	43.4	Very low	208 Å²	208	164 Å²	164	91%	0.912	82%	0.821	S	S	*	*				56	131.6	86.6	-70.6	-73.3	0	0	0	112.9
3	A	42.6	Very low	43.8	Very low	88 Å²	88	160.6 Å²	160.6	73%	0.727	81%	0.806	S	S	*	*			cis	-170	147.6	-17.7	0	0	0	0	0	108.8
4	L	36.8	Very low	44.2	Very low	171 Å²	171	154.1 Å²	154.1	90%	0.895	78%	0.784	S	S	*	*			trans	-146	156.9	171.6	-92.2	169.9	0	0	0	109.9
5	P	47.6	Very low	44.7	Very low	108 Å²	108	148.3 Å²	148.3	70%	0.701	77%	0.768	S	S	*	*				-118.1	147.8	-114.7	38	-29.1	0	0	0	115.9
6	K	47.5	Very low	45.1	Very low	210 Å²	210	146.8 Å²	146.8	91%	0.913	76%	0.76	S	S	*	*			trans	-107.4	66.9	-169.7	-162.8	179.5	-171.1	178.6	0	112.2
7	V	48.1	Very low	45.5	Very low	127 Å²	127	143.4 Å²	143.4	77%	0.77	75%	0.748	S	S	*	*			trans	-130	-24.4	-175.4	-173.2	0	0	0	0	115.2
8	R	44.1	Very low	45.8	Very low	239 Å²	239	141.2 Å²	141.2	90%	0.902	74%	0.736	S	S	*	*	S	Bend	trans	-83	-13.1	-171.5	-107.3	-179.9	176	177.1	-1.9	116.9
9	Q	44.3	Very low	45.7	Very low	164 Å²	164	135.6 Å²	135.6	77%	0.766	72%	0.716	S	S	*	*	S	Bend	trans	-85.6	-27	-171.2	-113.9	169.3	-10.8	0	0	115.5
10	C	42.9	Very low	45.7	Very low	111 Å²	111	132 Å²	132	75%	0.75	71%	0.706	S	S	*	*	H	α-helix	trans	-74.7	-26.2	-174.5	-75.9	0	0	0	0	114.8
11	R	45.5	Very low	45.6	Very low	224 Å²	224	131.3 Å²	131.3	85%	0.845	70%	0.701	S	S	*	*	H	α-helix	trans	-74.3	-26.1	179.4	-80.4	-171.3	169.8	-171	-3.3	113.6
12	V	50.6	Low	46	Very low	91 Å²	91	125.2 Å²	125.2	55%	0.552	68%	0.677	S	S	*	*	H	α-helix	trans	-77.7	-39.8	-179.1	-175.5	0	0	0	0	111.4	S14 A15 L16	V12-S14 PolarHBondContact O-N 3.09Å; V12-A15 PolarHBondContact O-N 3.46Å; V12-L16 HydrophobicContact CG1-CD1 4.33Å; V12-L16 PolarHBondContact O-N 3.03Å
13	L	48.5	Very low	46.1	Very low	120 Å²	120	119.8 Å²	119.8	63%	0.628	66%	0.664	S	S	*	*	H	α-helix	trans	-63.6	-40.7	176.1	-98.7	78.5	0	0	0	112.5	A15 L16 V17	L13-A15 VanDerWaalsContact C-N 3.34Å; L13-A15 PolarHBondContact O-N 3.48Å; L13-L16 PolarHBondContact O-N 3.16Å; L13-V17 WeakPolarHBondContact O-CG2 3.37Å; L13-V17 PolarHBondContact O-N 3.48Å; L13-V17 VanDerWaalsContact O-N 3.09Å
14	S	49	Very low	45.8	Very low	70 Å²	70	121.3 Å²	121.3	49%	0.49	67%	0.667	S	S	.	*	H	α-helix	trans	-66.3	-36.1	-178.4	-165.7	0	0	0	0	112.5	V12 V17 I18	V12-S14 PolarHBondContact O-N 3.09Å; S14-V17 PolarHBondContact O-N 3.26Å; S14-I18 WeakPolarHBondContact O-CG1 3.47Å; S14-I18 PolarHBondContact O-N 3.44Å; S14-I18 VanDerWaalsContact O-N 3.16Å
15	A	51.6	Low	45.9	Very low	67 Å²	67	117.1 Å²	117.1	55%	0.554	66%	0.658	S	S	*	*	H	α-helix	trans	-66.4	-37.6	174.1	0	0	0	0	0	112.8	V12 L13 G19	V12-A15 PolarHBondContact O-N 3.46Å; L13-A15 VanDerWaalsContact C-N 3.34Å; L13-A15 PolarHBondContact O-N 3.48Å; A15-G19 PolarHBondContact O-N 3.03Å
16	L	51.5	Low	45.5	Very low	123 Å²	123	118.8 Å²	118.8	64%	0.644	65%	0.654	S	S	*	*	H	α-helix	trans	-67.5	-38.4	176.4	-85.5	159.5	0	0	0	112.8	V12 L13 G19 A20	V12-L16 HydrophobicContact CG1-CD1 4.33Å; V12-L16 PolarHBondContact O-N 3.03Å; L13-L16 PolarHBondContact O-N 3.16Å; L16-G19 PolarHBondContact O-N 3.26Å; L16-A20 PolarHBondContact O-N 3.43Å
17	V	51.6	Low	45.2	Very low	90 Å²	90	112.6 Å²	112.6	55%	0.545	64%	0.637	S	S	.	*	H	α-helix	trans	-69.4	-39	177.2	175.4	0	0	0	0	111.7	L13 S14 A20 I21	L13-V17 WeakPolarHBondContact O-CG2 3.37Å; L13-V17 PolarHBondContact O-N 3.48Å; L13-V17 VanDerWaalsContact O-N 3.09Å; S14-V17 PolarHBondContact O-N 3.26Å; V17-A20 PolarHBondContact O-N 3.38Å; V17-I21 HydrophobicContact CG1-CD1 4.17Å; V17-I21 WeakPolarHBondContact O-CG1 3.39Å; V17-I21 PolarHBondContact O-N 3.33Å; V17-I21 VanDerWaalsContact O-N 3.17Å
18	I	51.5	Low	45.1	Very low	103 Å²	103	112.6 Å²	112.6	53%	0.528	64%	0.637	S	S	.	*	H	α-helix	trans	-68.7	-39.3	175.7	-64.6	168.5	0	0	0	110.7	S14 A20 I21 V22	S14-I18 WeakPolarHBondContact O-CG1 3.47Å; S14-I18 PolarHBondContact O-N 3.44Å; S14-I18 VanDerWaalsContact O-N 3.16Å; I18-A20 VanDerWaalsContact C-N 3.33Å; I18-A20 PolarHBondContact O-N 3.47Å; I18-I21 PolarHBondContact O-N 3.48Å; I18-V22 HydrophobicContact CG2-CG2 4.47Å; I18-V22 WeakPolarHBondContact O-CG2 3.43Å; I18-V22 PolarHBondContact O-N 2.98Å
19	G	43.7	Very low	45.2	Very low	36 Å²	36	108.1 Å²	108.1	37%	0.371	63%	0.631	S	S	.	*	H	α-helix	trans	-60	-39.6	173.2	0	0	0	0	0	113.3	A15 L16 V22 C23	A15-G19 PolarHBondContact O-N 3.03Å; L16-G19 PolarHBondContact O-N 3.26Å; G19-V22 PolarHBondContact O-N 3.39Å; G19-C23 PolarHBondContact O-N 3.11Å; G19-C23 VanDerWaalsContact O-N 3.11Å; G19-C23 PolarHBondContact O-SG 3.26Å
20	A	44.9	Very low	45.3	Very low	62 Å²	62	105.3 Å²	105.3	51%	0.512	62%	0.618	S	S	.	*	H	α-helix	trans	-66.2	-39.6	176.4	0	0	0	0	0	112.9	L16 V17 I18 C23	L16-A20 PolarHBondContact O-N 3.43Å; V17-A20 PolarHBondContact O-N 3.38Å; I18-A20 VanDerWaalsContact C-N 3.33Å; I18-A20 PolarHBondContact O-N 3.47Å; A20-C23 PolarHBondContact O-N 3.3Å
21	I	44.6	Very low	45.4	Very low	118 Å²	118	106.1 Å²	106.1	61%	0.605	62%	0.622	S	S	*	*	H	α-helix	trans	-70.5	-37.1	178.6	-66.6	168.8	0	0	0	111.2	V17 I18 C23 C24	V17-I21 HydrophobicContact CG1-CD1 4.17Å; V17-I21 WeakPolarHBondContact O-CG1 3.39Å; V17-I21 PolarHBondContact O-N 3.33Å; V17-I21 VanDerWaalsContact O-N 3.17Å; I18-I21 PolarHBondContact O-N 3.48Å; I21-C23 VanDerWaalsContact C-N 3.32Å; I21-C23 PolarHBondContact O-N 3.17Å; I21-C24 PolarHBondContact O-N 3.49Å
22	V	42.7	Very low	45.6	Very low	100 Å²	100	97.5 Å²	97.5	61%	0.606	60%	0.602	S	S	*	*	H	α-helix	trans	-69.1	-29.3	175.5	175	0	0	0	0	112	I18 G19 C24 A25	I18-V22 HydrophobicContact CG2-CG2 4.47Å; I18-V22 WeakPolarHBondContact O-CG2 3.43Å; I18-V22 PolarHBondContact O-N 2.98Å; G19-V22 PolarHBondContact O-N 3.39Å; V22-C24 VanDerWaalsContact C-N 3.26Å; V22-C24 PolarHBondContact O-N 3.47Å; V22-A25 PolarHBondContact O-N 3.01Å; V22-A25 VanDerWaalsContact O-N 3.14Å
23	C	37.8	Very low	46.4	Very low	94 Å²	94	96.9 Å²	96.9	64%	0.635	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-15.1	173.3	-77.9	0	0	0	0	114.8	G19 A20 I21 A25	G19-C23 PolarHBondContact O-N 3.11Å; G19-C23 VanDerWaalsContact O-N 3.11Å; G19-C23 PolarHBondContact O-SG 3.26Å; A20-C23 PolarHBondContact O-N 3.3Å; I21-C23 VanDerWaalsContact C-N 3.32Å; I21-C23 PolarHBondContact O-N 3.17Å; C23-A25 VanDerWaalsContact C-N 3.28Å
24	C	36.3	Very low	47.9	Very low	119 Å²	119	98.2 Å²	98.2	80%	0.804	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-11.1	170.1	-79.8	0	0	0	0	113.4	I21 V22 K26	I21-C24 PolarHBondContact O-N 3.49Å; V22-C24 VanDerWaalsContact C-N 3.26Å; V22-C24 PolarHBondContact O-N 3.47Å; C24-K26 PolarHBondContact O-N 3.14Å
25	A	40.5	Very low	49.7	Very low	84 Å²	84	98.5 Å²	98.5	69%	0.694	60%	0.603	S	S	*	*			trans	-87.9	41.5	169	0	0	0	0	0	111.8	V22 C23 S27	V22-A25 PolarHBondContact O-N 3.01Å; V22-A25 VanDerWaalsContact O-N 3.14Å; C23-A25 VanDerWaalsContact C-N 3.28Å; A25-S27 PolarHBondContact O-N 3.25Å
26	K	39.1	Very low	51.5	Low	143 Å²	143	99.3 Å²	99.3	62%	0.622	60%	0.597	S	S	*	*			trans	-67.4	104.2	172.2	-100.7	-164.9	169.6	-148.5	0	110.1	C24 E30	C24-K26 PolarHBondContact O-N 3.14Å; K26-E30 IonicContact NZ-OE1 2.71Å; K26-E30 PolarHBondContact NZ-OE1 2.87Å; K26-E30 IonicContact NZ-OE2 3.9Å
27	S	40.2	Very low	53.3	Low	79 Å²	79	95.3 Å²	95.3	55%	0.552	58%	0.578	S	S	*	*			trans	-3.1	123.7	154.4	-175.9	0	0	0	0	115.8	A25 N29	A25-S27 PolarHBondContact O-N 3.25Å; S27-N29 PolarHBondContact O-N 2.68Å; S27-N29 PolarHBondContact OG-N 2.75Å
28	V	45.9	Very low	55.2	Low	127 Å²	127	97.5 Å²	97.5	77%	0.77	58%	0.58	S	S	*	*	S	Bend	trans	-67.3	6	176.5	179	0	0	0	0	113.1
29	N	46.2	Very low	57.2	Low	145 Å²	145	99.4 Å²	99.4	78%	0.775	59%	0.586	S	S	*	*			trans	-118.6	74.1	-179.8	-78.5	-20	0	0	0	112.2	S27	S27-N29 PolarHBondContact O-N 2.68Å; S27-N29 PolarHBondContact OG-N 2.75Å
30	E	45.9	Very low	59.5	Low	105 Å²	105	98.9 Å²	98.9	49%	0.491	58%	0.576	S	S	.	*			trans	-119.5	142	163.1	-85.2	-172.3	-177.6	0	0	111.3	K26 G32 N33	K26-E30 IonicContact NZ-OE1 2.71Å; K26-E30 PolarHBondContact NZ-OE1 2.87Å; K26-E30 IonicContact NZ-OE2 3.9Å; E30-G32 PolarHBondContact O-N 2.98Å; E30-N33 PolarHBondContact O-N 2.7Å
31	P	45.3	Very low	61.8	Low	129 Å²	129	97 Å²	97	84%	0.838	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-4.1	-175.1	26.6	-34.6	0	0	0	115.3	N33	P31-N33 PolarHBondContact O-N 3.35Å
32	G	49.3	Very low	64.2	Low	42 Å²	42	95.5 Å²	95.5	43%	0.433	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.7	-11	171.6	0	0	0	0	0	114.6	E30 S35	E30-G32 PolarHBondContact O-N 2.98Å; G32-S35 PolarHBondContact O-OG 2.93Å
33	N	68.5	Low	66.7	Low	78 Å²	78	98.6 Å²	98.6	42%	0.417	56%	0.557	S	S	.	*	H	α-helix	trans	-70.9	-28.7	-179.6	-117.3	-19.6	0	0	0	113.5	E30 P31 I36 V37	E30-N33 PolarHBondContact O-N 2.7Å; P31-N33 PolarHBondContact O-N 3.35Å; N33-I36 PolarHBondContact O-N 2.82Å; N33-V37 WeakPolarHBondContact O-CG2 3.35Å; N33-V37 PolarHBondContact O-N 3.29Å; N33-V37 VanDerWaalsContact O-N 3.07Å
34	M	80.7	Confident	69.4	Low	148 Å²	148	95.3 Å²	95.3	73%	0.729	53%	0.533	S	S	*	.	H	α-helix	trans	-69.9	-38.4	-171.5	-169.9	64.7	71.4	0	0	113	K38	M34-K38 WeakPolarHBondContact O-CB 3.32Å; M34-K38 PolarHBondContact O-N 3.15Å
35	S	86.3	Confident	72.2	Confident	77 Å²	77	91.8 Å²	91.8	54%	0.538	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-40.7	175.8	46.2	0	0	0	0	111.7	G32 K38 E39	G32-S35 PolarHBondContact O-OG 2.93Å; S35-K38 PolarHBondContact O-N 3.48Å; S35-E39 WeakPolarHBondContact O-CB 3.41Å; S35-E39 PolarHBondContact O-N 2.99Å
36	I	88.3	Confident	74.8	Confident	83 Å²	83	96.6 Å²	96.6	43%	0.426	51%	0.511	S	S	.	.	H	α-helix	trans	-62.6	-46.4	177.4	-59.7	172	0	0	0	110.7	N33 K38 T40	N33-I36 PolarHBondContact O-N 2.82Å; I36-K38 PolarHBondContact O-N 2.81Å; I36-T40 VanDerWaalsContact O-CB 3.31Å; I36-T40 WeakPolarHBondContact O-CB 3.43Å; I36-T40 PolarHBondContact O-N 3.13Å; I36-T40 PolarHBondContact O-OG1 3.35Å
37	V	89.6	Confident	77.5	Confident	39 Å²	39	93.7 Å²	93.7	24%	0.236	52%	0.522	C	S	.	.	H	α-helix	trans	-60.8	-45.7	175.9	173.7	0	0	0	0	110.7	N33 T40 V41 I102 L106	N33-V37 WeakPolarHBondContact O-CG2 3.35Å; N33-V37 PolarHBondContact O-N 3.29Å; N33-V37 VanDerWaalsContact O-N 3.07Å; V37-T40 PolarHBondContact O-N 3.43Å; V37-V41 WeakPolarHBondContact O-CG2 3.44Å; V37-V41 PolarHBondContact O-N 2.96Å; V37-I102 HydrophobicContact CG2-CD1 4.02Å; V37-L106 HydrophobicContact CG1-CD2 3.99Å; V37-L106 HydrophobicContact CG2-CD2 4.46Å
38	K	92.6	Very high	80.2	Confident	137 Å²	137	91.4 Å²	91.4	60%	0.596	50%	0.501	S	S	*	.	H	α-helix	trans	-61.2	-52.8	178.3	-173	-166.6	170.6	-166.2	0	111.8	M34 S35 I36 T40 V41 D42	M34-K38 WeakPolarHBondContact O-CB 3.32Å; M34-K38 PolarHBondContact O-N 3.15Å; S35-K38 PolarHBondContact O-N 3.48Å; I36-K38 PolarHBondContact O-N 2.81Å; K38-T40 PolarHBondContact O-N 2.67Å; K38-V41 PolarHBondContact O-N 3.48Å; K38-V41 VanDerWaalsContact O-N 3.13Å; K38-D42 VanDerWaalsContact CE-OD2 3.24Å; K38-D42 WeakPolarHBondContact CE-OD2 3.29Å; K38-D42 WeakPolarHBondContact O-CB 3.49Å; K38-D42 PolarHBondContact O-N 3.03Å
39	E	93	Very high	82.6	Confident	142 Å²	142	87.5 Å²	87.5	66%	0.664	48%	0.476	S	S	*	.	H	α-helix	trans	-59.9	-36.8	-179.9	-173.9	-178.9	170.5	0	0	111.5	S35 K43	S35-E39 WeakPolarHBondContact O-CB 3.41Å; S35-E39 PolarHBondContact O-N 2.99Å; E39-K43 WeakPolarHBondContact O-CB 3.1Å; E39-K43 PolarHBondContact O-N 3Å
40	T	92.8	Very high	84.9	Confident	25 Å²	25	84.6 Å²	84.6	15%	0.153	46%	0.46	C	S	.	.	H	α-helix	trans	-62.1	-50.1	174.1	-57.6	0	0	0	0	111.1	I36 V37 K38 K43 L44 Y99 I102	I36-T40 VanDerWaalsContact O-CB 3.31Å; I36-T40 WeakPolarHBondContact O-CB 3.43Å; I36-T40 PolarHBondContact O-N 3.13Å; I36-T40 PolarHBondContact O-OG1 3.35Å; V37-T40 PolarHBondContact O-N 3.43Å; K38-T40 PolarHBondContact O-N 2.67Å; T40-K43 PolarHBondContact O-N 3.17Å; T40-L44 WeakPolarHBondContact O-CG 3.43Å; T40-L44 PolarHBondContact O-N 3.04Å; T40-Y99 HydrophobicContact CG2-CG 4.37Å; T40-I102 HydrophobicContact CG2-CD1 4.14Å
41	V	93.3	Very high	87.3	Confident	23 Å²	23	88.8 Å²	88.8	14%	0.139	47%	0.471	C	S	.	.	H	α-helix	trans	-64.7	-44.5	179.2	174	0	0	0	0	111.6	V37 K38 K43 L44 L45 L106 L108	V37-V41 WeakPolarHBondContact O-CG2 3.44Å; V37-V41 PolarHBondContact O-N 2.96Å; K38-V41 PolarHBondContact O-N 3.48Å; K38-V41 VanDerWaalsContact O-N 3.13Å; V41-K43 PolarHBondContact O-N 3.24Å; V41-L44 PolarHBondContact O-N 3.14Å; V41-L44 VanDerWaalsContact O-N 3.15Å; V41-L45 HydrophobicContact CG1-CD1 4.03Å; V41-L45 WeakPolarHBondContact O-CG 3.38Å; V41-L45 PolarHBondContact O-N 3.24Å; V41-L45 VanDerWaalsContact O-N 3.08Å; V41-L106 HydrophobicContact CG2-CD1 4.39Å; V41-L108 HydrophobicContact CG2-CD2 4.06Å
42	D	94.5	Very high	89.7	Confident	87 Å²	87	85.8 Å²	85.8	47%	0.465	45%	0.447	S	S	.	.	H	α-helix	trans	-58.8	-37.8	175.8	-71.4	-17.3	0	0	0	110.9	K38 K46	K38-D42 VanDerWaalsContact CE-OD2 3.24Å; K38-D42 WeakPolarHBondContact CE-OD2 3.29Å; K38-D42 WeakPolarHBondContact O-CB 3.49Å; K38-D42 PolarHBondContact O-N 3.03Å; D42-K46 VanDerWaalsContact O-CB 3.32Å; D42-K46 WeakPolarHBondContact O-CB 3.31Å; D42-K46 PolarHBondContact O-N 3.38Å
43	K	94.4	Very high	92	Very high	164 Å²	164	84.1 Å²	84.1	71%	0.713	43%	0.428	S	S	*	.	H	α-helix	trans	-70.4	-36.1	175.8	-176.6	179	178.6	-178.8	0	113.4	E39 T40 V41	E39-K43 WeakPolarHBondContact O-CB 3.1Å; E39-K43 PolarHBondContact O-N 3Å; T40-K43 PolarHBondContact O-N 3.17Å; V41-K43 PolarHBondContact O-N 3.24Å
44	L	94.7	Very high	93.4	Very high	26 Å²	26	80.5 Å²	80.5	14%	0.136	41%	0.409	C	S	.	.	H	α-helix	trans	-67.3	-37.4	175.7	-68.4	-179.4	0	0	0	112.1	T40 V41 L97 A98 Y99 L143	T40-L44 WeakPolarHBondContact O-CG 3.43Å; T40-L44 PolarHBondContact O-N 3.04Å; V41-L44 PolarHBondContact O-N 3.14Å; V41-L44 VanDerWaalsContact O-N 3.15Å; L44-L97 HydrophobicContact CB-CD2 4.43Å; L44-A98 WeakPolarHBondContact CD2-O 3.33Å; L44-Y99 HydrophobicContact CD1-CD1 4.27Å; L44-L143 HydrophobicContact CD1-CD1 4.14Å
45	L	95.3	Very high	94.1	Very high	44 Å²	44	76.4 Å²	76.4	23%	0.23	39%	0.39	C	S	.	.	H	α-helix	trans	-82	-22	-179.7	-62.9	174.6	0	0	0	112.9	V41 G47 Y48 V112 L116	V41-L45 HydrophobicContact CG1-CD1 4.03Å; V41-L45 WeakPolarHBondContact O-CG 3.38Å; V41-L45 PolarHBondContact O-N 3.24Å; V41-L45 VanDerWaalsContact O-N 3.08Å; L45-G47 PolarHBondContact O-N 2.71Å; L45-Y48 PolarHBondContact O-N 2.83Å; L45-Y48 VanDerWaalsContact O-N 3.13Å; L45-V112 HydrophobicContact CD1-CG2 4.18Å; L45-V112 HydrophobicContact CD2-CG2 4.32Å; L45-L116 HydrophobicContact CD2-CD2 3.81Å
46	K	95.9	Very high	94.5	Very high	185 Å²	185	79.4 Å²	79.4	80%	0.804	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	103.3	-179.4	-175.6	177.5	-178.9	178.5	0	111.9	D42	D42-K46 VanDerWaalsContact O-CB 3.32Å; D42-K46 WeakPolarHBondContact O-CB 3.31Å; D42-K46 PolarHBondContact O-N 3.38Å
47	G	94.1	Very high	94.8	Very high	82 Å²	82	79.3 Å²	79.3	85%	0.845	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	12.7	-179.3	0	0	0	0	0	113.9	L45 D49	L45-G47 PolarHBondContact O-N 2.71Å; G47-D49 PolarHBondContact O-N 3.5Å
48	Y	97.2	Very high	95.1	Very high	31 Å²	31	79.2 Å²	79.2	12%	0.122	42%	0.42	C	S	.	.			trans	-72.4	123.1	172.1	-172.2	-87.8	0	0	0	110.4	L45 I50 D94 R96 L97 L116 W117	L45-Y48 PolarHBondContact O-N 2.83Å; L45-Y48 VanDerWaalsContact O-N 3.13Å; Y48-I50 HydrophobicContact CD1-CG2 4Å; Y48-I50 HydrophobicContact CE1-CG2 4.07Å; Y48-D94 WeakPolarHBondContact CE2-OD2 3.17Å; Y48-D94 PolarHBondContact OH-OD2 3.36Å; Y48-R96 HydrophobicContact CD2-CB 4.07Å; Y48-R96 HydrophobicContact CE2-CB 3.94Å; Y48-R96 PolarHBondContact OH-NH2 3.02Å; Y48-R96 VanDerWaalsContact OH-NH2 3.16Å; Y48-L97 HydrophobicContact CD2-CD2 3.88Å; Y48-L97 HydrophobicContact CE2-CD1 4.29Å; Y48-L97 HydrophobicContact CE2-CD2 3.67Å; Y48-L97 HydrophobicContact CE2-CG 3.9Å; Y48-L116 HydrophobicContact CD1-CD2 4.44Å; Y48-L116 HydrophobicContact CE1-CD2 4.09Å; Y48-W117 PolarHBondContact OH-N 3.29Å
49	D	96.3	Very high	95.3	Very high	46 Å²	46	76.6 Å²	76.6	25%	0.246	42%	0.417	C	S	.	.			trans	-98.6	109.8	174.7	-166.7	-18.2	0	0	0	111	G47 R51 L52 R96	G47-D49 PolarHBondContact O-N 3.5Å; D49-R51 PolarHBondContact O-N 3.47Å; D49-R51 VanDerWaalsContact OD1-CB 3.3Å; D49-R51 WeakPolarHBondContact OD1-CB 3.47Å; D49-R51 WeakPolarHBondContact OD1-CG 3.5Å; D49-R51 IonicContact OD1-CZ 3.12Å; D49-R51 PolarHBondContact OD1-N 3.19Å; D49-R51 IonicContact OD1-NE 3.4Å; D49-R51 PolarHBondContact OD1-NE 3.26Å; D49-R51 IonicContact OD1-NH2 2.91Å; D49-R51 IonicContact OD2-CZ 3.76Å; D49-R51 IonicContact OD2-NE 3.9Å; D49-R51 PolarHBondContact OD2-NE 3.48Å; D49-R51 IonicContact OD2-NH2 3.28Å; D49-R51 PolarHBondContact OD2-NH2 2.66Å; D49-L52 HydrophobicContact CB-CD1 4.36Å; D49-L52 HydrophobicContact CB-CG 4.5Å; D49-L52 PolarHBondContact O-N 3.23Å; D49-R96 PolarHBondContact O-NH1 2.85Å
50	I	96.1	Very high	95.5	Very high	84 Å²	84	71.7 Å²	71.7	43%	0.431	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-18.3	179.7	65.6	175.9	0	0	0	113.8	Y48 L52 Q115	Y48-I50 HydrophobicContact CD1-CG2 4Å; Y48-I50 HydrophobicContact CE1-CG2 4.07Å; I50-L52 VanDerWaalsContact C-N 3.32Å; I50-Q115 VanDerWaalsContact CG2-C 3.41Å; I50-Q115 WeakPolarHBondContact CG2-O 3.44Å
51	R	95.3	Very high	95.8	Very high	192 Å²	192	71 Å²	71	73%	0.725	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-16	-175.3	-57.4	170.5	-65.2	174.2	4.9	112.6	D49	D49-R51 PolarHBondContact O-N 3.47Å; D49-R51 VanDerWaalsContact OD1-CB 3.3Å; D49-R51 WeakPolarHBondContact OD1-CB 3.47Å; D49-R51 WeakPolarHBondContact OD1-CG 3.5Å; D49-R51 IonicContact OD1-CZ 3.12Å; D49-R51 PolarHBondContact OD1-N 3.19Å; D49-R51 IonicContact OD1-NE 3.4Å; D49-R51 PolarHBondContact OD1-NE 3.26Å; D49-R51 IonicContact OD1-NH2 2.91Å; D49-R51 IonicContact OD2-CZ 3.76Å; D49-R51 IonicContact OD2-NE 3.9Å; D49-R51 PolarHBondContact OD2-NE 3.48Å; D49-R51 IonicContact OD2-NH2 3.28Å; D49-R51 PolarHBondContact OD2-NH2 2.66Å
52	L	96.7	Very high	96	Very high	66 Å²	66	72 Å²	72	35%	0.346	40%	0.403	S	S	.	.	S	Bend	trans	-105.7	125.6	-175.9	-60.2	178.4	0	0	0	110.4	D49 I50 F56 R96	D49-L52 HydrophobicContact CB-CD1 4.36Å; D49-L52 HydrophobicContact CB-CG 4.5Å; D49-L52 PolarHBondContact O-N 3.23Å; I50-L52 VanDerWaalsContact C-N 3.32Å; L52-F56 HydrophobicContact CD2-CD1 4.07Å; L52-F56 HydrophobicContact CD2-CD2 4.3Å; L52-F56 HydrophobicContact CD2-CE1 4.15Å; L52-F56 HydrophobicContact CD2-CE2 4.37Å; L52-F56 HydrophobicContact CD2-CG 4.15Å; L52-F56 HydrophobicContact CD2-CZ 4.29Å; L52-R96 PolarHBondContact O-NH1 3.13Å; L52-R96 PolarHBondContact O-NH2 3.34Å
53	R	97	Very high	96.2	Very high	8 Å²	8	67.8 Å²	67.8	3%	0.03	38%	0.381	C	S	.	.			trans	-60.8	156.1	170.8	68.3	165.5	-178.5	95.8	-17.3	111.1	D55 F56 G58 P59 W117 Y184 D188	R53-D55 PolarHBondContact NH1-O 3.28Å; R53-D55 VanDerWaalsContact NH1-O 3.15Å; R53-F56 HydrophobicContact CG-CB 4.36Å; R53-F56 HydrophobicContact CG-CD2 4.17Å; R53-F56 PolarHBondContact O-N 3.05Å; R53-G58 PolarHBondContact NH2-O 2.97Å; R53-P59 PolarHBondContact NH1-O 3.05Å; R53-W117 HydrophobicContact CB-CD2 4.5Å; R53-W117 HydrophobicContact CB-CH2 4.48Å; R53-W117 HydrophobicContact CB-CZ2 3.76Å; R53-Y184 HydrophobicContact CB-CE1 4.41Å; R53-D188 WeakPolarHBondContact CD-O 3.05Å; R53-D188 IonicContact CZ-OD1 3.62Å; R53-D188 IonicContact NE-OD1 3.33Å; R53-D188 PolarHBondContact NE-OD1 2.78Å; R53-D188 IonicContact NH2-OD1 3.04Å; R53-D188 PolarHBondContact NH2-OD1 2.79Å
54	P	97.3	Very high	96.3	Very high	1 Å²	1	60 Å²	60	1%	0.006	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	143.6	167.3	-24.6	34.8	0	0	0	111.4	F56 V61 D94 W117	P54-F56 PolarHBondContact O-N 3.43Å; P54-V61 HydrophobicContact CB-CG2 4.14Å; P54-V61 HydrophobicContact CG-CG2 4.17Å; P54-D94 HydrophobicContact CB-CB 4.3Å; P54-D94 HydrophobicContact CG-CB 3.88Å; P54-W117 VanDerWaalsContact CD-CE3 3.44Å; P54-W117 HydrophobicContact CG-CE3 3.99Å; P54-W117 HydrophobicContact CG-CZ3 4.09Å
55	D	95.9	Very high	96.5	Very high	62 Å²	62	58.8 Å²	58.8	33%	0.332	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	36.4	-178.7	-66.6	-34.3	0	0	0	114.5	R53 G57 G58 K95	R53-D55 PolarHBondContact NH1-O 3.28Å; R53-D55 VanDerWaalsContact NH1-O 3.15Å; D55-G57 PolarHBondContact O-N 3.18Å; D55-G58 CarbonylContact O-C 3.55Å; D55-G58 WeakPolarHBondContact O-CA 3.39Å; D55-G58 PolarHBondContact O-N 3.22Å; D55-K95 WeakPolarHBondContact OD1-CD 3.34Å; D55-K95 IonicContact OD1-NZ 2.75Å; D55-K95 PolarHBondContact OD1-NZ 3.24Å; D55-K95 WeakPolarHBondContact OD2-CE 3.43Å; D55-K95 IonicContact OD2-NZ 2.68Å; D55-K95 PolarHBondContact OD2-NZ 3.11Å
56	F	95.2	Very high	96.6	Very high	141 Å²	141	57.7 Å²	57.7	62%	0.618	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	125.4	174.5	-174.5	-102.4	0	0	0	112	L52 R53 P54 G58	L52-F56 HydrophobicContact CD2-CD1 4.07Å; L52-F56 HydrophobicContact CD2-CD2 4.3Å; L52-F56 HydrophobicContact CD2-CE1 4.15Å; L52-F56 HydrophobicContact CD2-CE2 4.37Å; L52-F56 HydrophobicContact CD2-CG 4.15Å; L52-F56 HydrophobicContact CD2-CZ 4.29Å; R53-F56 HydrophobicContact CG-CB 4.36Å; R53-F56 HydrophobicContact CG-CD2 4.17Å; R53-F56 PolarHBondContact O-N 3.05Å; P54-F56 PolarHBondContact O-N 3.43Å; F56-G58 VanDerWaalsContact C-N 3.33Å
57	G	93.7	Very high	96.7	Very high	80 Å²	80	48.9 Å²	48.9	83%	0.825	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	2	-171.7	0	0	0	0	0	114.9	D55	D55-G57 PolarHBondContact O-N 3.18Å
58	G	95.4	Very high	96.8	Very high	38 Å²	38	46.7 Å²	46.7	39%	0.392	27%	0.267	S	S	.	.	S	Bend	trans	-121.7	-152.2	173.6	0	0	0	0	0	112.2	R53 D55 F56	R53-G58 PolarHBondContact NH2-O 2.97Å; D55-G58 CarbonylContact O-C 3.55Å; D55-G58 WeakPolarHBondContact O-CA 3.39Å; D55-G58 PolarHBondContact O-N 3.22Å; F56-G58 VanDerWaalsContact C-N 3.33Å
59	P	97.2	Very high	96.8	Very high	81 Å²	81	45.2 Å²	45.2	53%	0.526	26%	0.262	S	S	.	.	S	Bend	trans	-61.7	161	-175.8	28.1	-36.3	0	0	0	112.8	R53	R53-P59 PolarHBondContact NH1-O 3.05Å
60	P	97.6	Very high	96.7	Very high	40 Å²	40	45.1 Å²	45.1	26%	0.26	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-61.3	149.2	172.9	25.6	-34.4	0	0	0	111.4	A62 D188 E190	P60-A62 PolarHBondContact O-N 2.77Å; P60-D188 WeakPolarHBondContact CA-O 3.33Å; P60-E190 HydrophobicContact CB-CG 4.06Å; P60-E190 HydrophobicContact CG-CG 3.95Å
61	V	97.9	Very high	96.7	Very high	10 Å²	10	42.9 Å²	42.9	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	117.4	174.2	65.3	0	0	0	0	110.2	P54 V63 W92 W117 D188 I189 E190	P54-V61 HydrophobicContact CB-CG2 4.14Å; P54-V61 HydrophobicContact CG-CG2 4.17Å; V61-V63 HydrophobicContact CG1-CG2 4.41Å; V61-V63 PolarHBondContact O-N 2.72Å; V61-W92 HydrophobicContact CG2-CB 4.08Å; V61-W117 HydrophobicContact CG1-CH2 3.7Å; V61-W117 HydrophobicContact CG1-CZ2 4.42Å; V61-W117 HydrophobicContact CG1-CZ3 4.37Å; V61-D188 PolarHBondContact N-O 3.38Å; V61-I189 HydrophobicContact CG1-CB 4.35Å; V61-I189 HydrophobicContact CG1-CD1 4.27Å; V61-I189 HydrophobicContact CG1-CG1 3.9Å; V61-I189 WeakPolarHBondContact O-CG1 3.36Å; V61-E190 PolarHBondContact O-N 3.3Å
62	A	97.6	Very high	96.7	Very high	43 Å²	43	34.2 Å²	34.2	36%	0.355	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	118.3	175.8	0	0	0	0	0	110.6	P60 Y192	P60-A62 PolarHBondContact O-N 2.77Å; A62-Y192 HydrophobicContact CB-CD1 4.49Å; A62-Y192 HydrophobicContact CB-CE1 4Å
63	V	98.4	Very high	96.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	109.8	178.7	-173.2	0	0	0	0	110.1	V61 Q90 Y91 W92 P119 I189 E190 F191 Y192	V61-V63 HydrophobicContact CG1-CG2 4.41Å; V61-V63 PolarHBondContact O-N 2.72Å; V63-Q90 HydrophobicContact CG1-CB 4.18Å; V63-Y91 CarbonylContact C-O 3.53Å; V63-Y91 WeakPolarHBondContact CA-O 3.34Å; V63-W92 HydrophobicContact CG2-CB 4.13Å; V63-P119 HydrophobicContact CG1-CG 4.08Å; V63-P119 HydrophobicContact CG2-CG 3.92Å; V63-I189 HydrophobicContact CG2-CD1 3.86Å; V63-I189 HydrophobicContact CG2-CG1 3.86Å; V63-E190 PolarHBondContact N-O 3.28Å; V63-F191 HydrophobicContact CB-CD1 3.98Å; V63-F191 HydrophobicContact CB-CE1 4.14Å; V63-F191 HydrophobicContact CG2-CE1 4.44Å; V63-Y192 VanDerWaalsContact C-CE1 3.49Å; V63-Y192 PolarHBondContact O-N 3.15Å
64	G	98	Very high	96.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.3	175.9	0	0	0	0	0	111.3	Q90 Y91 Y192	G64-Q90 CarbonylContact O-C 3.54Å; G64-Y91 PolarHBondContact N-O 3.08Å; G64-Y91 PolarHBondContact O-N 3.21Å; G64-Y192 CarbonylContact C-O 3.57Å; G64-Y192 WeakPolarHBondContact CA-O 3.49Å
65	M	98	Very high	96.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	146.5	179.1	-59.1	-168.2	-170.7	0	0	112.3	F88 Q89 T121 I179 F191 Y192 K194 L233	M65-F88 HydrophobicContact CB-CE2 4.45Å; M65-F88 HydrophobicContact CE-CZ 4.46Å; M65-F88 HydrophobicContact CG-CE2 4.41Å; M65-F88 HydrophobicContact SD-CE2 3.75Å; M65-F88 HydrophobicContact SD-CZ 3.7Å; M65-Q89 WeakPolarHBondContact CA-O 3.22Å; M65-T121 HydrophobicContact CE-CG2 3.48Å; M65-T121 VanDerWaalsContact CE-CG2 3.48Å; M65-I179 HydrophobicContact CE-CG2 4.14Å; M65-I179 HydrophobicContact SD-CD1 4.47Å; M65-I179 HydrophobicContact SD-CG2 3.76Å; M65-F191 HydrophobicContact CE-CB 4.48Å; M65-F191 HydrophobicContact CE-CD1 3.65Å; M65-F191 HydrophobicContact CE-CD2 3.63Å; M65-F191 HydrophobicContact CE-CE1 3.56Å; M65-F191 HydrophobicContact CE-CE2 3.53Å; M65-F191 HydrophobicContact CE-CG 3.68Å; M65-F191 HydrophobicContact CE-CZ 3.51Å; M65-Y192 PolarHBondContact N-O 2.94Å; M65-K194 WeakPolarHBondContact O-CB 3.39Å; M65-K194 PolarHBondContact O-N 2.74Å; M65-L233 HydrophobicContact CB-CD1 3.99Å; M65-L233 HydrophobicContact CG-CD1 4.02Å; M65-L233 HydrophobicContact SD-CD1 3.82Å
66	S	97.4	Very high	96.1	Very high	22 Å²	22	38.1 Å²	38.1	15%	0.154	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	144.5	173.4	179.6	0	0	0	0	109.6	Q89 A199	S66-Q89 PolarHBondContact N-O 3.39Å; S66-Q89 PolarHBondContact O-N 3.02Å; S66-A199 CarbonylContact C-O 3.45Å; S66-A199 VanDerWaalsContact CA-O 3.27Å; S66-A199 WeakPolarHBondContact CA-O 3.08Å; S66-A199 PolarHBondContact OG-O 3.08Å
67	I	97.7	Very high	96	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	120	-174.8	-56.8	179.3	0	0	0	109.1	V69 M86 Y87 F88 I179 W193 A199 V200 T201 L235	I67-V69 HydrophobicContact CG2-CG2 4.05Å; I67-M86 HydrophobicContact CD1-SD 4.36Å; I67-M86 HydrophobicContact CG2-CB 3.92Å; I67-M86 HydrophobicContact CG2-CG 4.34Å; I67-M86 HydrophobicContact CG2-SD 3.67Å; I67-Y87 WeakPolarHBondContact CA-O 3.37Å; I67-F88 HydrophobicContact CD1-CD2 4.46Å; I67-F88 HydrophobicContact CG1-CD2 4.07Å; I67-I179 HydrophobicContact CD1-CD1 3.88Å; I67-W193 HydrophobicContact CD1-CH2 3.83Å; I67-W193 HydrophobicContact CD1-CZ3 3.79Å; I67-W193 HydrophobicContact CG1-CZ3 4.11Å; I67-A199 PolarHBondContact N-O 2.6Å; I67-V200 HydrophobicContact CB-CG1 4.43Å; I67-V200 HydrophobicContact CB-CG2 4.17Å; I67-V200 CarbonylContact O-C 3.53Å; I67-V200 VanDerWaalsContact O-CA 3.26Å; I67-V200 WeakPolarHBondContact O-CA 3.26Å; I67-T201 PolarHBondContact O-N 3.43Å; I67-L235 HydrophobicContact CD1-CD2 4.08Å
68	D	96.9	Very high	95.9	Very high	35 Å²	35	32.6 Å²	32.6	19%	0.187	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	112.6	162.4	-169.6	40	0	0	0	108.8	A70 M86 Y87 T201 G202 R205	D68-A70 PolarHBondContact O-N 2.93Å; D68-M86 WeakPolarHBondContact O-CA 3.41Å; D68-Y87 HydrophobicContact CB-CD2 4.26Å; D68-Y87 PolarHBondContact N-O 2.87Å; D68-Y87 PolarHBondContact O-N 3.11Å; D68-T201 WeakPolarHBondContact CB-OG1 3.1Å; D68-T201 VanDerWaalsContact CG-OG1 3.24Å; D68-T201 WeakPolarHBondContact OD1-CB 3.38Å; D68-T201 PolarHBondContact OD1-OG1 2.79Å; D68-G202 WeakPolarHBondContact OD1-CA 3.32Å; D68-G202 PolarHBondContact OD1-N 2.04Å; D68-R205 IonicContact OD1-NH2 3.04Å; D68-R205 PolarHBondContact OD1-NH2 2.93Å; D68-R205 IonicContact OD2-NH2 3.69Å; D68-R205 PolarHBondContact OD2-NH2 2.92Å; D68-R205 VanDerWaalsContact OD2-NH2 3.09Å
69	V	96.7	Very high	95.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.7	177.6	-173.8	0	0	0	0	108.9	I67 L84 V200 T201 V203 I206 F237	I67-V69 HydrophobicContact CG2-CG2 4.05Å; V69-L84 HydrophobicContact CG1-CD1 3.52Å; V69-L84 HydrophobicContact CG2-CD1 4.43Å; V69-V200 HydrophobicContact CG2-CG1 4.26Å; V69-T201 PolarHBondContact N-O 2.8Å; V69-V203 HydrophobicContact CG2-CG2 4.27Å; V69-I206 HydrophobicContact CB-CD1 3.99Å; V69-I206 HydrophobicContact CG1-CD1 3.38Å; V69-I206 HydrophobicContact CG1-CG1 4.4Å; V69-F237 HydrophobicContact CG2-CZ 4.35Å
70	A	95.4	Very high	95.7	Very high	45 Å²	45	33.8 Å²	33.8	37%	0.372	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-47.4	178	0	0	0	0	0	111.1	D68 T85 Y87	D68-A70 PolarHBondContact O-N 2.93Å; A70-T85 HydrophobicContact CB-CG2 4.28Å; A70-T85 WeakPolarHBondContact CB-O 3.38Å; A70-T85 PolarHBondContact N-O 2.87Å; A70-Y87 HydrophobicContact CB-CE2 4.09Å
71	S	95.1	Very high	95.6	Very high	37 Å²	37	32.5 Å²	32.5	26%	0.259	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	155	177.8	52.6	0	0	0	0	111.7	D73 T85	S71-D73 VanDerWaalsContact CB-OD1 3.3Å; S71-D73 WeakPolarHBondContact CB-OD1 3.38Å; S71-D73 PolarHBondContact OG-OD1 3.5Å; S71-T85 PolarHBondContact N-O 3.29Å; S71-T85 VanDerWaalsContact N-O 3.15Å; S71-T85 PolarHBondContact O-N 3.42Å
72	I	95.8	Very high	95.6	Very high	10 Å²	10	32.1 Å²	32.1	5%	0.051	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	114.8	157	-64.4	169.8	0	0	0	104.9	V75 T83 L84 I206 L208 I213	I72-V75 HydrophobicContact CG2-CG2 4.14Å; I72-T83 CarbonylContact C-O 3.59Å; I72-T83 WeakPolarHBondContact CA-O 3.39Å; I72-L84 HydrophobicContact CG1-CD1 3.71Å; I72-I206 HydrophobicContact CB-CG2 4.31Å; I72-I206 HydrophobicContact CD1-CD1 4.28Å; I72-I206 HydrophobicContact CG1-CD1 4.29Å; I72-I206 HydrophobicContact CG1-CG2 4.44Å; I72-L208 HydrophobicContact CB-CD1 4.34Å; I72-L208 HydrophobicContact CB-CD2 4.03Å; I72-L208 HydrophobicContact CD1-CD1 4.38Å; I72-L208 HydrophobicContact CG2-CD1 4.24Å; I72-L208 HydrophobicContact CG2-CD2 3.94Å; I72-L208 WeakPolarHBondContact O-CD2 3.32Å; I72-I213 HydrophobicContact CD1-CD1 4.06Å
73	D	92.6	Very high	95.6	Very high	84 Å²	84	31 Å²	31	45%	0.449	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-39.6	-163.9	-57.2	-42.5	0	0	0	111.6	S71 T83 T85	S71-D73 VanDerWaalsContact CB-OD1 3.3Å; S71-D73 WeakPolarHBondContact CB-OD1 3.38Å; S71-D73 PolarHBondContact OG-OD1 3.5Å; D73-T83 HydrophobicContact CB-CG2 4.15Å; D73-T83 PolarHBondContact N-O 2.91Å; D73-T85 PolarHBondContact OD2-OG1 3.04Å
74	M	92.5	Very high	95.5	Very high	105 Å²	105	31 Å²	31	52%	0.517	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	152.2	173.2	63.4	-173.4	-63	0	0	111.1	Y82 T83	M74-Y82 CarbonylContact O-C 3.5Å; M74-Y82 WeakPolarHBondContact O-CA 3.34Å; M74-T83 PolarHBondContact O-N 3.12Å
75	V	95.3	Very high	95.4	Very high	15 Å²	15	31.2 Å²	31.2	9%	0.091	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127	168.8	-179.8	0	0	0	0	106.1	I72 M163 F211 L239	I72-V75 HydrophobicContact CG2-CG2 4.14Å; V75-M163 HydrophobicContact CG1-CE 3.57Å; V75-F211 HydrophobicContact CB-CD2 4.2Å; V75-F211 HydrophobicContact CB-CE2 3.74Å; V75-F211 HydrophobicContact CB-CZ 4.38Å; V75-F211 HydrophobicContact CG1-CE2 3.77Å; V75-F211 HydrophobicContact CG1-CZ 3.89Å; V75-F211 HydrophobicContact CG2-CD2 4.27Å; V75-F211 HydrophobicContact CG2-CE2 4.28Å; V75-L239 HydrophobicContact CG2-CD1 4.25Å
76	S	94.5	Very high	95.4	Very high	14 Å²	14	31.2 Å²	31.2	10%	0.098	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	110.2	-177.5	-171.5	0	0	0	0	111	V78 N79 M80 D81	S76-V78 VanDerWaalsContact C-N 3.27Å; S76-N79 PolarHBondContact OG-N 3.21Å; S76-M80 WeakPolarHBondContact O-CA 3.32Å; S76-M80 PolarHBondContact O-N 2.79Å; S76-D81 WeakPolarHBondContact CB-OD1 3.17Å; S76-D81 PolarHBondContact N-O 3.16Å; S76-D81 PolarHBondContact O-N 2.77Å
77	E	92.3	Very high	95.4	Very high	21 Å²	21	34.9 Å²	34.9	10%	0.098	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-34.1	168.8	-61.3	78.6	-175.7	0	0	111.2	M163 L165 F211 R241 P298	E77-M163 HydrophobicContact CG-SD 4.13Å; E77-L165 HydrophobicContact CB-CD1 4.04Å; E77-L165 HydrophobicContact CG-CD1 4.21Å; E77-L165 HydrophobicContact CG-CD2 4.47Å; E77-F211 WeakPolarHBondContact OE1-CZ 3.21Å; E77-R241 IonicContact OE1-CZ 3.76Å; E77-R241 VanDerWaalsContact OE1-CZ 3.28Å; E77-R241 IonicContact OE1-NH1 3.16Å; E77-R241 PolarHBondContact OE1-NH1 2.8Å; E77-R241 IonicContact OE1-NH2 2.71Å; E77-R241 PolarHBondContact OE1-NH2 3.32Å; E77-P298 HydrophobicContact CB-CG 3.99Å; E77-P298 WeakPolarHBondContact O-CB 3.37Å; E77-P298 WeakPolarHBondContact O-CG 3.5Å
78	V	91.4	Very high	95.4	Very high	85 Å²	85	35 Å²	35	52%	0.515	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-46.4	-178.6	179.5	0	0	0	0	111	S76	S76-V78 VanDerWaalsContact C-N 3.27Å
79	N	93.4	Very high	95.5	Very high	94 Å²	94	35.7 Å²	35.7	50%	0.503	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-11.4	-178.7	-60.7	-29.6	0	0	0	113.4	S76 D81 K127	S76-N79 PolarHBondContact OG-N 3.21Å; N79-D81 WeakPolarHBondContact CB-OD1 3.16Å; N79-D81 WeakPolarHBondContact CB-OD2 3.3Å; N79-K127 PolarHBondContact O-NZ 3.03Å
80	M	94.6	Very high	95.6	Very high	50 Å²	50	35.7 Å²	35.7	25%	0.246	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	55.1	-170	-62.5	-172.6	179.5	0	0	111.9	S76 K127 C161 M162 I300	S76-M80 WeakPolarHBondContact O-CA 3.32Å; S76-M80 PolarHBondContact O-N 2.79Å; M80-K127 PolarHBondContact O-NZ 2.84Å; M80-C161 CarbonylContact C-O 3.55Å; M80-C161 WeakPolarHBondContact CB-O 3.36Å; M80-C161 PolarHBondContact O-N 2.81Å; M80-M162 HydrophobicContact SD-CE 4.4Å; M80-M162 HydrophobicContact SD-SD 4.36Å; M80-I300 HydrophobicContact CE-CD1 4.02Å; M80-I300 HydrophobicContact CE-CG1 4.41Å
81	D	96.9	Very high	95.7	Very high	13 Å²	13	35.3 Å²	35.3	7%	0.07	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	169.7	175.1	49.3	45.7	0	0	0	113.1	S76 N79 K127 T158 A159	S76-D81 WeakPolarHBondContact CB-OD1 3.17Å; S76-D81 PolarHBondContact N-O 3.16Å; S76-D81 PolarHBondContact O-N 2.77Å; N79-D81 WeakPolarHBondContact CB-OD1 3.16Å; N79-D81 WeakPolarHBondContact CB-OD2 3.3Å; D81-K127 HydrophobicContact CB-CD 4.23Å; D81-K127 WeakPolarHBondContact OD2-CD 3.5Å; D81-K127 IonicContact OD2-NZ 3.68Å; D81-K127 PolarHBondContact OD2-NZ 3.29Å; D81-T158 HydrophobicContact CB-CG2 3.81Å; D81-A159 CarbonylContact C-O 3.58Å; D81-A159 WeakPolarHBondContact CA-O 3.41Å; D81-A159 WeakPolarHBondContact CB-O 3.22Å
82	Y	97	Very high	95.8	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	145.6	170.7	68.7	-73.8	0	0	0	109.9	M74 L84 T158 A159 C161 C175 T176 L177 F237	M74-Y82 CarbonylContact O-C 3.5Å; M74-Y82 WeakPolarHBondContact O-CA 3.34Å; Y82-L84 HydrophobicContact CD2-CB 4.35Å; Y82-L84 HydrophobicContact CE2-CB 4.14Å; Y82-T158 CarbonylContact O-C 3.52Å; Y82-T158 WeakPolarHBondContact O-CA 3.15Å; Y82-A159 HydrophobicContact CD1-CB 4.28Å; Y82-A159 VanDerWaalsContact CD1-O 3.32Å; Y82-A159 WeakPolarHBondContact CD1-O 3.42Å; Y82-A159 HydrophobicContact CE1-CB 3.66Å; Y82-A159 PolarHBondContact N-O 2.87Å; Y82-A159 PolarHBondContact O-N 2.65Å; Y82-C161 HydrophobicContact CD1-CB 3.84Å; Y82-C161 HydrophobicContact CE1-CB 4.14Å; Y82-C175 HydrophobicContact CD1-CB 3.87Å; Y82-C175 HydrophobicContact CE1-CB 3.64Å; Y82-T176 VanDerWaalsContact OH-C 3.26Å; Y82-T176 PolarHBondContact OH-O 3.09Å; Y82-L177 PolarHBondContact OH-N 2.81Å; Y82-F237 HydrophobicContact CE2-CD2 4.32Å; Y82-F237 HydrophobicContact CE2-CE2 4.33Å
83	T	97.1	Very high	95.9	Very high	18 Å²	18	39.9 Å²	39.9	11%	0.11	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	121.4	178.3	-61.3	0	0	0	0	109.7	I72 D73 M74 T156 T157 T158	I72-T83 CarbonylContact C-O 3.59Å; I72-T83 WeakPolarHBondContact CA-O 3.39Å; D73-T83 HydrophobicContact CB-CG2 4.15Å; D73-T83 PolarHBondContact N-O 2.91Å; M74-T83 PolarHBondContact O-N 3.12Å; T83-T156 HydrophobicContact CG2-CG2 3.54Å; T83-T157 WeakPolarHBondContact CA-O 3.48Å; T83-T158 PolarHBondContact OG1-OG1 3.28Å
84	L	96.8	Very high	96.2	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.7	-177.3	177	72.4	0	0	0	109.4	V69 I72 Y82 M86 T156 T157 L177 F237	V69-L84 HydrophobicContact CG1-CD1 3.52Å; V69-L84 HydrophobicContact CG2-CD1 4.43Å; I72-L84 HydrophobicContact CG1-CD1 3.71Å; Y82-L84 HydrophobicContact CD2-CB 4.35Å; Y82-L84 HydrophobicContact CE2-CB 4.14Å; L84-M86 HydrophobicContact CD2-CG 4.46Å; L84-M86 HydrophobicContact CD2-SD 3.85Å; L84-T156 VanDerWaalsContact O-CA 3.32Å; L84-T156 WeakPolarHBondContact O-CA 3.43Å; L84-T157 HydrophobicContact CB-CG2 4.32Å; L84-T157 PolarHBondContact N-O 2.74Å; L84-T157 PolarHBondContact O-N 2.92Å; L84-L177 HydrophobicContact CD2-CD2 3.9Å; L84-F237 HydrophobicContact CD1-CZ 4.37Å; L84-F237 HydrophobicContact CD2-CE2 4.44Å
85	T	97.1	Very high	96.4	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.6	170.6	-65.5	0	0	0	0	109.6	A70 S71 D73 I155 T156	A70-T85 HydrophobicContact CB-CG2 4.28Å; A70-T85 WeakPolarHBondContact CB-O 3.38Å; A70-T85 PolarHBondContact N-O 2.87Å; S71-T85 PolarHBondContact N-O 3.29Å; S71-T85 VanDerWaalsContact N-O 3.15Å; S71-T85 PolarHBondContact O-N 3.42Å; D73-T85 PolarHBondContact OD2-OG1 3.04Å; T85-I155 WeakPolarHBondContact CA-O 3.35Å; T85-T156 WeakPolarHBondContact OG1-CG2 3.16Å; T85-T156 PolarHBondContact OG1-OG1 3.36Å
86	M	97.3	Very high	96.4	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157.1	-172.3	62.3	176	179.2	0	0	113.5	I67 D68 L84 F88 F123 I155 T157 L177	I67-M86 HydrophobicContact CD1-SD 4.36Å; I67-M86 HydrophobicContact CG2-CB 3.92Å; I67-M86 HydrophobicContact CG2-CG 4.34Å; I67-M86 HydrophobicContact CG2-SD 3.67Å; D68-M86 WeakPolarHBondContact O-CA 3.41Å; L84-M86 HydrophobicContact CD2-CG 4.46Å; L84-M86 HydrophobicContact CD2-SD 3.85Å; M86-F88 HydrophobicContact CE-CB 4.36Å; M86-F123 HydrophobicContact CE-CE1 3.73Å; M86-F123 HydrophobicContact CE-CE2 4.04Å; M86-F123 HydrophobicContact CE-CZ 3.34Å; M86-I155 PolarHBondContact N-O 2.85Å; M86-I155 PolarHBondContact O-N 2.64Å; M86-T157 HydrophobicContact CE-CG2 4.25Å; M86-L177 HydrophobicContact CE-CD2 3.88Å; M86-L177 HydrophobicContact SD-CD2 3.96Å
87	Y	97.8	Very high	96.5	Very high	100 Å²	100	39.5 Å²	39.5	39%	0.392	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	105.2	163	-59.2	-81.2	0	0	0	108.6	I67 D68 A70 L153 R154	I67-Y87 WeakPolarHBondContact CA-O 3.37Å; D68-Y87 HydrophobicContact CB-CD2 4.26Å; D68-Y87 PolarHBondContact N-O 2.87Å; D68-Y87 PolarHBondContact O-N 3.11Å; A70-Y87 HydrophobicContact CB-CE2 4.09Å; Y87-L153 CarbonylContact C-O 3.48Å; Y87-L153 WeakPolarHBondContact CA-O 3.41Å; Y87-R154 HydrophobicContact CD1-CB 4.1Å; Y87-R154 HydrophobicContact CD1-CG 4.07Å; Y87-R154 HydrophobicContact CE1-CB 4.13Å; Y87-R154 HydrophobicContact CE1-CG 3.83Å
88	F	98.1	Very high	96.7	Very high	1 Å²	1	40.5 Å²	40.5	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	119.8	178.2	-177.1	-133.7	0	0	0	109.3	M65 I67 M86 Q90 F123 G152 L153 I155 I179	M65-F88 HydrophobicContact CB-CE2 4.45Å; M65-F88 HydrophobicContact CE-CZ 4.46Å; M65-F88 HydrophobicContact CG-CE2 4.41Å; M65-F88 HydrophobicContact SD-CE2 3.75Å; M65-F88 HydrophobicContact SD-CZ 3.7Å; I67-F88 HydrophobicContact CD1-CD2 4.46Å; I67-F88 HydrophobicContact CG1-CD2 4.07Å; M86-F88 HydrophobicContact CE-CB 4.36Å; F88-Q90 HydrophobicContact CE1-CG 4.18Å; F88-Q90 HydrophobicContact CZ-CG 4.17Å; F88-F123 HydrophobicContact CD1-CZ 4.15Å; F88-F123 HydrophobicContact CE1-CZ 4.14Å; F88-F123 HydrophobicContact CG-CZ 4.46Å; F88-F123 HydrophobicContact CZ-CE1 4.47Å; F88-F123 HydrophobicContact CZ-CZ 4.49Å; F88-G152 CarbonylContact O-C 3.59Å; F88-G152 WeakPolarHBondContact O-CA 3.29Å; F88-L153 HydrophobicContact CD1-CD1 4.47Å; F88-L153 PolarHBondContact N-O 2.81Å; F88-L153 PolarHBondContact O-N 2.83Å; F88-I155 HydrophobicContact CB-CD1 4.01Å; F88-I155 HydrophobicContact CB-CG1 4.5Å; F88-I155 HydrophobicContact CD1-CD1 3.86Å; F88-I155 HydrophobicContact CG-CD1 4.34Å; F88-I179 HydrophobicContact CE2-CD1 4.13Å; F88-I179 HydrophobicContact CE2-CG2 4.45Å; F88-I179 HydrophobicContact CZ-CG2 3.98Å
89	Q	97.9	Very high	96.8	Very high	50 Å²	50	36.9 Å²	36.9	23%	0.234	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	134.4	-177.3	-61.9	-176.8	15.1	0	0	110.7	M65 S66 Y91 L150 Y151	M65-Q89 WeakPolarHBondContact CA-O 3.22Å; S66-Q89 PolarHBondContact N-O 3.39Å; S66-Q89 PolarHBondContact O-N 3.02Å; Q89-Y91 HydrophobicContact CB-CE2 4.15Å; Q89-Y91 PolarHBondContact OE1-OH 2.97Å; Q89-Y91 VanDerWaalsContact OE1-OH 3.11Å; Q89-L150 HydrophobicContact CB-CD1 4.09Å; Q89-L150 HydrophobicContact CG-CD1 4.4Å; Q89-Y151 WeakPolarHBondContact CA-O 3.44Å
90	Q	98.3	Very high	96.7	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141.5	176.7	-60.7	-179.6	33	0	0	109.8	V63 G64 F88 W92 P119 T121 L150 Y151	V63-Q90 HydrophobicContact CG1-CB 4.18Å; G64-Q90 CarbonylContact O-C 3.54Å; F88-Q90 HydrophobicContact CE1-CG 4.18Å; F88-Q90 HydrophobicContact CZ-CG 4.17Å; Q90-W92 HydrophobicContact CB-CE3 4.28Å; Q90-W92 HydrophobicContact CB-CZ3 4.06Å; Q90-P119 VanDerWaalsContact OE1-CG 3.31Å; Q90-T121 PolarHBondContact NE2-OG1 3.03Å; Q90-L150 WeakPolarHBondContact O-CA 3.16Å; Q90-Y151 PolarHBondContact N-O 3.24Å; Q90-Y151 PolarHBondContact O-N 2.81Å
91	Y	98.1	Very high	96.2	Very high	37 Å²	37	41.3 Å²	41.3	15%	0.145	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.8	177.5	-63.3	-93.4	0	0	0	109.6	V63 G64 Q89 V149 L150 K194	V63-Y91 CarbonylContact C-O 3.53Å; V63-Y91 WeakPolarHBondContact CA-O 3.34Å; G64-Y91 PolarHBondContact N-O 3.08Å; G64-Y91 PolarHBondContact O-N 3.21Å; Q89-Y91 HydrophobicContact CB-CE2 4.15Å; Q89-Y91 PolarHBondContact OE1-OH 2.97Å; Q89-Y91 VanDerWaalsContact OE1-OH 3.11Å; Y91-V149 WeakPolarHBondContact CA-O 3.4Å; Y91-L150 HydrophobicContact CD1-CB 3.9Å; Y91-L150 HydrophobicContact CD1-CD1 4.08Å; Y91-L150 HydrophobicContact CD1-CG 4.46Å; Y91-L150 HydrophobicContact CD2-CD1 4.44Å; Y91-L150 HydrophobicContact CE1-CB 3.68Å; Y91-L150 HydrophobicContact CE1-CD1 3.56Å; Y91-L150 HydrophobicContact CE1-CD2 3.88Å; Y91-L150 HydrophobicContact CE1-CG 3.88Å; Y91-L150 HydrophobicContact CE2-CD1 3.95Å; Y91-L150 VanDerWaalsContact CZ-CD1 3.48Å; Y91-K194 HydrophobicContact CD1-CD 4.49Å; Y91-K194 HydrophobicContact CD2-CD 3.33Å; Y91-K194 HydrophobicContact CE2-CD 3.59Å; Y91-K194 HydrophobicContact CG-CD 3.82Å; Y91-K194 VanDerWaalsContact CZ-NZ 3.35Å
92	W	98.2	Very high	95.8	Very high	7 Å²	7	41.2 Å²	41.2	3%	0.027	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	171.9	169.9	67.6	94.6	0	0	0	109.5	V61 V63 Q90 W117 V118 P119 T148 V149 Y151	V61-W92 HydrophobicContact CG2-CB 4.08Å; V63-W92 HydrophobicContact CG2-CB 4.13Å; Q90-W92 HydrophobicContact CB-CE3 4.28Å; Q90-W92 HydrophobicContact CB-CZ3 4.06Å; W92-W117 HydrophobicContact CD2-CZ3 4.39Å; W92-W117 HydrophobicContact CG-CZ3 4.31Å; W92-W117 VanDerWaalsContact CZ2-O 3.3Å; W92-W117 WeakPolarHBondContact CZ2-O 2.92Å; W92-W117 AromaticContact NE1-CE3 3.93Å; W92-W117 AromaticContact NE1-CZ3 3.99Å; W92-V118 HydrophobicContact CH2-CB 4.32Å; W92-V118 HydrophobicContact CH2-CG1 4.03Å; W92-V118 HydrophobicContact CZ2-CG1 4.38Å; W92-P119 HydrophobicContact CD2-CG 4.41Å; W92-P119 HydrophobicContact CE3-CG 3.98Å; W92-P119 HydrophobicContact CZ3-CG 4.14Å; W92-T148 CarbonylContact O-C 3.6Å; W92-T148 WeakPolarHBondContact O-CA 3.45Å; W92-V149 HydrophobicContact CD2-CB 4.13Å; W92-V149 HydrophobicContact CH2-CB 4.43Å; W92-V149 HydrophobicContact CH2-CG1 3.96Å; W92-V149 HydrophobicContact CZ2-CB 3.88Å; W92-V149 HydrophobicContact CZ2-CG1 3.64Å; W92-V149 HydrophobicContact CZ2-CG2 4.31Å; W92-V149 PolarHBondContact N-O 2.88Å; W92-V149 PolarHBondContact O-N 3.15Å; W92-Y151 HydrophobicContact CH2-CD1 4.4Å; W92-Y151 HydrophobicContact CH2-CG 4.21Å; W92-Y151 HydrophobicContact CZ3-CD1 4.41Å; W92-Y151 HydrophobicContact CZ3-CG 4.37Å
93	R	97.9	Very high	95.4	Very high	135 Å²	135	47.1 Å²	47.1	51%	0.509	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.6	176.8	-167.6	175.9	-176.7	-173.5	1.4	110.5	D146	R93-D146 PolarHBondContact NE-O 3.26Å; R93-D146 PolarHBondContact NH2-O 2.93Å
94	D	97.9	Very high	95	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.011	27%	0.268	C	S	.	.			trans	-113.4	107.7	172	-169.3	-15.4	0	0	0	109.5	Y48 P54 R96 L97 G147 V149	Y48-D94 WeakPolarHBondContact CE2-OD2 3.17Å; Y48-D94 PolarHBondContact OH-OD2 3.36Å; P54-D94 HydrophobicContact CB-CB 4.3Å; P54-D94 HydrophobicContact CG-CB 3.88Å; D94-R96 PolarHBondContact O-N 2.86Å; D94-R96 VanDerWaalsContact O-N 3.13Å; D94-R96 VanDerWaalsContact OD1-CB 3.22Å; D94-R96 WeakPolarHBondContact OD1-CB 3.26Å; D94-R96 WeakPolarHBondContact OD1-CG 3.48Å; D94-R96 IonicContact OD1-CZ 2.7Å; D94-R96 PolarHBondContact OD1-N 3.37Å; D94-R96 IonicContact OD1-NE 3.33Å; D94-R96 PolarHBondContact OD1-NE 2.87Å; D94-R96 IonicContact OD1-NH2 2.77Å; D94-R96 IonicContact OD2-CZ 3.58Å; D94-R96 IonicContact OD2-NE 2.72Å; D94-R96 PolarHBondContact OD2-NE 2.85Å; D94-R96 VanDerWaalsContact OD2-NE 3.12Å; D94-R96 IonicContact OD2-NH2 3.16Å; D94-R96 PolarHBondContact OD2-NH2 3.3Å; D94-L97 HydrophobicContact CB-CB 4.44Å; D94-L97 HydrophobicContact CB-CD1 4.03Å; D94-L97 HydrophobicContact CB-CG 4.17Å; D94-L97 PolarHBondContact O-N 3.07Å; D94-G147 PolarHBondContact N-O 3.31Å; D94-G147 WeakPolarHBondContact O-CA 3.37Å; D94-V149 HydrophobicContact CB-CG2 4.42Å
95	K	96.3	Very high	94.9	Very high	124 Å²	124	55.3 Å²	55.3	54%	0.539	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-60.2	-23.2	179.9	-63.2	171.1	-170.2	150.6	0	112.6	D55 L97	D55-K95 WeakPolarHBondContact OD1-CD 3.34Å; D55-K95 IonicContact OD1-NZ 2.75Å; D55-K95 PolarHBondContact OD1-NZ 3.24Å; D55-K95 WeakPolarHBondContact OD2-CE 3.43Å; D55-K95 IonicContact OD2-NZ 2.68Å; D55-K95 PolarHBondContact OD2-NZ 3.11Å; K95-L97 PolarHBondContact O-N 3.05Å
96	R	96.5	Very high	94.7	Very high	81 Å²	81	56 Å²	56	31%	0.306	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-69.6	-22.7	176.8	-57.1	172.3	-69.5	-173.8	-0.5	112.4	Y48 D49 L52 D94	Y48-R96 HydrophobicContact CD2-CB 4.07Å; Y48-R96 HydrophobicContact CE2-CB 3.94Å; Y48-R96 PolarHBondContact OH-NH2 3.02Å; Y48-R96 VanDerWaalsContact OH-NH2 3.16Å; D49-R96 PolarHBondContact O-NH1 2.85Å; L52-R96 PolarHBondContact O-NH1 3.13Å; L52-R96 PolarHBondContact O-NH2 3.34Å; D94-R96 PolarHBondContact O-N 2.86Å; D94-R96 VanDerWaalsContact O-N 3.13Å; D94-R96 VanDerWaalsContact OD1-CB 3.22Å; D94-R96 WeakPolarHBondContact OD1-CB 3.26Å; D94-R96 WeakPolarHBondContact OD1-CG 3.48Å; D94-R96 IonicContact OD1-CZ 2.7Å; D94-R96 PolarHBondContact OD1-N 3.37Å; D94-R96 IonicContact OD1-NE 3.33Å; D94-R96 PolarHBondContact OD1-NE 2.87Å; D94-R96 IonicContact OD1-NH2 2.77Å; D94-R96 IonicContact OD2-CZ 3.58Å; D94-R96 IonicContact OD2-NE 2.72Å; D94-R96 PolarHBondContact OD2-NE 2.85Å; D94-R96 VanDerWaalsContact OD2-NE 3.12Å; D94-R96 IonicContact OD2-NH2 3.16Å; D94-R96 PolarHBondContact OD2-NH2 3.3Å
97	L	96.4	Very high	94.6	Very high	3 Å²	3	59.9 Å²	59.9	2%	0.016	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-101.5	8.9	-177	-58.8	177.4	0	0	0	113.2	L44 Y48 D94 K95 L116 L143 V149	L44-L97 HydrophobicContact CB-CD2 4.43Å; Y48-L97 HydrophobicContact CD2-CD2 3.88Å; Y48-L97 HydrophobicContact CE2-CD1 4.29Å; Y48-L97 HydrophobicContact CE2-CD2 3.67Å; Y48-L97 HydrophobicContact CE2-CG 3.9Å; D94-L97 HydrophobicContact CB-CB 4.44Å; D94-L97 HydrophobicContact CB-CD1 4.03Å; D94-L97 HydrophobicContact CB-CG 4.17Å; D94-L97 PolarHBondContact O-N 3.07Å; K95-L97 PolarHBondContact O-N 3.05Å; L97-L116 HydrophobicContact CD1-CD1 4.41Å; L97-L116 HydrophobicContact CD1-CD2 3.89Å; L97-L116 HydrophobicContact CD2-CD2 3.79Å; L97-L143 HydrophobicContact CB-CD2 4.45Å; L97-L143 HydrophobicContact CD1-CD2 4.15Å; L97-V149 HydrophobicContact CD1-CG2 3.83Å
98	A	95.7	Very high	94.4	Very high	43 Å²	43	56.8 Å²	56.8	36%	0.355	31%	0.307	S	S	.	.			trans	-73.6	137.2	175.8	0	0	0	0	0	111.4	L44	L44-A98 WeakPolarHBondContact CD2-O 3.33Å
99	Y	94.4	Very high	94.3	Very high	9 Å²	9	60.6 Å²	60.6	4%	0.035	33%	0.327	C	S	.	.			trans	-133.1	151.7	-177.2	59.4	-90.6	0	0	0	112.3	T40 L44 I102 L104 L106 L143 H144 P145	T40-Y99 HydrophobicContact CG2-CG 4.37Å; L44-Y99 HydrophobicContact CD1-CD1 4.27Å; Y99-I102 HydrophobicContact CD2-CB 4.06Å; Y99-I102 HydrophobicContact CE2-CB 3.95Å; Y99-I102 HydrophobicContact CE2-CG2 4.26Å; Y99-L104 PolarHBondContact OH-O 2.95Å; Y99-L106 HydrophobicContact CD1-CD1 4.35Å; Y99-L106 HydrophobicContact CD2-CD1 4.36Å; Y99-L106 HydrophobicContact CE1-CD1 4.04Å; Y99-L106 HydrophobicContact CE1-CG 4.33Å; Y99-L106 HydrophobicContact CE2-CD1 4.06Å; Y99-L106 HydrophobicContact CE2-CG 4.17Å; Y99-L106 HydrophobicContact CG-CD1 4.5Å; Y99-L106 PolarHBondContact OH-N 3.39Å; Y99-L143 HydrophobicContact CE1-CB 3.9Å; Y99-L143 PolarHBondContact OH-O 2.95Å; Y99-H144 VanDerWaalsContact CE1-C 3.5Å; Y99-H144 WeakPolarHBondContact CE1-O 3.24Å; Y99-P145 HydrophobicContact CD2-CB 4.18Å; Y99-P145 HydrophobicContact CE2-CB 3.82Å; Y99-P145 PolarHBondContact N-O 3.39Å
100	I	90.1	Very high	94.1	Very high	165 Å²	165	59.1 Å²	59.1	85%	0.846	32%	0.32	S	S	*	.	S	Bend	trans	-124.5	146.2	-175.1	-57.4	173.2	0	0	0	108.4
101	G	84.8	Confident	93.9	Very high	72 Å²	72	67.2 Å²	67.2	74%	0.742	35%	0.351	S	S	*	.	S	Bend	trans	95.9	-6.1	175.3	0	0	0	0	0	115.5
102	I	88.5	Confident	93.7	Very high	11 Å²	11	66.4 Å²	66.4	6%	0.056	35%	0.35	C	S	.	.			trans	-120.1	114.1	175.9	-60.4	165	0	0	0	108.8	V37 T40 Y99 L104 L106	V37-I102 HydrophobicContact CG2-CD1 4.02Å; T40-I102 HydrophobicContact CG2-CD1 4.14Å; Y99-I102 HydrophobicContact CD2-CB 4.06Å; Y99-I102 HydrophobicContact CE2-CB 3.95Å; Y99-I102 HydrophobicContact CE2-CG2 4.26Å; I102-L104 HydrophobicContact CG2-CB 4.01Å; I102-L104 PolarHBondContact O-N 2.98Å; I102-L106 HydrophobicContact CD1-CD1 4.33Å; I102-L106 HydrophobicContact CG2-CD2 4.22Å
103	P	87.4	Confident	93.6	Very high	125 Å²	125	66.3 Å²	66.3	81%	0.812	35%	0.351	S	S	*	.			trans	-82	15.9	-178.2	34.8	-37	0	0	0	113.7
104	L	90.4	Very high	93.4	Very high	108 Å²	108	64.7 Å²	64.7	57%	0.565	35%	0.352	S	S	*	.	S	Bend	trans	-117.2	149.9	-174.1	-61	174.4	0	0	0	110.6	Y99 I102 L106	Y99-L104 PolarHBondContact OH-O 2.95Å; I102-L104 HydrophobicContact CG2-CB 4.01Å; I102-L104 PolarHBondContact O-N 2.98Å; L104-L106 PolarHBondContact O-N 3.15Å
105	N	94.2	Very high	93.4	Very high	82 Å²	82	69.8 Å²	69.8	44%	0.439	38%	0.376	S	S	.	.			trans	-80.6	113.7	171.5	-59.7	-38.2	0	0	0	109.4	T107 R142 L143 H144	N105-T107 PolarHBondContact O-N 2.85Å; N105-T107 VanDerWaalsContact O-N 3.15Å; N105-R142 HydrophobicContact CB-CG 4.15Å; N105-L143 CarbonylContact C-O 3.59Å; N105-L143 WeakPolarHBondContact CA-O 3.44Å; N105-H144 PolarHBondContact ND2-CE1 2.89Å; N105-H144 PolarHBondContact ND2-ND1 2.89Å; N105-H144 PolarHBondContact OD1-ND1 2.74Å
106	L	93.4	Very high	93.4	Very high	19 Å²	19	64.4 Å²	64.4	10%	0.099	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	105.1	-176.6	-64.5	177.1	0	0	0	110.1	V37 V41 Y99 I102 L104 L108 R142 L143	V37-L106 HydrophobicContact CG1-CD2 3.99Å; V37-L106 HydrophobicContact CG2-CD2 4.46Å; V41-L106 HydrophobicContact CG2-CD1 4.39Å; Y99-L106 HydrophobicContact CD1-CD1 4.35Å; Y99-L106 HydrophobicContact CD2-CD1 4.36Å; Y99-L106 HydrophobicContact CE1-CD1 4.04Å; Y99-L106 HydrophobicContact CE1-CG 4.33Å; Y99-L106 HydrophobicContact CE2-CD1 4.06Å; Y99-L106 HydrophobicContact CE2-CG 4.17Å; Y99-L106 HydrophobicContact CG-CD1 4.5Å; Y99-L106 PolarHBondContact OH-N 3.39Å; I102-L106 HydrophobicContact CD1-CD1 4.33Å; I102-L106 HydrophobicContact CG2-CD2 4.22Å; L104-L106 PolarHBondContact O-N 3.15Å; L106-L108 HydrophobicContact CB-CD2 4.4Å; L106-R142 CarbonylContact O-C 3.58Å; L106-R142 WeakPolarHBondContact O-CA 3.38Å; L106-L143 HydrophobicContact CB-CB 4.46Å; L106-L143 PolarHBondContact N-O 3.26Å; L106-L143 PolarHBondContact O-N 3.34Å
107	T	95.3	Very high	93.4	Very high	82 Å²	82	61 Å²	61	50%	0.503	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	112.9	169.4	-54.6	0	0	0	0	108.1	N105 R142	N105-T107 PolarHBondContact O-N 2.85Å; N105-T107 VanDerWaalsContact O-N 3.15Å; T107-R142 PolarHBondContact OG1-NE 2.89Å
108	L	93.8	Very high	93.5	Very high	36 Å²	36	63 Å²	63	19%	0.188	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	160.7	-175	-61.3	-179.6	0	0	0	111.3	V41 L106 V112 I141 L143	V41-L108 HydrophobicContact CG2-CD2 4.06Å; L106-L108 HydrophobicContact CB-CD2 4.4Å; L108-V112 HydrophobicContact CB-CG1 3.75Å; L108-V112 HydrophobicContact CD1-CG1 3.95Å; L108-V112 HydrophobicContact CD1-CG2 4.29Å; L108-I141 HydrophobicContact CB-CB 4.45Å; L108-I141 HydrophobicContact CB-CG2 4.31Å; L108-I141 HydrophobicContact CD1-CG2 4.39Å; L108-I141 PolarHBondContact N-O 2.87Å; L108-L143 HydrophobicContact CD1-CD1 3.67Å; L108-L143 HydrophobicContact CD1-CG 4.06Å
109	D	94.8	Very high	93.6	Very high	81 Å²	81	61.3 Å²	61.3	43%	0.433	34%	0.338	S	S	.	.			trans	-66.7	150.1	176.4	-179.1	48.7	0	0	0	112.5	R111 V112	D109-R111 PolarHBondContact O-N 3.5Å; D109-R111 IonicContact OD2-CZ 2.67Å; D109-R111 IonicContact OD2-NE 3.9Å; D109-R111 PolarHBondContact OD2-NE 3.31Å; D109-R111 IonicContact OD2-NH2 2.79Å; D109-R111 PolarHBondContact OD2-NH2 3.02Å; D109-V112 WeakPolarHBondContact O-CG1 3.39Å; D109-V112 PolarHBondContact O-N 3.07Å; D109-V112 VanDerWaalsContact O-N 3.11Å
110	N	93	Very high	93.7	Very high	18 Å²	18	63.3 Å²	63.3	10%	0.096	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15	-170.3	71.4	-0.7	0	0	0	114.8	K137 R139	N110-K137 PolarHBondContact ND2-O 2.91Å; N110-R139 HydrophobicContact CB-CB 4.27Å; N110-R139 WeakPolarHBondContact CB-O 3.5Å; N110-R139 PolarHBondContact O-NE 2.83Å; N110-R139 PolarHBondContact O-NH2 2.61Å
111	R	94.1	Very high	94.1	Very high	172 Å²	172	56.9 Å²	56.9	65%	0.649	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-22.8	176.9	-73.5	172.7	-69.1	-176.4	-0.7	113.2	D109 A113 D114	D109-R111 PolarHBondContact O-N 3.5Å; D109-R111 IonicContact OD2-CZ 2.67Å; D109-R111 IonicContact OD2-NE 3.9Å; D109-R111 PolarHBondContact OD2-NE 3.31Å; D109-R111 IonicContact OD2-NH2 2.79Å; D109-R111 PolarHBondContact OD2-NH2 3.02Å; R111-A113 PolarHBondContact O-N 3.4Å; R111-D114 PolarHBondContact O-N 3.49Å
112	V	95.2	Very high	94.7	Very high	19 Å²	19	56.7 Å²	56.7	12%	0.115	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-66.3	-24.5	177.1	83	0	0	0	0	111.8	L45 L108 D109 D114 Q115 L116 I141	L45-V112 HydrophobicContact CD1-CG2 4.18Å; L45-V112 HydrophobicContact CD2-CG2 4.32Å; L108-V112 HydrophobicContact CB-CG1 3.75Å; L108-V112 HydrophobicContact CD1-CG1 3.95Å; L108-V112 HydrophobicContact CD1-CG2 4.29Å; D109-V112 WeakPolarHBondContact O-CG1 3.39Å; D109-V112 PolarHBondContact O-N 3.07Å; D109-V112 VanDerWaalsContact O-N 3.11Å; V112-D114 PolarHBondContact O-N 2.85Å; V112-Q115 CarbonylContact O-C 3.6Å; V112-Q115 WeakPolarHBondContact O-CA 3.3Å; V112-Q115 PolarHBondContact O-N 3.02Å; V112-L116 HydrophobicContact CG1-CD1 4.15Å; V112-L116 HydrophobicContact CG2-CD1 4.37Å; V112-L116 HydrophobicContact CG2-CG 4.44Å; V112-L116 WeakPolarHBondContact O-CG 3.3Å; V112-L116 PolarHBondContact O-N 2.69Å; V112-I141 HydrophobicContact CG1-CB 3.88Å; V112-I141 HydrophobicContact CG1-CG1 3.89Å; V112-I141 HydrophobicContact CG1-CG2 3.85Å
113	A	95.1	Very high	95.1	Very high	6 Å²	6	57.2 Å²	57.2	5%	0.05	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-59.1	-26.8	176.9	0	0	0	0	0	113.1	R111 Q115 I141 Y151	R111-A113 PolarHBondContact O-N 3.4Å; A113-Q115 PolarHBondContact O-N 3.3Å; A113-I141 HydrophobicContact CB-CD1 4.03Å; A113-I141 HydrophobicContact CB-CG1 3.84Å; A113-Y151 HydrophobicContact CB-CE2 4.12Å
114	D	95.1	Very high	95.5	Very high	100 Å²	100	54.7 Å²	54.7	54%	0.535	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-81	-3.1	177.1	-53	-51.2	0	0	0	112.6	R111 V112 R139	R111-D114 PolarHBondContact O-N 3.49Å; V112-D114 PolarHBondContact O-N 2.85Å; D114-R139 VanDerWaalsContact CG-NH2 3.26Å; D114-R139 IonicContact OD1-CZ 3.64Å; D114-R139 IonicContact OD1-NH1 3.25Å; D114-R139 PolarHBondContact OD1-NH1 2.92Å; D114-R139 IonicContact OD1-NH2 2.77Å; D114-R139 PolarHBondContact OD1-NH2 2.96Å; D114-R139 VanDerWaalsContact OD1-NH2 3.16Å; D114-R139 IonicContact OD2-CZ 2.68Å; D114-R139 IonicContact OD2-NH1 3.37Å; D114-R139 IonicContact OD2-NH2 2.66Å; D114-R139 PolarHBondContact OD2-NH2 2.9Å
115	Q	96.1	Very high	95.8	Very high	110 Å²	110	51.3 Å²	51.3	51%	0.514	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-117.9	8.2	177.4	-57.7	-178.2	18.3	0	0	112.7	I50 V112 A113	I50-Q115 VanDerWaalsContact CG2-C 3.41Å; I50-Q115 WeakPolarHBondContact CG2-O 3.44Å; V112-Q115 CarbonylContact O-C 3.6Å; V112-Q115 WeakPolarHBondContact O-CA 3.3Å; V112-Q115 PolarHBondContact O-N 3.02Å; A113-Q115 PolarHBondContact O-N 3.3Å
116	L	96.8	Very high	95.9	Very high	11 Å²	11	49.7 Å²	49.7	6%	0.058	25%	0.25	C	C	.	.	S	Bend	trans	-120.8	152.9	178.5	-66	178.5	0	0	0	109.8	L45 Y48 L97 V112 I141	L45-L116 HydrophobicContact CD2-CD2 3.81Å; Y48-L116 HydrophobicContact CD1-CD2 4.44Å; Y48-L116 HydrophobicContact CE1-CD2 4.09Å; L97-L116 HydrophobicContact CD1-CD1 4.41Å; L97-L116 HydrophobicContact CD1-CD2 3.89Å; L97-L116 HydrophobicContact CD2-CD2 3.79Å; V112-L116 HydrophobicContact CG1-CD1 4.15Å; V112-L116 HydrophobicContact CG2-CD1 4.37Å; V112-L116 HydrophobicContact CG2-CG 4.44Å; V112-L116 WeakPolarHBondContact O-CG 3.3Å; V112-L116 PolarHBondContact O-N 2.69Å; L116-I141 HydrophobicContact CD1-CD1 4.49Å; L116-I141 HydrophobicContact CD1-CG2 4.11Å
117	W	97.9	Very high	96.1	Very high	10 Å²	10	53.8 Å²	53.8	4%	0.038	27%	0.267	C	S	.	.			trans	-69.4	133.3	166.8	179.1	90.8	0	0	0	108.8	Y48 R53 P54 V61 W92 P119 Y184 I189	Y48-W117 PolarHBondContact OH-N 3.29Å; R53-W117 HydrophobicContact CB-CD2 4.5Å; R53-W117 HydrophobicContact CB-CH2 4.48Å; R53-W117 HydrophobicContact CB-CZ2 3.76Å; P54-W117 VanDerWaalsContact CD-CE3 3.44Å; P54-W117 HydrophobicContact CG-CE3 3.99Å; P54-W117 HydrophobicContact CG-CZ3 4.09Å; V61-W117 HydrophobicContact CG1-CH2 3.7Å; V61-W117 HydrophobicContact CG1-CZ2 4.42Å; V61-W117 HydrophobicContact CG1-CZ3 4.37Å; W92-W117 HydrophobicContact CD2-CZ3 4.39Å; W92-W117 HydrophobicContact CG-CZ3 4.31Å; W92-W117 VanDerWaalsContact CZ2-O 3.3Å; W92-W117 WeakPolarHBondContact CZ2-O 2.92Å; W92-W117 AromaticContact NE1-CE3 3.93Å; W92-W117 AromaticContact NE1-CZ3 3.99Å; W117-P119 HydrophobicContact CH2-CB 4.26Å; W117-P119 HydrophobicContact CH2-CG 3.77Å; W117-P119 HydrophobicContact CZ3-CG 3.76Å; W117-Y184 HydrophobicContact CZ2-CD2 4.41Å; W117-Y184 AromaticContact CZ2-CE2 3.82Å; W117-Y184 HydrophobicContact CZ2-CE2 3.82Å; W117-Y184 AromaticContact NE1-CE2 3.86Å; W117-Y184 AromaticContact NE1-CZ 3.73Å; W117-Y184 PolarHBondContact NE1-OH 2.87Å; W117-I189 HydrophobicContact CH2-CD1 4.31Å
118	V	97.6	Very high	96.2	Very high	45 Å²	45	57.2 Å²	57.2	27%	0.273	28%	0.275	S	S	.	.			trans	-129.7	145.6	172.7	-61.5	0	0	0	0	109	W92 Y151	W92-V118 HydrophobicContact CH2-CB 4.32Å; W92-V118 HydrophobicContact CH2-CG1 4.03Å; W92-V118 HydrophobicContact CZ2-CG1 4.38Å; V118-Y151 HydrophobicContact CB-CE1 4.28Å; V118-Y151 HydrophobicContact CG1-CD1 4.42Å; V118-Y151 HydrophobicContact CG1-CE1 4.26Å
119	P	97.7	Very high	96.3	Very high	7 Å²	7	58 Å²	58	5%	0.045	28%	0.283	C	S	.	.			trans	-58.5	141.4	175.3	-25.7	35.5	0	0	0	112.7	V63 Q90 W92 W117 T121 I189	V63-P119 HydrophobicContact CG1-CG 4.08Å; V63-P119 HydrophobicContact CG2-CG 3.92Å; Q90-P119 VanDerWaalsContact OE1-CG 3.31Å; W92-P119 HydrophobicContact CD2-CG 4.41Å; W92-P119 HydrophobicContact CE3-CG 3.98Å; W92-P119 HydrophobicContact CZ3-CG 4.14Å; W117-P119 HydrophobicContact CH2-CB 4.26Å; W117-P119 HydrophobicContact CH2-CG 3.77Å; W117-P119 HydrophobicContact CZ3-CG 3.76Å; P119-T121 HydrophobicContact CB-CG2 4.01Å; P119-T121 PolarHBondContact O-N 2.82Å; P119-I189 HydrophobicContact CB-CD1 4.1Å
120	D	96.8	Very high	96.4	Very high	51 Å²	51	59.1 Å²	59.1	27%	0.273	28%	0.284	S	S	.	.			trans	-84	43.9	-179.6	66.1	-13	0	0	0	112.6	Y122 S181 Y182 G183	D120-Y122 PolarHBondContact O-N 2.95Å; D120-S181 PolarHBondContact OD1-OG 3.37Å; D120-Y182 PolarHBondContact O-N 2.7Å; D120-Y182 PolarHBondContact OD2-N 2.71Å; D120-G183 WeakPolarHBondContact OD2-CA 3.33Å; D120-G183 PolarHBondContact OD2-N 3.16Å
121	T	97.6	Very high	96.7	Very high	29 Å²	29	61.3 Å²	61.3	18%	0.178	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	127.2	-178.7	53.7	0	0	0	0	111.5	M65 Q90 P119 E180 F191	M65-T121 HydrophobicContact CE-CG2 3.48Å; M65-T121 VanDerWaalsContact CE-CG2 3.48Å; Q90-T121 PolarHBondContact NE2-OG1 3.03Å; P119-T121 HydrophobicContact CB-CG2 4.01Å; P119-T121 PolarHBondContact O-N 2.82Å; T121-E180 CarbonylContact C-O 3.49Å; T121-E180 WeakPolarHBondContact CA-O 3.47Å; T121-F191 HydrophobicContact CG2-CE1 4.29Å; T121-F191 HydrophobicContact CG2-CE2 4.4Å; T121-F191 HydrophobicContact CG2-CZ 3.71Å
122	Y	97.6	Very high	96.8	Very high	68 Å²	68	54.9 Å²	54.9	27%	0.267	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	166.4	172	78.1	-76	0	0	0	111.4	D120 L124 E180 Y182	D120-Y122 PolarHBondContact O-N 2.95Å; Y122-L124 HydrophobicContact CE2-CB 4.36Å; Y122-L124 HydrophobicContact CE2-CD1 4.11Å; Y122-E180 HydrophobicContact CD1-CB 4.27Å; Y122-E180 VanDerWaalsContact CD1-O 3.22Å; Y122-E180 WeakPolarHBondContact CD1-O 3.38Å; Y122-E180 HydrophobicContact CE1-CB 3.68Å; Y122-E180 HydrophobicContact CE1-CG 3.76Å; Y122-E180 PolarHBondContact N-O 3.5Å; Y122-E180 PolarHBondContact O-N 3.05Å; Y122-E180 PolarHBondContact OH-OE2 2.84Å; Y122-Y182 HydrophobicContact CD1-CD2 4.04Å; Y122-Y182 HydrophobicContact CD1-CG 4.41Å; Y122-Y182 AromaticContact CE1-CD2 3.91Å; Y122-Y182 HydrophobicContact CE1-CD2 3.91Å; Y122-Y182 HydrophobicContact CE1-CG 4.45Å; Y122-Y182 HydrophobicContact CG-CD2 4.48Å
123	F	98	Very high	96.7	Very high	23 Å²	23	56.1 Å²	56.1	10%	0.101	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.8	176.3	-58	-61.9	0	0	0	108.9	M86 F88 N125 D126 I155 L177 E178 I179	M86-F123 HydrophobicContact CE-CE1 3.73Å; M86-F123 HydrophobicContact CE-CE2 4.04Å; M86-F123 HydrophobicContact CE-CZ 3.34Å; F88-F123 HydrophobicContact CD1-CZ 4.15Å; F88-F123 HydrophobicContact CE1-CZ 4.14Å; F88-F123 HydrophobicContact CG-CZ 4.46Å; F88-F123 HydrophobicContact CZ-CE1 4.47Å; F88-F123 HydrophobicContact CZ-CZ 4.49Å; F123-N125 VanDerWaalsContact C-N 3.31Å; F123-N125 PolarHBondContact O-N 3.42Å; F123-D126 HydrophobicContact CB-CB 3.79Å; F123-D126 PolarHBondContact O-N 2.98Å; F123-I155 HydrophobicContact CE2-CD1 3.93Å; F123-I155 HydrophobicContact CE2-CG2 4.3Å; F123-I155 HydrophobicContact CZ-CD1 4.07Å; F123-L177 HydrophobicContact CB-CD1 4.36Å; F123-L177 HydrophobicContact CD1-CD1 3.81Å; F123-L177 HydrophobicContact CD1-CD2 4.37Å; F123-L177 HydrophobicContact CD1-CG 4.12Å; F123-L177 HydrophobicContact CE1-CD1 4.43Å; F123-L177 HydrophobicContact CE1-CD2 4.25Å; F123-L177 HydrophobicContact CE1-CG 4.49Å; F123-L177 HydrophobicContact CG-CD1 4.17Å; F123-E178 WeakPolarHBondContact CA-O 3.5Å; F123-I179 HydrophobicContact CD1-CB 4.5Å; F123-I179 HydrophobicContact CD1-CG1 3.95Å; F123-I179 HydrophobicContact CD1-CG2 4.39Å; F123-I179 HydrophobicContact CE1-CD1 4.29Å; F123-I179 HydrophobicContact CE1-CG1 3.94Å; F123-I179 HydrophobicContact CE1-CG2 4.2Å
124	L	96.1	Very high	96.7	Very high	72 Å²	72	61.8 Å²	61.8	38%	0.377	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-35.2	-175.3	-179.3	69.4	0	0	0	112.5	Y122 D126 E178 R232	Y122-L124 HydrophobicContact CE2-CB 4.36Å; Y122-L124 HydrophobicContact CE2-CD1 4.11Å; L124-D126 VanDerWaalsContact C-N 3.33Å; L124-E178 HydrophobicContact CB-CB 4Å; L124-E178 HydrophobicContact CD2-CB 4.49Å; L124-E178 PolarHBondContact N-O 3.04Å; L124-R232 VanDerWaalsContact CD2-NH1 3.35Å
125	N	95.8	Very high	96.7	Very high	37 Å²	37	63.5 Å²	63.5	20%	0.198	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-0.6	-176.6	-63.3	-6.3	0	0	0	112.8	F123 K127 A159 A160 T176	F123-N125 VanDerWaalsContact C-N 3.31Å; F123-N125 PolarHBondContact O-N 3.42Å; N125-K127 PolarHBondContact O-N 3.23Å; N125-A159 HydrophobicContact CB-CB 4.3Å; N125-A159 CarbonylContact O-C 3.57Å; N125-A159 WeakPolarHBondContact O-CA 3.45Å; N125-A160 PolarHBondContact O-N 3.01Å; N125-T176 PolarHBondContact ND2-O 3.28Å; N125-T176 PolarHBondContact ND2-OG1 3.24Å
126	D	97	Very high	96.6	Very high	47 Å²	47	62.3 Å²	62.3	25%	0.251	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	124.6	-173.8	-176.9	45.9	0	0	0	112.2	F123 L124 K128 S129 T157	F123-D126 HydrophobicContact CB-CB 3.79Å; F123-D126 PolarHBondContact O-N 2.98Å; L124-D126 VanDerWaalsContact C-N 3.33Å; D126-K128 PolarHBondContact OD1-N 3.13Å; D126-K128 VanDerWaalsContact OD1-N 3.08Å; D126-S129 PolarHBondContact OD1-N 2.97Å; D126-S129 WeakPolarHBondContact OD2-CB 3.38Å; D126-S129 PolarHBondContact OD2-N 2.92Å; D126-S129 VanDerWaalsContact OD2-N 3.08Å; D126-S129 PolarHBondContact OD2-OG 2.91Å; D126-T157 PolarHBondContact OD1-OG1 3.17Å
127	K	96.8	Very high	96.5	Very high	106 Å²	106	68 Å²	68	46%	0.461	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-32.6	168.1	-63.8	-178.4	-175.1	175.5	0	111.5	N79 M80 D81 N125 T158 A160	N79-K127 PolarHBondContact O-NZ 3.03Å; M80-K127 PolarHBondContact O-NZ 2.84Å; D81-K127 HydrophobicContact CB-CD 4.23Å; D81-K127 WeakPolarHBondContact OD2-CD 3.5Å; D81-K127 IonicContact OD2-NZ 3.68Å; D81-K127 PolarHBondContact OD2-NZ 3.29Å; N125-K127 PolarHBondContact O-N 3.23Å; K127-T158 PolarHBondContact N-O 2.91Å; K127-A160 HydrophobicContact CG-CB 4.33Å
128	K	96.6	Very high	96.4	Very high	153 Å²	153	70 Å²	70	67%	0.665	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-166.8	116	-176.5	-176	179.2	-179.8	-178.6	0	110	D126 T158	D126-K128 PolarHBondContact OD1-N 3.13Å; D126-K128 VanDerWaalsContact OD1-N 3.08Å; K128-T158 PolarHBondContact O-N 3.25Å
129	S	97.1	Very high	96.3	Very high	53 Å²	53	69.8 Å²	69.8	37%	0.371	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	159.8	170.6	56.4	0	0	0	0	112.5	D126 T156	D126-S129 PolarHBondContact OD1-N 2.97Å; D126-S129 WeakPolarHBondContact OD2-CB 3.38Å; D126-S129 PolarHBondContact OD2-N 2.92Å; D126-S129 VanDerWaalsContact OD2-N 3.08Å; D126-S129 PolarHBondContact OD2-OG 2.91Å; S129-T156 CarbonylContact C-O 3.53Å; S129-T156 WeakPolarHBondContact CA-O 3.48Å; S129-T156 WeakPolarHBondContact CB-O 3.49Å
130	F	97.5	Very high	96.2	Very high	105 Å²	105	72.2 Å²	72.2	46%	0.461	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	146.1	169.4	63.2	-83.9	0	0	0	111.1	H132 T156	F130-H132 AromaticContact CE2-CE1 3.57Å; F130-H132 AromaticContact CE2-ND1 3.96Å; F130-H132 AromaticContact CE2-NE2 3.73Å; F130-T156 HydrophobicContact CE1-CG2 3.85Å; F130-T156 HydrophobicContact CZ-CG2 4.04Å; F130-T156 PolarHBondContact N-O 3Å; F130-T156 PolarHBondContact O-N 2.82Å
131	V	97.5	Very high	96.2	Very high	64 Å²	64	69.8 Å²	69.8	39%	0.388	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	133.3	167.6	-177	0	0	0	0	107.9	R139 L153 I155	V131-R139 HydrophobicContact CG1-CG 4.45Å; V131-L153 HydrophobicContact CG1-CD2 4.32Å; V131-I155 HydrophobicContact CG2-CG1 4.47Å
132	H	96.3	Very high	96.2	Very high	37 Å²	37	72.4 Å²	72.4	17%	0.171	38%	0.375	C	S	.	.			trans	-62.9	147.7	178.1	-73.6	-96.2	0	0	0	111.5	F130 K137 N138 R154 T156	F130-H132 AromaticContact CE2-CE1 3.57Å; F130-H132 AromaticContact CE2-ND1 3.96Å; F130-H132 AromaticContact CE2-NE2 3.73Å; H132-K137 CarbonylContact O-C 3.53Å; H132-K137 WeakPolarHBondContact O-CA 3.26Å; H132-N138 HydrophobicContact CB-CB 4.1Å; H132-N138 WeakPolarHBondContact CB-OD1 3.44Å; H132-N138 PolarHBondContact O-N 2.87Å; H132-N138 PolarHBondContact O-OD1 2.84Å; H132-R154 PolarHBondContact CD2-O 3.02Å; H132-R154 PolarHBondContact CE1-NH1 3.02Å; H132-R154 VanDerWaalsContact CE1-NH1 3.3Å; H132-R154 PolarHBondContact N-O 2.97Å; H132-R154 PolarHBondContact ND1-NH1 2.87Å; H132-T156 PolarHBondContact NE2-OG1 3.43Å
133	G	94.6	Very high	96.2	Very high	44 Å²	44	69.4 Å²	69.4	45%	0.454	36%	0.364	S	S	.	.			trans	-128.9	14.4	-168.1	0	0	0	0	0	115.8	T135 V136 N138	G133-T135 CarbonylContact O-C 3.59Å; G133-V136 CarbonylContact C-O 3.52Å; G133-V136 WeakPolarHBondContact CA-O 3.27Å; G133-V136 CarbonylContact O-C 3.45Å; G133-V136 PolarHBondContact O-N 3.32Å; G133-N138 PolarHBondContact N-OD1 2.87Å
134	V	93.8	Very high	96.1	Very high	125 Å²	125	70.2 Å²	70.2	76%	0.758	37%	0.368	S	S	*	.	S	Bend	trans	-119.9	124.5	-170.6	-177	0	0	0	0	110.4	V136	V134-V136 VanDerWaalsContact C-N 3.29Å; V134-V136 PolarHBondContact N-O 2.93Å
135	T	94.6	Very high	96.1	Very high	136 Å²	136	69.3 Å²	69.3	83%	0.834	37%	0.366	S	S	*	.	S	Bend	cis	-76.3	-11.5	-8.5	49.9	0	0	0	0	113.7	G133	G133-T135 CarbonylContact O-C 3.59Å
136	V	95.8	Very high	96.1	Very high	85 Å²	85	70.7 Å²	70.7	52%	0.515	37%	0.373	S	S	.	.	S	Bend	trans	-136	167.4	175.4	-63.9	0	0	0	0	109.1	G133 V134 N138	G133-V136 CarbonylContact C-O 3.52Å; G133-V136 WeakPolarHBondContact CA-O 3.27Å; G133-V136 CarbonylContact O-C 3.45Å; G133-V136 PolarHBondContact O-N 3.32Å; V134-V136 VanDerWaalsContact C-N 3.29Å; V134-V136 PolarHBondContact N-O 2.93Å; V136-N138 PolarHBondContact O-N 3.01Å; V136-N138 VanDerWaalsContact O-N 3.09Å; V136-N138 PolarHBondContact O-OD1 2.84Å
137	K	94.9	Very high	96	Very high	130 Å²	130	68.5 Å²	68.5	57%	0.565	36%	0.362	S	S	*	.			trans	-53.4	118.8	172.1	-71.1	-172.9	178	-179.1	0	110.4	N110 H132 R139	N110-K137 PolarHBondContact ND2-O 2.91Å; H132-K137 CarbonylContact O-C 3.53Å; H132-K137 WeakPolarHBondContact O-CA 3.26Å; K137-R139 HydrophobicContact CB-CG 4.27Å; K137-R139 PolarHBondContact O-N 2.9Å
138	N	95	Very high	96	Very high	54 Å²	54	64.9 Å²	64.9	29%	0.289	35%	0.349	S	S	.	.			trans	-74.4	70.1	-176.2	-65.3	85.8	0	0	0	110.9	H132 G133 V136 R154	H132-N138 HydrophobicContact CB-CB 4.1Å; H132-N138 WeakPolarHBondContact CB-OD1 3.44Å; H132-N138 PolarHBondContact O-N 2.87Å; H132-N138 PolarHBondContact O-OD1 2.84Å; G133-N138 PolarHBondContact N-OD1 2.87Å; V136-N138 PolarHBondContact O-N 3.01Å; V136-N138 VanDerWaalsContact O-N 3.09Å; V136-N138 PolarHBondContact O-OD1 2.84Å; N138-R154 HydrophobicContact CB-CB 3.79Å; N138-R154 PolarHBondContact O-N 2.8Å; N138-R154 VanDerWaalsContact O-N 3.07Å
139	R	96.1	Very high	96.1	Very high	40 Å²	40	57.6 Å²	57.6	15%	0.151	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	144.3	172	-40.1	-172.8	-70	-164	-4.2	108.7	N110 D114 V131 K137 Y151 G152 L153	N110-R139 HydrophobicContact CB-CB 4.27Å; N110-R139 WeakPolarHBondContact CB-O 3.5Å; N110-R139 PolarHBondContact O-NE 2.83Å; N110-R139 PolarHBondContact O-NH2 2.61Å; D114-R139 VanDerWaalsContact CG-NH2 3.26Å; D114-R139 IonicContact OD1-CZ 3.64Å; D114-R139 IonicContact OD1-NH1 3.25Å; D114-R139 PolarHBondContact OD1-NH1 2.92Å; D114-R139 IonicContact OD1-NH2 2.77Å; D114-R139 PolarHBondContact OD1-NH2 2.96Å; D114-R139 VanDerWaalsContact OD1-NH2 3.16Å; D114-R139 IonicContact OD2-CZ 2.68Å; D114-R139 IonicContact OD2-NH1 3.37Å; D114-R139 IonicContact OD2-NH2 2.66Å; D114-R139 PolarHBondContact OD2-NH2 2.9Å; V131-R139 HydrophobicContact CG1-CG 4.45Å; K137-R139 HydrophobicContact CB-CG 4.27Å; K137-R139 PolarHBondContact O-N 2.9Å; R139-Y151 HydrophobicContact CB-CE2 4.22Å; R139-G152 CarbonylContact C-O 3.46Å; R139-G152 VanDerWaalsContact CA-O 3.23Å; R139-G152 WeakPolarHBondContact CA-O 2.97Å; R139-L153 HydrophobicContact CB-CD2 3.93Å; R139-L153 HydrophobicContact CG-CD2 3.56Å
140	M	95.3	Very high	96.1	Very high	57 Å²	57	55.3 Å²	55.3	28%	0.281	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	140.5	170	61.9	174.5	-69.2	0	0	110.6	R142 L150 Y151 G152	M140-R142 HydrophobicContact CE-CB 4.37Å; M140-L150 HydrophobicContact CE-CD2 3.73Å; M140-L150 HydrophobicContact CE-CG 4.11Å; M140-Y151 WeakPolarHBondContact O-CA 3.36Å; M140-G152 PolarHBondContact N-O 3.12Å; M140-G152 PolarHBondContact O-N 3.22Å
141	I	97.1	Very high	96.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.1	167.7	-66.8	-71.8	0	0	0	107.3	L108 V112 A113 L116 L143 L150 Y151	L108-I141 HydrophobicContact CB-CB 4.45Å; L108-I141 HydrophobicContact CB-CG2 4.31Å; L108-I141 HydrophobicContact CD1-CG2 4.39Å; L108-I141 PolarHBondContact N-O 2.87Å; V112-I141 HydrophobicContact CG1-CB 3.88Å; V112-I141 HydrophobicContact CG1-CG1 3.89Å; V112-I141 HydrophobicContact CG1-CG2 3.85Å; A113-I141 HydrophobicContact CB-CD1 4.03Å; A113-I141 HydrophobicContact CB-CG1 3.84Å; L116-I141 HydrophobicContact CD1-CD1 4.49Å; L116-I141 HydrophobicContact CD1-CG2 4.11Å; I141-L143 HydrophobicContact CG2-CD2 4.2Å; I141-L143 HydrophobicContact CG2-CG 4.4Å; I141-L150 WeakPolarHBondContact CA-O 3.48Å; I141-Y151 HydrophobicContact CD1-CD2 3.52Å; I141-Y151 HydrophobicContact CD1-CE2 4.18Å; I141-Y151 HydrophobicContact CD1-CG 4.26Å; I141-Y151 HydrophobicContact CG1-CD2 4.38Å
142	R	97.3	Very high	96.2	Very high	85 Å²	85	48.7 Å²	48.7	32%	0.321	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.8	169.8	176.3	179.3	-64	149.7	2.3	109.2	N105 L106 T107 M140 L150	N105-R142 HydrophobicContact CB-CG 4.15Å; L106-R142 CarbonylContact O-C 3.58Å; L106-R142 WeakPolarHBondContact O-CA 3.38Å; T107-R142 PolarHBondContact OG1-NE 2.89Å; M140-R142 HydrophobicContact CE-CB 4.37Å; R142-L150 HydrophobicContact CB-CB 4.19Å; R142-L150 HydrophobicContact CB-CD2 4.46Å; R142-L150 PolarHBondContact N-O 3.37Å; R142-L150 PolarHBondContact O-N 3.42Å
143	L	96.6	Very high	96.2	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	143.1	173.1	-55.8	-178.1	0	0	0	109.7	L44 L97 Y99 N105 L106 L108 I141 V149	L44-L143 HydrophobicContact CD1-CD1 4.14Å; L97-L143 HydrophobicContact CB-CD2 4.45Å; L97-L143 HydrophobicContact CD1-CD2 4.15Å; Y99-L143 HydrophobicContact CE1-CB 3.9Å; Y99-L143 PolarHBondContact OH-O 2.95Å; N105-L143 CarbonylContact C-O 3.59Å; N105-L143 WeakPolarHBondContact CA-O 3.44Å; L106-L143 HydrophobicContact CB-CB 4.46Å; L106-L143 PolarHBondContact N-O 3.26Å; L106-L143 PolarHBondContact O-N 3.34Å; L108-L143 HydrophobicContact CD1-CD1 3.67Å; L108-L143 HydrophobicContact CD1-CG 4.06Å; I141-L143 HydrophobicContact CG2-CD2 4.2Å; I141-L143 HydrophobicContact CG2-CG 4.4Å; L143-V149 HydrophobicContact CD2-CB 4.4Å; L143-V149 HydrophobicContact CD2-CG1 4.05Å; L143-V149 HydrophobicContact CD2-CG2 3.9Å
144	H	96.6	Very high	96.4	Very high	40 Å²	40	49 Å²	49	19%	0.185	26%	0.255	C	S	.	.			trans	-111.4	150.9	170.2	-67.2	-86.6	0	0	0	109.1	Y99 N105 D146 G147 T148	Y99-H144 VanDerWaalsContact CE1-C 3.5Å; Y99-H144 WeakPolarHBondContact CE1-O 3.24Å; N105-H144 PolarHBondContact ND2-CE1 2.89Å; N105-H144 PolarHBondContact ND2-ND1 2.89Å; N105-H144 PolarHBondContact OD1-ND1 2.74Å; H144-D146 WeakPolarHBondContact CB-OD1 3.39Å; H144-D146 PolarHBondContact O-N 2.73Å; H144-D146 VanDerWaalsContact O-N 3.14Å; H144-G147 PolarHBondContact O-N 2.88Å; H144-T148 WeakPolarHBondContact CB-O 3.39Å; H144-T148 PolarHBondContact CD2-O 3.38Å; H144-T148 PolarHBondContact N-O 2.9Å
145	P	95.3	Very high	96.6	Very high	53 Å²	53	43.6 Å²	43.6	34%	0.344	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-22.3	-172.6	24.7	-34.7	0	0	0	114	Y99 G147	Y99-P145 HydrophobicContact CD2-CB 4.18Å; Y99-P145 HydrophobicContact CE2-CB 3.82Å; Y99-P145 PolarHBondContact N-O 3.39Å; P145-G147 PolarHBondContact O-N 2.68Å
146	D	95.5	Very high	96.7	Very high	65 Å²	65	37.5 Å²	37.5	35%	0.348	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-3.2	176.5	72.1	-36.9	0	0	0	114.3	R93 H144 T148	R93-D146 PolarHBondContact NE-O 3.26Å; R93-D146 PolarHBondContact NH2-O 2.93Å; H144-D146 WeakPolarHBondContact CB-OD1 3.39Å; H144-D146 PolarHBondContact O-N 2.73Å; H144-D146 VanDerWaalsContact O-N 3.14Å; D146-T148 VanDerWaalsContact OD1-CB 3.29Å; D146-T148 WeakPolarHBondContact OD1-CB 3.46Å; D146-T148 PolarHBondContact OD1-N 2.79Å; D146-T148 PolarHBondContact OD1-OG1 3.5Å; D146-T148 PolarHBondContact OD2-OG1 2.59Å
147	G	95.9	Very high	96.8	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.01	16%	0.16	C	C	.	.	S	Bend	trans	89.8	5.1	-173	0	0	0	0	0	114.2	D94 H144 P145 V149	D94-G147 PolarHBondContact N-O 3.31Å; D94-G147 WeakPolarHBondContact O-CA 3.37Å; H144-G147 PolarHBondContact O-N 2.88Å; P145-G147 PolarHBondContact O-N 2.68Å; G147-V149 PolarHBondContact O-N 3.35Å
148	T	97.4	Very high	97	Very high	30 Å²	30	28.6 Å²	28.6	18%	0.184	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	129.2	174.5	-65.7	0	0	0	0	110.2	W92 H144 D146	W92-T148 CarbonylContact O-C 3.6Å; W92-T148 WeakPolarHBondContact O-CA 3.45Å; H144-T148 WeakPolarHBondContact CB-O 3.39Å; H144-T148 PolarHBondContact CD2-O 3.38Å; H144-T148 PolarHBondContact N-O 2.9Å; D146-T148 VanDerWaalsContact OD1-CB 3.29Å; D146-T148 WeakPolarHBondContact OD1-CB 3.46Å; D146-T148 PolarHBondContact OD1-N 2.79Å; D146-T148 PolarHBondContact OD1-OG1 3.5Å; D146-T148 PolarHBondContact OD2-OG1 2.59Å
149	V	97.9	Very high	97.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.4	176.9	-170.2	0	0	0	0	108.5	Y91 W92 D94 L97 L143 G147	Y91-V149 WeakPolarHBondContact CA-O 3.4Å; W92-V149 HydrophobicContact CD2-CB 4.13Å; W92-V149 HydrophobicContact CH2-CB 4.43Å; W92-V149 HydrophobicContact CH2-CG1 3.96Å; W92-V149 HydrophobicContact CZ2-CB 3.88Å; W92-V149 HydrophobicContact CZ2-CG1 3.64Å; W92-V149 HydrophobicContact CZ2-CG2 4.31Å; W92-V149 PolarHBondContact N-O 2.88Å; W92-V149 PolarHBondContact O-N 3.15Å; D94-V149 HydrophobicContact CB-CG2 4.42Å; L97-V149 HydrophobicContact CD1-CG2 3.83Å; L143-V149 HydrophobicContact CD2-CB 4.4Å; L143-V149 HydrophobicContact CD2-CG1 4.05Å; L143-V149 HydrophobicContact CD2-CG2 3.9Å; G147-V149 PolarHBondContact O-N 3.35Å
150	L	97.9	Very high	97.1	Very high	6 Å²	6	25.6 Å²	25.6	3%	0.031	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	119.1	162.7	163.3	55.2	0	0	0	108.8	Q89 Q90 Y91 M140 I141 R142	Q89-L150 HydrophobicContact CB-CD1 4.09Å; Q89-L150 HydrophobicContact CG-CD1 4.4Å; Q90-L150 WeakPolarHBondContact O-CA 3.16Å; Y91-L150 HydrophobicContact CD1-CB 3.9Å; Y91-L150 HydrophobicContact CD1-CD1 4.08Å; Y91-L150 HydrophobicContact CD1-CG 4.46Å; Y91-L150 HydrophobicContact CD2-CD1 4.44Å; Y91-L150 HydrophobicContact CE1-CB 3.68Å; Y91-L150 HydrophobicContact CE1-CD1 3.56Å; Y91-L150 HydrophobicContact CE1-CD2 3.88Å; Y91-L150 HydrophobicContact CE1-CG 3.88Å; Y91-L150 HydrophobicContact CE2-CD1 3.95Å; Y91-L150 VanDerWaalsContact CZ-CD1 3.48Å; M140-L150 HydrophobicContact CE-CD2 3.73Å; M140-L150 HydrophobicContact CE-CG 4.11Å; I141-L150 WeakPolarHBondContact CA-O 3.48Å; R142-L150 HydrophobicContact CB-CB 4.19Å; R142-L150 HydrophobicContact CB-CD2 4.46Å; R142-L150 PolarHBondContact N-O 3.37Å; R142-L150 PolarHBondContact O-N 3.42Å
151	Y	98	Very high	97.2	Very high	24 Å²	24	23.1 Å²	23.1	9%	0.094	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.1	169	-177.8	-134.8	0	0	0	109.7	Q89 Q90 W92 A113 V118 R139 M140 I141 L153	Q89-Y151 WeakPolarHBondContact CA-O 3.44Å; Q90-Y151 PolarHBondContact N-O 3.24Å; Q90-Y151 PolarHBondContact O-N 2.81Å; W92-Y151 HydrophobicContact CH2-CD1 4.4Å; W92-Y151 HydrophobicContact CH2-CG 4.21Å; W92-Y151 HydrophobicContact CZ3-CD1 4.41Å; W92-Y151 HydrophobicContact CZ3-CG 4.37Å; A113-Y151 HydrophobicContact CB-CE2 4.12Å; V118-Y151 HydrophobicContact CB-CE1 4.28Å; V118-Y151 HydrophobicContact CG1-CD1 4.42Å; V118-Y151 HydrophobicContact CG1-CE1 4.26Å; R139-Y151 HydrophobicContact CB-CE2 4.22Å; M140-Y151 WeakPolarHBondContact O-CA 3.36Å; I141-Y151 HydrophobicContact CD1-CD2 3.52Å; I141-Y151 HydrophobicContact CD1-CE2 4.18Å; I141-Y151 HydrophobicContact CD1-CG 4.26Å; I141-Y151 HydrophobicContact CG1-CD2 4.38Å; Y151-L153 HydrophobicContact CD1-CG 4.49Å; Y151-L153 HydrophobicContact CE1-CD1 3.77Å; Y151-L153 HydrophobicContact CE1-CD2 4.23Å; Y151-L153 HydrophobicContact CE1-CG 3.97Å; Y151-L153 HydrophobicContact CE2-CD2 4.03Å; Y151-L153 HydrophobicContact CE2-CG 4.42Å
152	G	97.6	Very high	97.1	Very high	6 Å²	6	31 Å²	31	6%	0.062	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	138.4	177.6	0	0	0	0	0	111.3	F88 R139 M140	F88-G152 CarbonylContact O-C 3.59Å; F88-G152 WeakPolarHBondContact O-CA 3.29Å; R139-G152 CarbonylContact C-O 3.46Å; R139-G152 VanDerWaalsContact CA-O 3.23Å; R139-G152 WeakPolarHBondContact CA-O 2.97Å; M140-G152 PolarHBondContact N-O 3.12Å; M140-G152 PolarHBondContact O-N 3.22Å
153	L	97.5	Very high	96.9	Very high	19 Å²	19	27.5 Å²	27.5	10%	0.099	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.8	177.9	-68.4	176.3	0	0	0	110.1	Y87 F88 V131 R139 Y151 I155	Y87-L153 CarbonylContact C-O 3.48Å; Y87-L153 WeakPolarHBondContact CA-O 3.41Å; F88-L153 HydrophobicContact CD1-CD1 4.47Å; F88-L153 PolarHBondContact N-O 2.81Å; F88-L153 PolarHBondContact O-N 2.83Å; V131-L153 HydrophobicContact CG1-CD2 4.32Å; R139-L153 HydrophobicContact CB-CD2 3.93Å; R139-L153 HydrophobicContact CG-CD2 3.56Å; Y151-L153 HydrophobicContact CD1-CG 4.49Å; Y151-L153 HydrophobicContact CE1-CD1 3.77Å; Y151-L153 HydrophobicContact CE1-CD2 4.23Å; Y151-L153 HydrophobicContact CE1-CG 3.97Å; Y151-L153 HydrophobicContact CE2-CD2 4.03Å; Y151-L153 HydrophobicContact CE2-CG 4.42Å; L153-I155 HydrophobicContact CB-CD1 3.93Å; L153-I155 HydrophobicContact CB-CG1 3.77Å; L153-I155 HydrophobicContact CD1-CD1 3.96Å
154	R	97.6	Very high	96.8	Very high	69 Å²	69	30.6 Å²	30.6	26%	0.26	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	110.9	163.2	-169.1	-179.9	178.2	-110.7	-6.4	109	Y87 H132 N138	Y87-R154 HydrophobicContact CD1-CB 4.1Å; Y87-R154 HydrophobicContact CD1-CG 4.07Å; Y87-R154 HydrophobicContact CE1-CB 4.13Å; Y87-R154 HydrophobicContact CE1-CG 3.83Å; H132-R154 PolarHBondContact CD2-O 3.02Å; H132-R154 PolarHBondContact CE1-NH1 3.02Å; H132-R154 VanDerWaalsContact CE1-NH1 3.3Å; H132-R154 PolarHBondContact N-O 2.97Å; H132-R154 PolarHBondContact ND1-NH1 2.87Å; N138-R154 HydrophobicContact CB-CB 3.79Å; N138-R154 PolarHBondContact O-N 2.8Å; N138-R154 VanDerWaalsContact O-N 3.07Å
155	I	97.7	Very high	96.7	Very high	10 Å²	10	28.8 Å²	28.8	5%	0.051	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	137.8	-173.4	-50.9	-179.1	0	0	0	109.1	T85 M86 F88 F123 V131 L153	T85-I155 WeakPolarHBondContact CA-O 3.35Å; M86-I155 PolarHBondContact N-O 2.85Å; M86-I155 PolarHBondContact O-N 2.64Å; F88-I155 HydrophobicContact CB-CD1 4.01Å; F88-I155 HydrophobicContact CB-CG1 4.5Å; F88-I155 HydrophobicContact CD1-CD1 3.86Å; F88-I155 HydrophobicContact CG-CD1 4.34Å; F123-I155 HydrophobicContact CE2-CD1 3.93Å; F123-I155 HydrophobicContact CE2-CG2 4.3Å; F123-I155 HydrophobicContact CZ-CD1 4.07Å; V131-I155 HydrophobicContact CG2-CG1 4.47Å; L153-I155 HydrophobicContact CB-CD1 3.93Å; L153-I155 HydrophobicContact CB-CG1 3.77Å; L153-I155 HydrophobicContact CD1-CD1 3.96Å
156	T	98.1	Very high	96.6	Very high	8 Å²	8	33.3 Å²	33.3	5%	0.049	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.7	157.2	-62.8	0	0	0	0	108	T83 L84 T85 S129 F130 H132	T83-T156 HydrophobicContact CG2-CG2 3.54Å; L84-T156 VanDerWaalsContact O-CA 3.32Å; L84-T156 WeakPolarHBondContact O-CA 3.43Å; T85-T156 WeakPolarHBondContact OG1-CG2 3.16Å; T85-T156 PolarHBondContact OG1-OG1 3.36Å; S129-T156 CarbonylContact C-O 3.53Å; S129-T156 WeakPolarHBondContact CA-O 3.48Å; S129-T156 WeakPolarHBondContact CB-O 3.49Å; F130-T156 HydrophobicContact CE1-CG2 3.85Å; F130-T156 HydrophobicContact CZ-CG2 4.04Å; F130-T156 PolarHBondContact N-O 3Å; F130-T156 PolarHBondContact O-N 2.82Å; H132-T156 PolarHBondContact NE2-OG1 3.43Å
157	T	97.6	Very high	96.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.8	178.5	170	0	0	0	0	109.7	T83 L84 M86 D126 L177	T83-T157 WeakPolarHBondContact CA-O 3.48Å; L84-T157 HydrophobicContact CB-CG2 4.32Å; L84-T157 PolarHBondContact N-O 2.74Å; L84-T157 PolarHBondContact O-N 2.92Å; M86-T157 HydrophobicContact CE-CG2 4.25Å; D126-T157 PolarHBondContact OD1-OG1 3.17Å; T157-L177 HydrophobicContact CG2-CD1 4.29Å
158	T	98.1	Very high	96.5	Very high	29 Å²	29	36.5 Å²	36.5	18%	0.178	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	99.2	168.8	-60.9	0	0	0	0	107.9	D81 Y82 T83 K127 K128	D81-T158 HydrophobicContact CB-CG2 3.81Å; Y82-T158 CarbonylContact O-C 3.52Å; Y82-T158 WeakPolarHBondContact O-CA 3.15Å; T83-T158 PolarHBondContact OG1-OG1 3.28Å; K127-T158 PolarHBondContact N-O 2.91Å; K128-T158 PolarHBondContact O-N 3.25Å
159	A	97.7	Very high	96.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	134.8	-176.8	0	0	0	0	0	111.2	D81 Y82 N125 L177	D81-A159 CarbonylContact C-O 3.58Å; D81-A159 WeakPolarHBondContact CA-O 3.41Å; D81-A159 WeakPolarHBondContact CB-O 3.22Å; Y82-A159 HydrophobicContact CD1-CB 4.28Å; Y82-A159 VanDerWaalsContact CD1-O 3.32Å; Y82-A159 WeakPolarHBondContact CD1-O 3.42Å; Y82-A159 HydrophobicContact CE1-CB 3.66Å; Y82-A159 PolarHBondContact N-O 2.87Å; Y82-A159 PolarHBondContact O-N 2.65Å; N125-A159 HydrophobicContact CB-CB 4.3Å; N125-A159 CarbonylContact O-C 3.57Å; N125-A159 WeakPolarHBondContact O-CA 3.45Å; A159-L177 HydrophobicContact CB-CD1 4.35Å
160	A	97.4	Very high	96.1	Very high	31 Å²	31	36.9 Å²	36.9	26%	0.256	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	136.4	173.3	0	0	0	0	0	111	N125 K127	N125-A160 PolarHBondContact O-N 3.01Å; K127-A160 HydrophobicContact CG-CB 4.33Å
161	C	96.6	Very high	96	Very high	5 Å²	5	36.8 Å²	36.8	3%	0.034	17%	0.172	C	C	.	.			trans	-137.8	113.4	175	175.8	0	0	0	0	109.6	M80 Y82 M163 C175	M80-C161 CarbonylContact C-O 3.55Å; M80-C161 WeakPolarHBondContact CB-O 3.36Å; M80-C161 PolarHBondContact O-N 2.81Å; Y82-C161 HydrophobicContact CD1-CB 3.84Å; Y82-C161 HydrophobicContact CE1-CB 4.14Å; C161-M163 HydrophobicContact CB-CE 4.35Å; C161-M163 PolarHBondContact O-N 2.82Å; C161-C175 HydrophobicContact CB-CB 3.72Å; C161-C175 WeakPolarHBondContact CB-SG 3.5Å; C161-C175 WeakPolarHBondContact SG-CA 3.23Å; C161-C175 WeakPolarHBondContact SG-CB 3.39Å; C161-C175 CovalentContact SG-SG 2.04Å; C161-C175 PolarHBondContact SG-SG 3.18Å
162	M	93.8	Very high	95.9	Very high	165 Å²	165	39.8 Å²	39.8	81%	0.813	19%	0.187	S	C	*	.			trans	-77	101.6	178.6	-65.8	-60.9	-66.7	0	0	110	M80	M80-M162 HydrophobicContact SD-CE 4.4Å; M80-M162 HydrophobicContact SD-SD 4.36Å
163	M	94.1	Very high	95.8	Very high	11 Å²	11	40 Å²	40	5%	0.054	19%	0.187	C	C	.	.			trans	-89.2	137.3	-176.1	-60.4	175.3	-164.5	0	0	112.3	V75 E77 C161 L165 Q173	V75-M163 HydrophobicContact CG1-CE 3.57Å; E77-M163 HydrophobicContact CG-SD 4.13Å; C161-M163 HydrophobicContact CB-CE 4.35Å; C161-M163 PolarHBondContact O-N 2.82Å; M163-L165 HydrophobicContact CB-CD2 4.08Å; M163-L165 HydrophobicContact CB-CG 4.15Å; M163-Q173 VanDerWaalsContact CA-OE1 3.24Å; M163-Q173 HydrophobicContact CB-CG 4.42Å; M163-Q173 HydrophobicContact CG-CG 4.24Å
164	D	94.1	Very high	95.7	Very high	70 Å²	70	43.5 Å²	43.5	37%	0.374	21%	0.206	S	C	.	.			trans	-94.8	103.7	167.2	-172	-15.2	0	0	0	109.6	R166 Q173	D164-R166 VanDerWaalsContact OD1-CB 3.26Å; D164-R166 WeakPolarHBondContact OD1-CB 3.45Å; D164-R166 VanDerWaalsContact OD1-CD 3.25Å; D164-R166 WeakPolarHBondContact OD1-CD 2.96Å; D164-R166 WeakPolarHBondContact OD1-CG 3.17Å; D164-R166 PolarHBondContact OD1-N 2.86Å; D164-R166 IonicContact OD1-NE 3.09Å; D164-R166 IonicContact OD2-CZ 2.79Å; D164-R166 IonicContact OD2-NE 2.97Å; D164-R166 IonicContact OD2-NH1 2.65Å; D164-R166 PolarHBondContact OD2-NH1 3.02Å; D164-Q173 PolarHBondContact O-NE2 2.97Å
165	L	94.4	Very high	95.7	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	19%	0.193	C	C	.	.			trans	-95.8	14.1	-176.4	-60.3	-177.6	0	0	0	112.9	E77 M163 R167 Y168 P298 I300 Y302	E77-L165 HydrophobicContact CB-CD1 4.04Å; E77-L165 HydrophobicContact CG-CD1 4.21Å; E77-L165 HydrophobicContact CG-CD2 4.47Å; M163-L165 HydrophobicContact CB-CD2 4.08Å; M163-L165 HydrophobicContact CB-CG 4.15Å; L165-R167 VanDerWaalsContact C-N 3.28Å; L165-R167 PolarHBondContact O-N 3.11Å; L165-Y168 HydrophobicContact CD2-CD2 4.07Å; L165-Y168 WeakPolarHBondContact O-CB 3.14Å; L165-Y168 PolarHBondContact O-N 3.25Å; L165-Y168 VanDerWaalsContact O-N 3.07Å; L165-P298 HydrophobicContact CD1-CG 3.79Å; L165-I300 HydrophobicContact CB-CD1 4.17Å; L165-I300 HydrophobicContact CD1-CD1 3.65Å; L165-I300 HydrophobicContact CG-CD1 4.28Å; L165-Y302 HydrophobicContact CB-CE2 4.45Å; L165-Y302 PolarHBondContact N-OH 3.01Å
166	R	93.8	Very high	95.7	Very high	149 Å²	149	41.5 Å²	41.5	56%	0.562	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-39.5	176.7	-72.5	166.1	-177.9	146.4	-9.9	112.6	D164 Y302 K304 A305	D164-R166 VanDerWaalsContact OD1-CB 3.26Å; D164-R166 WeakPolarHBondContact OD1-CB 3.45Å; D164-R166 VanDerWaalsContact OD1-CD 3.25Å; D164-R166 WeakPolarHBondContact OD1-CD 2.96Å; D164-R166 WeakPolarHBondContact OD1-CG 3.17Å; D164-R166 PolarHBondContact OD1-N 2.86Å; D164-R166 IonicContact OD1-NE 3.09Å; D164-R166 IonicContact OD2-CZ 2.79Å; D164-R166 IonicContact OD2-NE 2.97Å; D164-R166 IonicContact OD2-NH1 2.65Å; D164-R166 PolarHBondContact OD2-NH1 3.02Å; R166-Y302 HydrophobicContact CB-CE2 4.38Å; R166-Y302 HydrophobicContact CG-CD2 3.74Å; R166-Y302 HydrophobicContact CG-CE2 3.66Å; R166-Y302 HydrophobicContact CG-CG 4.42Å; R166-K304 CarbonylContact O-C 3.56Å; R166-A305 PolarHBondContact O-N 3Å
167	R	94.5	Very high	95.7	Very high	125 Å²	125	41.1 Å²	41.1	47%	0.472	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	2.4	177.4	-72.3	-172.5	174.9	-116.3	-2.4	114.1	L165 L170 D171 Y506	L165-R167 VanDerWaalsContact C-N 3.28Å; L165-R167 PolarHBondContact O-N 3.11Å; R167-L170 CarbonylContact O-C 3.57Å; R167-L170 WeakPolarHBondContact O-CA 3.47Å; R167-L170 PolarHBondContact O-N 3.02Å; R167-D171 HydrophobicContact CB-CB 4.38Å; R167-Y506 HydrophobicContact CG-CD1 4.49Å
168	Y	94.1	Very high	95.7	Very high	8 Å²	8	41.9 Å²	41.9	3%	0.031	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	133.9	-175.1	178.1	-86.5	0	0	0	113.1	L165 R241 F246 L297 K304 I306	L165-Y168 HydrophobicContact CD2-CD2 4.07Å; L165-Y168 WeakPolarHBondContact O-CB 3.14Å; L165-Y168 PolarHBondContact O-N 3.25Å; L165-Y168 VanDerWaalsContact O-N 3.07Å; Y168-R241 VanDerWaalsContact CE2-CZ 3.5Å; Y168-F246 AromaticContact CZ-CE1 3.92Å; Y168-F246 WeakPolarHBondContact OH-CE1 3.35Å; Y168-F246 VanDerWaalsContact OH-CZ 3.22Å; Y168-F246 WeakPolarHBondContact OH-CZ 3.48Å; Y168-L297 HydrophobicContact CD1-CD1 4.19Å; Y168-L297 HydrophobicContact CE1-CD1 3.64Å; Y168-L297 HydrophobicContact CE1-CD2 3.88Å; Y168-L297 HydrophobicContact CE1-CG 4.44Å; Y168-L297 HydrophobicContact CE2-CD2 4.17Å; Y168-L297 VanDerWaalsContact OH-CD2 3.27Å; Y168-L297 WeakPolarHBondContact OH-CD2 3.39Å; Y168-K304 HydrophobicContact CD1-CD 4.47Å; Y168-I306 HydrophobicContact CD1-CB 4.49Å; Y168-I306 HydrophobicContact CD1-CG2 3.77Å; Y168-I306 HydrophobicContact CE1-CD1 4.45Å; Y168-I306 HydrophobicContact CE1-CG2 4.2Å; Y168-I306 PolarHBondContact O-N 3.24Å; Y168-I306 VanDerWaalsContact O-N 3.13Å
169	P	94.7	Very high	95.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	cis	-95.1	22	2	37.6	-39.4	0	0	0	115.1	D171 R241 I243 F246 Y251 I306	P169-D171 VanDerWaalsContact C-N 3.3Å; P169-D171 WeakPolarHBondContact CA-OD1 3.46Å; P169-R241 WeakPolarHBondContact O-CD 3.42Å; P169-I243 HydrophobicContact CB-CD1 4.18Å; P169-I243 HydrophobicContact CG-CD1 3.6Å; P169-F246 HydrophobicContact CB-CB 4.48Å; P169-F246 HydrophobicContact CB-CD1 4.23Å; P169-F246 HydrophobicContact CB-CD2 3.56Å; P169-F246 HydrophobicContact CB-CE1 4.44Å; P169-F246 HydrophobicContact CB-CE2 3.8Å; P169-F246 HydrophobicContact CB-CG 3.79Å; P169-F246 HydrophobicContact CB-CZ 4.23Å; P169-F246 HydrophobicContact CG-CB 3.93Å; P169-F246 HydrophobicContact CG-CD1 4.3Å; P169-F246 HydrophobicContact CG-CD2 3.95Å; P169-F246 HydrophobicContact CG-CG 3.76Å; P169-Y251 HydrophobicContact CG-CE2 4.27Å; P169-I306 HydrophobicContact CG-CD1 4.26Å
170	L	94	Very high	95.7	Very high	37 Å²	37	40.5 Å²	40.5	19%	0.194	19%	0.194	C	C	.	.	S	Bend	trans	-99.3	40.4	177.1	-66.4	165	0	0	0	110.6	R167 I243 W503 V507	R167-L170 CarbonylContact O-C 3.57Å; R167-L170 WeakPolarHBondContact O-CA 3.47Å; R167-L170 PolarHBondContact O-N 3.02Å; L170-I243 HydrophobicContact CD2-CB 4.35Å; L170-I243 HydrophobicContact CD2-CD1 3.65Å; L170-I243 HydrophobicContact CD2-CG1 3.78Å; L170-I243 HydrophobicContact CG-CD1 4.03Å; L170-W503 HydrophobicContact CD1-CE3 4.48Å; L170-W503 HydrophobicContact CD1-CZ3 4.19Å; L170-V507 HydrophobicContact CD1-CG2 4.09Å; L170-V507 HydrophobicContact CD2-CG2 4.16Å
171	D	94.8	Very high	95.7	Very high	5 Å²	5	39 Å²	39	3%	0.027	18%	0.182	C	C	.	.			trans	-103.2	148	-171.3	56.3	-55	0	0	0	113.9	R167 P169 Q173 R241	R167-D171 HydrophobicContact CB-CB 4.38Å; P169-D171 VanDerWaalsContact C-N 3.3Å; P169-D171 WeakPolarHBondContact CA-OD1 3.46Å; D171-Q173 PolarHBondContact OD2-NE2 3.48Å; D171-R241 PolarHBondContact O-N 3.13Å; D171-R241 WeakPolarHBondContact OD1-CD 3.44Å; D171-R241 IonicContact OD1-CZ 3.36Å; D171-R241 IonicContact OD1-NE 2.85Å; D171-R241 PolarHBondContact OD1-NE 3.07Å; D171-R241 IonicContact OD1-NH2 2.7Å; D171-R241 IonicContact OD2-CZ 3.71Å; D171-R241 IonicContact OD2-NE 3.66Å; D171-R241 PolarHBondContact OD2-NE 3.19Å; D171-R241 IonicContact OD2-NH2 2.79Å; D171-R241 PolarHBondContact OD2-NH2 3.27Å
172	E	95.2	Very high	95.7	Very high	86 Å²	86	47 Å²	47	40%	0.402	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.3	165.6	-63.1	-172.9	163.8	0	0	107.8	K238 L239 K240	E172-K238 WeakPolarHBondContact OE2-CE 3.21Å; E172-K238 IonicContact OE2-NZ 3.57Å; E172-K238 PolarHBondContact OE2-NZ 2.68Å; E172-L239 CarbonylContact C-O 3.15Å; E172-L239 WeakPolarHBondContact CA-O 3.47Å; E172-K240 HydrophobicContact CG-CB 4.25Å; E172-K240 HydrophobicContact CG-CD 4.42Å; E172-K240 HydrophobicContact CG-CG 4.12Å; E172-K240 IonicContact OE1-NZ 3.35Å; E172-K240 PolarHBondContact OE1-NZ 2.88Å
173	Q	96.3	Very high	95.8	Very high	11 Å²	11	41.4 Å²	41.4	5%	0.051	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	146.4	-179.4	-58.8	-56.4	-27.4	0	0	110.6	M163 D164 D171 L239	M163-Q173 VanDerWaalsContact CA-OE1 3.24Å; M163-Q173 HydrophobicContact CB-CG 4.42Å; M163-Q173 HydrophobicContact CG-CG 4.24Å; D164-Q173 PolarHBondContact O-NE2 2.97Å; D171-Q173 PolarHBondContact OD2-NE2 3.48Å; Q173-L239 HydrophobicContact CB-CB 4.49Å; Q173-L239 PolarHBondContact N-O 2.92Å; Q173-L239 PolarHBondContact O-N 2.83Å
174	N	96.4	Very high	96	Very high	93 Å²	93	43.3 Å²	43.3	50%	0.497	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	107.2	172.2	-175.5	0.1	0	0	0	109.1	S236 F237	N174-S236 PolarHBondContact ND2-OG 2.92Å; N174-S236 PolarHBondContact OD1-OG 3.28Å; N174-F237 WeakPolarHBondContact CA-O 3.11Å
175	C	97.1	Very high	96.1	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.8	178.8	-65.4	0	0	0	0	110.2	Y82 C161 F237	Y82-C175 HydrophobicContact CD1-CB 3.87Å; Y82-C175 HydrophobicContact CE1-CB 3.64Å; C161-C175 HydrophobicContact CB-CB 3.72Å; C161-C175 WeakPolarHBondContact CB-SG 3.5Å; C161-C175 WeakPolarHBondContact SG-CA 3.23Å; C161-C175 WeakPolarHBondContact SG-CB 3.39Å; C161-C175 CovalentContact SG-SG 2.04Å; C161-C175 PolarHBondContact SG-SG 3.18Å; C175-F237 PolarHBondContact N-O 3.5Å; C175-F237 PolarHBondContact O-N 3.32Å
176	T	97.1	Very high	96.3	Very high	35 Å²	35	42.3 Å²	42.3	22%	0.215	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	142.5	-176.9	69.9	0	0	0	0	112.8	Y82 N125 E178 L235	Y82-T176 VanDerWaalsContact OH-C 3.26Å; Y82-T176 PolarHBondContact OH-O 3.09Å; N125-T176 PolarHBondContact ND2-O 3.28Å; N125-T176 PolarHBondContact ND2-OG1 3.24Å; T176-E178 PolarHBondContact OG1-OE1 3.33Å; T176-E178 VanDerWaalsContact OG1-OE1 3.12Å; T176-L235 CarbonylContact C-O 3.54Å; T176-L235 WeakPolarHBondContact CA-O 3.45Å
177	L	97.6	Very high	96.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	105	164	-177.3	73.2	0	0	0	107.8	Y82 L84 M86 F123 T157 A159 I179 S234 L235	Y82-L177 PolarHBondContact OH-N 2.81Å; L84-L177 HydrophobicContact CD2-CD2 3.9Å; M86-L177 HydrophobicContact CE-CD2 3.88Å; M86-L177 HydrophobicContact SD-CD2 3.96Å; F123-L177 HydrophobicContact CB-CD1 4.36Å; F123-L177 HydrophobicContact CD1-CD1 3.81Å; F123-L177 HydrophobicContact CD1-CD2 4.37Å; F123-L177 HydrophobicContact CD1-CG 4.12Å; F123-L177 HydrophobicContact CE1-CD1 4.43Å; F123-L177 HydrophobicContact CE1-CD2 4.25Å; F123-L177 HydrophobicContact CE1-CG 4.49Å; F123-L177 HydrophobicContact CG-CD1 4.17Å; T157-L177 HydrophobicContact CG2-CD1 4.29Å; A159-L177 HydrophobicContact CB-CD1 4.35Å; L177-I179 HydrophobicContact CD2-CD1 4.44Å; L177-I179 HydrophobicContact CG-CG1 4.34Å; L177-S234 WeakPolarHBondContact O-CA 3.33Å; L177-L235 HydrophobicContact CB-CB 4.42Å; L177-L235 PolarHBondContact N-O 3.36Å; L177-L235 PolarHBondContact O-N 3.39Å
178	E	97.3	Very high	96.6	Very high	16 Å²	16	37 Å²	37	8%	0.075	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	127.7	177	-56.1	-74.6	153.6	0	0	109.5	F123 L124 T176 R221 R232 S234	F123-E178 WeakPolarHBondContact CA-O 3.5Å; L124-E178 HydrophobicContact CB-CB 4Å; L124-E178 HydrophobicContact CD2-CB 4.49Å; L124-E178 PolarHBondContact N-O 3.04Å; T176-E178 PolarHBondContact OG1-OE1 3.33Å; T176-E178 VanDerWaalsContact OG1-OE1 3.12Å; E178-R221 IonicContact OE1-NH2 3.29Å; E178-R221 IonicContact OE2-CZ 2.69Å; E178-R221 IonicContact OE2-NE 2.74Å; E178-R221 IonicContact OE2-NH2 3.8Å; E178-R221 PolarHBondContact OE2-NH2 2.84Å; E178-R232 WeakPolarHBondContact OE2-CD 3.49Å; E178-S234 PolarHBondContact OE1-OG 2.97Å
179	I	98.2	Very high	96.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.5	-174.3	-44.7	174	0	0	0	108.7	M65 I67 F88 F123 L177 W193 R232 L233	M65-I179 HydrophobicContact CE-CG2 4.14Å; M65-I179 HydrophobicContact SD-CD1 4.47Å; M65-I179 HydrophobicContact SD-CG2 3.76Å; I67-I179 HydrophobicContact CD1-CD1 3.88Å; F88-I179 HydrophobicContact CE2-CD1 4.13Å; F88-I179 HydrophobicContact CE2-CG2 4.45Å; F88-I179 HydrophobicContact CZ-CG2 3.98Å; F123-I179 HydrophobicContact CD1-CB 4.5Å; F123-I179 HydrophobicContact CD1-CG1 3.95Å; F123-I179 HydrophobicContact CD1-CG2 4.39Å; F123-I179 HydrophobicContact CE1-CD1 4.29Å; F123-I179 HydrophobicContact CE1-CG1 3.94Å; F123-I179 HydrophobicContact CE1-CG2 4.2Å; L177-I179 HydrophobicContact CD2-CD1 4.44Å; L177-I179 HydrophobicContact CG-CG1 4.34Å; I179-W193 HydrophobicContact CD1-CH2 4.05Å; I179-R232 WeakPolarHBondContact O-CA 3.3Å; I179-R232 WeakPolarHBondContact O-CG 3.19Å; I179-L233 HydrophobicContact CB-CB 4.41Å; I179-L233 PolarHBondContact N-O 2.73Å; I179-L233 PolarHBondContact O-N 2.59Å
180	E	97.9	Very high	96.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	154.8	-167.3	-173.6	154.1	-118	0	0	111.9	T121 Y122 V223 R232	T121-E180 CarbonylContact C-O 3.49Å; T121-E180 WeakPolarHBondContact CA-O 3.47Å; Y122-E180 HydrophobicContact CD1-CB 4.27Å; Y122-E180 VanDerWaalsContact CD1-O 3.22Å; Y122-E180 WeakPolarHBondContact CD1-O 3.38Å; Y122-E180 HydrophobicContact CE1-CB 3.68Å; Y122-E180 HydrophobicContact CE1-CG 3.76Å; Y122-E180 PolarHBondContact N-O 3.5Å; Y122-E180 PolarHBondContact O-N 3.05Å; Y122-E180 PolarHBondContact OH-OE2 2.84Å; E180-V223 WeakPolarHBondContact OE1-CG2 3.2Å; E180-R232 HydrophobicContact CB-CG 4.37Å; E180-R232 VanDerWaalsContact CD-NE 3.29Å; E180-R232 IonicContact OE1-CZ 3.73Å; E180-R232 VanDerWaalsContact OE1-CZ 3.25Å; E180-R232 IonicContact OE1-NE 2.88Å; E180-R232 PolarHBondContact OE1-NE 3.47Å; E180-R232 IonicContact OE1-NH2 3.76Å; E180-R232 PolarHBondContact OE1-NH2 2.79Å; E180-R232 IonicContact OE2-CZ 2.89Å; E180-R232 IonicContact OE2-NE 3.7Å; E180-R232 PolarHBondContact OE2-NE 2.89Å; E180-R232 IonicContact OE2-NH2 2.77Å; E180-R232 PolarHBondContact OE2-NH2 3.3Å
181	S	97.8	Very high	97.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	139.9	169	174.1	0	0	0	0	109.4	D120 Y184 Y230	D120-S181 PolarHBondContact OD1-OG 3.37Å; S181-Y184 PolarHBondContact OG-N 2.85Å; S181-Y184 PolarHBondContact OG-O 2.84Å; S181-Y230 WeakPolarHBondContact O-CD1 3.43Å
182	Y	96.8	Very high	97.2	Very high	173 Å²	173	45.3 Å²	45.3	68%	0.678	23%	0.227	S	C	*	.	S	Bend	trans	-85.4	-49.4	-173.5	-171.7	-97.5	0	0	0	113.3	D120 Y122 Y230	D120-Y182 PolarHBondContact O-N 2.7Å; D120-Y182 PolarHBondContact OD2-N 2.71Å; Y122-Y182 HydrophobicContact CD1-CD2 4.04Å; Y122-Y182 HydrophobicContact CD1-CG 4.41Å; Y122-Y182 AromaticContact CE1-CD2 3.91Å; Y122-Y182 HydrophobicContact CE1-CD2 3.91Å; Y122-Y182 HydrophobicContact CE1-CG 4.45Å; Y122-Y182 HydrophobicContact CG-CD2 4.48Å; Y182-Y230 WeakPolarHBondContact O-CE1 3.28Å
183	G	96	Very high	97.3	Very high	48 Å²	48	42.4 Å²	42.4	50%	0.495	21%	0.212	S	C	.	.	S	Bend	trans	-103.5	-32.6	-174.7	0	0	0	0	0	114.4	D120	D120-G183 WeakPolarHBondContact OD2-CA 3.33Å; D120-G183 PolarHBondContact OD2-N 3.16Å
184	Y	97.6	Very high	97.3	Very high	50 Å²	50	45.7 Å²	45.7	20%	0.196	23%	0.227	C	C	.	.			trans	-88.6	128	-175.8	-61.4	-68.9	0	0	0	111.9	R53 W117 S181 D188 Y230	R53-Y184 HydrophobicContact CB-CE1 4.41Å; W117-Y184 HydrophobicContact CZ2-CD2 4.41Å; W117-Y184 AromaticContact CZ2-CE2 3.82Å; W117-Y184 HydrophobicContact CZ2-CE2 3.82Å; W117-Y184 AromaticContact NE1-CE2 3.86Å; W117-Y184 AromaticContact NE1-CZ 3.73Å; W117-Y184 PolarHBondContact NE1-OH 2.87Å; S181-Y184 PolarHBondContact OG-N 2.85Å; S181-Y184 PolarHBondContact OG-O 2.84Å; Y184-D188 HydrophobicContact CD1-CB 3.79Å; Y184-D188 HydrophobicContact CG-CB 4.22Å; Y184-Y230 VanDerWaalsContact O-CD1 3.26Å; Y184-Y230 WeakPolarHBondContact O-CD1 3.36Å
185	T	97.8	Very high	96.9	Very high	25 Å²	25	43.7 Å²	43.7	15%	0.153	23%	0.227	C	C	.	.			trans	-77.9	174.6	174	62	0	0	0	0	111.3	D187 D188 I189 A229 Y230	T185-D187 PolarHBondContact O-N 3.47Å; T185-D187 PolarHBondContact OG1-N 2.98Å; T185-D187 PolarHBondContact OG1-OD2 3.06Å; T185-D188 PolarHBondContact O-N 3.07Å; T185-I189 PolarHBondContact O-N 2.93Å; T185-A229 CarbonylContact C-O 3.6Å; T185-A229 WeakPolarHBondContact CA-O 3.46Å; T185-A229 WeakPolarHBondContact CB-O 3.32Å; T185-Y230 HydrophobicContact CG2-CE1 4.43Å
186	T	97.3	Very high	96.6	Very high	26 Å²	26	45.5 Å²	45.5	16%	0.16	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-19.5	172.7	50.3	0	0	0	0	114.4	D188 I189 N222 A229 P231	T186-D188 VanDerWaalsContact C-N 3.34Å; T186-I189 WeakPolarHBondContact CA-O 3.43Å; T186-N222 HydrophobicContact CG2-CB 4.31Å; T186-A229 HydrophobicContact CG2-CB 4.3Å; T186-A229 PolarHBondContact N-O 3.05Å; T186-P231 HydrophobicContact CG2-CB 4.38Å
187	D	96.9	Very high	96	Very high	116 Å²	116	52 Å²	52	62%	0.62	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-20.5	178	-46.4	-53.3	0	0	0	112.3	T185	T185-D187 PolarHBondContact O-N 3.47Å; T185-D187 PolarHBondContact OG1-N 2.98Å; T185-D187 PolarHBondContact OG1-OD2 3.06Å
188	D	97.5	Very high	95.7	Very high	47 Å²	47	56 Å²	56	25%	0.251	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-31.5	-179.2	-84.4	-33.3	0	0	0	113.3	R53 P60 V61 Y184 T185 T186	R53-D188 WeakPolarHBondContact CD-O 3.05Å; R53-D188 IonicContact CZ-OD1 3.62Å; R53-D188 IonicContact NE-OD1 3.33Å; R53-D188 PolarHBondContact NE-OD1 2.78Å; R53-D188 IonicContact NH2-OD1 3.04Å; R53-D188 PolarHBondContact NH2-OD1 2.79Å; P60-D188 WeakPolarHBondContact CA-O 3.33Å; V61-D188 PolarHBondContact N-O 3.38Å; Y184-D188 HydrophobicContact CD1-CB 3.79Å; Y184-D188 HydrophobicContact CG-CB 4.22Å; T185-D188 PolarHBondContact O-N 3.07Å; T186-D188 VanDerWaalsContact C-N 3.34Å
189	I	98	Very high	95.6	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	140.2	-175.1	-160	163	0	0	0	111.9	V61 V63 W117 P119 T185 T186 F191 P231	V61-I189 HydrophobicContact CG1-CB 4.35Å; V61-I189 HydrophobicContact CG1-CD1 4.27Å; V61-I189 HydrophobicContact CG1-CG1 3.9Å; V61-I189 WeakPolarHBondContact O-CG1 3.36Å; V63-I189 HydrophobicContact CG2-CD1 3.86Å; V63-I189 HydrophobicContact CG2-CG1 3.86Å; W117-I189 HydrophobicContact CH2-CD1 4.31Å; P119-I189 HydrophobicContact CB-CD1 4.1Å; T185-I189 PolarHBondContact O-N 2.93Å; T186-I189 WeakPolarHBondContact CA-O 3.43Å; I189-F191 HydrophobicContact CD1-CE1 3.65Å; I189-F191 HydrophobicContact CD1-CZ 4.34Å; I189-F191 HydrophobicContact CG1-CD1 4.22Å; I189-F191 HydrophobicContact CG1-CE1 3.78Å; I189-P231 HydrophobicContact CG2-CG 3.86Å
190	E	97.7	Very high	95.5	Very high	104 Å²	104	55.4 Å²	55.4	49%	0.486	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.7	175.3	-74.7	-177.2	175.6	0	0	110.3	P60 V61 V63	P60-E190 HydrophobicContact CB-CG 4.06Å; P60-E190 HydrophobicContact CG-CG 3.95Å; V61-E190 PolarHBondContact O-N 3.3Å; V63-E190 PolarHBondContact N-O 3.28Å
191	F	98.1	Very high	95.3	Very high	13 Å²	13	58.5 Å²	58.5	6%	0.057	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.6	178.9	-68	-14.8	0	0	0	112.7	V63 M65 T121 I189 P231 L233	V63-F191 HydrophobicContact CB-CD1 3.98Å; V63-F191 HydrophobicContact CB-CE1 4.14Å; V63-F191 HydrophobicContact CG2-CE1 4.44Å; M65-F191 HydrophobicContact CE-CB 4.48Å; M65-F191 HydrophobicContact CE-CD1 3.65Å; M65-F191 HydrophobicContact CE-CD2 3.63Å; M65-F191 HydrophobicContact CE-CE1 3.56Å; M65-F191 HydrophobicContact CE-CE2 3.53Å; M65-F191 HydrophobicContact CE-CG 3.68Å; M65-F191 HydrophobicContact CE-CZ 3.51Å; T121-F191 HydrophobicContact CG2-CE1 4.29Å; T121-F191 HydrophobicContact CG2-CE2 4.4Å; T121-F191 HydrophobicContact CG2-CZ 3.71Å; I189-F191 HydrophobicContact CD1-CE1 3.65Å; I189-F191 HydrophobicContact CD1-CZ 4.34Å; I189-F191 HydrophobicContact CG1-CD1 4.22Å; I189-F191 HydrophobicContact CG1-CE1 3.78Å; F191-P231 HydrophobicContact CB-CB 4.14Å; F191-P231 HydrophobicContact CD1-CG 4.42Å; F191-P231 HydrophobicContact CD2-CB 4.12Å; F191-P231 HydrophobicContact CD2-CG 4.01Å; F191-P231 WeakPolarHBondContact CD2-O 3.35Å; F191-P231 HydrophobicContact CE2-CG 4.32Å; F191-P231 HydrophobicContact CG-CB 4.1Å; F191-P231 HydrophobicContact CG-CG 4.07Å; F191-L233 HydrophobicContact CB-CD1 4.05Å; F191-L233 HydrophobicContact CB-CD2 4.01Å; F191-L233 HydrophobicContact CB-CG 3.79Å; F191-L233 HydrophobicContact CD2-CG 4.46Å
192	Y	97.5	Very high	95	Very high	106 Å²	106	58.9 Å²	58.9	42%	0.416	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	153	175	68.3	-84.5	0	0	0	112.9	A62 V63 G64 M65 K194	A62-Y192 HydrophobicContact CB-CD1 4.49Å; A62-Y192 HydrophobicContact CB-CE1 4Å; V63-Y192 VanDerWaalsContact C-CE1 3.49Å; V63-Y192 PolarHBondContact O-N 3.15Å; G64-Y192 CarbonylContact C-O 3.57Å; G64-Y192 WeakPolarHBondContact CA-O 3.49Å; M65-Y192 PolarHBondContact N-O 2.94Å; Y192-K194 HydrophobicContact CE2-CB 4.37Å; Y192-K194 PolarHBondContact O-N 2.71Å
193	W	97.6	Very high	94.8	Very high	25 Å²	25	51.1 Å²	51.1	10%	0.095	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	113.1	173.6	-70.6	112	0	0	0	110.3	I67 I179 G195 G196 A199 V200 L218 V219 L233 L235	I67-W193 HydrophobicContact CD1-CH2 3.83Å; I67-W193 HydrophobicContact CD1-CZ3 3.79Å; I67-W193 HydrophobicContact CG1-CZ3 4.11Å; I179-W193 HydrophobicContact CD1-CH2 4.05Å; W193-G195 PolarHBondContact O-N 3.09Å; W193-G196 PolarHBondContact O-N 2.81Å; W193-G196 VanDerWaalsContact O-N 3.11Å; W193-A199 HydrophobicContact CB-CB 3.79Å; W193-A199 HydrophobicContact CD2-CB 4.47Å; W193-A199 HydrophobicContact CE3-CB 3.9Å; W193-A199 HydrophobicContact CG-CB 4.5Å; W193-V200 HydrophobicContact CE3-CG2 4.23Å; W193-V200 HydrophobicContact CH2-CG2 4.31Å; W193-V200 HydrophobicContact CZ3-CG2 3.8Å; W193-L218 HydrophobicContact CD2-CB 4.38Å; W193-L218 HydrophobicContact CD2-CD1 4.31Å; W193-L218 HydrophobicContact CD2-CD2 4.46Å; W193-L218 HydrophobicContact CG-CB 4.29Å; W193-L218 HydrophobicContact CG-CD1 4.35Å; W193-L218 HydrophobicContact CH2-CD2 4.34Å; W193-L218 HydrophobicContact CZ2-CD2 4.13Å; W193-V219 PolarHBondContact NE1-O 3.25Å; W193-L233 HydrophobicContact CD2-CD1 4.01Å; W193-L233 HydrophobicContact CE3-CD1 4.34Å; W193-L233 HydrophobicContact CG-CD1 4.4Å; W193-L233 HydrophobicContact CH2-CB 4.38Å; W193-L233 HydrophobicContact CZ2-CB 3.66Å; W193-L233 HydrophobicContact CZ2-CD1 4.29Å; W193-L235 HydrophobicContact CH2-CB 4.13Å; W193-L235 HydrophobicContact CZ2-CB 4.34Å
194	K	94.8	Very high	94.3	Very high	81 Å²	81	55.5 Å²	55.5	35%	0.352	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	98.7	-177	-174.8	177.9	178.1	173.8	0	110.7	M65 Y91 Y192 A199	M65-K194 WeakPolarHBondContact O-CB 3.39Å; M65-K194 PolarHBondContact O-N 2.74Å; Y91-K194 HydrophobicContact CD1-CD 4.49Å; Y91-K194 HydrophobicContact CD2-CD 3.33Å; Y91-K194 HydrophobicContact CE2-CD 3.59Å; Y91-K194 HydrophobicContact CG-CD 3.82Å; Y91-K194 VanDerWaalsContact CZ-NZ 3.35Å; Y192-K194 HydrophobicContact CE2-CB 4.37Å; Y192-K194 PolarHBondContact O-N 2.71Å; K194-A199 WeakPolarHBondContact O-CA 3.32Å; K194-A199 VanDerWaalsContact O-CB 3.3Å; K194-A199 WeakPolarHBondContact O-CB 3.42Å
195	G	88.4	Confident	93.9	Very high	50 Å²	50	60.8 Å²	60.8	52%	0.515	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.7	3.8	-174.7	0	0	0	0	0	114	W193 E197 S198	W193-G195 PolarHBondContact O-N 3.09Å; G195-E197 PolarHBondContact O-N 2.75Å; G195-S198 PolarHBondContact O-N 2.97Å; G195-S198 PolarHBondContact O-OG 3.19Å; G195-S198 VanDerWaalsContact O-OG 3.04Å
196	G	90.3	Very high	93.6	Very high	39 Å²	39	60.8 Å²	60.8	40%	0.402	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	60.2	-122.3	-175.9	0	0	0	0	0	110.1	W193 S198 A199 L218	W193-G196 PolarHBondContact O-N 2.81Å; W193-G196 VanDerWaalsContact O-N 3.11Å; G196-S198 PolarHBondContact O-N 2.95Å; G196-A199 WeakPolarHBondContact O-CB 3.25Å; G196-A199 PolarHBondContact O-N 2.78Å; G196-L218 WeakPolarHBondContact O-CD1 3.38Å
197	E	85.3	Confident	92.9	Very high	173 Å²	173	68.6 Å²	68.6	81%	0.808	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-57.2	-32.1	177.5	-62.4	-177.6	167.7	0	0	113.4	G195 A199	G195-E197 PolarHBondContact O-N 2.75Å; E197-A199 VanDerWaalsContact C-N 3.26Å; E197-A199 PolarHBondContact O-N 3.4Å
198	S	90.9	Very high	92.6	Very high	83 Å²	83	64 Å²	64	58%	0.58	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-82.3	2.8	178.5	72.2	0	0	0	0	114.5	G195 G196 V200	G195-S198 PolarHBondContact O-N 2.97Å; G195-S198 PolarHBondContact O-OG 3.19Å; G195-S198 VanDerWaalsContact O-OG 3.04Å; G196-S198 PolarHBondContact O-N 2.95Å; S198-V200 PolarHBondContact O-N 2.85Å
199	A	94.8	Very high	92.2	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-68.5	-21.1	179.2	0	0	0	0	0	113.2	S66 I67 W193 K194 G196 E197 L218	S66-A199 CarbonylContact C-O 3.45Å; S66-A199 VanDerWaalsContact CA-O 3.27Å; S66-A199 WeakPolarHBondContact CA-O 3.08Å; S66-A199 PolarHBondContact OG-O 3.08Å; I67-A199 PolarHBondContact N-O 2.6Å; W193-A199 HydrophobicContact CB-CB 3.79Å; W193-A199 HydrophobicContact CD2-CB 4.47Å; W193-A199 HydrophobicContact CE3-CB 3.9Å; W193-A199 HydrophobicContact CG-CB 4.5Å; K194-A199 WeakPolarHBondContact O-CA 3.32Å; K194-A199 VanDerWaalsContact O-CB 3.3Å; K194-A199 WeakPolarHBondContact O-CB 3.42Å; G196-A199 WeakPolarHBondContact O-CB 3.25Å; G196-A199 PolarHBondContact O-N 2.78Å; E197-A199 VanDerWaalsContact C-N 3.26Å; E197-A199 PolarHBondContact O-N 3.4Å; A199-L218 HydrophobicContact CB-CD1 4.34Å
200	V	95.9	Very high	91.9	Very high	3 Å²	3	71.3 Å²	71.3	2%	0.018	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	120.8	178.2	-177.8	0	0	0	0	110.5	I67 V69 W193 S198 V203 Y216 L218 L235	I67-V200 HydrophobicContact CB-CG1 4.43Å; I67-V200 HydrophobicContact CB-CG2 4.17Å; I67-V200 CarbonylContact O-C 3.53Å; I67-V200 VanDerWaalsContact O-CA 3.26Å; I67-V200 WeakPolarHBondContact O-CA 3.26Å; V69-V200 HydrophobicContact CG2-CG1 4.26Å; W193-V200 HydrophobicContact CE3-CG2 4.23Å; W193-V200 HydrophobicContact CH2-CG2 4.31Å; W193-V200 HydrophobicContact CZ3-CG2 3.8Å; S198-V200 PolarHBondContact O-N 2.85Å; V200-V203 HydrophobicContact CG1-CG2 3.85Å; V200-Y216 HydrophobicContact CB-CE2 4.19Å; V200-Y216 HydrophobicContact CG1-CE2 4.49Å; V200-L218 HydrophobicContact CB-CD2 4.16Å; V200-L218 HydrophobicContact CG2-CD1 4.06Å; V200-L218 HydrophobicContact CG2-CD2 3.43Å; V200-L218 VanDerWaalsContact CG2-CD2 3.43Å; V200-L218 HydrophobicContact CG2-CG 4.4Å; V200-L235 HydrophobicContact CG1-CD1 4.26Å; V200-L235 HydrophobicContact CG1-CD2 4.05Å; V200-L235 HydrophobicContact CG2-CD1 4.38Å; V200-L235 HydrophobicContact CG2-CD2 4.32Å
201	T	95	Very high	91.7	Very high	66 Å²	66	66.7 Å²	66.7	41%	0.405	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	171.6	-178.8	60.4	0	0	0	0	111.7	I67 D68 V69 V203	I67-T201 PolarHBondContact O-N 3.43Å; D68-T201 WeakPolarHBondContact CB-OG1 3.1Å; D68-T201 VanDerWaalsContact CG-OG1 3.24Å; D68-T201 WeakPolarHBondContact OD1-CB 3.38Å; D68-T201 PolarHBondContact OD1-OG1 2.79Å; V69-T201 PolarHBondContact N-O 2.8Å; T201-V203 PolarHBondContact O-N 2.96Å
202	G	91.8	Very high	91.5	Very high	8 Å²	8	68.2 Å²	68.2	8%	0.082	37%	0.372	C	S	.	.	S	Bend	trans	83.8	-18.8	174.7	0	0	0	0	0	115.9	D68 T204 R205	D68-G202 WeakPolarHBondContact OD1-CA 3.32Å; D68-G202 PolarHBondContact OD1-N 2.04Å; G202-T204 VanDerWaalsContact C-N 3.27Å; G202-T204 PolarHBondContact O-N 2.67Å; G202-R205 VanDerWaalsContact CA-NH2 3.28Å; G202-R205 WeakPolarHBondContact O-CB 3.06Å; G202-R205 PolarHBondContact O-N 3.23Å
203	V	91.6	Very high	91.3	Very high	10 Å²	10	65 Å²	65	6%	0.061	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-52.5	-40.5	-177.7	-172.3	0	0	0	0	113.2	V69 V200 T201 R205 I206 I213 Y216 F237	V69-V203 HydrophobicContact CG2-CG2 4.27Å; V200-V203 HydrophobicContact CG1-CG2 3.85Å; T201-V203 PolarHBondContact O-N 2.96Å; V203-R205 PolarHBondContact O-N 2.9Å; V203-I206 WeakPolarHBondContact O-CG1 3.32Å; V203-I206 PolarHBondContact O-N 2.91Å; V203-I213 HydrophobicContact CG1-CD1 3.92Å; V203-I213 HydrophobicContact CG1-CG2 3.91Å; V203-Y216 HydrophobicContact CB-CD1 4.2Å; V203-Y216 HydrophobicContact CB-CE1 4.28Å; V203-Y216 HydrophobicContact CG1-CD1 3.85Å; V203-Y216 HydrophobicContact CG1-CE1 4.38Å; V203-Y216 HydrophobicContact CG1-CG 4.35Å; V203-Y216 HydrophobicContact CG2-CD1 4.29Å; V203-Y216 HydrophobicContact CG2-CE1 4.41Å; V203-Y216 HydrophobicContact CG2-CG 4.38Å; V203-F237 HydrophobicContact CG1-CE1 4.38Å; V203-F237 HydrophobicContact CG2-CE1 4.26Å
204	T	86.3	Confident	91.1	Very high	139 Å²	139	67.4 Å²	67.4	85%	0.853	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-70.2	-11.2	179.4	52.1	0	0	0	0	114.7	G202	G202-T204 VanDerWaalsContact C-N 3.27Å; G202-T204 PolarHBondContact O-N 2.67Å
205	R	88.2	Confident	91.1	Very high	162 Å²	162	66.7 Å²	66.7	61%	0.611	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-94.5	-1.8	177.1	-53.4	180	-62.9	-150.3	-3.1	112.7	D68 G202 V203	D68-R205 IonicContact OD1-NH2 3.04Å; D68-R205 PolarHBondContact OD1-NH2 2.93Å; D68-R205 IonicContact OD2-NH2 3.69Å; D68-R205 PolarHBondContact OD2-NH2 2.92Å; D68-R205 VanDerWaalsContact OD2-NH2 3.09Å; G202-R205 VanDerWaalsContact CA-NH2 3.28Å; G202-R205 WeakPolarHBondContact O-CB 3.06Å; G202-R205 PolarHBondContact O-N 3.23Å; V203-R205 PolarHBondContact O-N 2.9Å
206	I	90.8	Very high	91.4	Very high	24 Å²	24	68 Å²	68	12%	0.123	37%	0.369	C	S	.	.			trans	-90.2	111	-173.3	-53.5	172.9	0	0	0	109.5	V69 I72 V203 L208 I213	V69-I206 HydrophobicContact CB-CD1 3.99Å; V69-I206 HydrophobicContact CG1-CD1 3.38Å; V69-I206 HydrophobicContact CG1-CG1 4.4Å; I72-I206 HydrophobicContact CB-CG2 4.31Å; I72-I206 HydrophobicContact CD1-CD1 4.28Å; I72-I206 HydrophobicContact CG1-CD1 4.29Å; I72-I206 HydrophobicContact CG1-CG2 4.44Å; V203-I206 WeakPolarHBondContact O-CG1 3.32Å; V203-I206 PolarHBondContact O-N 2.91Å; I206-L208 HydrophobicContact CG2-CG 4.22Å; I206-I213 HydrophobicContact CB-CD1 3.87Å; I206-I213 HydrophobicContact CD1-CD1 3.93Å; I206-I213 HydrophobicContact CG1-CD1 4.47Å; I206-I213 HydrophobicContact CG2-CD1 4.04Å
207	E	84.4	Confident	91.6	Very high	190 Å²	190	71.9 Å²	71.9	89%	0.888	38%	0.375	S	S	*	.			trans	-99	118.5	168.7	-66.1	-176.3	174.5	0	0	109.4
208	L	90.6	Very high	92.1	Very high	20 Å²	20	65.7 Å²	65.7	11%	0.105	35%	0.347	C	S	.	.			trans	-103.2	136.4	173.8	-78.6	168	0	0	0	109.2	I72 I206 Q210 F211 I213 L239	I72-L208 HydrophobicContact CB-CD1 4.34Å; I72-L208 HydrophobicContact CB-CD2 4.03Å; I72-L208 HydrophobicContact CD1-CD1 4.38Å; I72-L208 HydrophobicContact CG2-CD1 4.24Å; I72-L208 HydrophobicContact CG2-CD2 3.94Å; I72-L208 WeakPolarHBondContact O-CD2 3.32Å; I206-L208 HydrophobicContact CG2-CG 4.22Å; L208-Q210 PolarHBondContact O-N 3.14Å; L208-F211 HydrophobicContact CB-CB 4.07Å; L208-F211 WeakPolarHBondContact CB-O 3.32Å; L208-F211 HydrophobicContact CD1-CB 4.05Å; L208-I213 HydrophobicContact CD1-CG1 4.47Å; L208-L239 HydrophobicContact CD1-CD2 4.25Å
209	P	88.9	Confident	92.3	Very high	121 Å²	121	64.9 Å²	64.9	79%	0.786	34%	0.339	S	S	*	.	S	Bend	trans	-69.1	-32.8	-175.3	25.4	-33.8	0	0	0	113.1
210	Q	90.1	Very high	92.4	Very high	81 Å²	81	68.1 Å²	68.1	38%	0.379	36%	0.362	S	S	.	.	S	Bend	trans	-108.5	-10.1	-175.8	-69.7	179.9	-31.5	0	0	114.2	L208 N242	L208-Q210 PolarHBondContact O-N 3.14Å; Q210-N242 PolarHBondContact O-N 3.04Å
211	F	94	Very high	92.4	Very high	6 Å²	6	72.7 Å²	72.7	3%	0.026	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	160.2	-174.3	-68.1	-89.1	0	0	0	111	V75 E77 L208 L239 K240 R241 N242	V75-F211 HydrophobicContact CB-CD2 4.2Å; V75-F211 HydrophobicContact CB-CE2 3.74Å; V75-F211 HydrophobicContact CB-CZ 4.38Å; V75-F211 HydrophobicContact CG1-CE2 3.77Å; V75-F211 HydrophobicContact CG1-CZ 3.89Å; V75-F211 HydrophobicContact CG2-CD2 4.27Å; V75-F211 HydrophobicContact CG2-CE2 4.28Å; E77-F211 WeakPolarHBondContact OE1-CZ 3.21Å; L208-F211 HydrophobicContact CB-CB 4.07Å; L208-F211 WeakPolarHBondContact CB-O 3.32Å; L208-F211 HydrophobicContact CD1-CB 4.05Å; F211-L239 HydrophobicContact CD1-CB 4.04Å; F211-K240 CarbonylContact C-O 3.47Å; F211-K240 VanDerWaalsContact CA-O 3.28Å; F211-K240 WeakPolarHBondContact CA-O 3.49Å; F211-R241 HydrophobicContact CD1-CB 4.33Å; F211-R241 HydrophobicContact CE1-CB 4.27Å; F211-R241 HydrophobicContact CE1-CG 4.48Å; F211-N242 PolarHBondContact O-ND2 3.07Å
212	S	93.8	Very high	92.4	Very high	45 Å²	45	74.8 Å²	74.8	32%	0.315	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	140.3	165.6	43.8	0	0	0	0	108.9	K240 N242	S212-K240 PolarHBondContact N-O 2.89Å; S212-K240 PolarHBondContact O-N 3.08Å; S212-K240 PolarHBondContact OG-O 3.13Å; S212-N242 PolarHBondContact OG-OD1 3.37Å
213	I	94.4	Very high	92.7	Very high	40 Å²	40	75.3 Å²	75.3	21%	0.205	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	115.6	172.2	-51.7	-179.8	0	0	0	106.9	I72 V203 I206 L208 L239	I72-I213 HydrophobicContact CD1-CD1 4.06Å; V203-I213 HydrophobicContact CG1-CD1 3.92Å; V203-I213 HydrophobicContact CG1-CG2 3.91Å; I206-I213 HydrophobicContact CB-CD1 3.87Å; I206-I213 HydrophobicContact CD1-CD1 3.93Å; I206-I213 HydrophobicContact CG1-CD1 4.47Å; I206-I213 HydrophobicContact CG2-CD1 4.04Å; L208-I213 HydrophobicContact CD1-CG1 4.47Å; I213-L239 HydrophobicContact CG1-CD2 3.93Å
214	V	93.5	Very high	92.9	Very high	75 Å²	75	80.7 Å²	80.7	46%	0.455	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-42.3	-178.9	179.5	0	0	0	0	111.2	K238 K240	V214-K238 HydrophobicContact CB-CB 4.49Å; V214-K238 HydrophobicContact CB-CD 4.31Å; V214-K238 HydrophobicContact CB-CG 4.44Å; V214-K238 HydrophobicContact CG1-CD 4.34Å; V214-K238 PolarHBondContact N-O 2.71Å; V214-K240 HydrophobicContact CG2-CB 3.4Å; V214-K240 HydrophobicContact CG2-CD 4.05Å; V214-K240 HydrophobicContact CG2-CG 4.38Å
215	D	93.6	Very high	93.3	Very high	65 Å²	65	78.6 Å²	78.6	35%	0.348	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	158.2	-171.4	-172.8	22	0	0	0	109.2	K217 K238	D215-K217 WeakPolarHBondContact OD2-CE 3.21Å; D215-K217 IonicContact OD2-NZ 3.77Å; D215-K238 HydrophobicContact CB-CB 4.09Å; D215-K238 HydrophobicContact CB-CD 4.47Å; D215-K238 WeakPolarHBondContact O-CB 3.37Å; D215-K238 PolarHBondContact O-N 3.4Å
216	Y	94.3	Very high	93.7	Very high	77 Å²	77	77.2 Å²	77.2	30%	0.302	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	144.6	169	69.5	-81.7	0	0	0	110.6	V200 V203 L218 L235 S236	V200-Y216 HydrophobicContact CB-CE2 4.19Å; V200-Y216 HydrophobicContact CG1-CE2 4.49Å; V203-Y216 HydrophobicContact CB-CD1 4.2Å; V203-Y216 HydrophobicContact CB-CE1 4.28Å; V203-Y216 HydrophobicContact CG1-CD1 3.85Å; V203-Y216 HydrophobicContact CG1-CE1 4.38Å; V203-Y216 HydrophobicContact CG1-CG 4.35Å; V203-Y216 HydrophobicContact CG2-CD1 4.29Å; V203-Y216 HydrophobicContact CG2-CE1 4.41Å; V203-Y216 HydrophobicContact CG2-CG 4.38Å; Y216-L218 HydrophobicContact CD2-CD2 4.4Å; Y216-L235 HydrophobicContact CD2-CD1 4.16Å; Y216-S236 CarbonylContact C-O 3.56Å; Y216-S236 WeakPolarHBondContact CA-O 3.33Å; Y216-S236 WeakPolarHBondContact CB-O 3.42Å
217	K	94.8	Very high	93.9	Very high	121 Å²	121	81 Å²	81	53%	0.526	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	138.5	-174.5	-63	-171	-179.4	-171.9	0	111.9	D215 S236	D215-K217 WeakPolarHBondContact OD2-CE 3.21Å; D215-K217 IonicContact OD2-NZ 3.77Å; K217-S236 PolarHBondContact N-O 3.24Å; K217-S236 PolarHBondContact O-N 3.49Å
218	L	96.1	Very high	94.5	Very high	44 Å²	44	73 Å²	73	23%	0.23	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.7	176.8	-52.8	-176.5	0	0	0	108.7	W193 G196 A199 V200 Y216 L235	W193-L218 HydrophobicContact CD2-CB 4.38Å; W193-L218 HydrophobicContact CD2-CD1 4.31Å; W193-L218 HydrophobicContact CD2-CD2 4.46Å; W193-L218 HydrophobicContact CG-CB 4.29Å; W193-L218 HydrophobicContact CG-CD1 4.35Å; W193-L218 HydrophobicContact CH2-CD2 4.34Å; W193-L218 HydrophobicContact CZ2-CD2 4.13Å; G196-L218 WeakPolarHBondContact O-CD1 3.38Å; A199-L218 HydrophobicContact CB-CD1 4.34Å; V200-L218 HydrophobicContact CB-CD2 4.16Å; V200-L218 HydrophobicContact CG2-CD1 4.06Å; V200-L218 HydrophobicContact CG2-CD2 3.43Å; V200-L218 VanDerWaalsContact CG2-CD2 3.43Å; V200-L218 HydrophobicContact CG2-CG 4.4Å; Y216-L218 HydrophobicContact CD2-CD2 4.4Å; L218-L235 HydrophobicContact CD2-CB 4.42Å; L218-L235 HydrophobicContact CD2-CD1 3.63Å
219	V	95.4	Very high	94.8	Very high	66 Å²	66	73.5 Å²	73.5	40%	0.4	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141.6	176.7	-178.1	0	0	0	0	108.4	W193 L233 S234	W193-V219 PolarHBondContact NE1-O 3.25Å; V219-L233 WeakPolarHBondContact O-CA 3.44Å; V219-S234 PolarHBondContact N-O 3.13Å; V219-S234 PolarHBondContact O-N 3.3Å
220	S	96	Very high	95.3	Very high	68 Å²	68	68.8 Å²	68.8	48%	0.476	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	135.1	163.9	-177.9	0	0	0	0	108.1	L233	S220-L233 WeakPolarHBondContact OG-CD2 3.39Å
221	R	95.9	Very high	95.6	Very high	99 Å²	99	65.1 Å²	65.1	37%	0.374	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	153.4	-177.6	61.5	-176.2	-179.8	131.9	-11.3	110.7	E178 V223 R232	E178-R221 IonicContact OE1-NH2 3.29Å; E178-R221 IonicContact OE2-CZ 2.69Å; E178-R221 IonicContact OE2-NE 2.74Å; E178-R221 IonicContact OE2-NH2 3.8Å; E178-R221 PolarHBondContact OE2-NH2 2.84Å; R221-V223 HydrophobicContact CG-CG1 4.44Å; R221-R232 HydrophobicContact CG-CB 4.21Å; R221-R232 PolarHBondContact N-O 2.83Å; R221-R232 WeakPolarHBondContact O-CA 3.47Å; R221-R232 PolarHBondContact O-N 2.86Å
222	N	96.7	Very high	95.8	Very high	109 Å²	109	65.7 Å²	65.7	58%	0.583	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	143.7	165.9	-64.3	-8.8	0	0	0	108.9	T186 Y230	T186-N222 HydrophobicContact CG2-CB 4.31Å; N222-Y230 WeakPolarHBondContact CA-O 3.22Å
223	V	96.4	Very high	96	Very high	20 Å²	20	63.6 Å²	63.6	12%	0.121	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	152.1	175.5	-63.4	0	0	0	0	109.8	E180 R221 F225 A229 Y230 R232	E180-V223 WeakPolarHBondContact OE1-CG2 3.2Å; R221-V223 HydrophobicContact CG-CG1 4.44Å; V223-F225 HydrophobicContact CG2-CD2 4.3Å; V223-F225 HydrophobicContact CG2-CE2 3.82Å; V223-A229 CarbonylContact O-C 3.58Å; V223-A229 VanDerWaalsContact O-CA 3.29Å; V223-A229 WeakPolarHBondContact O-CA 3.42Å; V223-Y230 PolarHBondContact N-O 2.88Å; V223-Y230 PolarHBondContact O-N 2.95Å; V223-R232 HydrophobicContact CG2-CB 4.47Å
224	V	96.8	Very high	96.1	Very high	122 Å²	122	62 Å²	62	74%	0.739	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.1	-175.6	-175.4	0	0	0	0	109.4	A229	V224-A229 HydrophobicContact CG2-CB 4.27Å
225	F	95.6	Very high	96.3	Very high	96 Å²	96	58.4 Å²	58.4	42%	0.421	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	175.8	171.2	-69.7	-78.9	0	0	0	110	V223 T227 G228 Y230	V223-F225 HydrophobicContact CG2-CD2 4.3Å; V223-F225 HydrophobicContact CG2-CE2 3.82Å; F225-T227 PolarHBondContact O-N 2.7Å; F225-G228 PolarHBondContact N-O 2.89Å; F225-G228 PolarHBondContact O-N 2.78Å; F225-Y230 HydrophobicContact CB-CE2 4.33Å; F225-Y230 AromaticContact CD2-CD2 3.76Å; F225-Y230 HydrophobicContact CD2-CD2 3.76Å; F225-Y230 HydrophobicContact CD2-CE2 4.21Å
226	S	95.9	Very high	96.4	Very high	133 Å²	133	56 Å²	56	93%	0.93	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-21.4	175.3	50.3	0	0	0	0	114
227	T	95.8	Very high	96.4	Very high	102 Å²	102	52.4 Å²	52.4	63%	0.626	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-19.5	179.5	49.6	0	0	0	0	114	F225 Y230	F225-T227 PolarHBondContact O-N 2.7Å; T227-Y230 WeakPolarHBondContact CB-OH 3.33Å; T227-Y230 WeakPolarHBondContact OG1-CE2 3.28Å; T227-Y230 PolarHBondContact OG1-OH 3Å
228	G	96.1	Very high	96.5	Very high	23 Å²	23	50.1 Å²	50.1	24%	0.237	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.1	-176.4	-175.4	0	0	0	0	0	113.6	F225 Y230	F225-G228 PolarHBondContact N-O 2.89Å; F225-G228 PolarHBondContact O-N 2.78Å; G228-Y230 WeakPolarHBondContact O-CD2 3.31Å; G228-Y230 WeakPolarHBondContact O-CE2 3.41Å
229	A	97.8	Very high	96.4	Very high	30 Å²	30	48.1 Å²	48.1	25%	0.248	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	136.6	170.6	0	0	0	0	0	110.3	T185 T186 V223 V224	T185-A229 CarbonylContact C-O 3.6Å; T185-A229 WeakPolarHBondContact CA-O 3.46Å; T185-A229 WeakPolarHBondContact CB-O 3.32Å; T186-A229 HydrophobicContact CG2-CB 4.3Å; T186-A229 PolarHBondContact N-O 3.05Å; V223-A229 CarbonylContact O-C 3.58Å; V223-A229 VanDerWaalsContact O-CA 3.29Å; V223-A229 WeakPolarHBondContact O-CA 3.42Å; V224-A229 HydrophobicContact CG2-CB 4.27Å
230	Y	98.1	Very high	96.4	Very high	23 Å²	23	49.4 Å²	49.4	9%	0.09	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	142.1	-176.2	-64.8	-98.4	0	0	0	110.8	S181 Y182 Y184 T185 N222 V223 F225 T227 G228	S181-Y230 WeakPolarHBondContact O-CD1 3.43Å; Y182-Y230 WeakPolarHBondContact O-CE1 3.28Å; Y184-Y230 VanDerWaalsContact O-CD1 3.26Å; Y184-Y230 WeakPolarHBondContact O-CD1 3.36Å; T185-Y230 HydrophobicContact CG2-CE1 4.43Å; N222-Y230 WeakPolarHBondContact CA-O 3.22Å; V223-Y230 PolarHBondContact N-O 2.88Å; V223-Y230 PolarHBondContact O-N 2.95Å; F225-Y230 HydrophobicContact CB-CE2 4.33Å; F225-Y230 AromaticContact CD2-CD2 3.76Å; F225-Y230 HydrophobicContact CD2-CD2 3.76Å; F225-Y230 HydrophobicContact CD2-CE2 4.21Å; T227-Y230 WeakPolarHBondContact CB-OH 3.33Å; T227-Y230 WeakPolarHBondContact OG1-CE2 3.28Å; T227-Y230 PolarHBondContact OG1-OH 3Å; G228-Y230 WeakPolarHBondContact O-CD2 3.31Å; G228-Y230 WeakPolarHBondContact O-CE2 3.41Å
231	P	97.7	Very high	96.4	Very high	4 Å²	4	46.7 Å²	46.7	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	136.4	174.7	33	-34.3	0	0	0	110.4	T186 I189 F191	T186-P231 HydrophobicContact CG2-CB 4.38Å; I189-P231 HydrophobicContact CG2-CG 3.86Å; F191-P231 HydrophobicContact CB-CB 4.14Å; F191-P231 HydrophobicContact CD1-CG 4.42Å; F191-P231 HydrophobicContact CD2-CB 4.12Å; F191-P231 HydrophobicContact CD2-CG 4.01Å; F191-P231 WeakPolarHBondContact CD2-O 3.35Å; F191-P231 HydrophobicContact CE2-CG 4.32Å; F191-P231 HydrophobicContact CG-CB 4.1Å; F191-P231 HydrophobicContact CG-CG 4.07Å
232	R	97.9	Very high	96.3	Very high	18 Å²	18	44.9 Å²	44.9	7%	0.068	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	127.5	-179.7	-168.4	-176.8	-64.6	-169.8	-8.5	112	L124 E178 I179 E180 R221 V223	L124-R232 VanDerWaalsContact CD2-NH1 3.35Å; E178-R232 WeakPolarHBondContact OE2-CD 3.49Å; I179-R232 WeakPolarHBondContact O-CA 3.3Å; I179-R232 WeakPolarHBondContact O-CG 3.19Å; E180-R232 HydrophobicContact CB-CG 4.37Å; E180-R232 VanDerWaalsContact CD-NE 3.29Å; E180-R232 IonicContact OE1-CZ 3.73Å; E180-R232 VanDerWaalsContact OE1-CZ 3.25Å; E180-R232 IonicContact OE1-NE 2.88Å; E180-R232 PolarHBondContact OE1-NE 3.47Å; E180-R232 IonicContact OE1-NH2 3.76Å; E180-R232 PolarHBondContact OE1-NH2 2.79Å; E180-R232 IonicContact OE2-CZ 2.89Å; E180-R232 IonicContact OE2-NE 3.7Å; E180-R232 PolarHBondContact OE2-NE 2.89Å; E180-R232 IonicContact OE2-NH2 2.77Å; E180-R232 PolarHBondContact OE2-NH2 3.3Å; R221-R232 HydrophobicContact CG-CB 4.21Å; R221-R232 PolarHBondContact N-O 2.83Å; R221-R232 WeakPolarHBondContact O-CA 3.47Å; R221-R232 PolarHBondContact O-N 2.86Å; V223-R232 HydrophobicContact CG2-CB 4.47Å
233	L	97.7	Very high	96.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	144.3	167.7	-58	-173.5	0	0	0	109.7	M65 I179 F191 W193 V219 S220	M65-L233 HydrophobicContact CB-CD1 3.99Å; M65-L233 HydrophobicContact CG-CD1 4.02Å; M65-L233 HydrophobicContact SD-CD1 3.82Å; I179-L233 HydrophobicContact CB-CB 4.41Å; I179-L233 PolarHBondContact N-O 2.73Å; I179-L233 PolarHBondContact O-N 2.59Å; F191-L233 HydrophobicContact CB-CD1 4.05Å; F191-L233 HydrophobicContact CB-CD2 4.01Å; F191-L233 HydrophobicContact CB-CG 3.79Å; F191-L233 HydrophobicContact CD2-CG 4.46Å; W193-L233 HydrophobicContact CD2-CD1 4.01Å; W193-L233 HydrophobicContact CE3-CD1 4.34Å; W193-L233 HydrophobicContact CG-CD1 4.4Å; W193-L233 HydrophobicContact CH2-CB 4.38Å; W193-L233 HydrophobicContact CZ2-CB 3.66Å; W193-L233 HydrophobicContact CZ2-CD1 4.29Å; V219-L233 WeakPolarHBondContact O-CA 3.44Å; S220-L233 WeakPolarHBondContact OG-CD2 3.39Å
234	S	96.7	Very high	95.8	Very high	7 Å²	7	42.8 Å²	42.8	5%	0.049	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.6	175	165.9	0	0	0	0	110.6	L177 E178 V219	L177-S234 WeakPolarHBondContact O-CA 3.33Å; E178-S234 PolarHBondContact OE1-OG 2.97Å; V219-S234 PolarHBondContact N-O 3.13Å; V219-S234 PolarHBondContact O-N 3.3Å
235	L	96.5	Very high	95.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	113.2	167.6	166.9	57.4	0	0	0	108.4	I67 T176 L177 W193 V200 Y216 L218 F237	I67-L235 HydrophobicContact CD1-CD2 4.08Å; T176-L235 CarbonylContact C-O 3.54Å; T176-L235 WeakPolarHBondContact CA-O 3.45Å; L177-L235 HydrophobicContact CB-CB 4.42Å; L177-L235 PolarHBondContact N-O 3.36Å; L177-L235 PolarHBondContact O-N 3.39Å; W193-L235 HydrophobicContact CH2-CB 4.13Å; W193-L235 HydrophobicContact CZ2-CB 4.34Å; V200-L235 HydrophobicContact CG1-CD1 4.26Å; V200-L235 HydrophobicContact CG1-CD2 4.05Å; V200-L235 HydrophobicContact CG2-CD1 4.38Å; V200-L235 HydrophobicContact CG2-CD2 4.32Å; Y216-L235 HydrophobicContact CD2-CD1 4.16Å; L218-L235 HydrophobicContact CD2-CB 4.42Å; L218-L235 HydrophobicContact CD2-CD1 3.63Å; L235-F237 HydrophobicContact CD1-CE1 4.17Å; L235-F237 HydrophobicContact CD1-CZ 4.13Å; L235-F237 HydrophobicContact CD2-CE1 4.3Å; L235-F237 HydrophobicContact CD2-CE2 3.93Å; L235-F237 HydrophobicContact CD2-CZ 3.54Å; L235-F237 HydrophobicContact CG-CD2 4.49Å; L235-F237 HydrophobicContact CG-CE1 4.31Å; L235-F237 HydrophobicContact CG-CE2 3.85Å; L235-F237 HydrophobicContact CG-CZ 3.76Å
236	S	95.4	Very high	95.5	Very high	14 Å²	14	38.7 Å²	38.7	10%	0.098	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126.1	-178.4	161.8	0	0	0	0	109.7	N174 Y216 K217	N174-S236 PolarHBondContact ND2-OG 2.92Å; N174-S236 PolarHBondContact OD1-OG 3.28Å; Y216-S236 CarbonylContact C-O 3.56Å; Y216-S236 WeakPolarHBondContact CA-O 3.33Å; Y216-S236 WeakPolarHBondContact CB-O 3.42Å; K217-S236 PolarHBondContact N-O 3.24Å; K217-S236 PolarHBondContact O-N 3.49Å
237	F	95.4	Very high	95.4	Very high	1 Å²	1	34.9 Å²	34.9	0%	0.004	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.2	174	-61.7	-77.1	0	0	0	110.4	V69 Y82 L84 N174 C175 V203 L235 L239	V69-F237 HydrophobicContact CG2-CZ 4.35Å; Y82-F237 HydrophobicContact CE2-CD2 4.32Å; Y82-F237 HydrophobicContact CE2-CE2 4.33Å; L84-F237 HydrophobicContact CD1-CZ 4.37Å; L84-F237 HydrophobicContact CD2-CE2 4.44Å; N174-F237 WeakPolarHBondContact CA-O 3.11Å; C175-F237 PolarHBondContact N-O 3.5Å; C175-F237 PolarHBondContact O-N 3.32Å; V203-F237 HydrophobicContact CG1-CE1 4.38Å; V203-F237 HydrophobicContact CG2-CE1 4.26Å; L235-F237 HydrophobicContact CD1-CE1 4.17Å; L235-F237 HydrophobicContact CD1-CZ 4.13Å; L235-F237 HydrophobicContact CD2-CE1 4.3Å; L235-F237 HydrophobicContact CD2-CE2 3.93Å; L235-F237 HydrophobicContact CD2-CZ 3.54Å; L235-F237 HydrophobicContact CG-CD2 4.49Å; L235-F237 HydrophobicContact CG-CE1 4.31Å; L235-F237 HydrophobicContact CG-CE2 3.85Å; L235-F237 HydrophobicContact CG-CZ 3.76Å; F237-L239 HydrophobicContact CB-CD2 4.33Å; F237-L239 HydrophobicContact CB-CG 4.43Å; F237-L239 PolarHBondContact O-N 3.01Å
238	K	95.8	Very high	95.3	Very high	74 Å²	74	36.2 Å²	36.2	32%	0.322	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	100.5	171.7	-164.2	-175.4	-177.2	-158.5	0	109.7	E172 V214 D215	E172-K238 WeakPolarHBondContact OE2-CE 3.21Å; E172-K238 IonicContact OE2-NZ 3.57Å; E172-K238 PolarHBondContact OE2-NZ 2.68Å; V214-K238 HydrophobicContact CB-CB 4.49Å; V214-K238 HydrophobicContact CB-CD 4.31Å; V214-K238 HydrophobicContact CB-CG 4.44Å; V214-K238 HydrophobicContact CG1-CD 4.34Å; V214-K238 PolarHBondContact N-O 2.71Å; D215-K238 HydrophobicContact CB-CB 4.09Å; D215-K238 HydrophobicContact CB-CD 4.47Å; D215-K238 WeakPolarHBondContact O-CB 3.37Å; D215-K238 PolarHBondContact O-N 3.4Å
239	L	95.6	Very high	95	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	128.6	-179.3	-57.7	177.8	0	0	0	110.2	V75 E172 Q173 L208 F211 I213 F237	V75-L239 HydrophobicContact CG2-CD1 4.25Å; E172-L239 CarbonylContact C-O 3.15Å; E172-L239 WeakPolarHBondContact CA-O 3.47Å; Q173-L239 HydrophobicContact CB-CB 4.49Å; Q173-L239 PolarHBondContact N-O 2.92Å; Q173-L239 PolarHBondContact O-N 2.83Å; L208-L239 HydrophobicContact CD1-CD2 4.25Å; F211-L239 HydrophobicContact CD1-CB 4.04Å; I213-L239 HydrophobicContact CG1-CD2 3.93Å; F237-L239 HydrophobicContact CB-CD2 4.33Å; F237-L239 HydrophobicContact CB-CG 4.43Å; F237-L239 PolarHBondContact O-N 3.01Å
240	K	95.1	Very high	94.8	Very high	93 Å²	93	37.7 Å²	37.7	40%	0.404	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132.5	173.7	179.2	170.4	-164.7	135.7	0	110.2	E172 F211 S212 V214	E172-K240 HydrophobicContact CG-CB 4.25Å; E172-K240 HydrophobicContact CG-CD 4.42Å; E172-K240 HydrophobicContact CG-CG 4.12Å; E172-K240 IonicContact OE1-NZ 3.35Å; E172-K240 PolarHBondContact OE1-NZ 2.88Å; F211-K240 CarbonylContact C-O 3.47Å; F211-K240 VanDerWaalsContact CA-O 3.28Å; F211-K240 WeakPolarHBondContact CA-O 3.49Å; S212-K240 PolarHBondContact N-O 2.89Å; S212-K240 PolarHBondContact O-N 3.08Å; S212-K240 PolarHBondContact OG-O 3.13Å; V214-K240 HydrophobicContact CG2-CB 3.4Å; V214-K240 HydrophobicContact CG2-CD 4.05Å; V214-K240 HydrophobicContact CG2-CG 4.38Å
241	R	95.2	Very high	94.6	Very high	11 Å²	11	36.6 Å²	36.6	4%	0.042	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	137.8	-178.1	-166.8	176	-59.1	-81.5	0.4	112	E77 Y168 P169 D171 F211 I243 F246	E77-R241 IonicContact OE1-CZ 3.76Å; E77-R241 VanDerWaalsContact OE1-CZ 3.28Å; E77-R241 IonicContact OE1-NH1 3.16Å; E77-R241 PolarHBondContact OE1-NH1 2.8Å; E77-R241 IonicContact OE1-NH2 2.71Å; E77-R241 PolarHBondContact OE1-NH2 3.32Å; Y168-R241 VanDerWaalsContact CE2-CZ 3.5Å; P169-R241 WeakPolarHBondContact O-CD 3.42Å; D171-R241 PolarHBondContact O-N 3.13Å; D171-R241 WeakPolarHBondContact OD1-CD 3.44Å; D171-R241 IonicContact OD1-CZ 3.36Å; D171-R241 IonicContact OD1-NE 2.85Å; D171-R241 PolarHBondContact OD1-NE 3.07Å; D171-R241 IonicContact OD1-NH2 2.7Å; D171-R241 IonicContact OD2-CZ 3.71Å; D171-R241 IonicContact OD2-NE 3.66Å; D171-R241 PolarHBondContact OD2-NE 3.19Å; D171-R241 IonicContact OD2-NH2 2.79Å; D171-R241 PolarHBondContact OD2-NH2 3.27Å; F211-R241 HydrophobicContact CD1-CB 4.33Å; F211-R241 HydrophobicContact CE1-CB 4.27Å; F211-R241 HydrophobicContact CE1-CG 4.48Å; R241-I243 PolarHBondContact O-N 2.81Å; R241-F246 HydrophobicContact CG-CE2 4.07Å
242	N	93.4	Very high	94.5	Very high	61 Å²	61	40.9 Å²	40.9	33%	0.326	20%	0.204	S	C	.	.			trans	-83.6	112.1	175	-64.9	-21.2	0	0	0	109.7	Q210 F211 S212 G244	Q210-N242 PolarHBondContact O-N 3.04Å; F211-N242 PolarHBondContact O-ND2 3.07Å; S212-N242 PolarHBondContact OG-OD1 3.37Å; N242-G244 PolarHBondContact O-N 3.33Å
243	I	93	Very high	94.4	Very high	45 Å²	45	42 Å²	42	23%	0.231	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-21	-170.3	-169.1	59	0	0	0	114.9	P169 L170 R241 Y245 F246 I247 Y251	P169-I243 HydrophobicContact CB-CD1 4.18Å; P169-I243 HydrophobicContact CG-CD1 3.6Å; L170-I243 HydrophobicContact CD2-CB 4.35Å; L170-I243 HydrophobicContact CD2-CD1 3.65Å; L170-I243 HydrophobicContact CD2-CG1 3.78Å; L170-I243 HydrophobicContact CG-CD1 4.03Å; R241-I243 PolarHBondContact O-N 2.81Å; I243-Y245 VanDerWaalsContact C-N 3.33Å; I243-Y245 PolarHBondContact O-N 3.2Å; I243-F246 HydrophobicContact CD1-CB 4.25Å; I243-F246 HydrophobicContact CD1-CD2 4.43Å; I243-F246 PolarHBondContact O-N 2.94Å; I243-F246 VanDerWaalsContact O-N 3.09Å; I243-I247 HydrophobicContact CG1-CD1 4.06Å; I243-I247 HydrophobicContact CG1-CG1 4.07Å; I243-I247 HydrophobicContact CG2-CD1 4.04Å; I243-I247 PolarHBondContact O-N 2.91Å; I243-Y251 HydrophobicContact CD1-CE2 4.27Å
244	G	91.4	Very high	94.3	Very high	39 Å²	39	42 Å²	42	40%	0.402	21%	0.214	S	C	.	.	H	α-helix	trans	-57.8	-37.1	-168.1	0	0	0	0	0	115.4	N242 I247 L248	N242-G244 PolarHBondContact O-N 3.33Å; G244-I247 PolarHBondContact O-N 3.43Å; G244-L248 PolarHBondContact O-N 2.96Å
245	Y	92.4	Very high	94.3	Very high	123 Å²	123	43.5 Å²	43.5	48%	0.482	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-48.2	175.9	175.6	-108.7	0	0	0	112	I243 I247 L248 Q249	I243-Y245 VanDerWaalsContact C-N 3.33Å; I243-Y245 PolarHBondContact O-N 3.2Å; Y245-I247 VanDerWaalsContact C-N 3.31Å; Y245-I247 PolarHBondContact O-N 3Å; Y245-L248 PolarHBondContact O-N 3.24Å; Y245-Q249 WeakPolarHBondContact O-CB 3.46Å; Y245-Q249 PolarHBondContact O-N 2.9Å; Y245-Q249 PolarHBondContact OH-NE2 3.45Å; Y245-Q249 PolarHBondContact OH-OE1 3.46Å; Y245-Q249 VanDerWaalsContact OH-OE1 3.09Å
246	F	93.2	Very high	94.2	Very high	9 Å²	9	48.4 Å²	48.4	4%	0.039	25%	0.247	C	C	.	.	H	α-helix	trans	-67.3	-31.9	-179.4	-56.8	-73.5	0	0	0	112.5	Y168 P169 R241 I243 T250 Y251	Y168-F246 AromaticContact CZ-CE1 3.92Å; Y168-F246 WeakPolarHBondContact OH-CE1 3.35Å; Y168-F246 VanDerWaalsContact OH-CZ 3.22Å; Y168-F246 WeakPolarHBondContact OH-CZ 3.48Å; P169-F246 HydrophobicContact CB-CB 4.48Å; P169-F246 HydrophobicContact CB-CD1 4.23Å; P169-F246 HydrophobicContact CB-CD2 3.56Å; P169-F246 HydrophobicContact CB-CE1 4.44Å; P169-F246 HydrophobicContact CB-CE2 3.8Å; P169-F246 HydrophobicContact CB-CG 3.79Å; P169-F246 HydrophobicContact CB-CZ 4.23Å; P169-F246 HydrophobicContact CG-CB 3.93Å; P169-F246 HydrophobicContact CG-CD1 4.3Å; P169-F246 HydrophobicContact CG-CD2 3.95Å; P169-F246 HydrophobicContact CG-CG 3.76Å; R241-F246 HydrophobicContact CG-CE2 4.07Å; I243-F246 HydrophobicContact CD1-CB 4.25Å; I243-F246 HydrophobicContact CD1-CD2 4.43Å; I243-F246 PolarHBondContact O-N 2.94Å; I243-F246 VanDerWaalsContact O-N 3.09Å; F246-T250 WeakPolarHBondContact O-CA 3.46Å; F246-T250 WeakPolarHBondContact O-CB 3.25Å; F246-T250 PolarHBondContact O-N 3.33Å; F246-Y251 HydrophobicContact CB-CD2 4.35Å; F246-Y251 HydrophobicContact CB-CE2 4.17Å; F246-Y251 WeakPolarHBondContact O-CD2 3.42Å; F246-Y251 PolarHBondContact O-N 2.91Å
247	I	93.9	Very high	94.3	Very high	53 Å²	53	48.6 Å²	48.6	27%	0.272	25%	0.247	S	C	.	.	I	π-helix	trans	-59.1	-50.4	173.8	-67.6	171.5	0	0	0	110.1	I243 G244 Y245 Y251 M252	I243-I247 HydrophobicContact CG1-CD1 4.06Å; I243-I247 HydrophobicContact CG1-CG1 4.07Å; I243-I247 HydrophobicContact CG2-CD1 4.04Å; I243-I247 PolarHBondContact O-N 2.91Å; G244-I247 PolarHBondContact O-N 3.43Å; Y245-I247 VanDerWaalsContact C-N 3.31Å; Y245-I247 PolarHBondContact O-N 3Å; I247-Y251 HydrophobicContact CG1-CD2 4.41Å; I247-M252 HydrophobicContact CG2-CE 4.3Å; I247-M252 HydrophobicContact CG2-CG 4.1Å; I247-M252 VanDerWaalsContact O-CB 3.3Å; I247-M252 WeakPolarHBondContact O-CB 3.33Å; I247-M252 VanDerWaalsContact O-CG 3.28Å; I247-M252 WeakPolarHBondContact O-CG 3.4Å; I247-M252 PolarHBondContact O-N 3Å
248	L	92.4	Very high	94.3	Very high	130 Å²	130	48.5 Å²	48.5	68%	0.681	25%	0.246	S	C	*	.	I	π-helix	trans	-74.5	-37.7	-177.1	-64.7	175.6	0	0	0	113.1	G244 Y245 P253	G244-L248 PolarHBondContact O-N 2.96Å; Y245-L248 PolarHBondContact O-N 3.24Å; L248-P253 VanDerWaalsContact O-CD 3.31Å; L248-P253 WeakPolarHBondContact O-CD 3.32Å
249	Q	90.3	Very high	94.2	Very high	78 Å²	78	48.5 Å²	48.5	36%	0.364	25%	0.249	S	C	.	.	I	π-helix	trans	-87.5	-30.1	-174.2	-160.7	-167.4	23.2	0	0	114	Y245	Y245-Q249 WeakPolarHBondContact O-CB 3.46Å; Y245-Q249 PolarHBondContact O-N 2.9Å; Y245-Q249 PolarHBondContact OH-NE2 3.45Å; Y245-Q249 PolarHBondContact OH-OE1 3.46Å; Y245-Q249 VanDerWaalsContact OH-OE1 3.09Å
250	T	93.4	Very high	94.2	Very high	6 Å²	6	53.1 Å²	53.1	4%	0.037	27%	0.273	C	S	.	.	I	π-helix	trans	-121.9	-55.3	-173	-45.5	0	0	0	0	113.1	F246 S254 I289 I306 L310	F246-T250 WeakPolarHBondContact O-CA 3.46Å; F246-T250 WeakPolarHBondContact O-CB 3.25Å; F246-T250 PolarHBondContact O-N 3.33Å; T250-S254 VanDerWaalsContact O-CB 3.31Å; T250-S254 WeakPolarHBondContact O-CB 3.35Å; T250-S254 PolarHBondContact O-N 3.04Å; T250-S254 VanDerWaalsContact O-N 3.16Å; T250-S254 PolarHBondContact O-OG 3.17Å; T250-I289 HydrophobicContact CG2-CG2 4.35Å; T250-I306 HydrophobicContact CG2-CD1 4.07Å; T250-I306 HydrophobicContact CG2-CG1 4.46Å; T250-L310 HydrophobicContact CG2-CD1 4.11Å; T250-L310 HydrophobicContact CG2-CD2 4.03Å; T250-L310 HydrophobicContact CG2-CG 4.44Å
251	Y	94.9	Very high	94.1	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	26%	0.255	C	S	.	.	I	π-helix	trans	-66.6	-49.8	-174.7	-67.8	-84.1	0	0	0	111.9	P169 I243 F246 I247 S254 I255 Y309 Y502 W503	P169-Y251 HydrophobicContact CG-CE2 4.27Å; I243-Y251 HydrophobicContact CD1-CE2 4.27Å; F246-Y251 HydrophobicContact CB-CD2 4.35Å; F246-Y251 HydrophobicContact CB-CE2 4.17Å; F246-Y251 WeakPolarHBondContact O-CD2 3.42Å; F246-Y251 PolarHBondContact O-N 2.91Å; I247-Y251 HydrophobicContact CG1-CD2 4.41Å; Y251-S254 PolarHBondContact O-N 2.91Å; Y251-I255 VanDerWaalsContact O-CG1 3.27Å; Y251-I255 WeakPolarHBondContact O-CG1 3.4Å; Y251-I255 PolarHBondContact O-N 3.09Å; Y251-Y309 AromaticContact CD1-CD1 3.58Å; Y251-Y309 HydrophobicContact CD1-CD1 3.58Å; Y251-Y309 HydrophobicContact CD1-CD2 4.15Å; Y251-Y309 AromaticContact CD1-CE1 3.49Å; Y251-Y309 HydrophobicContact CD1-CE1 3.49Å; Y251-Y309 VanDerWaalsContact CD1-CE1 3.49Å; Y251-Y309 HydrophobicContact CD1-CE2 4.07Å; Y251-Y309 AromaticContact CD1-CG 3.92Å; Y251-Y309 HydrophobicContact CD1-CG 3.92Å; Y251-Y309 AromaticContact CD1-CZ 3.75Å; Y251-Y309 AromaticContact CE1-CD1 3.73Å; Y251-Y309 HydrophobicContact CE1-CD1 3.73Å; Y251-Y309 AromaticContact CE1-CD2 3.92Å; Y251-Y309 HydrophobicContact CE1-CD2 3.92Å; Y251-Y309 HydrophobicContact CE1-CE1 4.1Å; Y251-Y309 HydrophobicContact CE1-CE2 4.27Å; Y251-Y309 AromaticContact CE1-CG 3.63Å; Y251-Y309 HydrophobicContact CE1-CG 3.63Å; Y251-Y309 HydrophobicContact CG-CE1 4.46Å; Y251-Y502 AromaticContact CE1-CE1 3.79Å; Y251-Y502 HydrophobicContact CE1-CE1 3.79Å; Y251-Y502 PolarHBondContact OH-OH 3.46Å; Y251-W503 HydrophobicContact CD1-CH2 4.14Å; Y251-W503 AromaticContact CD1-CZ2 3.77Å; Y251-W503 HydrophobicContact CD1-CZ2 3.77Å; Y251-W503 HydrophobicContact CD2-CH2 4.27Å; Y251-W503 HydrophobicContact CE1-CH2 4.08Å; Y251-W503 AromaticContact CE1-CZ2 3.99Å; Y251-W503 HydrophobicContact CE1-CZ2 3.99Å; Y251-W503 HydrophobicContact CE2-CH2 4.2Å; Y251-W503 HydrophobicContact CG-CH2 4.25Å; Y251-W503 HydrophobicContact CG-CZ2 4.1Å
252	M	95.2	Very high	94.1	Very high	93 Å²	93	49.9 Å²	49.9	46%	0.458	26%	0.259	S	S	.	.	H	α-helix	trans	-60.5	-50.2	-179	-76.9	-69.3	-177.2	0	0	112.8	I247 S254 I255 L256	I247-M252 HydrophobicContact CG2-CE 4.3Å; I247-M252 HydrophobicContact CG2-CG 4.1Å; I247-M252 VanDerWaalsContact O-CB 3.3Å; I247-M252 WeakPolarHBondContact O-CB 3.33Å; I247-M252 VanDerWaalsContact O-CG 3.28Å; I247-M252 WeakPolarHBondContact O-CG 3.4Å; I247-M252 PolarHBondContact O-N 3Å; M252-S254 VanDerWaalsContact C-N 3.32Å; M252-S254 PolarHBondContact O-N 2.66Å; M252-I255 PolarHBondContact O-N 3.2Å; M252-L256 VanDerWaalsContact O-CG 3.31Å; M252-L256 WeakPolarHBondContact O-CG 3.34Å; M252-L256 PolarHBondContact O-N 3.44Å
253	P	95.8	Very high	94.1	Very high	42 Å²	42	50 Å²	50	27%	0.273	26%	0.262	S	S	.	.	H	α-helix	trans	-57.9	-41.6	174	-28.8	37.9	0	0	0	113.3	L248 I255 L256 I257 I289	L248-P253 VanDerWaalsContact O-CD 3.31Å; L248-P253 WeakPolarHBondContact O-CD 3.32Å; P253-I255 PolarHBondContact O-N 3.42Å; P253-L256 PolarHBondContact O-N 2.85Å; P253-I257 WeakPolarHBondContact O-CB 3.45Å; P253-I257 WeakPolarHBondContact O-CD1 3.45Å; P253-I257 VanDerWaalsContact O-CG1 3.23Å; P253-I257 WeakPolarHBondContact O-CG1 3.32Å; P253-I257 PolarHBondContact O-N 3.33Å; P253-I289 HydrophobicContact CB-CD1 4.26Å
254	S	96	Very high	94	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-38.3	179.9	-56.7	0	0	0	0	112.6	T250 Y251 M252 T258 L310	T250-S254 VanDerWaalsContact O-CB 3.31Å; T250-S254 WeakPolarHBondContact O-CB 3.35Å; T250-S254 PolarHBondContact O-N 3.04Å; T250-S254 VanDerWaalsContact O-N 3.16Å; T250-S254 PolarHBondContact O-OG 3.17Å; Y251-S254 PolarHBondContact O-N 2.91Å; M252-S254 VanDerWaalsContact C-N 3.32Å; M252-S254 PolarHBondContact O-N 2.66Å; S254-T258 WeakPolarHBondContact O-CB 3.29Å; S254-T258 PolarHBondContact O-N 2.77Å; S254-T258 PolarHBondContact O-OG1 2.96Å; S254-L310 VanDerWaalsContact OG-CD2 3.24Å; S254-L310 WeakPolarHBondContact OG-CD2 3.4Å
255	I	95.7	Very high	93.9	Very high	38 Å²	38	46.4 Å²	46.4	20%	0.195	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-50.3	172.3	-70.1	163.2	0	0	0	110	Y251 M252 P253 I257 T258 I259 Y309 F495	Y251-I255 VanDerWaalsContact O-CG1 3.27Å; Y251-I255 WeakPolarHBondContact O-CG1 3.4Å; Y251-I255 PolarHBondContact O-N 3.09Å; M252-I255 PolarHBondContact O-N 3.2Å; P253-I255 PolarHBondContact O-N 3.42Å; I255-I257 PolarHBondContact O-N 3.41Å; I255-T258 WeakPolarHBondContact O-CB 3.36Å; I255-T258 PolarHBondContact O-N 3.02Å; I255-T258 VanDerWaalsContact O-N 3.16Å; I255-I259 HydrophobicContact CG2-CD1 3.74Å; I255-I259 HydrophobicContact CG2-CG1 4.5Å; I255-I259 WeakPolarHBondContact O-CG1 3.45Å; I255-I259 PolarHBondContact O-N 3.33Å; I255-Y309 WeakPolarHBondContact CG1-OH 3.4Å; I255-F495 HydrophobicContact CG1-CE1 4.33Å; I255-F495 HydrophobicContact CG1-CZ 4.06Å; I255-F495 HydrophobicContact CG2-CE1 4.29Å
256	L	95.7	Very high	93.8	Very high	103 Å²	103	48.8 Å²	48.8	54%	0.539	24%	0.242	S	C	.	.	H	α-helix	trans	-61.9	-42.8	-178.9	-68.7	172.2	0	0	0	112.1	M252 P253 T258 I259 L260	M252-L256 VanDerWaalsContact O-CG 3.31Å; M252-L256 WeakPolarHBondContact O-CG 3.34Å; M252-L256 PolarHBondContact O-N 3.44Å; P253-L256 PolarHBondContact O-N 2.85Å; L256-T258 VanDerWaalsContact C-N 3.32Å; L256-T258 PolarHBondContact O-N 3.35Å; L256-I259 PolarHBondContact O-N 3.24Å; L256-L260 WeakPolarHBondContact O-CB 3.41Å; L256-L260 VanDerWaalsContact O-CG 3.28Å; L256-L260 WeakPolarHBondContact O-CG 3.4Å; L256-L260 PolarHBondContact O-N 3.01Å
257	I	95.9	Very high	93.7	Very high	18 Å²	18	50.5 Å²	50.5	9%	0.092	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-39.5	175	-68.8	159.8	0	0	0	111.2	P253 I255 L260 S261 T282 T285 M286 I289	P253-I257 WeakPolarHBondContact O-CB 3.45Å; P253-I257 WeakPolarHBondContact O-CD1 3.45Å; P253-I257 VanDerWaalsContact O-CG1 3.23Å; P253-I257 WeakPolarHBondContact O-CG1 3.32Å; P253-I257 PolarHBondContact O-N 3.33Å; I255-I257 PolarHBondContact O-N 3.41Å; I257-L260 PolarHBondContact O-N 3.11Å; I257-S261 PolarHBondContact O-N 2.67Å; I257-S261 VanDerWaalsContact O-N 3.07Å; I257-T282 HydrophobicContact CG2-CG2 4.22Å; I257-T285 HydrophobicContact CD1-CG2 3.47Å; I257-T285 VanDerWaalsContact CD1-CG2 3.47Å; I257-T285 HydrophobicContact CG1-CG2 4.23Å; I257-M286 HydrophobicContact CB-CE 4.28Å; I257-M286 HydrophobicContact CG2-CE 3.95Å; I257-I289 HydrophobicContact CD1-CD1 3.37Å
258	T	95.9	Very high	93.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-44.3	176.4	-54.2	0	0	0	0	110.8	S254 I255 L256 L260 S261 W262 M316 V317 F495	S254-T258 WeakPolarHBondContact O-CB 3.29Å; S254-T258 PolarHBondContact O-N 2.77Å; S254-T258 PolarHBondContact O-OG1 2.96Å; I255-T258 WeakPolarHBondContact O-CB 3.36Å; I255-T258 PolarHBondContact O-N 3.02Å; I255-T258 VanDerWaalsContact O-N 3.16Å; L256-T258 VanDerWaalsContact C-N 3.32Å; L256-T258 PolarHBondContact O-N 3.35Å; T258-L260 PolarHBondContact O-N 3.14Å; T258-S261 WeakPolarHBondContact O-CB 3.46Å; T258-S261 PolarHBondContact O-N 2.79Å; T258-S261 PolarHBondContact O-OG 2.88Å; T258-W262 HydrophobicContact CG2-CZ2 3.87Å; T258-W262 PolarHBondContact O-NE1 3.44Å; T258-M316 HydrophobicContact CG2-CB 4.11Å; T258-V317 HydrophobicContact CG2-CG2 4.45Å; T258-F495 HydrophobicContact CG2-CD2 3.86Å; T258-F495 HydrophobicContact CG2-CE2 3.81Å; T258-F495 HydrophobicContact CG2-CG 4.26Å; T258-F495 HydrophobicContact CG2-CZ 4.15Å
259	I	94.8	Very high	92.8	Very high	74 Å²	74	48.3 Å²	48.3	38%	0.379	24%	0.239	S	C	.	.	H	α-helix	trans	-63.3	-41.2	175	-65.3	165.8	0	0	0	111.4	I255 L256 S261 W262	I255-I259 HydrophobicContact CG2-CD1 3.74Å; I255-I259 HydrophobicContact CG2-CG1 4.5Å; I255-I259 WeakPolarHBondContact O-CG1 3.45Å; I255-I259 PolarHBondContact O-N 3.33Å; L256-I259 PolarHBondContact O-N 3.24Å; I259-S261 VanDerWaalsContact C-N 3.26Å; I259-S261 PolarHBondContact O-N 3.21Å; I259-W262 HydrophobicContact CB-CE3 4.37Å; I259-W262 HydrophobicContact CB-CZ3 4.44Å; I259-W262 HydrophobicContact CG1-CE3 4.22Å; I259-W262 HydrophobicContact CG1-CH2 4.13Å; I259-W262 HydrophobicContact CG1-CZ3 3.8Å; I259-W262 HydrophobicContact CG2-CE3 4.38Å; I259-W262 WeakPolarHBondContact O-CB 3.27Å; I259-W262 PolarHBondContact O-N 3.46Å
260	L	93.9	Very high	92.3	Very high	98 Å²	98	49.7 Å²	49.7	51%	0.513	25%	0.249	S	C	.	.	H	α-helix	trans	-60.6	-33.6	176.5	-76	170.7	0	0	0	112.4	L256 I257 T258 W262 V263 T282	L256-L260 WeakPolarHBondContact O-CB 3.41Å; L256-L260 VanDerWaalsContact O-CG 3.28Å; L256-L260 WeakPolarHBondContact O-CG 3.4Å; L256-L260 PolarHBondContact O-N 3.01Å; I257-L260 PolarHBondContact O-N 3.11Å; T258-L260 PolarHBondContact O-N 3.14Å; L260-W262 PolarHBondContact O-N 3.4Å; L260-V263 WeakPolarHBondContact O-CB 3.22Å; L260-V263 WeakPolarHBondContact O-CG2 2.98Å; L260-V263 PolarHBondContact O-N 2.97Å; L260-T282 HydrophobicContact CB-CG2 4.47Å
261	S	94.7	Very high	92.1	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-31.3	175.2	79	0	0	0	0	112.6	I257 T258 I259 V263 S264	I257-S261 PolarHBondContact O-N 2.67Å; I257-S261 VanDerWaalsContact O-N 3.07Å; T258-S261 WeakPolarHBondContact O-CB 3.46Å; T258-S261 PolarHBondContact O-N 2.79Å; T258-S261 PolarHBondContact O-OG 2.88Å; I259-S261 VanDerWaalsContact C-N 3.26Å; I259-S261 PolarHBondContact O-N 3.21Å; S261-V263 VanDerWaalsContact C-N 3.3Å; S261-V263 PolarHBondContact O-N 2.9Å; S261-S264 WeakPolarHBondContact O-CB 3.36Å; S261-S264 PolarHBondContact O-N 3.48Å; S261-S264 PolarHBondContact O-OG 3.3Å
262	W	93.8	Very high	91.6	Very high	33 Å²	33	53.7 Å²	53.7	13%	0.125	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-77.2	-12.2	-179.5	-48.6	-21.7	0	0	0	113.9	T258 I259 L260 S264 F265 P492 F495	T258-W262 HydrophobicContact CG2-CZ2 3.87Å; T258-W262 PolarHBondContact O-NE1 3.44Å; I259-W262 HydrophobicContact CB-CE3 4.37Å; I259-W262 HydrophobicContact CB-CZ3 4.44Å; I259-W262 HydrophobicContact CG1-CE3 4.22Å; I259-W262 HydrophobicContact CG1-CH2 4.13Å; I259-W262 HydrophobicContact CG1-CZ3 3.8Å; I259-W262 HydrophobicContact CG2-CE3 4.38Å; I259-W262 WeakPolarHBondContact O-CB 3.27Å; I259-W262 PolarHBondContact O-N 3.46Å; L260-W262 PolarHBondContact O-N 3.4Å; W262-S264 PolarHBondContact O-N 2.98Å; W262-F265 HydrophobicContact CB-CD2 3.86Å; W262-F265 HydrophobicContact CB-CE2 3.83Å; W262-F265 AromaticContact CD1-CE2 3.8Å; W262-F265 HydrophobicContact CG-CD2 4.5Å; W262-F265 HydrophobicContact CG-CE2 4.02Å; W262-F265 WeakPolarHBondContact O-CD2 3.27Å; W262-F265 PolarHBondContact O-N 3.48Å; W262-P492 HydrophobicContact CD2-CG 4.27Å; W262-P492 HydrophobicContact CE3-CB 4.34Å; W262-P492 HydrophobicContact CE3-CG 3.74Å; W262-P492 HydrophobicContact CH2-CB 4.1Å; W262-P492 HydrophobicContact CH2-CG 4.29Å; W262-P492 HydrophobicContact CZ3-CB 3.82Å; W262-P492 HydrophobicContact CZ3-CG 3.75Å; W262-F495 HydrophobicContact CH2-CB 3.9Å; W262-F495 AromaticContact CH2-CD1 3.71Å; W262-F495 HydrophobicContact CH2-CD1 3.71Å; W262-F495 HydrophobicContact CH2-CG 4.05Å; W262-F495 HydrophobicContact CZ2-CB 3.63Å; W262-F495 AromaticContact CZ2-CD1 3.94Å; W262-F495 HydrophobicContact CZ2-CD1 3.94Å; W262-F495 AromaticContact CZ2-CG 3.85Å; W262-F495 HydrophobicContact CZ2-CG 3.85Å
263	V	92.9	Very high	91.3	Very high	65 Å²	65	52.9 Å²	52.9	39%	0.394	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-61.8	-28.3	172.8	179.8	0	0	0	0	110.6	L260 S261 F265 W266 I267	L260-V263 WeakPolarHBondContact O-CB 3.22Å; L260-V263 WeakPolarHBondContact O-CG2 2.98Å; L260-V263 PolarHBondContact O-N 2.97Å; S261-V263 VanDerWaalsContact C-N 3.3Å; S261-V263 PolarHBondContact O-N 2.9Å; V263-F265 PolarHBondContact O-N 3.01Å; V263-W266 PolarHBondContact O-N 2.99Å; V263-I267 HydrophobicContact CG1-CD1 4.48Å; V263-I267 PolarHBondContact O-N 3.46Å
264	S	91.1	Very high	91.1	Very high	6 Å²	6	52.9 Å²	52.9	4%	0.042	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-55.8	-35	174.6	64.7	0	0	0	0	113.6	S261 W262 W266 I267 R275	S261-S264 WeakPolarHBondContact O-CB 3.36Å; S261-S264 PolarHBondContact O-N 3.48Å; S261-S264 PolarHBondContact O-OG 3.3Å; W262-S264 PolarHBondContact O-N 2.98Å; S264-W266 PolarHBondContact O-N 3.12Å; S264-I267 PolarHBondContact O-N 2.89Å; S264-R275 PolarHBondContact O-NE 3.13Å; S264-R275 VanDerWaalsContact O-NE 3.16Å
265	F	90.9	Very high	91	Very high	1 Å²	1	53 Å²	53	0%	0.004	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-70.5	-13.5	178.5	-47.9	-41.6	0	0	0	113.6	W262 V263 A320 E323 R488 F491	W262-F265 HydrophobicContact CB-CD2 3.86Å; W262-F265 HydrophobicContact CB-CE2 3.83Å; W262-F265 AromaticContact CD1-CE2 3.8Å; W262-F265 HydrophobicContact CG-CD2 4.5Å; W262-F265 HydrophobicContact CG-CE2 4.02Å; W262-F265 WeakPolarHBondContact O-CD2 3.27Å; W262-F265 PolarHBondContact O-N 3.48Å; V263-F265 PolarHBondContact O-N 3.01Å; F265-A320 HydrophobicContact CE1-CB 4.27Å; F265-A320 HydrophobicContact CZ-CB 3.84Å; F265-E323 HydrophobicContact CD1-CG 4.45Å; F265-E323 HydrophobicContact CE1-CB 4.08Å; F265-E323 HydrophobicContact CE1-CG 3.89Å; F265-R488 HydrophobicContact CB-CG 3.87Å; F265-R488 PolarHBondContact O-NE 2.95Å; F265-R488 PolarHBondContact O-NH2 2.98Å; F265-F491 HydrophobicContact CE1-CE2 4.32Å; F265-F491 HydrophobicContact CE2-CB 3.98Å; F265-F491 HydrophobicContact CE2-CD1 4.38Å; F265-F491 AromaticContact CE2-CD2 3.73Å; F265-F491 HydrophobicContact CE2-CD2 3.73Å; F265-F491 HydrophobicContact CE2-CE2 4.26Å; F265-F491 AromaticContact CE2-CG 3.79Å; F265-F491 HydrophobicContact CE2-CG 3.79Å; F265-F491 HydrophobicContact CZ-CD1 4.13Å; F265-F491 AromaticContact CZ-CD2 3.58Å; F265-F491 HydrophobicContact CZ-CD2 3.58Å; F265-F491 HydrophobicContact CZ-CE1 4.17Å; F265-F491 AromaticContact CZ-CE2 3.63Å; F265-F491 HydrophobicContact CZ-CE2 3.63Å; F265-F491 AromaticContact CZ-CG 3.84Å; F265-F491 HydrophobicContact CZ-CG 3.84Å; F265-F491 AromaticContact CZ-CZ 3.93Å; F265-F491 HydrophobicContact CZ-CZ 3.93Å
266	W	90.1	Very high	90.8	Very high	174 Å²	174	53.6 Å²	53.6	66%	0.659	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-98.4	-21.5	178.2	-70.8	91.5	0	0	0	113.3	V263 S264 R488	V263-W266 PolarHBondContact O-N 2.99Å; S264-W266 PolarHBondContact O-N 3.12Å; W266-R488 HydrophobicContact CZ2-CG 4.44Å
267	I	89.6	Confident	90.7	Very high	44 Å²	44	51.2 Å²	51.2	23%	0.226	29%	0.293	C	S	.	.	S	Bend	trans	-75	137.6	174.6	-65	170.9	0	0	0	108.7	V263 S264 A271 A274 R275 L278	V263-I267 HydrophobicContact CG1-CD1 4.48Å; V263-I267 PolarHBondContact O-N 3.46Å; S264-I267 PolarHBondContact O-N 2.89Å; I267-A271 HydrophobicContact CG2-CB 3.77Å; I267-A274 HydrophobicContact CG2-CB 4.49Å; I267-R275 HydrophobicContact CB-CG 4.32Å; I267-R275 HydrophobicContact CG2-CG 4.15Å; I267-R275 VanDerWaalsContact O-CZ 3.24Å; I267-R275 PolarHBondContact O-NE 3.38Å; I267-R275 PolarHBondContact O-NH2 2.93Å; I267-L278 HydrophobicContact CD1-CD1 3.43Å; I267-L278 VanDerWaalsContact CD1-CD1 3.43Å
268	N	85.4	Confident	90.6	Very high	113 Å²	113	53.3 Å²	53.3	60%	0.604	30%	0.304	S	S	*	.			trans	-59	143.5	177.6	-69	-22.3	0	0	0	111.9	D270 A271	N268-D270 PolarHBondContact O-N 2.85Å; N268-A271 PolarHBondContact O-N 2.83Å
269	Y	82.3	Confident	90.5	Very high	25 Å²	25	53.7 Å²	53.7	10%	0.098	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-24.4	-177.1	64	-97.8	0	0	0	113.1	A271 F331 V480	Y269-A271 PolarHBondContact O-N 3.06Å; Y269-F331 HydrophobicContact CD2-CD2 4.38Å; Y269-F331 HydrophobicContact CD2-CE2 4.35Å; Y269-F331 HydrophobicContact CD2-CZ 4.5Å; Y269-F331 AromaticContact CE2-CD2 3.99Å; Y269-F331 HydrophobicContact CE2-CD2 3.99Å; Y269-F331 HydrophobicContact CE2-CE1 4.27Å; Y269-F331 AromaticContact CE2-CE2 3.56Å; Y269-F331 HydrophobicContact CE2-CE2 3.56Å; Y269-F331 AromaticContact CE2-CZ 3.72Å; Y269-F331 HydrophobicContact CE2-CZ 3.72Å; Y269-V480 HydrophobicContact CD1-CG1 3.74Å; Y269-V480 HydrophobicContact CE1-CG1 4.37Å; Y269-V480 HydrophobicContact CG-CG1 3.97Å
270	D	80.2	Confident	90.5	Very high	107 Å²	107	54.8 Å²	54.8	57%	0.572	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-29.4	174.4	-58.7	-57	0	0	0	112.4	N268 S272	N268-D270 PolarHBondContact O-N 2.85Å; D270-S272 PolarHBondContact O-N 3.41Å
271	A	88.8	Confident	90.6	Very high	42 Å²	42	53.9 Å²	53.9	35%	0.347	31%	0.312	S	S	.	.			trans	-81.4	51.5	178.6	0	0	0	0	0	112.2	I267 N268 Y269 A273 A274 R275	I267-A271 HydrophobicContact CG2-CB 3.77Å; N268-A271 PolarHBondContact O-N 2.83Å; Y269-A271 PolarHBondContact O-N 3.06Å; A271-A273 VanDerWaalsContact C-N 3.33Å; A271-A273 PolarHBondContact O-N 2.91Å; A271-A274 HydrophobicContact CB-CB 4.37Å; A271-A274 PolarHBondContact O-N 2.85Å; A271-R275 PolarHBondContact O-N 2.94Å
272	S	85.1	Confident	90.6	Very high	49 Å²	49	54.2 Å²	54.2	34%	0.343	31%	0.314	S	S	.	.	H	α-helix	trans	-45.6	-49.6	-178.9	51.3	0	0	0	0	113.8	D270 A274 R275 V276 Y324	D270-S272 PolarHBondContact O-N 3.41Å; S272-A274 VanDerWaalsContact C-N 3.31Å; S272-A274 PolarHBondContact O-N 3.4Å; S272-R275 PolarHBondContact O-N 3.27Å; S272-V276 WeakPolarHBondContact O-CG2 3.19Å; S272-V276 PolarHBondContact O-N 3.44Å; S272-Y324 WeakPolarHBondContact CA-OH 3.45Å; S272-Y324 WeakPolarHBondContact CB-OH 3.47Å
273	A	89.7	Confident	90.7	Very high	76 Å²	76	54 Å²	54	63%	0.628	32%	0.316	S	S	*	.	H	α-helix	trans	-58.4	-39.5	179.7	0	0	0	0	0	113.2	A271 A277	A271-A273 VanDerWaalsContact C-N 3.33Å; A271-A273 PolarHBondContact O-N 2.91Å; A273-A277 VanDerWaalsContact O-CB 3.28Å; A273-A277 WeakPolarHBondContact O-CB 3.41Å; A273-A277 PolarHBondContact O-N 2.86Å
274	A	91.5	Very high	90.9	Very high	42 Å²	42	56 Å²	56	35%	0.347	32%	0.324	S	S	.	.	H	α-helix	trans	-71.2	-43.9	-179.8	0	0	0	0	0	112	I267 A271 S272 A277 L278	I267-A274 HydrophobicContact CG2-CB 4.49Å; A271-A274 HydrophobicContact CB-CB 4.37Å; A271-A274 PolarHBondContact O-N 2.85Å; S272-A274 VanDerWaalsContact C-N 3.31Å; S272-A274 PolarHBondContact O-N 3.4Å; A274-A277 PolarHBondContact O-N 3.5Å; A274-L278 WeakPolarHBondContact O-CG 3.49Å; A274-L278 PolarHBondContact O-N 3.47Å; A274-L278 VanDerWaalsContact O-N 3.11Å
275	R	92.3	Very high	91.1	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-44.4	176.2	-72.1	-168.3	178.1	-154.3	11.2	111.5	S264 I267 A271 S272 G279 E323 Y324 D484	S264-R275 PolarHBondContact O-NE 3.13Å; S264-R275 VanDerWaalsContact O-NE 3.16Å; I267-R275 HydrophobicContact CB-CG 4.32Å; I267-R275 HydrophobicContact CG2-CG 4.15Å; I267-R275 VanDerWaalsContact O-CZ 3.24Å; I267-R275 PolarHBondContact O-NE 3.38Å; I267-R275 PolarHBondContact O-NH2 2.93Å; A271-R275 PolarHBondContact O-N 2.94Å; S272-R275 PolarHBondContact O-N 3.27Å; R275-G279 PolarHBondContact O-N 3Å; R275-E323 IonicContact NH1-OE2 2.99Å; R275-Y324 HydrophobicContact CB-CD2 3.62Å; R275-Y324 HydrophobicContact CB-CE2 3.86Å; R275-Y324 HydrophobicContact CB-CG 4.08Å; R275-Y324 HydrophobicContact CG-CD2 4.17Å; R275-Y324 HydrophobicContact CG-CE2 4.48Å; R275-D484 IonicContact CZ-OD1 2.64Å; R275-D484 VanDerWaalsContact CZ-OD1 3.3Å; R275-D484 IonicContact CZ-OD2 2.78Å; R275-D484 IonicContact NH1-OD1 3.8Å; R275-D484 PolarHBondContact NH1-OD1 3.29Å; R275-D484 IonicContact NH1-OD2 3.8Å; R275-D484 IonicContact NH2-OD1 3.26Å; R275-D484 PolarHBondContact NH2-OD1 3Å; R275-D484 IonicContact NH2-OD2 3.53Å; R275-D484 PolarHBondContact NH2-OD2 3.03Å
276	V	92.4	Very high	91.2	Very high	50 Å²	50	58.2 Å²	58.2	30%	0.303	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-48.6	176.7	173.8	0	0	0	0	111.7	S272 L278 G279 I280 Y324	S272-V276 WeakPolarHBondContact O-CG2 3.19Å; S272-V276 PolarHBondContact O-N 3.44Å; V276-L278 VanDerWaalsContact C-N 3.34Å; V276-L278 PolarHBondContact O-N 3.44Å; V276-G279 PolarHBondContact O-N 2.98Å; V276-I280 HydrophobicContact CG1-CD1 3.56Å; V276-I280 HydrophobicContact CG1-CG1 4.19Å; V276-I280 WeakPolarHBondContact O-CG1 3.27Å; V276-I280 PolarHBondContact O-N 3.28Å; V276-Y324 HydrophobicContact CG2-CD1 3.94Å; V276-Y324 HydrophobicContact CG2-CE1 3.18Å
277	A	94	Very high	91.4	Very high	53 Å²	53	52.6 Å²	52.6	44%	0.438	32%	0.323	S	S	.	.	H	α-helix	trans	-59.8	-44	-178.1	0	0	0	0	0	111.8	A273 A274 T281	A273-A277 VanDerWaalsContact O-CB 3.28Å; A273-A277 WeakPolarHBondContact O-CB 3.41Å; A273-A277 PolarHBondContact O-N 2.86Å; A274-A277 PolarHBondContact O-N 3.5Å; A277-T281 WeakPolarHBondContact O-CB 3.22Å; A277-T281 PolarHBondContact O-N 3.31Å; A277-T281 PolarHBondContact O-OG1 3.1Å
278	L	93.9	Very high	91.7	Very high	63 Å²	63	54.2 Å²	54.2	33%	0.33	33%	0.334	S	S	.	.	H	α-helix	trans	-63.6	-45.9	175.6	-72.2	170	0	0	0	112.3	I267 A274 V276 T281 T282	I267-L278 HydrophobicContact CD1-CD1 3.43Å; I267-L278 VanDerWaalsContact CD1-CD1 3.43Å; A274-L278 WeakPolarHBondContact O-CG 3.49Å; A274-L278 PolarHBondContact O-N 3.47Å; A274-L278 VanDerWaalsContact O-N 3.11Å; V276-L278 VanDerWaalsContact C-N 3.34Å; V276-L278 PolarHBondContact O-N 3.44Å; L278-T281 PolarHBondContact O-N 3.45Å; L278-T282 WeakPolarHBondContact O-CB 3.36Å; L278-T282 WeakPolarHBondContact O-CG2 3.49Å; L278-T282 PolarHBondContact O-N 3.04Å; L278-T282 PolarHBondContact O-OG1 3.1Å
279	G	92.9	Very high	92	Very high	8 Å²	8	50.3 Å²	50.3	8%	0.082	31%	0.313	C	S	.	.	H	α-helix	trans	-64.6	-44.8	-179.9	0	0	0	0	0	113.4	R275 V276 T282 V283	R275-G279 PolarHBondContact O-N 3Å; V276-G279 PolarHBondContact O-N 2.98Å; G279-T282 PolarHBondContact O-OG1 2.86Å; G279-T282 VanDerWaalsContact O-OG1 3.1Å; G279-V283 WeakPolarHBondContact O-CG2 3.28Å; G279-V283 PolarHBondContact O-N 3.43Å
280	I	94.6	Very high	92.4	Very high	96 Å²	96	50.6 Å²	50.6	49%	0.492	32%	0.316	S	S	.	.	H	α-helix	trans	-66.4	-44.3	176.5	-66.1	177.4	0	0	0	110.8	V276 T282 V283 L284	V276-I280 HydrophobicContact CG1-CD1 3.56Å; V276-I280 HydrophobicContact CG1-CG1 4.19Å; V276-I280 WeakPolarHBondContact O-CG1 3.27Å; V276-I280 PolarHBondContact O-N 3.28Å; I280-T282 PolarHBondContact O-N 3.37Å; I280-V283 PolarHBondContact O-N 3.11Å; I280-L284 WeakPolarHBondContact O-CB 3.16Å; I280-L284 PolarHBondContact O-N 3.3Å
281	T	96.1	Very high	93	Very high	79 Å²	79	48.8 Å²	48.8	49%	0.485	31%	0.31	S	S	.	.	H	α-helix	trans	-63.6	-42.9	-179.2	-55.3	0	0	0	0	111.2	A277 L278 L284 T285	A277-T281 WeakPolarHBondContact O-CB 3.22Å; A277-T281 PolarHBondContact O-N 3.31Å; A277-T281 PolarHBondContact O-OG1 3.1Å; L278-T281 PolarHBondContact O-N 3.45Å; T281-L284 PolarHBondContact O-N 3.04Å; T281-T285 PolarHBondContact O-N 3.34Å; T281-T285 PolarHBondContact O-OG1 2.9Å
282	T	95.6	Very high	93.1	Very high	11 Å²	11	51.2 Å²	51.2	7%	0.067	31%	0.313	C	S	.	.	H	α-helix	trans	-66.2	-38.5	178.8	47.6	0	0	0	0	112.9	I257 L260 L278 G279 I280 M286 V317	I257-T282 HydrophobicContact CG2-CG2 4.22Å; L260-T282 HydrophobicContact CB-CG2 4.47Å; L278-T282 WeakPolarHBondContact O-CB 3.36Å; L278-T282 WeakPolarHBondContact O-CG2 3.49Å; L278-T282 PolarHBondContact O-N 3.04Å; L278-T282 PolarHBondContact O-OG1 3.1Å; G279-T282 PolarHBondContact O-OG1 2.86Å; G279-T282 VanDerWaalsContact O-OG1 3.1Å; I280-T282 PolarHBondContact O-N 3.37Å; T282-M286 WeakPolarHBondContact O-CB 3.3Å; T282-M286 PolarHBondContact O-N 2.73Å; T282-V317 WeakPolarHBondContact OG1-CG1 3.43Å
283	V	95.9	Very high	93.2	Very high	27 Å²	27	49.4 Å²	49.4	16%	0.164	30%	0.3	C	S	.	.	H	α-helix	trans	-62.5	-43.1	171.2	173.2	0	0	0	0	111.2	G279 I280 M286 T287 F314 V317 L321	G279-V283 WeakPolarHBondContact O-CG2 3.28Å; G279-V283 PolarHBondContact O-N 3.43Å; I280-V283 PolarHBondContact O-N 3.11Å; V283-M286 PolarHBondContact O-N 2.72Å; V283-T287 WeakPolarHBondContact O-CB 3.48Å; V283-T287 PolarHBondContact O-N 2.91Å; V283-T287 PolarHBondContact O-OG1 3.5Å; V283-F314 HydrophobicContact CG1-CE2 3.94Å; V283-F314 HydrophobicContact CG1-CZ 4.28Å; V283-V317 HydrophobicContact CG2-CG1 3.8Å; V283-L321 HydrophobicContact CG2-CD2 4.3Å
284	L	95.8	Very high	93	Very high	107 Å²	107	54.1 Å²	54.1	56%	0.56	30%	0.301	S	S	*	.	H	α-helix	trans	-62.4	-49.4	177.1	179.4	61.2	0	0	0	111.2	I280 T281 M286 T287 T288	I280-L284 WeakPolarHBondContact O-CB 3.16Å; I280-L284 PolarHBondContact O-N 3.3Å; T281-L284 PolarHBondContact O-N 3.04Å; L284-M286 VanDerWaalsContact C-N 3.33Å; L284-M286 PolarHBondContact O-N 3.16Å; L284-T287 CarbonylContact O-C 3.6Å; L284-T287 WeakPolarHBondContact O-CA 3.4Å; L284-T287 WeakPolarHBondContact O-CB 3.33Å; L284-T287 PolarHBondContact O-N 3.26Å; L284-T288 PolarHBondContact O-N 2.97Å; L284-T288 PolarHBondContact O-OG1 3.25Å; L284-T288 VanDerWaalsContact O-OG1 3.09Å
285	T	95.7	Very high	92.9	Very high	55 Å²	55	59.4 Å²	59.4	34%	0.337	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-41.3	179.3	-49.5	0	0	0	0	112	I257 T281 T287 T288 I289	I257-T285 HydrophobicContact CD1-CG2 3.47Å; I257-T285 VanDerWaalsContact CD1-CG2 3.47Å; I257-T285 HydrophobicContact CG1-CG2 4.23Å; T281-T285 PolarHBondContact O-N 3.34Å; T281-T285 PolarHBondContact O-OG1 2.9Å; T285-T287 VanDerWaalsContact C-N 3.31Å; T285-T287 PolarHBondContact O-N 2.93Å; T285-T288 PolarHBondContact O-N 3.3Å; T285-I289 WeakPolarHBondContact O-CG1 3.17Å; T285-I289 PolarHBondContact O-N 2.88Å
286	M	93.6	Very high	92.6	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-63.7	-37.8	174.5	-168.6	66.1	67.1	0	0	111.7	I257 T282 V283 L284 I289 N290 L310 C313 F314 V317	I257-M286 HydrophobicContact CB-CE 4.28Å; I257-M286 HydrophobicContact CG2-CE 3.95Å; T282-M286 WeakPolarHBondContact O-CB 3.3Å; T282-M286 PolarHBondContact O-N 2.73Å; V283-M286 PolarHBondContact O-N 2.72Å; L284-M286 VanDerWaalsContact C-N 3.33Å; L284-M286 PolarHBondContact O-N 3.16Å; M286-I289 PolarHBondContact O-N 3.37Å; M286-N290 PolarHBondContact O-N 3.09Å; M286-N290 VanDerWaalsContact O-N 3.07Å; M286-N290 PolarHBondContact O-ND2 3.43Å; M286-N290 PolarHBondContact O-OD1 3.45Å; M286-L310 HydrophobicContact SD-CD2 4.32Å; M286-C313 HydrophobicContact CE-CB 3.65Å; M286-C313 HydrophobicContact SD-CB 4.04Å; M286-F314 HydrophobicContact CB-CD2 4.23Å; M286-F314 HydrophobicContact CG-CB 3.92Å; M286-F314 HydrophobicContact CG-CD2 3.9Å; M286-F314 HydrophobicContact CG-CG 4.43Å; M286-V317 HydrophobicContact CE-CG2 4.21Å
287	T	94.1	Very high	92.2	Very high	56 Å²	56	61.2 Å²	61.2	34%	0.344	33%	0.33	S	S	.	.	H	α-helix	trans	-63.5	-43.3	174.3	-54	0	0	0	0	111.3	V283 L284 T285 I289 N290 T291	V283-T287 WeakPolarHBondContact O-CB 3.48Å; V283-T287 PolarHBondContact O-N 2.91Å; V283-T287 PolarHBondContact O-OG1 3.5Å; L284-T287 CarbonylContact O-C 3.6Å; L284-T287 WeakPolarHBondContact O-CA 3.4Å; L284-T287 WeakPolarHBondContact O-CB 3.33Å; L284-T287 PolarHBondContact O-N 3.26Å; T285-T287 VanDerWaalsContact C-N 3.31Å; T285-T287 PolarHBondContact O-N 2.93Å; T287-I289 PolarHBondContact O-N 3.39Å; T287-N290 WeakPolarHBondContact O-CB 3.36Å; T287-N290 PolarHBondContact O-N 3.47Å; T287-T291 PolarHBondContact O-N 3.15Å; T287-T291 PolarHBondContact O-OG1 3.45Å
288	T	95.2	Very high	91.9	Very high	77 Å²	77	59.3 Å²	59.3	47%	0.472	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-39.4	177.3	-54.2	0	0	0	0	112.7	L284 T285 T291 H292	L284-T288 PolarHBondContact O-N 2.97Å; L284-T288 PolarHBondContact O-OG1 3.25Å; L284-T288 VanDerWaalsContact O-OG1 3.09Å; T285-T288 PolarHBondContact O-N 3.3Å; T288-T291 WeakPolarHBondContact CA-OG1 3.39Å; T288-T291 PolarHBondContact O-N 3.23Å; T288-T291 PolarHBondContact O-OG1 3.38Å; T288-H292 WeakPolarHBondContact O-CB 3.24Å; T288-H292 PolarHBondContact O-N 3.02Å
289	I	93.6	Very high	91.5	Very high	31 Å²	31	66.2 Å²	66.2	16%	0.159	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-43.9	173.4	-69.6	171.2	0	0	0	110.3	T250 P253 I257 T285 M286 T287 T291 H292 L293 L310	T250-I289 HydrophobicContact CG2-CG2 4.35Å; P253-I289 HydrophobicContact CB-CD1 4.26Å; I257-I289 HydrophobicContact CD1-CD1 3.37Å; T285-I289 WeakPolarHBondContact O-CG1 3.17Å; T285-I289 PolarHBondContact O-N 2.88Å; M286-I289 PolarHBondContact O-N 3.37Å; T287-I289 PolarHBondContact O-N 3.39Å; I289-T291 PolarHBondContact O-N 3.28Å; I289-H292 PolarHBondContact O-N 2.78Å; I289-L293 PolarHBondContact O-N 3.03Å; I289-L310 HydrophobicContact CG2-CD2 4.05Å
290	N	90.3	Very high	91.2	Very high	31 Å²	31	67.3 Å²	67.3	17%	0.166	34%	0.344	C	S	.	.	H	α-helix	trans	-64.8	-35.2	179.1	-69.1	-11.4	0	0	0	113.1	M286 T287 R294 L310	M286-N290 PolarHBondContact O-N 3.09Å; M286-N290 VanDerWaalsContact O-N 3.07Å; M286-N290 PolarHBondContact O-ND2 3.43Å; M286-N290 PolarHBondContact O-OD1 3.45Å; T287-N290 WeakPolarHBondContact O-CB 3.36Å; T287-N290 PolarHBondContact O-N 3.47Å; N290-R294 WeakPolarHBondContact O-CD 3.23Å; N290-R294 VanDerWaalsContact O-CG 3.25Å; N290-R294 WeakPolarHBondContact O-CG 3.34Å; N290-R294 PolarHBondContact O-N 3.34Å; N290-L310 WeakPolarHBondContact OD1-CB 3.28Å; N290-L310 WeakPolarHBondContact OD1-CD1 3.45Å
291	T	91.4	Very high	90.9	Very high	70 Å²	70	69.2 Å²	69.2	43%	0.429	36%	0.363	S	S	.	.	H	α-helix	trans	-72.3	-45.3	174.5	49.8	0	0	0	0	111.4	T287 T288 I289 L293 R294 E295	T287-T291 PolarHBondContact O-N 3.15Å; T287-T291 PolarHBondContact O-OG1 3.45Å; T288-T291 WeakPolarHBondContact CA-OG1 3.39Å; T288-T291 PolarHBondContact O-N 3.23Å; T288-T291 PolarHBondContact O-OG1 3.38Å; I289-T291 PolarHBondContact O-N 3.28Å; T291-L293 PolarHBondContact O-N 3.08Å; T291-R294 WeakPolarHBondContact O-CB 3.48Å; T291-R294 PolarHBondContact O-N 2.9Å; T291-E295 PolarHBondContact O-N 3.01Å
292	H	91.2	Very high	90.6	Very high	92 Å²	92	68.9 Å²	68.9	43%	0.426	35%	0.353	S	S	.	.	H	α-helix	trans	-59.7	-43.7	179.5	-178.8	55.1	0	0	0	112.4	T288 I289 R294 E295 T296	T288-H292 WeakPolarHBondContact O-CB 3.24Å; T288-H292 PolarHBondContact O-N 3.02Å; I289-H292 PolarHBondContact O-N 2.78Å; H292-R294 PolarHBondContact O-N 3.38Å; H292-E295 PolarHBondContact O-N 3.47Å; H292-E295 VanDerWaalsContact O-N 3.15Å; H292-T296 PolarHBondContact O-N 3.22Å
293	L	88	Confident	90.4	Very high	12 Å²	12	72.8 Å²	72.8	6%	0.063	38%	0.377	C	S	.	.	H	α-helix	trans	-64.8	-25.9	176.2	-174.4	66.7	0	0	0	113.1	I289 T291 T296 L297 I306 L310	I289-L293 PolarHBondContact O-N 3.03Å; T291-L293 PolarHBondContact O-N 3.08Å; L293-T296 PolarHBondContact O-OG1 3.45Å; L293-L297 HydrophobicContact CD1-CD1 3.84Å; L293-L297 HydrophobicContact CD1-CG 4.34Å; L293-L297 HydrophobicContact CG-CD1 3.88Å; L293-L297 WeakPolarHBondContact O-CD1 3.47Å; L293-L297 VanDerWaalsContact O-CG 3.23Å; L293-L297 WeakPolarHBondContact O-CG 3.47Å; L293-I306 HydrophobicContact CD1-CD1 4.25Å; L293-I306 HydrophobicContact CD2-CB 4.43Å; L293-I306 HydrophobicContact CD2-CD1 3.65Å; L293-I306 HydrophobicContact CD2-CG1 3.71Å; L293-I306 HydrophobicContact CD2-CG2 3.9Å; L293-L310 HydrophobicContact CD2-CD1 3.37Å
294	R	85.6	Confident	90.3	Very high	174 Å²	174	72.3 Å²	72.3	66%	0.657	37%	0.373	S	S	*	.	H	α-helix	trans	-80.1	-17.7	176.4	-73.9	172.3	178.6	-154	-0.2	113.4	N290 T291 H292	N290-R294 WeakPolarHBondContact O-CD 3.23Å; N290-R294 VanDerWaalsContact O-CG 3.25Å; N290-R294 WeakPolarHBondContact O-CG 3.34Å; N290-R294 PolarHBondContact O-N 3.34Å; T291-R294 WeakPolarHBondContact O-CB 3.48Å; T291-R294 PolarHBondContact O-N 2.9Å; H292-R294 PolarHBondContact O-N 3.38Å
295	E	87.9	Confident	90.2	Very high	153 Å²	153	67.2 Å²	67.2	72%	0.715	35%	0.346	S	S	*	.	H	α-helix	trans	-83	-32.2	175.3	-68.9	172.3	167.9	0	0	111.8	T291 H292 L297	T291-E295 PolarHBondContact O-N 3.01Å; H292-E295 PolarHBondContact O-N 3.47Å; H292-E295 VanDerWaalsContact O-N 3.15Å; E295-L297 VanDerWaalsContact C-N 3.35Å
296	T	85.8	Confident	90.2	Very high	76 Å²	76	64.6 Å²	64.6	47%	0.466	33%	0.33	S	S	.	.	S	Bend	trans	-82.9	-8.4	-179.9	57	0	0	0	0	114.2	H292 L293	H292-T296 PolarHBondContact O-N 3.22Å; L293-T296 PolarHBondContact O-OG1 3.45Å
297	L	84.8	Confident	90.1	Very high	15 Å²	15	66.1 Å²	66.1	8%	0.079	34%	0.338	C	S	.	.	S	Bend	trans	-118.7	153	-173.8	-62	-178.4	0	0	0	113.3	Y168 L293 E295	Y168-L297 HydrophobicContact CD1-CD1 4.19Å; Y168-L297 HydrophobicContact CE1-CD1 3.64Å; Y168-L297 HydrophobicContact CE1-CD2 3.88Å; Y168-L297 HydrophobicContact CE1-CG 4.44Å; Y168-L297 HydrophobicContact CE2-CD2 4.17Å; Y168-L297 VanDerWaalsContact OH-CD2 3.27Å; Y168-L297 WeakPolarHBondContact OH-CD2 3.39Å; L293-L297 HydrophobicContact CD1-CD1 3.84Å; L293-L297 HydrophobicContact CD1-CG 4.34Å; L293-L297 HydrophobicContact CG-CD1 3.88Å; L293-L297 WeakPolarHBondContact O-CD1 3.47Å; L293-L297 VanDerWaalsContact O-CG 3.23Å; L293-L297 WeakPolarHBondContact O-CG 3.47Å; E295-L297 VanDerWaalsContact C-N 3.35Å
298	P	87.6	Confident	90.1	Very high	13 Å²	13	68.2 Å²	68.2	8%	0.084	35%	0.345	C	S	.	.			trans	-54.3	140.1	168.6	24	-36.2	0	0	0	111.9	E77 L165 I300	E77-P298 HydrophobicContact CB-CG 3.99Å; E77-P298 WeakPolarHBondContact O-CB 3.37Å; E77-P298 WeakPolarHBondContact O-CG 3.5Å; L165-P298 HydrophobicContact CD1-CG 3.79Å; P298-I300 HydrophobicContact CB-CD1 4.02Å; P298-I300 HydrophobicContact CB-CG1 3.93Å; P298-I300 HydrophobicContact CG-CD1 3.64Å; P298-I300 HydrophobicContact CG-CG1 4.07Å; P298-I300 PolarHBondContact O-N 3.07Å
299	K	85.1	Confident	90.1	Very high	207 Å²	207	64.6 Å²	64.6	90%	0.9	32%	0.323	S	S	*	.			trans	-74.5	92.3	173.1	-68.3	-178.1	-177.5	175.8	0	109.9
300	I	87.1	Confident	90.2	Very high	31 Å²	31	63.3 Å²	63.3	16%	0.159	32%	0.316	C	S	.	.			trans	-106.4	138.1	-176.6	-70.2	-179.5	0	0	0	110.1	M80 L165 P298 Y302	M80-I300 HydrophobicContact CE-CD1 4.02Å; M80-I300 HydrophobicContact CE-CG1 4.41Å; L165-I300 HydrophobicContact CB-CD1 4.17Å; L165-I300 HydrophobicContact CD1-CD1 3.65Å; L165-I300 HydrophobicContact CG-CD1 4.28Å; P298-I300 HydrophobicContact CB-CD1 4.02Å; P298-I300 HydrophobicContact CB-CG1 3.93Å; P298-I300 HydrophobicContact CG-CD1 3.64Å; P298-I300 HydrophobicContact CG-CG1 4.07Å; P298-I300 PolarHBondContact O-N 3.07Å; I300-Y302 VanDerWaalsContact C-N 3.34Å; I300-Y302 HydrophobicContact CG2-CD1 3.48Å; I300-Y302 VanDerWaalsContact CG2-CD1 3.48Å; I300-Y302 HydrophobicContact CG2-CD2 3.63Å; I300-Y302 HydrophobicContact CG2-CE1 3.33Å; I300-Y302 HydrophobicContact CG2-CE2 3.46Å; I300-Y302 VanDerWaalsContact CG2-CE2 3.46Å; I300-Y302 HydrophobicContact CG2-CG 3.64Å; I300-Y302 PolarHBondContact O-N 3.44Å
301	P	87.7	Confident	90.3	Very high	136 Å²	136	67.2 Å²	67.2	88%	0.883	34%	0.335	S	S	*	.	S	Bend	trans	-78.2	-12.5	-173.6	31	-37.2	0	0	0	114.7
302	Y	90.9	Very high	90.5	Very high	72 Å²	72	64.6 Å²	64.6	28%	0.282	32%	0.321	S	S	.	.	S	Bend	trans	-99.5	153.5	178.3	58.2	-107.9	0	0	0	112.6	L165 R166 I300	L165-Y302 HydrophobicContact CB-CE2 4.45Å; L165-Y302 PolarHBondContact N-OH 3.01Å; R166-Y302 HydrophobicContact CB-CE2 4.38Å; R166-Y302 HydrophobicContact CG-CD2 3.74Å; R166-Y302 HydrophobicContact CG-CE2 3.66Å; R166-Y302 HydrophobicContact CG-CG 4.42Å; I300-Y302 VanDerWaalsContact C-N 3.34Å; I300-Y302 HydrophobicContact CG2-CD1 3.48Å; I300-Y302 VanDerWaalsContact CG2-CD1 3.48Å; I300-Y302 HydrophobicContact CG2-CD2 3.63Å; I300-Y302 HydrophobicContact CG2-CE1 3.33Å; I300-Y302 HydrophobicContact CG2-CE2 3.46Å; I300-Y302 VanDerWaalsContact CG2-CE2 3.46Å; I300-Y302 HydrophobicContact CG2-CG 3.64Å; I300-Y302 PolarHBondContact O-N 3.44Å
303	V	91.3	Very high	90.7	Very high	93 Å²	93	60.2 Å²	60.2	56%	0.564	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-73.4	133	178.9	-171.6	0	0	0	0	110.3	D307 M308	V303-D307 HydrophobicContact CG1-CB 3.88Å; V303-M308 HydrophobicContact CG1-CG 3.82Å; V303-M308 HydrophobicContact CG1-SD 3.75Å
304	K	93.7	Very high	91.1	Very high	18 Å²	18	62.2 Å²	62.2	8%	0.078	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-96.4	157.1	177.4	-54.2	176.9	-57.9	-56.8	0	110.7	R166 Y168 I306 D307 M308	R166-K304 CarbonylContact O-C 3.56Å; Y168-K304 HydrophobicContact CD1-CD 4.47Å; K304-I306 HydrophobicContact CB-CG2 4.14Å; K304-I306 PolarHBondContact O-N 3.45Å; K304-D307 WeakPolarHBondContact CB-OD2 3.31Å; K304-D307 PolarHBondContact N-OD2 3.39Å; K304-D307 IonicContact NZ-OD1 3.16Å; K304-D307 PolarHBondContact NZ-OD1 3.37Å; K304-D307 IonicContact NZ-OD2 3.3Å; K304-D307 PolarHBondContact NZ-OD2 3.03Å; K304-D307 WeakPolarHBondContact O-CB 3.42Å; K304-D307 PolarHBondContact O-N 3.18Å; K304-M308 PolarHBondContact O-N 2.94Å; K304-M308 VanDerWaalsContact O-N 3.14Å
305	A	94.4	Very high	91.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-54.4	-39.8	176.2	0	0	0	0	0	112.9	R166 M308 Y309 Y502 Y506	R166-A305 PolarHBondContact O-N 3Å; A305-M308 PolarHBondContact O-N 2.93Å; A305-Y309 PolarHBondContact O-N 3.45Å; A305-Y309 VanDerWaalsContact O-N 3.11Å; A305-Y502 WeakPolarHBondContact O-CE2 3.31Å; A305-Y502 PolarHBondContact O-OH 3.45Å; A305-Y506 HydrophobicContact CB-CD1 3.56Å; A305-Y506 HydrophobicContact CB-CD2 4.28Å; A305-Y506 HydrophobicContact CB-CE1 3.35Å; A305-Y506 HydrophobicContact CB-CE2 4.1Å; A305-Y506 HydrophobicContact CB-CG 4.03Å
306	I	94	Very high	91.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.5	-33.1	175	-161.8	160	0	0	0	113.6	Y168 P169 T250 L293 K304 M308 Y309 L310	Y168-I306 HydrophobicContact CD1-CB 4.49Å; Y168-I306 HydrophobicContact CD1-CG2 3.77Å; Y168-I306 HydrophobicContact CE1-CD1 4.45Å; Y168-I306 HydrophobicContact CE1-CG2 4.2Å; Y168-I306 PolarHBondContact O-N 3.24Å; Y168-I306 VanDerWaalsContact O-N 3.13Å; P169-I306 HydrophobicContact CG-CD1 4.26Å; T250-I306 HydrophobicContact CG2-CD1 4.07Å; T250-I306 HydrophobicContact CG2-CG1 4.46Å; L293-I306 HydrophobicContact CD1-CD1 4.25Å; L293-I306 HydrophobicContact CD2-CB 4.43Å; L293-I306 HydrophobicContact CD2-CD1 3.65Å; L293-I306 HydrophobicContact CD2-CG1 3.71Å; L293-I306 HydrophobicContact CD2-CG2 3.9Å; K304-I306 HydrophobicContact CB-CG2 4.14Å; K304-I306 PolarHBondContact O-N 3.45Å; I306-M308 VanDerWaalsContact C-N 3.34Å; I306-Y309 PolarHBondContact O-N 2.88Å; I306-L310 HydrophobicContact CG1-CD1 4.15Å; I306-L310 WeakPolarHBondContact O-CB 3.37Å; I306-L310 WeakPolarHBondContact O-CG 3.31Å; I306-L310 PolarHBondContact O-N 2.93Å
307	D	93	Very high	92.4	Very high	32 Å²	32	47.4 Å²	47.4	17%	0.171	25%	0.247	C	C	.	.	H	α-helix	trans	-67.2	-39.5	175.8	-56	-40.9	0	0	0	110.1	V303 K304 Y309 L310 M311	V303-D307 HydrophobicContact CG1-CB 3.88Å; K304-D307 WeakPolarHBondContact CB-OD2 3.31Å; K304-D307 PolarHBondContact N-OD2 3.39Å; K304-D307 IonicContact NZ-OD1 3.16Å; K304-D307 PolarHBondContact NZ-OD1 3.37Å; K304-D307 IonicContact NZ-OD2 3.3Å; K304-D307 PolarHBondContact NZ-OD2 3.03Å; K304-D307 WeakPolarHBondContact O-CB 3.42Å; K304-D307 PolarHBondContact O-N 3.18Å; D307-Y309 VanDerWaalsContact C-N 3.35Å; D307-L310 PolarHBondContact O-N 3.48Å; D307-M311 WeakPolarHBondContact O-CB 3.25Å; D307-M311 PolarHBondContact O-N 3.14Å
308	M	93.7	Very high	92.9	Very high	100 Å²	100	51.1 Å²	51.1	49%	0.493	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-40.6	174.8	-69.7	-61.2	-64.4	0	0	111.9	V303 K304 A305 I306 G312	V303-M308 HydrophobicContact CG1-CG 3.82Å; V303-M308 HydrophobicContact CG1-SD 3.75Å; K304-M308 PolarHBondContact O-N 2.94Å; K304-M308 VanDerWaalsContact O-N 3.14Å; A305-M308 PolarHBondContact O-N 2.93Å; I306-M308 VanDerWaalsContact C-N 3.34Å; M308-G312 PolarHBondContact O-N 3.22Å
309	Y	95.6	Very high	93.2	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.1	-54.1	175.8	-170.8	-98.1	0	0	0	111.6	Y251 I255 A305 I306 D307 M311 G312 C313 F498 N499 Y502	Y251-Y309 AromaticContact CD1-CD1 3.58Å; Y251-Y309 HydrophobicContact CD1-CD1 3.58Å; Y251-Y309 HydrophobicContact CD1-CD2 4.15Å; Y251-Y309 AromaticContact CD1-CE1 3.49Å; Y251-Y309 HydrophobicContact CD1-CE1 3.49Å; Y251-Y309 VanDerWaalsContact CD1-CE1 3.49Å; Y251-Y309 HydrophobicContact CD1-CE2 4.07Å; Y251-Y309 AromaticContact CD1-CG 3.92Å; Y251-Y309 HydrophobicContact CD1-CG 3.92Å; Y251-Y309 AromaticContact CD1-CZ 3.75Å; Y251-Y309 AromaticContact CE1-CD1 3.73Å; Y251-Y309 HydrophobicContact CE1-CD1 3.73Å; Y251-Y309 AromaticContact CE1-CD2 3.92Å; Y251-Y309 HydrophobicContact CE1-CD2 3.92Å; Y251-Y309 HydrophobicContact CE1-CE1 4.1Å; Y251-Y309 HydrophobicContact CE1-CE2 4.27Å; Y251-Y309 AromaticContact CE1-CG 3.63Å; Y251-Y309 HydrophobicContact CE1-CG 3.63Å; Y251-Y309 HydrophobicContact CG-CE1 4.46Å; I255-Y309 WeakPolarHBondContact CG1-OH 3.4Å; A305-Y309 PolarHBondContact O-N 3.45Å; A305-Y309 VanDerWaalsContact O-N 3.11Å; I306-Y309 PolarHBondContact O-N 2.88Å; D307-Y309 VanDerWaalsContact C-N 3.35Å; Y309-M311 VanDerWaalsContact C-N 3.35Å; Y309-M311 PolarHBondContact O-N 3.31Å; Y309-G312 PolarHBondContact O-N 3.28Å; Y309-G312 VanDerWaalsContact O-N 3.13Å; Y309-C313 VanDerWaalsContact CE1-SG 3.51Å; Y309-C313 PolarHBondContact O-N 3.24Å; Y309-C313 PolarHBondContact O-SG 3.33Å; Y309-F498 AromaticContact CD2-CE1 3.91Å; Y309-F498 HydrophobicContact CD2-CE1 3.91Å; Y309-F498 HydrophobicContact CD2-CZ 4.32Å; Y309-F498 AromaticContact CE2-CE1 3.95Å; Y309-F498 HydrophobicContact CE2-CE1 3.95Å; Y309-N499 WeakPolarHBondContact CE2-OD1 3.26Å; Y309-N499 PolarHBondContact OH-OD1 3.34Å; Y309-Y502 AromaticContact CD2-CD1 3.67Å; Y309-Y502 HydrophobicContact CD2-CD1 3.67Å; Y309-Y502 AromaticContact CD2-CD2 3.94Å; Y309-Y502 HydrophobicContact CD2-CD2 3.94Å; Y309-Y502 AromaticContact CD2-CE1 3.73Å; Y309-Y502 HydrophobicContact CD2-CE1 3.73Å; Y309-Y502 AromaticContact CD2-CE2 3.99Å; Y309-Y502 HydrophobicContact CD2-CE2 3.99Å; Y309-Y502 AromaticContact CD2-CG 3.78Å; Y309-Y502 HydrophobicContact CD2-CG 3.78Å; Y309-Y502 AromaticContact CD2-CZ 3.9Å; Y309-Y502 HydrophobicContact CE2-CD1 4.14Å; Y309-Y502 HydrophobicContact CE2-CE1 4.46Å; Y309-Y502 HydrophobicContact CE2-CG 4.4Å; Y309-Y502 HydrophobicContact CG-CE1 4.33Å; Y309-Y502 HydrophobicContact CG-CE2 4.33Å
310	L	94.1	Very high	93.6	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-36	-177.4	-73.2	170.5	0	0	0	112.8	T250 S254 M286 I289 N290 L293 I306 D307 C313 F314	T250-L310 HydrophobicContact CG2-CD1 4.11Å; T250-L310 HydrophobicContact CG2-CD2 4.03Å; T250-L310 HydrophobicContact CG2-CG 4.44Å; S254-L310 VanDerWaalsContact OG-CD2 3.24Å; S254-L310 WeakPolarHBondContact OG-CD2 3.4Å; M286-L310 HydrophobicContact SD-CD2 4.32Å; I289-L310 HydrophobicContact CG2-CD2 4.05Å; N290-L310 WeakPolarHBondContact OD1-CB 3.28Å; N290-L310 WeakPolarHBondContact OD1-CD1 3.45Å; L293-L310 HydrophobicContact CD2-CD1 3.37Å; I306-L310 HydrophobicContact CG1-CD1 4.15Å; I306-L310 WeakPolarHBondContact O-CB 3.37Å; I306-L310 WeakPolarHBondContact O-CG 3.31Å; I306-L310 PolarHBondContact O-N 2.93Å; D307-L310 PolarHBondContact O-N 3.48Å; L310-C313 PolarHBondContact O-N 3.07Å; L310-F314 VanDerWaalsContact O-CB 3.28Å; L310-F314 WeakPolarHBondContact O-CB 3.44Å; L310-F314 PolarHBondContact O-N 3.04Å
311	M	94.1	Very high	93.9	Very high	114 Å²	114	44.9 Å²	44.9	56%	0.562	24%	0.239	S	C	*	.	H	α-helix	trans	-66.3	-38.4	172.9	-168.5	63.4	133.5	0	0	111.6	D307 Y309 F314 V315	D307-M311 WeakPolarHBondContact O-CB 3.25Å; D307-M311 PolarHBondContact O-N 3.14Å; Y309-M311 VanDerWaalsContact C-N 3.35Å; Y309-M311 PolarHBondContact O-N 3.31Å; M311-F314 PolarHBondContact O-N 3.05Å; M311-F314 HydrophobicContact SD-CD1 4.37Å; M311-V315 WeakPolarHBondContact O-CG2 3.46Å; M311-V315 PolarHBondContact O-N 3.27Å
312	G	95	Very high	94.1	Very high	14 Å²	14	42.2 Å²	42.2	14%	0.144	22%	0.217	C	C	.	.	H	α-helix	trans	-60.6	-49.2	172.5	0	0	0	0	0	112.4	M308 Y309 F314 V315 M316	M308-G312 PolarHBondContact O-N 3.22Å; Y309-G312 PolarHBondContact O-N 3.28Å; Y309-G312 VanDerWaalsContact O-N 3.13Å; G312-F314 PolarHBondContact O-N 3.06Å; G312-V315 PolarHBondContact O-N 3.5Å; G312-M316 WeakPolarHBondContact O-CG 3.37Å; G312-M316 PolarHBondContact O-N 2.64Å; G312-M316 VanDerWaalsContact O-N 3.1Å
313	C	95.9	Very high	94.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.1	-44.6	174	-64.6	0	0	0	0	112.1	M286 Y309 L310 V315 M316 V317	M286-C313 HydrophobicContact CE-CB 3.65Å; M286-C313 HydrophobicContact SD-CB 4.04Å; Y309-C313 VanDerWaalsContact CE1-SG 3.51Å; Y309-C313 PolarHBondContact O-N 3.24Å; Y309-C313 PolarHBondContact O-SG 3.33Å; L310-C313 PolarHBondContact O-N 3.07Å; C313-V315 PolarHBondContact O-N 3.46Å; C313-M316 PolarHBondContact O-N 3.33Å; C313-V317 WeakPolarHBondContact O-CG2 3.46Å; C313-V317 PolarHBondContact O-N 3.19Å
314	F	95.8	Very high	94.1	Very high	55 Å²	55	36.1 Å²	36.1	24%	0.241	18%	0.184	C	C	.	.	H	α-helix	trans	-59.4	-44.7	177.3	-178.9	-91.5	0	0	0	112.4	V283 M286 L310 M311 G312 M316 V317 F318	V283-F314 HydrophobicContact CG1-CE2 3.94Å; V283-F314 HydrophobicContact CG1-CZ 4.28Å; M286-F314 HydrophobicContact CB-CD2 4.23Å; M286-F314 HydrophobicContact CG-CB 3.92Å; M286-F314 HydrophobicContact CG-CD2 3.9Å; M286-F314 HydrophobicContact CG-CG 4.43Å; L310-F314 VanDerWaalsContact O-CB 3.28Å; L310-F314 WeakPolarHBondContact O-CB 3.44Å; L310-F314 PolarHBondContact O-N 3.04Å; M311-F314 PolarHBondContact O-N 3.05Å; M311-F314 HydrophobicContact SD-CD1 4.37Å; G312-F314 PolarHBondContact O-N 3.06Å; F314-M316 VanDerWaalsContact C-N 3.35Å; F314-M316 PolarHBondContact O-N 2.9Å; F314-V317 PolarHBondContact O-N 2.85Å; F314-F318 VanDerWaalsContact O-CB 3.32Å; F314-F318 WeakPolarHBondContact O-CB 3.4Å; F314-F318 PolarHBondContact O-N 3.3Å
315	V	96.1	Very high	93.9	Very high	66 Å²	66	37.6 Å²	37.6	40%	0.4	20%	0.199	S	C	.	.	H	α-helix	trans	-62.5	-40.5	176.1	169.6	0	0	0	0	111.3	M311 G312 C313 F318 L319	M311-V315 WeakPolarHBondContact O-CG2 3.46Å; M311-V315 PolarHBondContact O-N 3.27Å; G312-V315 PolarHBondContact O-N 3.5Å; C313-V315 PolarHBondContact O-N 3.46Å; V315-F318 PolarHBondContact O-N 3.16Å; V315-L319 HydrophobicContact CG1-CD1 3.88Å; V315-L319 HydrophobicContact CG1-CG 4.33Å; V315-L319 WeakPolarHBondContact O-CB 3.46Å; V315-L319 VanDerWaalsContact O-CG 3.26Å; V315-L319 WeakPolarHBondContact O-CG 3.24Å; V315-L319 PolarHBondContact O-N 2.99Å
316	M	94.8	Very high	93.6	Very high	25 Å²	25	43 Å²	43	12%	0.123	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-43.9	177.2	-65.7	-62.1	161.9	0	0	112.4	T258 G312 C313 F314 L319 A320 V494 F495	T258-M316 HydrophobicContact CG2-CB 4.11Å; G312-M316 WeakPolarHBondContact O-CG 3.37Å; G312-M316 PolarHBondContact O-N 2.64Å; G312-M316 VanDerWaalsContact O-N 3.1Å; C313-M316 PolarHBondContact O-N 3.33Å; F314-M316 VanDerWaalsContact C-N 3.35Å; F314-M316 PolarHBondContact O-N 2.9Å; M316-L319 PolarHBondContact O-N 3.23Å; M316-A320 PolarHBondContact O-N 3.29Å; M316-A320 VanDerWaalsContact O-N 3.08Å; M316-V494 HydrophobicContact CE-CG1 3.54Å; M316-V494 HydrophobicContact SD-CG1 4.2Å; M316-F495 HydrophobicContact CG-CD2 4.36Å
317	V	95.9	Very high	93.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65	-40.9	176.4	174.1	0	0	0	0	111.1	T258 T282 V283 M286 C313 F314 A320 L321	T258-V317 HydrophobicContact CG2-CG2 4.45Å; T282-V317 WeakPolarHBondContact OG1-CG1 3.43Å; V283-V317 HydrophobicContact CG2-CG1 3.8Å; M286-V317 HydrophobicContact CE-CG2 4.21Å; C313-V317 WeakPolarHBondContact O-CG2 3.46Å; C313-V317 PolarHBondContact O-N 3.19Å; F314-V317 PolarHBondContact O-N 2.85Å; V317-A320 PolarHBondContact O-N 3.45Å; V317-L321 PolarHBondContact O-N 3.21Å
318	F	95.3	Very high	92.9	Very high	93 Å²	93	44.2 Å²	44.2	41%	0.408	23%	0.229	S	C	.	.	H	α-helix	trans	-64.7	-39.9	175.8	-177.4	-107.6	0	0	0	112.5	F314 V315 A320 L321 L322	F314-F318 VanDerWaalsContact O-CB 3.32Å; F314-F318 WeakPolarHBondContact O-CB 3.4Å; F314-F318 PolarHBondContact O-N 3.3Å; V315-F318 PolarHBondContact O-N 3.16Å; F318-A320 VanDerWaalsContact C-N 3.31Å; F318-A320 PolarHBondContact O-N 2.88Å; F318-L321 PolarHBondContact O-N 2.91Å; F318-L322 HydrophobicContact CD1-CD1 3.9Å; F318-L322 HydrophobicContact CD1-CG 4.35Å; F318-L322 HydrophobicContact CE1-CD1 3.48Å; F318-L322 VanDerWaalsContact CE1-CD1 3.48Å; F318-L322 HydrophobicContact CE1-CG 4.02Å; F318-L322 HydrophobicContact CZ-CD1 4.1Å; F318-L322 HydrophobicContact CZ-CD2 4.33Å; F318-L322 HydrophobicContact CZ-CG 4.22Å; F318-L322 PolarHBondContact O-N 3.25Å
319	L	94.8	Very high	92.5	Very high	75 Å²	75	46.1 Å²	46.1	39%	0.393	23%	0.232	S	C	.	.	H	α-helix	trans	-64.2	-34.1	174.1	-74.7	170	0	0	0	112.3	V315 M316 L322 E323 F491	V315-L319 HydrophobicContact CG1-CD1 3.88Å; V315-L319 HydrophobicContact CG1-CG 4.33Å; V315-L319 WeakPolarHBondContact O-CB 3.46Å; V315-L319 VanDerWaalsContact O-CG 3.26Å; V315-L319 WeakPolarHBondContact O-CG 3.24Å; V315-L319 PolarHBondContact O-N 2.99Å; M316-L319 PolarHBondContact O-N 3.23Å; L319-L322 HydrophobicContact CD2-CD1 4.35Å; L319-L322 PolarHBondContact O-N 3.49Å; L319-E323 WeakPolarHBondContact O-CB 3.38Å; L319-E323 PolarHBondContact O-N 3.2Å; L319-F491 HydrophobicContact CB-CE1 3.77Å; L319-F491 HydrophobicContact CB-CZ 4.01Å
320	A	92.6	Very high	91.9	Very high	4 Å²	4	48.2 Å²	48.2	3%	0.033	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-35.8	173.9	0	0	0	0	0	112.3	F265 M316 V317 F318 E323 Y324 F491	F265-A320 HydrophobicContact CE1-CB 4.27Å; F265-A320 HydrophobicContact CZ-CB 3.84Å; M316-A320 PolarHBondContact O-N 3.29Å; M316-A320 VanDerWaalsContact O-N 3.08Å; V317-A320 PolarHBondContact O-N 3.45Å; F318-A320 VanDerWaalsContact C-N 3.31Å; F318-A320 PolarHBondContact O-N 2.88Å; A320-E323 WeakPolarHBondContact O-CB 3.46Å; A320-E323 PolarHBondContact O-N 3.43Å; A320-Y324 PolarHBondContact O-N 3.05Å; A320-F491 HydrophobicContact CB-CE1 4.05Å; A320-F491 HydrophobicContact CB-CZ 4.48Å
321	L	92.9	Very high	91.1	Very high	41 Å²	41	51.2 Å²	51.2	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-68.8	-38.1	171.8	177.7	61.8	0	0	0	112.3	V283 V317 F318 E323 Y324 A325	V283-L321 HydrophobicContact CG2-CD2 4.3Å; V317-L321 PolarHBondContact O-N 3.21Å; F318-L321 PolarHBondContact O-N 2.91Å; L321-E323 VanDerWaalsContact C-N 3.34Å; L321-Y324 PolarHBondContact O-N 3.25Å; L321-A325 PolarHBondContact O-N 2.96Å; L321-A325 VanDerWaalsContact O-N 3.16Å
322	L	93	Very high	90.2	Very high	81 Å²	81	52 Å²	52	42%	0.424	26%	0.256	S	S	.	.	H	α-helix	trans	-67.3	-32.8	174.9	-73.8	-179.6	0	0	0	113	F318 L319 A325 F326	F318-L322 HydrophobicContact CD1-CD1 3.9Å; F318-L322 HydrophobicContact CD1-CG 4.35Å; F318-L322 HydrophobicContact CE1-CD1 3.48Å; F318-L322 VanDerWaalsContact CE1-CD1 3.48Å; F318-L322 HydrophobicContact CE1-CG 4.02Å; F318-L322 HydrophobicContact CZ-CD1 4.1Å; F318-L322 HydrophobicContact CZ-CD2 4.33Å; F318-L322 HydrophobicContact CZ-CG 4.22Å; F318-L322 PolarHBondContact O-N 3.25Å; L319-L322 HydrophobicContact CD2-CD1 4.35Å; L319-L322 PolarHBondContact O-N 3.49Å; L322-A325 PolarHBondContact O-N 2.91Å; L322-F326 WeakPolarHBondContact O-CB 3.22Å; L322-F326 PolarHBondContact O-N 3.32Å
323	E	92.4	Very high	88.9	Confident	17 Å²	17	52.5 Å²	52.5	8%	0.079	26%	0.262	C	S	.	.	H	α-helix	trans	-57.7	-49.6	173.6	-169	-87.9	-172.9	0	0	110.8	F265 R275 L319 A320 L321 A325 F326 V327 I483 S487 F491	F265-E323 HydrophobicContact CD1-CG 4.45Å; F265-E323 HydrophobicContact CE1-CB 4.08Å; F265-E323 HydrophobicContact CE1-CG 3.89Å; R275-E323 IonicContact NH1-OE2 2.99Å; L319-E323 WeakPolarHBondContact O-CB 3.38Å; L319-E323 PolarHBondContact O-N 3.2Å; A320-E323 WeakPolarHBondContact O-CB 3.46Å; A320-E323 PolarHBondContact O-N 3.43Å; L321-E323 VanDerWaalsContact C-N 3.34Å; E323-A325 VanDerWaalsContact C-N 3.34Å; E323-A325 PolarHBondContact O-N 3.23Å; E323-F326 WeakPolarHBondContact O-CB 3.42Å; E323-F326 PolarHBondContact O-N 2.98Å; E323-F326 VanDerWaalsContact O-N 3.14Å; E323-V327 WeakPolarHBondContact O-CG2 3.45Å; E323-V327 PolarHBondContact O-N 2.89Å; E323-I483 HydrophobicContact CG-CG2 4.41Å; E323-S487 WeakPolarHBondContact CG-OG 3.15Å; E323-S487 PolarHBondContact OE1-OG 3.21Å; E323-F491 HydrophobicContact CB-CZ 4.5Å
324	Y	88.6	Confident	87.5	Confident	20 Å²	20	59.6 Å²	59.6	8%	0.078	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-43.3	175	167	-99.6	0	0	0	112	S272 R275 V276 A320 L321 F326 V327 N328	S272-Y324 WeakPolarHBondContact CA-OH 3.45Å; S272-Y324 WeakPolarHBondContact CB-OH 3.47Å; R275-Y324 HydrophobicContact CB-CD2 3.62Å; R275-Y324 HydrophobicContact CB-CE2 3.86Å; R275-Y324 HydrophobicContact CB-CG 4.08Å; R275-Y324 HydrophobicContact CG-CD2 4.17Å; R275-Y324 HydrophobicContact CG-CE2 4.48Å; V276-Y324 HydrophobicContact CG2-CD1 3.94Å; V276-Y324 HydrophobicContact CG2-CE1 3.18Å; A320-Y324 PolarHBondContact O-N 3.05Å; L321-Y324 PolarHBondContact O-N 3.25Å; Y324-F326 VanDerWaalsContact C-N 3.26Å; Y324-F326 PolarHBondContact O-N 3.49Å; Y324-V327 PolarHBondContact O-N 3.27Å; Y324-N328 HydrophobicContact CE1-CB 4.37Å; Y324-N328 HydrophobicContact CE2-CB 4.31Å; Y324-N328 VanDerWaalsContact O-CB 3.23Å; Y324-N328 WeakPolarHBondContact O-CB 3.23Å; Y324-N328 PolarHBondContact O-N 3.04Å
325	A	89.2	Confident	86.1	Confident	48 Å²	48	58.2 Å²	58.2	40%	0.397	29%	0.29	S	S	.	.	H	α-helix	trans	-60.5	-37.2	177.5	0	0	0	0	0	112.1	L321 L322 E323 Y329	L321-A325 PolarHBondContact O-N 2.96Å; L321-A325 VanDerWaalsContact O-N 3.16Å; L322-A325 PolarHBondContact O-N 2.91Å; E323-A325 VanDerWaalsContact C-N 3.34Å; E323-A325 PolarHBondContact O-N 3.23Å; A325-Y329 VanDerWaalsContact O-CB 3.3Å; A325-Y329 WeakPolarHBondContact O-CB 3.37Å; A325-Y329 PolarHBondContact O-N 2.77Å
326	F	88.6	Confident	84.5	Confident	115 Å²	115	57.9 Å²	57.9	50%	0.504	29%	0.289	S	S	.	.	H	α-helix	trans	-70	-44.7	176.3	-176	-105.1	0	0	0	112.5	L322 E323 Y324 Y329 I330 I483	L322-F326 WeakPolarHBondContact O-CB 3.22Å; L322-F326 PolarHBondContact O-N 3.32Å; E323-F326 WeakPolarHBondContact O-CB 3.42Å; E323-F326 PolarHBondContact O-N 2.98Å; E323-F326 VanDerWaalsContact O-N 3.14Å; Y324-F326 VanDerWaalsContact C-N 3.26Å; Y324-F326 PolarHBondContact O-N 3.49Å; F326-Y329 PolarHBondContact O-N 3.39Å; F326-I330 HydrophobicContact CD1-CD1 3.95Å; F326-I330 HydrophobicContact CE1-CD1 3.42Å; F326-I330 VanDerWaalsContact CE1-CD1 3.42Å; F326-I330 HydrophobicContact CE2-CD1 4.18Å; F326-I330 HydrophobicContact CZ-CD1 3.57Å; F326-I330 PolarHBondContact O-N 3.2Å; F326-I483 HydrophobicContact CD1-CD1 4.22Å; F326-I483 HydrophobicContact CE1-CD1 3.99Å
327	V	86.8	Confident	82.9	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.012	31%	0.31	C	S	.	.	H	α-helix	trans	-55.8	-50.7	172.3	161.7	0	0	0	0	110.8	E323 Y324 Y329 I330 F331 V480 I483	E323-V327 WeakPolarHBondContact O-CG2 3.45Å; E323-V327 PolarHBondContact O-N 2.89Å; Y324-V327 PolarHBondContact O-N 3.27Å; V327-Y329 PolarHBondContact O-N 3.46Å; V327-I330 PolarHBondContact O-N 3.04Å; V327-F331 WeakPolarHBondContact O-CB 3.28Å; V327-F331 PolarHBondContact O-N 3.32Å; V327-V480 HydrophobicContact CG1-CG1 3.68Å; V327-I483 HydrophobicContact CG2-CB 4.32Å; V327-I483 HydrophobicContact CG2-CD1 4.49Å; V327-I483 HydrophobicContact CG2-CG2 3.86Å
328	N	85.9	Confident	81.2	Confident	54 Å²	54	67.3 Å²	67.3	29%	0.289	33%	0.334	S	S	.	.	H	α-helix	trans	-62.4	-40.4	-179.7	-165.5	50.3	0	0	0	111.9	Y324 F331 F332	Y324-N328 HydrophobicContact CE1-CB 4.37Å; Y324-N328 HydrophobicContact CE2-CB 4.31Å; Y324-N328 VanDerWaalsContact O-CB 3.23Å; Y324-N328 WeakPolarHBondContact O-CB 3.23Å; Y324-N328 PolarHBondContact O-N 3.04Å; N328-F331 PolarHBondContact O-N 3.09Å; N328-F332 PolarHBondContact O-N 3.08Å; N328-F332 WeakPolarHBondContact OD1-CD2 3.43Å; N328-F332 VanDerWaalsContact OD1-CE2 3.24Å; N328-F332 WeakPolarHBondContact OD1-CE2 3.32Å
329	Y	85.4	Confident	79.7	Confident	140 Å²	140	69.5 Å²	69.5	55%	0.549	35%	0.345	S	S	.	.	I	π-helix	trans	-66.8	-40.7	176.3	176.6	-98.5	0	0	0	113.2	A325 F326 V327 G333 R334	A325-Y329 VanDerWaalsContact O-CB 3.3Å; A325-Y329 WeakPolarHBondContact O-CB 3.37Å; A325-Y329 PolarHBondContact O-N 2.77Å; F326-Y329 PolarHBondContact O-N 3.39Å; V327-Y329 PolarHBondContact O-N 3.46Å; Y329-G333 WeakPolarHBondContact O-CA 3.42Å; Y329-G333 PolarHBondContact O-N 3.38Å; Y329-R334 PolarHBondContact O-N 2.96Å
330	I	82.9	Confident	78.4	Confident	45 Å²	45	72.9 Å²	72.9	23%	0.231	36%	0.357	C	S	.	.	I	π-helix	trans	-65	-46.7	175.4	-72.5	176.8	0	0	0	110.2	F326 V327 R334 G335 I483	F326-I330 HydrophobicContact CD1-CD1 3.95Å; F326-I330 HydrophobicContact CE1-CD1 3.42Å; F326-I330 VanDerWaalsContact CE1-CD1 3.42Å; F326-I330 HydrophobicContact CE2-CD1 4.18Å; F326-I330 HydrophobicContact CZ-CD1 3.57Å; F326-I330 PolarHBondContact O-N 3.2Å; V327-I330 PolarHBondContact O-N 3.04Å; I330-R334 WeakPolarHBondContact O-CA 3.5Å; I330-R334 WeakPolarHBondContact O-CB 3.43Å; I330-R334 PolarHBondContact O-N 3.22Å; I330-R334 VanDerWaalsContact O-N 3.15Å; I330-G335 PolarHBondContact O-N 2.99Å; I330-I483 HydrophobicContact CD1-CD1 3.96Å
331	F	77.3	Confident	77.2	Confident	66 Å²	66	78.6 Å²	78.6	29%	0.289	38%	0.381	S	S	.	.	I	π-helix	trans	-65.5	-59.9	-176.9	-172.3	-100.1	0	0	0	112.4	Y269 V327 N328 G335	Y269-F331 HydrophobicContact CD2-CD2 4.38Å; Y269-F331 HydrophobicContact CD2-CE2 4.35Å; Y269-F331 HydrophobicContact CD2-CZ 4.5Å; Y269-F331 AromaticContact CE2-CD2 3.99Å; Y269-F331 HydrophobicContact CE2-CD2 3.99Å; Y269-F331 HydrophobicContact CE2-CE1 4.27Å; Y269-F331 AromaticContact CE2-CE2 3.56Å; Y269-F331 HydrophobicContact CE2-CE2 3.56Å; Y269-F331 AromaticContact CE2-CZ 3.72Å; Y269-F331 HydrophobicContact CE2-CZ 3.72Å; V327-F331 WeakPolarHBondContact O-CB 3.28Å; V327-F331 PolarHBondContact O-N 3.32Å; N328-F331 PolarHBondContact O-N 3.09Å; F331-G335 VanDerWaalsContact O-CA 3.27Å; F331-G335 WeakPolarHBondContact O-CA 3.36Å; F331-G335 PolarHBondContact O-N 2.78Å; F331-G335 VanDerWaalsContact O-N 3.17Å
332	F	74.8	Confident	76.1	Confident	130 Å²	130	80.2 Å²	80.2	57%	0.57	39%	0.39	S	S	*	.	I	π-helix	trans	-83.3	-30.4	-176.9	-68.5	-77.2	0	0	0	114.1	N328 P336	N328-F332 PolarHBondContact O-N 3.08Å; N328-F332 WeakPolarHBondContact OD1-CD2 3.43Å; N328-F332 VanDerWaalsContact OD1-CE2 3.24Å; N328-F332 WeakPolarHBondContact OD1-CE2 3.32Å; F332-P336 WeakPolarHBondContact O-CD 3.46Å; F332-P336 WeakPolarHBondContact O-CG 3.42Å
333	G	68.9	Low	75.1	Confident	26 Å²	26	79.2 Å²	79.2	27%	0.268	39%	0.393	S	S	.	.	I	π-helix	trans	-83.1	-46.4	-177.9	0	0	0	0	0	113.3	Y329	Y329-G333 WeakPolarHBondContact O-CA 3.42Å; Y329-G333 PolarHBondContact O-N 3.38Å
334	R	65.8	Low	74.4	Confident	149 Å²	149	82.8 Å²	82.8	56%	0.562	41%	0.41	S	S	*	.	I	π-helix	trans	-96.6	-29.4	-179.2	-71.3	-173.5	172.4	-176.7	-0.3	114	Y329 I330 Q337 M338	Y329-R334 PolarHBondContact O-N 2.96Å; I330-R334 WeakPolarHBondContact O-CA 3.5Å; I330-R334 WeakPolarHBondContact O-CB 3.43Å; I330-R334 PolarHBondContact O-N 3.22Å; I330-R334 VanDerWaalsContact O-N 3.15Å; R334-Q337 PolarHBondContact O-N 2.79Å; R334-M338 PolarHBondContact O-N 3.21Å
335	G	65.4	Low	73.9	Confident	25 Å²	25	88.9 Å²	88.9	26%	0.258	44%	0.437	S	S	.	.	H	α-helix	trans	-52	-58.5	178.5	0	0	0	0	0	113.6	I330 F331 Q337 M338 Q339	I330-G335 PolarHBondContact O-N 2.99Å; F331-G335 VanDerWaalsContact O-CA 3.27Å; F331-G335 WeakPolarHBondContact O-CA 3.36Å; F331-G335 PolarHBondContact O-N 2.78Å; F331-G335 VanDerWaalsContact O-N 3.17Å; G335-Q337 VanDerWaalsContact C-N 3.29Å; G335-Q337 PolarHBondContact O-N 2.68Å; G335-M338 PolarHBondContact O-N 3.41Å; G335-Q339 WeakPolarHBondContact O-CG 3.44Å; G335-Q339 PolarHBondContact O-N 3.41Å
336	P	63.6	Low	73.4	Confident	60 Å²	60	88.9 Å²	88.9	39%	0.39	44%	0.437	S	S	.	.	H	α-helix	trans	-61.8	-33.7	179.2	-24.8	35.2	0	0	0	113.4	F332 K340	F332-P336 WeakPolarHBondContact O-CD 3.46Å; F332-P336 WeakPolarHBondContact O-CG 3.42Å; P336-K340 WeakPolarHBondContact O-CG 3.49Å; P336-K340 PolarHBondContact O-N 2.78Å
337	Q	61.2	Low	72.9	Confident	119 Å²	119	89.1 Å²	89.1	56%	0.556	44%	0.439	S	S	*	.	H	α-helix	trans	-71	-37	176.9	-63.6	-168.8	12	0	0	112.4	R334 G335 K341	R334-Q337 PolarHBondContact O-N 2.79Å; G335-Q337 VanDerWaalsContact C-N 3.29Å; G335-Q337 PolarHBondContact O-N 2.68Å; Q337-K341 WeakPolarHBondContact O-CB 3.42Å; Q337-K341 WeakPolarHBondContact O-CG 3.5Å; Q337-K341 PolarHBondContact O-N 2.94Å; Q337-K341 VanDerWaalsContact O-N 3.14Å
338	M	59.4	Low	72.7	Confident	103 Å²	103	95.6 Å²	95.6	51%	0.507	47%	0.467	S	S	.	.	H	α-helix	trans	-70.3	-41.6	172.7	-89.8	-171.2	61.7	0	0	111.9	R334 G335 K341 L342 P475	R334-M338 PolarHBondContact O-N 3.21Å; G335-M338 PolarHBondContact O-N 3.41Å; M338-K341 PolarHBondContact O-N 2.93Å; M338-L342 WeakPolarHBondContact O-CB 3.24Å; M338-L342 WeakPolarHBondContact O-CG 3.37Å; M338-L342 PolarHBondContact O-N 2.74Å; M338-P475 HydrophobicContact CE-CG 3.92Å
339	Q	63.6	Low	72.4	Confident	139 Å²	139	95.4 Å²	95.4	65%	0.65	47%	0.473	S	S	*	.	H	α-helix	trans	-59.6	-46.2	175.5	-74.7	178.1	-10.4	0	0	111.6	G335 K341 L342 A343	G335-Q339 WeakPolarHBondContact O-CG 3.44Å; G335-Q339 PolarHBondContact O-N 3.41Å; Q339-K341 PolarHBondContact O-N 2.85Å; Q339-L342 PolarHBondContact O-N 3.36Å; Q339-A343 WeakPolarHBondContact O-CB 3.32Å; Q339-A343 PolarHBondContact O-N 3.26Å
340	K	67.7	Low	72.1	Confident	146 Å²	146	93.7 Å²	93.7	64%	0.635	47%	0.474	S	S	*	.	H	α-helix	trans	-58.3	-48.2	173.2	-73.6	-176.7	-179.6	-172.8	0	112.2	P336 L342 A343 E344	P336-K340 WeakPolarHBondContact O-CG 3.49Å; P336-K340 PolarHBondContact O-N 2.78Å; K340-L342 VanDerWaalsContact C-N 3.27Å; K340-L342 PolarHBondContact O-N 3.42Å; K340-A343 PolarHBondContact O-N 3.03Å; K340-E344 WeakPolarHBondContact O-CG 3.44Å; K340-E344 PolarHBondContact O-N 3.25Å
341	K	68.4	Low	72	Confident	125 Å²	125	95.9 Å²	95.9	54%	0.543	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-26.7	177.2	-75.5	174.9	178.9	172.8	0	114	Q337 M338 Q339 K345	Q337-K341 WeakPolarHBondContact O-CB 3.42Å; Q337-K341 WeakPolarHBondContact O-CG 3.5Å; Q337-K341 PolarHBondContact O-N 2.94Å; Q337-K341 VanDerWaalsContact O-N 3.14Å; M338-K341 PolarHBondContact O-N 2.93Å; Q339-K341 PolarHBondContact O-N 2.85Å; K341-K345 WeakPolarHBondContact O-CD 3.36Å; K341-K345 VanDerWaalsContact O-CG 3.25Å; K341-K345 WeakPolarHBondContact O-CG 3.46Å; K341-K345 PolarHBondContact O-N 3.19Å
342	L	69	Low	72.1	Confident	75 Å²	75	97.3 Å²	97.3	39%	0.393	49%	0.493	S	S	.	.	H	α-helix	trans	-79.3	-42.1	174.4	-77	163.4	0	0	0	111.2	M338 Q339 K340 K345 A346 P475	M338-L342 WeakPolarHBondContact O-CB 3.24Å; M338-L342 WeakPolarHBondContact O-CG 3.37Å; M338-L342 PolarHBondContact O-N 2.74Å; Q339-L342 PolarHBondContact O-N 3.36Å; K340-L342 VanDerWaalsContact C-N 3.27Å; K340-L342 PolarHBondContact O-N 3.42Å; L342-K345 PolarHBondContact O-N 2.97Å; L342-A346 WeakPolarHBondContact O-CB 3.43Å; L342-A346 PolarHBondContact O-N 3.14Å; L342-P475 HydrophobicContact CD1-CG 4.23Å
343	A	72.3	Confident	72.2	Confident	59 Å²	59	99.2 Å²	99.2	49%	0.488	50%	0.497	S	S	.	.	H	α-helix	trans	-59.9	-49.8	173.6	0	0	0	0	0	111.4	Q339 K340 K345 A346 E347	Q339-A343 WeakPolarHBondContact O-CB 3.32Å; Q339-A343 PolarHBondContact O-N 3.26Å; K340-A343 PolarHBondContact O-N 3.03Å; A343-K345 PolarHBondContact O-N 3.34Å; A343-A346 PolarHBondContact O-N 2.97Å; A343-A346 VanDerWaalsContact O-N 3.09Å; A343-E347 WeakPolarHBondContact O-CB 3.3Å; A343-E347 PolarHBondContact O-N 3.38Å
344	E	77.7	Confident	72.6	Confident	93 Å²	93	100.1 Å²	100.1	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-57.5	-35.2	175.2	-73.6	173.1	-151.7	0	0	113	K340 K348	K340-E344 WeakPolarHBondContact O-CG 3.44Å; K340-E344 PolarHBondContact O-N 3.25Å; E344-K348 WeakPolarHBondContact O-CB 3.48Å; E344-K348 WeakPolarHBondContact O-CD 3.45Å; E344-K348 VanDerWaalsContact O-CG 3.24Å; E344-K348 WeakPolarHBondContact O-CG 3.23Å; E344-K348 PolarHBondContact O-N 2.96Å
345	K	78.8	Confident	73.1	Confident	148 Å²	148	95.9 Å²	95.9	64%	0.643	50%	0.499	S	S	*	.	H	α-helix	trans	-73.5	-38.9	176.1	-79.6	175.9	-179.9	-178.9	0	112	K341 L342 A343 A349	K341-K345 WeakPolarHBondContact O-CD 3.36Å; K341-K345 VanDerWaalsContact O-CG 3.25Å; K341-K345 WeakPolarHBondContact O-CG 3.46Å; K341-K345 PolarHBondContact O-N 3.19Å; L342-K345 PolarHBondContact O-N 2.97Å; A343-K345 PolarHBondContact O-N 3.34Å; K345-A349 WeakPolarHBondContact O-CB 3.45Å; K345-A349 PolarHBondContact O-N 3.34Å
346	A	77.3	Confident	73.6	Confident	48 Å²	48	100 Å²	100	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-66.4	-42.5	175.3	0	0	0	0	0	111.3	L342 A343 A349 N350	L342-A346 WeakPolarHBondContact O-CB 3.43Å; L342-A346 PolarHBondContact O-N 3.14Å; A343-A346 PolarHBondContact O-N 2.97Å; A343-A346 VanDerWaalsContact O-N 3.09Å; A346-A349 PolarHBondContact O-N 3Å; A346-N350 WeakPolarHBondContact O-CB 3.43Å; A346-N350 PolarHBondContact O-N 3.32Å
347	E	79.3	Confident	73.9	Confident	120 Å²	120	105.7 Å²	105.7	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-62.6	-48.4	175.6	-167	-168.2	157.1	0	0	111.4	A343 A349 N350 N351	A343-E347 WeakPolarHBondContact O-CB 3.3Å; A343-E347 PolarHBondContact O-N 3.38Å; E347-A349 VanDerWaalsContact C-N 3.3Å; E347-A349 PolarHBondContact O-N 2.87Å; E347-N350 WeakPolarHBondContact O-CB 3.5Å; E347-N350 PolarHBondContact O-N 2.9Å; E347-N351 PolarHBondContact O-N 3.16Å
348	K	81.2	Confident	74.4	Confident	137 Å²	137	104.6 Å²	104.6	60%	0.596	52%	0.522	S	S	*	.	H	α-helix	trans	-58.4	-40.8	173.8	-76	168.4	-176.8	165.1	0	112.2	E344 N350 N351 E352	E344-K348 WeakPolarHBondContact O-CB 3.48Å; E344-K348 WeakPolarHBondContact O-CD 3.45Å; E344-K348 VanDerWaalsContact O-CG 3.24Å; E344-K348 WeakPolarHBondContact O-CG 3.23Å; E344-K348 PolarHBondContact O-N 2.96Å; K348-N350 VanDerWaalsContact C-N 3.33Å; K348-N350 PolarHBondContact O-N 3.41Å; K348-N351 PolarHBondContact O-N 3.44Å; K348-E352 WeakPolarHBondContact O-CB 3.47Å; K348-E352 WeakPolarHBondContact O-CG 3.33Å; K348-E352 PolarHBondContact O-N 3.48Å
349	A	79.8	Confident	74.8	Confident	50 Å²	50	102.4 Å²	102.4	41%	0.413	52%	0.52	S	S	.	.	H	α-helix	trans	-67.5	-31.5	175.6	0	0	0	0	0	113.1	K345 A346 E347 R353	K345-A349 WeakPolarHBondContact O-CB 3.45Å; K345-A349 PolarHBondContact O-N 3.34Å; A346-A349 PolarHBondContact O-N 3Å; E347-A349 VanDerWaalsContact C-N 3.3Å; E347-A349 PolarHBondContact O-N 2.87Å; A349-R353 WeakPolarHBondContact O-CG 3.21Å; A349-R353 PolarHBondContact O-N 3.37Å
350	N	79.8	Confident	74.9	Confident	105 Å²	105	98.8 Å²	98.8	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-72.6	-45.9	174.7	-163.2	32	0	0	0	111.4	A346 E347 K348 E352 R353 A354	A346-N350 WeakPolarHBondContact O-CB 3.43Å; A346-N350 PolarHBondContact O-N 3.32Å; E347-N350 WeakPolarHBondContact O-CB 3.5Å; E347-N350 PolarHBondContact O-N 2.9Å; K348-N350 VanDerWaalsContact C-N 3.33Å; K348-N350 PolarHBondContact O-N 3.41Å; N350-E352 VanDerWaalsContact C-N 3.3Å; N350-E352 PolarHBondContact O-N 3.05Å; N350-R353 CarbonylContact O-C 3.6Å; N350-R353 WeakPolarHBondContact O-CA 3.41Å; N350-R353 WeakPolarHBondContact O-CB 3.41Å; N350-R353 PolarHBondContact O-N 2.7Å; N350-A354 PolarHBondContact O-N 3.03Å
351	N	80.2	Confident	74.8	Confident	90 Å²	90	101.4 Å²	101.4	48%	0.481	52%	0.52	S	S	.	.	H	α-helix	trans	-62.2	-37.4	176.2	-67.2	-10.9	0	0	0	111.4	E347 K348 R353 A354 A355	E347-N351 PolarHBondContact O-N 3.16Å; K348-N351 PolarHBondContact O-N 3.44Å; N351-R353 VanDerWaalsContact C-N 3.31Å; N351-R353 PolarHBondContact O-N 3.09Å; N351-A354 PolarHBondContact O-N 3.16Å; N351-A355 WeakPolarHBondContact O-CB 3.27Å; N351-A355 PolarHBondContact O-N 3.1Å
352	E	80.1	Confident	74.4	Confident	97 Å²	97	101.2 Å²	101.2	45%	0.453	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-26.3	170.7	-84.1	-156.4	-169	0	0	114.6	K348 N350 K356 R465	K348-E352 WeakPolarHBondContact O-CB 3.47Å; K348-E352 WeakPolarHBondContact O-CG 3.33Å; K348-E352 PolarHBondContact O-N 3.48Å; N350-E352 VanDerWaalsContact C-N 3.3Å; N350-E352 PolarHBondContact O-N 3.05Å; E352-K356 WeakPolarHBondContact O-CD 3.18Å; E352-K356 WeakPolarHBondContact O-CG 3.11Å; E352-R465 IonicContact OE1-NH2 2.75Å; E352-R465 PolarHBondContact OE1-NH2 2.64Å; E352-R465 IonicContact OE2-CZ 2.74Å; E352-R465 IonicContact OE2-NH1 2.71Å; E352-R465 IonicContact OE2-NH2 3.61Å; E352-R465 PolarHBondContact OE2-NH2 3.26Å
353	R	77.8	Confident	73.9	Confident	170 Å²	170	100.4 Å²	100.4	64%	0.642	53%	0.526	S	S	*	.	H	α-helix	trans	-76.6	-48.8	172.1	-78.9	177.2	174.4	-176.4	-1	110.2	A349 N350 N351 A355 K356 Y357	A349-R353 WeakPolarHBondContact O-CG 3.21Å; A349-R353 PolarHBondContact O-N 3.37Å; N350-R353 CarbonylContact O-C 3.6Å; N350-R353 WeakPolarHBondContact O-CA 3.41Å; N350-R353 WeakPolarHBondContact O-CB 3.41Å; N350-R353 PolarHBondContact O-N 2.7Å; N351-R353 VanDerWaalsContact C-N 3.31Å; N351-R353 PolarHBondContact O-N 3.09Å; R353-A355 PolarHBondContact O-N 2.7Å; R353-K356 WeakPolarHBondContact O-CB 3.24Å; R353-K356 PolarHBondContact O-N 3.34Å; R353-Y357 VanDerWaalsContact O-CD2 3.32Å; R353-Y357 WeakPolarHBondContact O-CD2 3.49Å; R353-Y357 PolarHBondContact O-N 3.26Å
354	A	75.9	Confident	73	Confident	44 Å²	44	99.5 Å²	99.5	36%	0.364	52%	0.522	S	S	.	.	H	α-helix	trans	-53.5	-51.8	176.9	0	0	0	0	0	111.5	N350 N351 K356 Y357 D358	N350-A354 PolarHBondContact O-N 3.03Å; N351-A354 PolarHBondContact O-N 3.16Å; A354-K356 PolarHBondContact O-N 3.23Å; A354-K356 VanDerWaalsContact O-N 3.09Å; A354-Y357 WeakPolarHBondContact O-CA 3.45Å; A354-Y357 WeakPolarHBondContact O-CB 3.12Å; A354-Y357 PolarHBondContact O-N 3.48Å; A354-D358 PolarHBondContact O-N 3.41Å
355	A	76.7	Confident	71.8	Confident	61 Å²	61	99 Å²	99	50%	0.504	53%	0.529	S	S	.	.	H	α-helix	trans	-59.6	-25.6	177.6	0	0	0	0	0	114.3	N351 R353 A359	N351-A355 WeakPolarHBondContact O-CB 3.27Å; N351-A355 PolarHBondContact O-N 3.1Å; R353-A355 PolarHBondContact O-N 2.7Å; A355-A359 VanDerWaalsContact O-CB 3.28Å; A355-A359 WeakPolarHBondContact O-CB 3.28Å; A355-A359 PolarHBondContact O-N 3.06Å
356	K	76.3	Confident	70.5	Confident	110 Å²	110	100.6 Å²	100.6	48%	0.478	53%	0.531	S	S	.	.	H	α-helix	trans	-78.3	-37.5	171.8	-75.9	171.1	-176.1	162.4	0	112.6	E352 R353 A354 A360	E352-K356 WeakPolarHBondContact O-CD 3.18Å; E352-K356 WeakPolarHBondContact O-CG 3.11Å; R353-K356 WeakPolarHBondContact O-CB 3.24Å; R353-K356 PolarHBondContact O-N 3.34Å; A354-K356 PolarHBondContact O-N 3.23Å; A354-K356 VanDerWaalsContact O-N 3.09Å; K356-A360 WeakPolarHBondContact O-CB 3.49Å; K356-A360 PolarHBondContact O-N 2.91Å
357	Y	69.8	Low	69.1	Low	180 Å²	180	103.8 Å²	103.8	71%	0.706	55%	0.545	S	S	*	.	H	α-helix	trans	-64.3	-43.7	174.5	-84.3	-77	0	0	0	111	R353 A354 A360 R361	R353-Y357 VanDerWaalsContact O-CD2 3.32Å; R353-Y357 WeakPolarHBondContact O-CD2 3.49Å; R353-Y357 PolarHBondContact O-N 3.26Å; A354-Y357 WeakPolarHBondContact O-CA 3.45Å; A354-Y357 WeakPolarHBondContact O-CB 3.12Å; A354-Y357 PolarHBondContact O-N 3.48Å; Y357-A360 PolarHBondContact O-N 3.11Å; Y357-R361 PolarHBondContact O-N 2.98Å
358	D	70.9	Confident	67.6	Low	96 Å²	96	101.9 Å²	101.9	51%	0.513	55%	0.55	S	S	.	*	H	α-helix	trans	-65.4	-43.9	176.8	-67.1	-40.1	0	0	0	112	A354 A360 R361 E362	A354-D358 PolarHBondContact O-N 3.41Å; D358-A360 VanDerWaalsContact C-N 3.28Å; D358-A360 PolarHBondContact O-N 2.66Å; D358-R361 WeakPolarHBondContact O-CB 3.35Å; D358-R361 PolarHBondContact O-N 3.07Å; D358-E362 PolarHBondContact O-N 3.2Å
359	A	68.2	Low	65.9	Low	57 Å²	57	100.6 Å²	100.6	47%	0.471	56%	0.559	S	S	.	*	H	α-helix	trans	-61.6	-34.1	174.5	0	0	0	0	0	113.1	A355 A363	A355-A359 VanDerWaalsContact O-CB 3.28Å; A355-A359 WeakPolarHBondContact O-CB 3.28Å; A355-A359 PolarHBondContact O-N 3.06Å; A359-A363 WeakPolarHBondContact O-CB 3.37Å; A359-A363 PolarHBondContact O-N 3.24Å; A359-A363 VanDerWaalsContact O-N 3.11Å
360	A	66.7	Low	64.3	Low	63 Å²	63	105.6 Å²	105.6	52%	0.521	58%	0.578	S	S	.	*	H	α-helix	trans	-69.8	-36.1	172.7	0	0	0	0	0	112	K356 Y357 D358 A363 G364	K356-A360 WeakPolarHBondContact O-CB 3.49Å; K356-A360 PolarHBondContact O-N 2.91Å; Y357-A360 PolarHBondContact O-N 3.11Å; D358-A360 VanDerWaalsContact C-N 3.28Å; D358-A360 PolarHBondContact O-N 2.66Å; A360-A363 PolarHBondContact O-N 3.05Å; A360-G364 PolarHBondContact O-N 3.24Å
361	R	65.3	Low	62.3	Low	201 Å²	201	110.2 Å²	110.2	76%	0.758	59%	0.593	S	S	*	*	H	α-helix	trans	-67.4	-41.4	176.5	-153.3	172.8	90	146.3	4	112	Y357 D358 G364 S365	Y357-R361 PolarHBondContact O-N 2.98Å; D358-R361 WeakPolarHBondContact O-CB 3.35Å; D358-R361 PolarHBondContact O-N 3.07Å; R361-G364 PolarHBondContact O-N 2.88Å; R361-S365 PolarHBondContact O-N 3.15Å
362	E	59.6	Low	60.2	Low	121 Å²	121	117.2 Å²	117.2	57%	0.565	61%	0.612	S	S	*	*	H	α-helix	trans	-64.5	-39.4	172.4	-71.6	-159.7	150.7	0	0	112.7	D358 S365 R366	D358-E362 PolarHBondContact O-N 3.2Å; E362-S365 PolarHBondContact O-N 3.31Å; E362-R366 PolarHBondContact O-N 3.31Å; E362-R366 IonicContact OE2-NH2 3.87Å
363	A	57.9	Low	58	Low	59 Å²	59	117 Å²	117	49%	0.488	62%	0.622	S	S	.	*	H	α-helix	trans	-63	-43.6	176.9	0	0	0	0	0	111.9	A359 A360 S365 R366 T367	A359-A363 WeakPolarHBondContact O-CB 3.37Å; A359-A363 PolarHBondContact O-N 3.24Å; A359-A363 VanDerWaalsContact O-N 3.11Å; A360-A363 PolarHBondContact O-N 3.05Å; A363-S365 VanDerWaalsContact C-N 3.33Å; A363-S365 PolarHBondContact O-N 3.17Å; A363-R366 PolarHBondContact O-N 3.3Å; A363-T367 PolarHBondContact O-N 2.89Å; A363-T367 PolarHBondContact O-OG1 2.97Å
364	G	54.7	Low	55.9	Low	40 Å²	40	116.4 Å²	116.4	41%	0.412	63%	0.631	S	S	.	*	H	α-helix	trans	-62.3	-36.6	176.1	0	0	0	0	0	113.6	A360 R361 T367 A368	A360-G364 PolarHBondContact O-N 3.24Å; R361-G364 PolarHBondContact O-N 2.88Å; G364-T367 PolarHBondContact O-N 3.43Å; G364-T367 PolarHBondContact O-OG1 3.49Å; G364-A368 PolarHBondContact O-N 2.91Å
365	S	52.5	Low	53.9	Low	83 Å²	83	123.7 Å²	123.7	58%	0.58	66%	0.658	S	S	*	*	H	α-helix	trans	-64.4	-40.5	176.7	-171.8	0	0	0	0	112.4	R361 E362 A363 T367 A368	R361-S365 PolarHBondContact O-N 3.15Å; E362-S365 PolarHBondContact O-N 3.31Å; A363-S365 VanDerWaalsContact C-N 3.33Å; A363-S365 PolarHBondContact O-N 3.17Å; S365-T367 VanDerWaalsContact C-N 3.3Å; S365-T367 PolarHBondContact O-N 3.08Å; S365-A368 PolarHBondContact O-N 3.3Å; S365-A368 VanDerWaalsContact O-N 3.13Å
366	R	50.5	Low	51.9	Low	181 Å²	181	126.6 Å²	126.6	68%	0.683	67%	0.669	S	S	*	*	H	α-helix	trans	-67.3	-26.9	179	-67.6	-178.5	-169	166.5	11.5	113.6	E362 A363	E362-R366 PolarHBondContact O-N 3.31Å; E362-R366 IonicContact OE2-NH2 3.87Å; A363-R366 PolarHBondContact O-N 3.3Å
367	T	48.5	Very low	49.8	Very low	114 Å²	114	131 Å²	131	70%	0.699	69%	0.688	S	S	*	*	H	α-helix	trans	-76.3	-21.6	172.8	35	0	0	0	0	114.3	A363 G364 S365	A363-T367 PolarHBondContact O-N 2.89Å; A363-T367 PolarHBondContact O-OG1 2.97Å; G364-T367 PolarHBondContact O-N 3.43Å; G364-T367 PolarHBondContact O-OG1 3.49Å; S365-T367 VanDerWaalsContact C-N 3.3Å; S365-T367 PolarHBondContact O-N 3.08Å
368	A	47.6	Very low	47.9	Very low	80 Å²	80	126.1 Å²	126.1	66%	0.661	69%	0.693	S	S	*	*	H	α-helix	trans	-78.3	-22.8	179.6	0	0	0	0	0	113.5	G364 S365 L370	G364-A368 PolarHBondContact O-N 2.91Å; S365-A368 PolarHBondContact O-N 3.3Å; S365-A368 VanDerWaalsContact O-N 3.13Å; A368-L370 VanDerWaalsContact C-N 3.34Å; A368-L370 PolarHBondContact O-N 3.02Å
369	S	44.6	Very low	46	Very low	111 Å²	111	128.6 Å²	128.6	78%	0.776	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	4.7	-173.5	-165.1	0	0	0	0	115.4
370	L	47.6	Very low	44.3	Very low	155 Å²	155	136.5 Å²	136.5	81%	0.812	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	15	-167.8	-120	152.8	0	0	0	115.3	A368	A368-L370 VanDerWaalsContact C-N 3.34Å; A368-L370 PolarHBondContact O-N 3.02Å
371	K	37.7	Very low	42.5	Very low	201 Å²	201	141.8 Å²	141.8	87%	0.874	74%	0.736	S	S	*	*			trans	-115.9	102	165.3	-88.3	-173.1	172.7	-177.9	0	112.1
372	R	35.9	Very low	40.7	Very low	237 Å²	237	136.9 Å²	136.9	89%	0.894	73%	0.733	S	S	*	*			trans	-43.4	135.6	160.3	-96.5	-179.8	164.8	177.7	-5.7	110.9
373	S	33.3	Very low	39.1	Very low	93 Å²	93	143.3 Å²	143.3	65%	0.65	75%	0.752	S	S	*	*				74.6	126.9	74.4	-174.7	0	0	0	0	113.2
374	N	34	Very low	37.6	Very low	157 Å²	157	145.5 Å²	145.5	84%	0.84	76%	0.764	S	S	*	*			trans	76	101.1	172.4	-57.2	-3.9	0	0	0	118.1
375	Q	33.8	Very low	36.3	Very low	198 Å²	198	148.2 Å²	148.2	93%	0.925	78%	0.782	S	S	*	*				-161.3	-177.1	91.2	-139.4	176.1	1.7	0	0	111.1
376	V	34.8	Very low	35.2	Very low	122 Å²	122	152.1 Å²	152.1	74%	0.739	79%	0.792	S	S	*	*			trans	-125.7	136.5	-147	164.4	0	0	0	0	114.3
377	K	31.5	Very low	34.5	Very low	202 Å²	202	149 Å²	149	88%	0.878	80%	0.795	S	S	*	*			trans	44.9	121.3	156.7	-69.4	171.7	179.5	178.2	0	120.9
378	G	31.2	Very low	33.5	Very low	78 Å²	78	152 Å²	152	80%	0.804	80%	0.801	S	S	*	*			trans	-142.1	148.1	149.1	0	0	0	0	0	109.3
379	L	31.3	Very low	32.6	Very low	148 Å²	148	151.7 Å²	151.7	78%	0.775	80%	0.804	S	S	*	*			trans	-100.4	143.6	-162.9	-125.1	73.8	0	0	0	114.4
380	R	31.2	Very low	32	Very low	222 Å²	222	156.1 Å²	156.1	84%	0.838	81%	0.813	S	S	*	*			trans	35.3	143.8	146	-66	175.3	-177.1	-175	1.1	119.4
381	H	28.9	Very low	31.2	Very low	175 Å²	175	152 Å²	152	81%	0.81	81%	0.807	S	S	*	*			cis	-156	174.4	38.5	-155.3	33.7	0	0	0	113.5
382	S	27.2	Very low	31	Very low	98 Å²	98	149.7 Å²	149.7	69%	0.685	81%	0.805	S	S	*	*			trans	-95.2	157.2	-157.4	-41.1	0	0	0	0	115.9
383	R	27.5	Very low	30.8	Very low	255 Å²	255	146 Å²	146	96%	0.962	80%	0.801	S	S	*	*				-153.5	149	127.8	-108.3	171.6	-161.1	-163.7	4.6	112
384	S	25.8	Very low	30.6	Very low	105 Å²	105	148.4 Å²	148.4	73%	0.734	81%	0.806	S	S	*	*			trans	-72.1	145.5	-160.6	-173.2	0	0	0	0	115.9
385	A	27.7	Very low	30.3	Very low	98 Å²	98	149.5 Å²	149.5	81%	0.81	81%	0.81	S	S	*	*			trans	-149.1	117.6	149.6	0	0	0	0	0	108.6
386	E	29.6	Very low	30	Very low	165 Å²	165	145.2 Å²	145.2	77%	0.771	80%	0.798	S	S	*	*			trans	-94.8	139.7	-179.9	-77.3	-172.6	130.6	0	0	112.6
387	P	34.6	Very low	29.8	Very low	115 Å²	115	145.5 Å²	145.5	75%	0.747	80%	0.8	S	S	*	*			trans	-110.7	118.9	173.2	36.3	-26.6	0	0	0	113.2
388	H	27.4	Very low	29.6	Very low	178 Å²	178	143.4 Å²	143.4	82%	0.824	80%	0.798	S	S	*	*			trans	-130.4	140.6	158.3	-63.4	-31.1	0	0	0	106.6
389	G	30.1	Very low	29.5	Very low	72 Å²	72	147.4 Å²	147.4	74%	0.742	80%	0.796	S	S	*	*			cis	139	90.6	18.2	0	0	0	0	0	106.4	G391	G389-G391 PolarHBondContact O-N 3.25Å
390	H	31.7	Very low	29.5	Very low	205 Å²	205	147.5 Å²	147.5	95%	0.949	80%	0.795	S	S	*	*			trans	-69.1	101.9	-179.4	-93.1	-50.3	0	0	0	110.6
391	G	29.8	Very low	29.2	Very low	68 Å²	68	144 Å²	144	70%	0.701	79%	0.788	S	S	*	*			trans	-107.3	121.3	163.9	0	0	0	0	0	110.1	G389	G389-G391 PolarHBondContact O-N 3.25Å
392	N	33.1	Very low	29.2	Very low	153 Å²	153	142.7 Å²	142.7	82%	0.818	79%	0.787	S	S	*	*			trans	-76	136.5	165.2	-55.5	-39.1	0	0	0	108.4
393	I	31.5	Very low	29.2	Very low	159 Å²	159	145.9 Å²	145.9	82%	0.815	79%	0.791	S	S	*	*			trans	-159.3	140.1	156.8	-106.7	148	0	0	0	110.2
394	L	29.8	Very low	29.3	Very low	143 Å²	143	140.1 Å²	140.1	75%	0.749	78%	0.784	S	S	*	*			trans	25.1	111.7	171.4	-78.4	85.5	0	0	0	118.8
395	L	27.3	Very low	29.4	Very low	180 Å²	180	139.9 Å²	139.9	94%	0.942	79%	0.789	S	S	*	*			trans	-81.8	114.6	140.2	-160.8	77.7	0	0	0	107.5
396	T	27.7	Very low	29.4	Very low	109 Å²	109	139 Å²	139	67%	0.669	79%	0.79	S	S	*	*			trans	-61.7	146.2	177.3	-21.4	0	0	0	0	110.8	L398	T396-L398 PolarHBondContact O-N 3.33Å; T396-L398 VanDerWaalsContact O-N 3.1Å
397	T	30.4	Very low	29.2	Very low	127 Å²	127	135 Å²	135	78%	0.779	79%	0.793	S	S	*	*			trans	-60.7	111.9	166.8	37.7	0	0	0	0	109.6	E399	T397-E399 PolarHBondContact O-N 3.46Å; T397-E399 VanDerWaalsContact O-N 3.13Å
398	L	28.9	Very low	28.8	Very low	159 Å²	159	138.4 Å²	138.4	83%	0.832	80%	0.798	S	S	*	*			trans	-78.2	93.9	170.7	-123.5	165.9	0	0	0	108.1	T396 I400	T396-L398 PolarHBondContact O-N 3.33Å; T396-L398 VanDerWaalsContact O-N 3.1Å; L398-I400 PolarHBondContact O-N 3.01Å
399	E	27.5	Very low	28.9	Very low	162 Å²	162	136.9 Å²	136.9	76%	0.757	80%	0.795	S	S	*	*			trans	-62.6	118.2	162.3	-69.1	178.8	142.5	0	0	108.2	T397	T397-E399 PolarHBondContact O-N 3.46Å; T397-E399 VanDerWaalsContact O-N 3.13Å
400	I	31.3	Very low	28.8	Very low	149 Å²	149	139.3 Å²	139.3	76%	0.764	80%	0.795	S	S	*	*			trans	-94.7	93.5	164.3	-62.9	-179.8	0	0	0	106.6	L398	L398-I400 PolarHBondContact O-N 3.01Å
401	H	25.9	Very low	28.6	Very low	148 Å²	148	135.2 Å²	135.2	69%	0.685	79%	0.785	S	S	*	*			trans	-56.5	133.6	157.3	-113	-96.9	0	0	0	108.3
402	N	29.1	Very low	28.5	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	79%	0.789	S	S	*	*			trans	-133.2	84.9	167.2	-158.2	34	0	0	0	108.9
403	E	26.4	Very low	28.3	Very low	164 Å²	164	136.8 Å²	136.8	77%	0.766	79%	0.791	S	S	*	*			trans	-85.3	110.9	167.9	-71.4	-168	156.2	0	0	109.6
404	V	30.3	Very low	28.2	Very low	134 Å²	134	133.3 Å²	133.3	81%	0.812	79%	0.786	S	S	*	*			trans	-139.9	96.9	146.8	-177.9	0	0	0	0	108.3
405	A	27.9	Very low	28	Very low	101 Å²	101	133.7 Å²	133.7	84%	0.835	79%	0.789	S	S	*	*			trans	-92.2	154.8	146.5	0	0	0	0	0	107.5
406	G	26.3	Very low	28	Very low	80 Å²	80	133 Å²	133	83%	0.825	78%	0.784	S	S	*	*			cis	-176.2	174.9	-2.3	0	0	0	0	0	109.4
407	G	25.9	Very low	28.2	Very low	81 Å²	81	139.2 Å²	139.2	84%	0.835	80%	0.796	S	S	*	*			trans	-176.8	108.5	178.1	0	0	0	0	0	110.7
408	E	26.6	Very low	28.1	Very low	185 Å²	185	140.4 Å²	140.4	86%	0.864	80%	0.797	S	S	*	*			trans	-86	165.7	-168.3	-56.1	174.4	126.4	0	0	113.4
409	I	29.3	Very low	28.1	Very low	147 Å²	147	136.6 Å²	136.6	75%	0.754	78%	0.784	S	S	*	*				175.6	107.8	117.3	-89.1	158.8	0	0	0	111.7
410	T	28.9	Very low	28.1	Very low	122 Å²	122	137.5 Å²	137.5	75%	0.748	79%	0.788	S	S	*	*			trans	58.5	156.2	147.2	69.6	0	0	0	0	121
411	T	27.7	Very low	27.9	Very low	119 Å²	119	136.6 Å²	136.6	73%	0.73	80%	0.795	S	S	*	*			cis	-155.8	152.6	14.3	8.5	0	0	0	0	111
412	S	26	Very low	27.9	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	80%	0.802	S	S	*	*			trans	56.5	152.6	153.5	65.5	0	0	0	0	119.4
413	V	29.6	Very low	27.9	Very low	141 Å²	141	137.1 Å²	137.1	86%	0.855	80%	0.804	S	S	*	*			cis	-136.4	161.7	27.2	170.5	0	0	0	0	111.8
414	A	29.8	Very low	28	Very low	87 Å²	87	136.9 Å²	136.9	72%	0.719	80%	0.803	S	S	*	*			trans	-82	179.7	-168.7	0	0	0	0	0	117.4
415	D	25.6	Very low	27.9	Very low	150 Å²	150	137.2 Å²	137.2	80%	0.802	80%	0.799	S	S	*	*			trans	-57.9	165.7	-174.7	-55.5	-86.8	0	0	0	117.7
416	I	27.8	Very low	27.7	Very low	166 Å²	166	138.7 Å²	138.7	85%	0.851	79%	0.793	S	S	*	*				-166.8	131.3	111.8	-91.4	150.6	0	0	0	110.6
417	R	30.5	Very low	27.8	Very low	240 Å²	240	138.9 Å²	138.9	91%	0.906	78%	0.782	S	S	*	*			trans	-145.9	166.8	160.2	-120.9	-177.4	-177.4	177.8	2	108.5
418	N	28.8	Very low	27.9	Very low	152 Å²	152	141.5 Å²	141.5	81%	0.813	78%	0.782	S	S	*	*			trans	72.2	145.5	-173.4	-90.9	14.8	0	0	0	114.6
419	S	29.2	Very low	27.9	Very low	79 Å²	79	138.2 Å²	138.2	55%	0.552	78%	0.779	S	S	*	*			cis	-153	154.3	17.5	-95.8	0	0	0	0	114.5
420	Q	26.6	Very low	27.9	Very low	181 Å²	181	137.2 Å²	137.2	85%	0.846	79%	0.785	S	S	*	*			trans	52.4	132.1	137.5	-62	169.9	-7.2	0	0	123
421	S	28.2	Very low	27.9	Very low	129 Å²	129	136 Å²	136	90%	0.902	78%	0.781	S	S	*	*				-168.6	161.3	105.2	51.2	0	0	0	0	112.3
422	M	26.3	Very low	27.9	Very low	169 Å²	169	137.3 Å²	137.3	83%	0.833	78%	0.784	S	S	*	*			trans	-146.9	132.7	-172.9	171.1	-124.8	-69.6	0	0	109.2
423	V	29.2	Very low	28.2	Very low	139 Å²	139	140.1 Å²	140.1	84%	0.842	79%	0.789	S	S	*	*			trans	-146.3	150.9	159.2	-176.1	0	0	0	0	109.6
424	Q	27.9	Very low	28	Very low	160 Å²	160	140.8 Å²	140.8	75%	0.748	78%	0.782	S	S	*	*			trans	-77.1	-175.9	-171.1	-53.3	153.2	-94.5	0	0	113.3
425	L	27.8	Very low	28	Very low	140 Å²	140	146.7 Å²	146.7	73%	0.733	79%	0.788	S	S	*	*			cis	-140	-168.9	9.9	-51.5	75.6	0	0	0	109.2
426	D	24.6	Very low	28	Very low	133 Å²	133	151.1 Å²	151.1	71%	0.711	79%	0.793	S	S	*	*			cis	-158.5	166.3	-1.5	-150.9	0.2	0	0	0	115
427	S	27.4	Very low	28	Very low	83 Å²	83	151.9 Å²	151.9	58%	0.58	79%	0.79	S	S	*	*			trans	76.3	123.9	140.9	76.3	0	0	0	0	123.7
428	T	27.2	Very low	27.9	Very low	136 Å²	136	149.4 Å²	149.4	83%	0.834	79%	0.789	S	S	*	*			trans	69.2	139.5	156.9	69.3	0	0	0	0	119.3
429	S	27.8	Very low	27.8	Very low	116 Å²	116	147.4 Å²	147.4	81%	0.811	79%	0.787	S	S	*	*			cis	-140.7	160.4	9.6	-59.6	0	0	0	0	112.3
430	S	29.6	Very low	27.8	Very low	126 Å²	126	147.6 Å²	147.6	88%	0.881	80%	0.802	S	S	*	*			trans	-112.8	178.6	-168.7	48	0	0	0	0	116.2
431	S	28.8	Very low	28	Very low	96 Å²	96	142.2 Å²	142.2	67%	0.671	79%	0.794	S	S	*	*			trans	-97.3	158.7	-153.6	54.9	0	0	0	0	118.7
432	N	27.9	Very low	28.2	Very low	148 Å²	148	143.8 Å²	143.8	79%	0.791	80%	0.798	S	S	*	*			trans	52.4	141.2	141.1	-66.5	-24.2	0	0	0	122.5
433	I	30.7	Very low	28.4	Very low	172 Å²	172	138.7 Å²	138.7	88%	0.882	79%	0.789	S	S	*	*			trans	-172.5	166.1	131.6	-98.4	155.9	0	0	0	111.9
434	Q	27.3	Very low	29.2	Very low	154 Å²	154	137.9 Å²	137.9	72%	0.72	79%	0.786	S	S	*	*			trans	-102.5	170.9	-157.4	-59.2	161.2	-63.9	0	0	117.5
435	Y	28.8	Very low	29.2	Very low	211 Å²	211	141.1 Å²	141.1	83%	0.827	79%	0.792	S	S	*	*			trans	67	125.2	147	-80.9	-63.4	0	0	0	122.2
436	R	26	Very low	29.2	Very low	244 Å²	244	139 Å²	139	92%	0.921	79%	0.789	S	S	*	*			trans	-146.2	151.7	138.8	-165.5	162.9	-179.9	148.9	-0.9	111.9
437	K	26.9	Very low	29.4	Very low	182 Å²	182	139 Å²	139	79%	0.791	79%	0.794	S	S	*	*			trans	-118.9	148.2	-171.9	178.4	-171.7	-174.2	-178.1	0	109.9
438	Q	27.9	Very low	29.4	Very low	188 Å²	188	139.8 Å²	139.8	88%	0.879	80%	0.799	S	S	*	*			trans	-150.5	167.2	154.2	-135.3	167.9	5.8	0	0	112.1
439	S	27.9	Very low	29.5	Very low	109 Å²	109	143.4 Å²	143.4	76%	0.762	80%	0.798	S	S	*	*			trans	-158.8	151.5	-148.6	51.1	0	0	0	0	113.5
440	G	29.2	Very low	29.5	Very low	84 Å²	84	145.7 Å²	145.7	87%	0.866	80%	0.795	S	S	*	*			trans	132.2	135.5	164.9	0	0	0	0	0	112.6
441	G	30.2	Very low	29.5	Very low	67 Å²	67	144.4 Å²	144.4	69%	0.691	79%	0.786	S	S	*	*			cis	168.5	164.7	-8.1	0	0	0	0	0	112
442	V	32.8	Very low	29.6	Very low	163 Å²	163	147.4 Å²	147.4	99%	0.988	79%	0.794	S	S	*	*			trans	64.2	140.1	165.2	-166.1	0	0	0	0	115
443	G	30.1	Very low	29.7	Very low	62 Å²	62	146.5 Å²	146.5	64%	0.639	79%	0.789	S	S	*	*			cis	-178.7	-173.6	14.3	0	0	0	0	0	109.3
444	P	46	Very low	29.7	Very low	121 Å²	121	148.8 Å²	148.8	79%	0.786	79%	0.786	S	S	*	*				-124.1	171	-128.3	42	-34.2	0	0	0	119.3
445	R	28.9	Very low	29.8	Very low	229 Å²	229	146.7 Å²	146.7	86%	0.864	79%	0.788	S	S	*	*			trans	75.4	111.1	146.5	-91.6	178.7	174.4	164.4	-2.3	121.5
446	S	27.7	Very low	29.9	Very low	95 Å²	95	141.9 Å²	141.9	66%	0.664	79%	0.792	S	S	*	*				53.7	132.8	120.3	70.8	0	0	0	0	120.2
447	T	29	Very low	30.1	Very low	133 Å²	133	139.3 Å²	139.3	82%	0.816	79%	0.791	S	S	*	*				-170.4	151.4	59.9	33.6	0	0	0	0	114.8
448	S	27	Very low	30.3	Very low	100 Å²	100	139.8 Å²	139.8	70%	0.699	80%	0.798	S	S	*	*			trans	57.1	121.3	138.9	-138.8	0	0	0	0	125.6
449	R	28.6	Very low	30.4	Very low	212 Å²	212	140.7 Å²	140.7	80%	0.8	80%	0.799	S	S	*	*				88.3	133.4	126.5	-97.2	179.8	174.8	177.3	-0.9	124.9
450	H	29.2	Very low	30.6	Very low	164 Å²	164	147.4 Å²	147.4	76%	0.759	81%	0.808	S	S	*	*			trans	64.5	137.2	157.8	-68.5	-71.1	0	0	0	117.4
451	S	28.3	Very low	30.6	Very low	98 Å²	98	148.6 Å²	148.6	69%	0.685	80%	0.803	S	S	*	*			cis	-176.1	161.2	39.3	48.1	0	0	0	0	113.9
452	L	31.2	Very low	30.9	Very low	159 Å²	159	157.1 Å²	157.1	83%	0.832	81%	0.814	S	S	*	*			trans	63.4	107.1	145	-67.6	165.1	0	0	0	123.7
453	D	29.1	Very low	31	Very low	130 Å²	130	158 Å²	158	70%	0.695	81%	0.812	S	S	*	*				70	138.7	110.3	-152.6	27.2	0	0	0	124.3
454	R	32.7	Very low	31.1	Very low	220 Å²	220	166 Å²	166	83%	0.83	82%	0.823	S	S	*	*			trans	54.9	151.9	163.5	-82.9	171.4	159	-176.2	-5.5	119.3
455	S	27.5	Very low	30.6	Very low	109 Å²	109	168.6 Å²	168.6	76%	0.762	82%	0.817	S	S	*	*			cis	-169.4	146.4	-6.8	45.1	0	0	0	0	110.6
456	A	31.7	Very low	30.7	Very low	110 Å²	110	168.9 Å²	168.9	91%	0.909	82%	0.818	S	S	*	*			trans	-147.4	134	160.3	0	0	0	0	0	111
457	Q	29.7	Very low	31.3	Very low	191 Å²	191	170.2 Å²	170.2	89%	0.893	83%	0.828	S	S	*	*			trans	-121.3	115.8	-162	-170.4	180	14.2	0	0	111.1
458	M	31.8	Very low	31.5	Very low	192 Å²	192	168.9 Å²	168.9	95%	0.946	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-94.5	120.7	-179.2	-157.6	179.9	-164.3	0	0	111.6
459	K	29.2	Very low	32.1	Very low	207 Å²	207	173.5 Å²	173.5	90%	0.9	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-78.1	130.1	178.1	-81.3	177.4	174.7	173	0	111.7
460	R	32.3	Very low	32.5	Very low	249 Å²	249	170.3 Å²	170.3	94%	0.94	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-86.4	141.9	166.6	-90.4	178.1	163.7	175.4	-3.8	111
461	S	29.8	Very low	32.6	Very low	109 Å²	109	172 Å²	172	76%	0.762	84%	0.838	S	S	*	*			trans	-149.1	113.2	148.3	60.2	0	0	0	0	114
462	R	36.3	Very low	33.1	Very low	247 Å²	247	173.3 Å²	173.3	93%	0.932	84%	0.836	S	S	*	*			trans	42.6	118.8	139	-59.6	178.5	177.3	-178.4	-1.2	119.7
463	L	35.4	Very low	33.2	Very low	180 Å²	180	175 Å²	175	94%	0.942	84%	0.837	S	S	*	*			trans	-136.6	136.5	142.2	-110.1	166.3	0	0	0	111.2
464	R	32.8	Very low	33.9	Very low	231 Å²	231	174.3 Å²	174.3	87%	0.872	83%	0.832	S	S	*	*			trans	-97.7	110.4	-166.1	172.5	-177.4	174.1	-168.1	0.8	109.8	R466	R464-R466 PolarHBondContact O-N 3.03Å
465	R	34.6	Very low	34.4	Very low	175 Å²	175	167.3 Å²	167.3	66%	0.66	81%	0.814	S	S	*	*			trans	-71.8	114.2	175.5	-87	178.2	162.6	171.6	-9.9	110.9	E352	E352-R465 IonicContact OE1-NH2 2.75Å; E352-R465 PolarHBondContact OE1-NH2 2.64Å; E352-R465 IonicContact OE2-CZ 2.74Å; E352-R465 IonicContact OE2-NH1 2.71Å; E352-R465 IonicContact OE2-NH2 3.61Å; E352-R465 PolarHBondContact OE2-NH2 3.26Å
466	R	32	Very low	35.3	Very low	235 Å²	235	166.6 Å²	166.6	89%	0.887	80%	0.802	S	S	*	*			trans	-81	140.5	154	-106.7	179.6	165.5	173.2	-5.6	108.2	R464	R464-R466 PolarHBondContact O-N 3.03Å
467	S	39.2	Very low	36.2	Very low	123 Å²	123	166 Å²	166	86%	0.86	78%	0.783	S	S	*	*			trans	-79.2	139.8	170.5	44.4	0	0	0	0	110.6
468	S	32.6	Very low	37.3	Very low	105 Å²	105	161.4 Å²	161.4	73%	0.734	77%	0.768	S	S	*	*			trans	-137.3	130.3	160.8	52.1	0	0	0	0	108	L470	S468-L470 PolarHBondContact O-N 2.9Å
469	Q	40.5	Very low	38.7	Very low	198 Å²	198	158 Å²	158	93%	0.925	75%	0.754	S	S	*	*			trans	-70.9	114.5	174.9	-68	-170.3	5.9	0	0	108.7	K471	Q469-K471 PolarHBondContact O-N 3.09Å
470	L	36.3	Very low	40.3	Very low	144 Å²	144	148.7 Å²	148.7	75%	0.754	71%	0.714	S	S	*	*			trans	-94.9	88.1	175.5	-141.6	160.9	0	0	0	108.3	S468 I472	S468-L470 PolarHBondContact O-N 2.9Å; L470-I472 HydrophobicContact CD2-CG1 4.26Å; L470-I472 PolarHBondContact O-N 3.25Å; L470-I472 VanDerWaalsContact O-N 3.08Å
471	K	31.5	Very low	42	Very low	200 Å²	200	139.6 Å²	139.6	87%	0.87	68%	0.684	S	S	*	*			trans	-70.8	98.7	171.3	-157.7	174	-170.5	178	0	106.7	Q469 K473	Q469-K471 PolarHBondContact O-N 3.09Å; K471-K473 PolarHBondContact O-N 2.99Å
472	I	38.4	Very low	44.2	Very low	126 Å²	126	135.9 Å²	135.9	65%	0.646	66%	0.66	S	S	*	*			trans	-64.5	104.3	-176.6	-61.8	172.4	0	0	0	107.9	L470	L470-I472 HydrophobicContact CD2-CG1 4.26Å; L470-I472 PolarHBondContact O-N 3.25Å; L470-I472 VanDerWaalsContact O-N 3.08Å
473	K	33.2	Very low	46.3	Very low	195 Å²	195	126 Å²	126	85%	0.848	63%	0.625	S	S	*	*			trans	-93.3	113.7	170.6	-150.7	178.8	-173.7	-172.3	0	106.6	K471	K471-K473 PolarHBondContact O-N 2.99Å
474	I	44.8	Very low	48.6	Very low	115 Å²	115	117.4 Å²	117.4	59%	0.59	58%	0.581	S	S	*	*			trans	-60.8	127.2	172.3	-55.7	160.4	0	0	0	106.6	D476	I474-D476 VanDerWaalsContact C-N 3.26Å; I474-D476 HydrophobicContact CB-CB 4.15Å; I474-D476 HydrophobicContact CG2-CB 3.68Å; I474-D476 PolarHBondContact O-N 3.23Å
475	P	43	Very low	51.1	Low	72 Å²	72	114.7 Å²	114.7	47%	0.468	57%	0.57	S	S	.	*			trans	-77.2	86.8	167.1	31.2	-29.3	0	0	0	107.1	M338 L342	M338-P475 HydrophobicContact CE-CG 3.92Å; L342-P475 HydrophobicContact CD1-CG 4.23Å
476	D	45.8	Very low	53.6	Low	95 Å²	95	114.4 Å²	114.4	51%	0.508	57%	0.569	S	S	.	*			trans	-110.7	121.6	-163.9	-145.2	-7.6	0	0	0	110.8	I474 T478	I474-D476 VanDerWaalsContact C-N 3.26Å; I474-D476 HydrophobicContact CB-CB 4.15Å; I474-D476 HydrophobicContact CG2-CB 3.68Å; I474-D476 PolarHBondContact O-N 3.23Å; D476-T478 WeakPolarHBondContact O-CG2 3.47Å; D476-T478 PolarHBondContact O-N 2.85Å; D476-T478 PolarHBondContact O-OG1 3.25Å
477	L	51.3	Low	56.3	Low	96 Å²	96	103.7 Å²	103.7	50%	0.503	53%	0.531	S	S	.	.	S	Bend	trans	50.5	-8.3	172.4	-109.6	69.1	0	0	0	120.1	N481	L477-N481 PolarHBondContact O-ND2 3.41Å; L477-N481 VanDerWaalsContact O-ND2 3.09Å
478	T	53.4	Low	58.8	Low	96 Å²	96	101.7 Å²	101.7	59%	0.589	50%	0.504	S	S	*	.	H	α-helix	trans	-82.4	-31.8	-165.9	43.1	0	0	0	0	114.4	D476 A482	D476-T478 WeakPolarHBondContact O-CG2 3.47Å; D476-T478 PolarHBondContact O-N 2.85Å; D476-T478 PolarHBondContact O-OG1 3.25Å; T478-A482 VanDerWaalsContact O-CB 3.24Å; T478-A482 WeakPolarHBondContact O-CB 3.49Å; T478-A482 PolarHBondContact O-N 3.29Å
479	D	59.4	Low	61.6	Low	119 Å²	119	101.5 Å²	101.5	64%	0.636	49%	0.494	S	S	*	.	H	α-helix	trans	-73.7	-37.8	-177.5	-73.5	-23.9	0	0	0	112.4	A482 I483	D479-A482 WeakPolarHBondContact O-CB 3.33Å; D479-A482 PolarHBondContact O-N 3.2Å; D479-I483 WeakPolarHBondContact O-CG1 3.25Å; D479-I483 PolarHBondContact O-N 2.85Å
480	V	63.8	Low	64.1	Low	12 Å²	12	96.1 Å²	96.1	7%	0.073	47%	0.47	C	S	.	.	H	α-helix	trans	-67.2	-48.3	176.8	175.3	0	0	0	0	110.7	Y269 V327 A482 I483 D484	Y269-V480 HydrophobicContact CD1-CG1 3.74Å; Y269-V480 HydrophobicContact CE1-CG1 4.37Å; Y269-V480 HydrophobicContact CG-CG1 3.97Å; V327-V480 HydrophobicContact CG1-CG1 3.68Å; V480-A482 PolarHBondContact O-N 3.48Å; V480-I483 PolarHBondContact O-N 3Å; V480-I483 VanDerWaalsContact O-N 3.08Å; V480-D484 PolarHBondContact O-N 2.88Å
481	N	67.7	Low	66.8	Low	59 Å²	59	90.5 Å²	90.5	32%	0.316	44%	0.44	S	S	.	.	H	α-helix	trans	-65.1	-18.5	173.3	-78.3	-54.7	0	0	0	113.4	L477 R485	L477-N481 PolarHBondContact O-ND2 3.41Å; L477-N481 VanDerWaalsContact O-ND2 3.09Å; N481-R485 VanDerWaalsContact O-CB 3.24Å; N481-R485 WeakPolarHBondContact O-CB 3.42Å; N481-R485 PolarHBondContact O-N 2.94Å
482	A	75.6	Confident	69.8	Low	31 Å²	31	83 Å²	83	26%	0.256	41%	0.412	S	S	.	.	H	α-helix	trans	-76.6	-40.4	170.6	0	0	0	0	0	111.4	T478 D479 V480 R485 W486	T478-A482 VanDerWaalsContact O-CB 3.24Å; T478-A482 WeakPolarHBondContact O-CB 3.49Å; T478-A482 PolarHBondContact O-N 3.29Å; D479-A482 WeakPolarHBondContact O-CB 3.33Å; D479-A482 PolarHBondContact O-N 3.2Å; V480-A482 PolarHBondContact O-N 3.48Å; A482-R485 WeakPolarHBondContact O-CB 3.38Å; A482-R485 PolarHBondContact O-N 3.26Å; A482-W486 PolarHBondContact O-N 3.14Å
483	I	80.4	Confident	72.4	Confident	38 Å²	38	80.3 Å²	80.3	20%	0.195	40%	0.404	C	S	.	.	H	α-helix	trans	-58.3	-56.5	175.4	-63.7	163.2	0	0	0	109.7	E323 F326 V327 I330 D479 V480 R485 W486 S487	E323-I483 HydrophobicContact CG-CG2 4.41Å; F326-I483 HydrophobicContact CD1-CD1 4.22Å; F326-I483 HydrophobicContact CE1-CD1 3.99Å; V327-I483 HydrophobicContact CG2-CB 4.32Å; V327-I483 HydrophobicContact CG2-CD1 4.49Å; V327-I483 HydrophobicContact CG2-CG2 3.86Å; I330-I483 HydrophobicContact CD1-CD1 3.96Å; D479-I483 WeakPolarHBondContact O-CG1 3.25Å; D479-I483 PolarHBondContact O-N 2.85Å; V480-I483 PolarHBondContact O-N 3Å; V480-I483 VanDerWaalsContact O-N 3.08Å; I483-R485 PolarHBondContact O-N 3.03Å; I483-R485 VanDerWaalsContact O-N 3.14Å; I483-W486 PolarHBondContact O-N 3.09Å; I483-S487 PolarHBondContact O-N 3.43Å; I483-S487 PolarHBondContact O-OG 3.37Å
484	D	83.6	Confident	75.4	Confident	1 Å²	1	74 Å²	74	1%	0.005	38%	0.382	C	S	.	.	H	α-helix	trans	-53.4	-38.9	176.6	-78.3	-50.1	0	0	0	111.8	R275 V480 S487 R488	R275-D484 IonicContact CZ-OD1 2.64Å; R275-D484 VanDerWaalsContact CZ-OD1 3.3Å; R275-D484 IonicContact CZ-OD2 2.78Å; R275-D484 IonicContact NH1-OD1 3.8Å; R275-D484 PolarHBondContact NH1-OD1 3.29Å; R275-D484 IonicContact NH1-OD2 3.8Å; R275-D484 IonicContact NH2-OD1 3.26Å; R275-D484 PolarHBondContact NH2-OD1 3Å; R275-D484 IonicContact NH2-OD2 3.53Å; R275-D484 PolarHBondContact NH2-OD2 3.03Å; V480-D484 PolarHBondContact O-N 2.88Å; D484-S487 PolarHBondContact O-N 2.95Å; D484-R488 VanDerWaalsContact O-CG 3.22Å; D484-R488 WeakPolarHBondContact O-CG 3.39Å; D484-R488 PolarHBondContact O-N 3.17Å
485	R	85.6	Confident	77.8	Confident	173 Å²	173	69.2 Å²	69.2	65%	0.653	36%	0.357	S	S	*	.	H	α-helix	trans	-67.2	-39.9	178.9	-175.4	-173.5	-57.1	-163.6	-0.9	113	N481 A482 I483	N481-R485 VanDerWaalsContact O-CB 3.24Å; N481-R485 WeakPolarHBondContact O-CB 3.42Å; N481-R485 PolarHBondContact O-N 2.94Å; A482-R485 WeakPolarHBondContact O-CB 3.38Å; A482-R485 PolarHBondContact O-N 3.26Å; I483-R485 PolarHBondContact O-N 3.03Å; I483-R485 VanDerWaalsContact O-N 3.14Å
486	W	87.1	Confident	80.3	Confident	170 Å²	170	69.5 Å²	69.5	64%	0.644	36%	0.361	S	S	*	.	H	α-helix	trans	-70.5	-42.1	174.1	-77.1	108	0	0	0	110.8	A482 I483 R488 I489 I490	A482-W486 PolarHBondContact O-N 3.14Å; I483-W486 PolarHBondContact O-N 3.09Å; W486-R488 VanDerWaalsContact C-N 3.31Å; W486-R488 PolarHBondContact O-N 3.42Å; W486-I489 PolarHBondContact O-N 3.44Å; W486-I490 HydrophobicContact CB-CD1 4.07Å; W486-I490 HydrophobicContact CE3-CD1 4.27Å; W486-I490 WeakPolarHBondContact O-CG1 3.36Å; W486-I490 PolarHBondContact O-N 2.88Å
487	S	89.7	Confident	82.7	Confident	10 Å²	10	69.7 Å²	69.7	7%	0.07	36%	0.361	C	S	.	.	H	α-helix	trans	-54.9	-44	176.4	-58.5	0	0	0	0	112.1	E323 I483 D484 I489 I490 F491	E323-S487 WeakPolarHBondContact CG-OG 3.15Å; E323-S487 PolarHBondContact OE1-OG 3.21Å; I483-S487 PolarHBondContact O-N 3.43Å; I483-S487 PolarHBondContact O-OG 3.37Å; D484-S487 PolarHBondContact O-N 2.95Å; S487-I489 PolarHBondContact O-N 3.5Å; S487-I489 VanDerWaalsContact O-N 3.11Å; S487-I490 PolarHBondContact O-N 2.85Å; S487-F491 WeakPolarHBondContact O-CD2 3.45Å; S487-F491 PolarHBondContact O-N 3.07Å; S487-F491 VanDerWaalsContact O-N 3.1Å
488	R	91.4	Very high	84.8	Confident	80 Å²	80	67.5 Å²	67.5	30%	0.302	35%	0.348	S	S	.	.	H	α-helix	trans	-58	-21.7	176.3	-73.1	169	-157.7	-174.2	8.8	115.2	F265 W266 D484 W486 P492	F265-R488 HydrophobicContact CB-CG 3.87Å; F265-R488 PolarHBondContact O-NE 2.95Å; F265-R488 PolarHBondContact O-NH2 2.98Å; W266-R488 HydrophobicContact CZ2-CG 4.44Å; D484-R488 VanDerWaalsContact O-CG 3.22Å; D484-R488 WeakPolarHBondContact O-CG 3.39Å; D484-R488 PolarHBondContact O-N 3.17Å; W486-R488 VanDerWaalsContact C-N 3.31Å; W486-R488 PolarHBondContact O-N 3.42Å; R488-P492 WeakPolarHBondContact O-CD 3.41Å; R488-P492 WeakPolarHBondContact O-CG 3.47Å
489	I	91.3	Very high	86.8	Confident	102 Å²	102	63.9 Å²	63.9	52%	0.523	33%	0.325	S	S	.	.	H	α-helix	trans	-102.2	-47.7	178.2	-59.9	173.4	0	0	0	109.9	W486 S487 P492 S493	W486-I489 PolarHBondContact O-N 3.44Å; S487-I489 PolarHBondContact O-N 3.5Å; S487-I489 VanDerWaalsContact O-N 3.11Å; I489-P492 WeakPolarHBondContact O-CD 3.36Å; I489-S493 WeakPolarHBondContact O-CB 3.45Å; I489-S493 PolarHBondContact O-N 2.88Å; I489-S493 VanDerWaalsContact O-N 3.12Å; I489-S493 PolarHBondContact O-OG 3.05Å
490	I	93.2	Very high	88.5	Confident	84 Å²	84	63.1 Å²	63.1	43%	0.431	32%	0.32	S	S	.	.	H	α-helix	trans	-63.7	-48.6	-173.7	-66.2	170.6	0	0	0	111.4	W486 S487 S493 V494	W486-I490 HydrophobicContact CB-CD1 4.07Å; W486-I490 HydrophobicContact CE3-CD1 4.27Å; W486-I490 WeakPolarHBondContact O-CG1 3.36Å; W486-I490 PolarHBondContact O-N 2.88Å; S487-I490 PolarHBondContact O-N 2.85Å; I490-S493 PolarHBondContact O-N 3.5Å; I490-V494 HydrophobicContact CG2-CG2 4.06Å; I490-V494 WeakPolarHBondContact O-CB 3.24Å; I490-V494 VanDerWaalsContact O-CG2 3.29Å; I490-V494 WeakPolarHBondContact O-CG2 3.4Å; I490-V494 PolarHBondContact O-N 2.83Å
491	F	93.3	Very high	90	Very high	26 Å²	26	67.5 Å²	67.5	11%	0.114	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-49.7	-176	-81.7	-99.3	0	0	0	112.6	F265 L319 A320 E323 S487 S493 V494 F495	F265-F491 HydrophobicContact CE1-CE2 4.32Å; F265-F491 HydrophobicContact CE2-CB 3.98Å; F265-F491 HydrophobicContact CE2-CD1 4.38Å; F265-F491 AromaticContact CE2-CD2 3.73Å; F265-F491 HydrophobicContact CE2-CD2 3.73Å; F265-F491 HydrophobicContact CE2-CE2 4.26Å; F265-F491 AromaticContact CE2-CG 3.79Å; F265-F491 HydrophobicContact CE2-CG 3.79Å; F265-F491 HydrophobicContact CZ-CD1 4.13Å; F265-F491 AromaticContact CZ-CD2 3.58Å; F265-F491 HydrophobicContact CZ-CD2 3.58Å; F265-F491 HydrophobicContact CZ-CE1 4.17Å; F265-F491 AromaticContact CZ-CE2 3.63Å; F265-F491 HydrophobicContact CZ-CE2 3.63Å; F265-F491 AromaticContact CZ-CG 3.84Å; F265-F491 HydrophobicContact CZ-CG 3.84Å; F265-F491 AromaticContact CZ-CZ 3.93Å; F265-F491 HydrophobicContact CZ-CZ 3.93Å; L319-F491 HydrophobicContact CB-CE1 3.77Å; L319-F491 HydrophobicContact CB-CZ 4.01Å; A320-F491 HydrophobicContact CB-CE1 4.05Å; A320-F491 HydrophobicContact CB-CZ 4.48Å; E323-F491 HydrophobicContact CB-CZ 4.5Å; S487-F491 WeakPolarHBondContact O-CD2 3.45Å; S487-F491 PolarHBondContact O-N 3.07Å; S487-F491 VanDerWaalsContact O-N 3.1Å; F491-S493 PolarHBondContact O-N 3.35Å; F491-V494 PolarHBondContact O-N 2.9Å; F491-F495 WeakPolarHBondContact O-CB 3.35Å; F491-F495 PolarHBondContact O-N 3.38Å
492	P	94	Very high	91.3	Very high	43 Å²	43	65.1 Å²	65.1	28%	0.279	33%	0.329	S	S	.	.	H	α-helix	trans	-61.3	-40.7	174.1	-24.4	34.1	0	0	0	113.8	W262 R488 I489 F495 S496	W262-P492 HydrophobicContact CD2-CG 4.27Å; W262-P492 HydrophobicContact CE3-CB 4.34Å; W262-P492 HydrophobicContact CE3-CG 3.74Å; W262-P492 HydrophobicContact CH2-CB 4.1Å; W262-P492 HydrophobicContact CH2-CG 4.29Å; W262-P492 HydrophobicContact CZ3-CB 3.82Å; W262-P492 HydrophobicContact CZ3-CG 3.75Å; R488-P492 WeakPolarHBondContact O-CD 3.41Å; R488-P492 WeakPolarHBondContact O-CG 3.47Å; I489-P492 WeakPolarHBondContact O-CD 3.36Å; P492-F495 PolarHBondContact O-N 3.11Å; P492-S496 VanDerWaalsContact O-CB 3.27Å; P492-S496 WeakPolarHBondContact O-CB 3.42Å; P492-S496 PolarHBondContact O-N 3.2Å
493	S	93.8	Very high	92.1	Very high	69 Å²	69	67.3 Å²	67.3	48%	0.483	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-45.3	179.2	-65.5	0	0	0	0	112.4	I489 I490 F491 S496 L497	I489-S493 WeakPolarHBondContact O-CB 3.45Å; I489-S493 PolarHBondContact O-N 2.88Å; I489-S493 VanDerWaalsContact O-N 3.12Å; I489-S493 PolarHBondContact O-OG 3.05Å; I490-S493 PolarHBondContact O-N 3.5Å; F491-S493 PolarHBondContact O-N 3.35Å; S493-S496 PolarHBondContact O-N 3.28Å; S493-L497 WeakPolarHBondContact O-CB 3.32Å; S493-L497 PolarHBondContact O-N 3.4Å
494	V	95.4	Very high	92.7	Very high	64 Å²	64	71.7 Å²	71.7	39%	0.388	35%	0.353	S	S	.	.	H	α-helix	trans	-67.9	-39.5	178.5	176.4	0	0	0	0	110.9	M316 I490 F491 L497 F498	M316-V494 HydrophobicContact CE-CG1 3.54Å; M316-V494 HydrophobicContact SD-CG1 4.2Å; I490-V494 HydrophobicContact CG2-CG2 4.06Å; I490-V494 WeakPolarHBondContact O-CB 3.24Å; I490-V494 VanDerWaalsContact O-CG2 3.29Å; I490-V494 WeakPolarHBondContact O-CG2 3.4Å; I490-V494 PolarHBondContact O-N 2.83Å; F491-V494 PolarHBondContact O-N 2.9Å; V494-L497 PolarHBondContact O-N 2.79Å; V494-F498 WeakPolarHBondContact O-CB 3.38Å; V494-F498 PolarHBondContact O-N 3.39Å
495	F	95.8	Very high	93.2	Very high	13 Å²	13	78.7 Å²	78.7	6%	0.057	38%	0.381	C	S	.	.	H	α-helix	trans	-67.4	-37.9	176.1	-174.1	-109.1	0	0	0	112.8	I255 T258 W262 M316 F491 P492 F498 N499	I255-F495 HydrophobicContact CG1-CE1 4.33Å; I255-F495 HydrophobicContact CG1-CZ 4.06Å; I255-F495 HydrophobicContact CG2-CE1 4.29Å; T258-F495 HydrophobicContact CG2-CD2 3.86Å; T258-F495 HydrophobicContact CG2-CE2 3.81Å; T258-F495 HydrophobicContact CG2-CG 4.26Å; T258-F495 HydrophobicContact CG2-CZ 4.15Å; W262-F495 HydrophobicContact CH2-CB 3.9Å; W262-F495 AromaticContact CH2-CD1 3.71Å; W262-F495 HydrophobicContact CH2-CD1 3.71Å; W262-F495 HydrophobicContact CH2-CG 4.05Å; W262-F495 HydrophobicContact CZ2-CB 3.63Å; W262-F495 AromaticContact CZ2-CD1 3.94Å; W262-F495 HydrophobicContact CZ2-CD1 3.94Å; W262-F495 AromaticContact CZ2-CG 3.85Å; W262-F495 HydrophobicContact CZ2-CG 3.85Å; M316-F495 HydrophobicContact CG-CD2 4.36Å; F491-F495 WeakPolarHBondContact O-CB 3.35Å; F491-F495 PolarHBondContact O-N 3.38Å; P492-F495 PolarHBondContact O-N 3.11Å; F495-F498 HydrophobicContact CD2-CD1 4.33Å; F495-F498 HydrophobicContact CE2-CD1 4.35Å; F495-F498 PolarHBondContact O-N 3.43Å; F495-N499 WeakPolarHBondContact CD1-ND2 3.37Å; F495-N499 WeakPolarHBondContact CE1-ND2 3.44Å; F495-N499 WeakPolarHBondContact CE2-ND2 3.47Å; F495-N499 WeakPolarHBondContact CZ-ND2 3.48Å; F495-N499 PolarHBondContact O-N 3.47Å; F495-N499 PolarHBondContact O-ND2 2.95Å
496	S	94.6	Very high	93.4	Very high	79 Å²	79	72.3 Å²	72.3	55%	0.552	36%	0.357	S	S	*	.	H	α-helix	trans	-63	-46.3	173.9	-174.6	0	0	0	0	111.3	P492 S493 F498 N499 L500	P492-S496 VanDerWaalsContact O-CB 3.27Å; P492-S496 WeakPolarHBondContact O-CB 3.42Å; P492-S496 PolarHBondContact O-N 3.2Å; S493-S496 PolarHBondContact O-N 3.28Å; S496-F498 PolarHBondContact O-N 3.04Å; S496-N499 PolarHBondContact O-N 2.91Å; S496-L500 WeakPolarHBondContact O-CB 3.43Å; S496-L500 PolarHBondContact O-N 3.27Å
497	L	95.9	Very high	93.3	Very high	98 Å²	98	70.8 Å²	70.8	51%	0.513	37%	0.366	S	S	.	.	H	α-helix	trans	-61.4	-42	174.7	-179.6	62.2	0	0	0	112.2	S493 V494 L500 I501	S493-L497 WeakPolarHBondContact O-CB 3.32Å; S493-L497 PolarHBondContact O-N 3.4Å; V494-L497 PolarHBondContact O-N 2.79Å; L497-L500 PolarHBondContact O-N 3.44Å; L497-I501 HydrophobicContact CD1-CD1 3.89Å; L497-I501 HydrophobicContact CD1-CG1 4.2Å; L497-I501 HydrophobicContact CG-CD1 3.87Å; L497-I501 WeakPolarHBondContact O-CG1 3.43Å; L497-I501 PolarHBondContact O-N 3.34Å
498	F	96	Very high	93.5	Very high	50 Å²	50	73.9 Å²	73.9	22%	0.219	38%	0.381	C	S	.	.	H	α-helix	trans	-59	-47.7	175.2	170.7	-102.8	0	0	0	111.9	Y309 V494 F495 S496 I501 Y502	Y309-F498 AromaticContact CD2-CE1 3.91Å; Y309-F498 HydrophobicContact CD2-CE1 3.91Å; Y309-F498 HydrophobicContact CD2-CZ 4.32Å; Y309-F498 AromaticContact CE2-CE1 3.95Å; Y309-F498 HydrophobicContact CE2-CE1 3.95Å; V494-F498 WeakPolarHBondContact O-CB 3.38Å; V494-F498 PolarHBondContact O-N 3.39Å; F495-F498 HydrophobicContact CD2-CD1 4.33Å; F495-F498 HydrophobicContact CE2-CD1 4.35Å; F495-F498 PolarHBondContact O-N 3.43Å; S496-F498 PolarHBondContact O-N 3.04Å; F498-I501 PolarHBondContact O-N 3.38Å; F498-Y502 VanDerWaalsContact O-CB 3.25Å; F498-Y502 WeakPolarHBondContact O-CB 3.43Å; F498-Y502 PolarHBondContact O-N 3.36Å
499	N	94.9	Very high	93.6	Very high	21 Å²	21	73.5 Å²	73.5	11%	0.112	39%	0.385	C	S	.	.	H	α-helix	trans	-63.1	-44.3	176.4	-81.1	-91.9	0	0	0	111.3	Y309 F495 S496 I501 Y502 W503	Y309-N499 WeakPolarHBondContact CE2-OD1 3.26Å; Y309-N499 PolarHBondContact OH-OD1 3.34Å; F495-N499 WeakPolarHBondContact CD1-ND2 3.37Å; F495-N499 WeakPolarHBondContact CE1-ND2 3.44Å; F495-N499 WeakPolarHBondContact CE2-ND2 3.47Å; F495-N499 WeakPolarHBondContact CZ-ND2 3.48Å; F495-N499 PolarHBondContact O-N 3.47Å; F495-N499 PolarHBondContact O-ND2 2.95Å; S496-N499 PolarHBondContact O-N 2.91Å; N499-I501 PolarHBondContact O-N 3.31Å; N499-Y502 PolarHBondContact O-N 3.13Å; N499-W503 PolarHBondContact O-N 3.05Å
500	L	95.1	Very high	93.8	Very high	102 Å²	102	71.9 Å²	71.9	53%	0.534	38%	0.378	S	S	.	.	H	α-helix	trans	-57.3	-49.1	178.2	-177.8	65.2	0	0	0	111.6	S496 L497 L504	S496-L500 WeakPolarHBondContact O-CB 3.43Å; S496-L500 PolarHBondContact O-N 3.27Å; L497-L500 PolarHBondContact O-N 3.44Å; L500-L504 HydrophobicContact CD1-CD1 3.82Å; L500-L504 HydrophobicContact CD1-CG 4.28Å; L500-L504 HydrophobicContact CG-CD1 3.9Å; L500-L504 VanDerWaalsContact O-CB 3.28Å; L500-L504 WeakPolarHBondContact O-CB 3.38Å; L500-L504 WeakPolarHBondContact O-CG 3.42Å; L500-L504 PolarHBondContact O-N 2.94Å; L500-L504 VanDerWaalsContact O-N 3.07Å
501	I	95.8	Very high	93.8	Very high	105 Å²	105	71.2 Å²	71.2	54%	0.538	38%	0.375	S	S	.	.	H	α-helix	trans	-63.8	-42.9	177.4	-66.9	168.2	0	0	0	111	L497 F498 N499 Y505	L497-I501 HydrophobicContact CD1-CD1 3.89Å; L497-I501 HydrophobicContact CD1-CG1 4.2Å; L497-I501 HydrophobicContact CG-CD1 3.87Å; L497-I501 WeakPolarHBondContact O-CG1 3.43Å; L497-I501 PolarHBondContact O-N 3.34Å; F498-I501 PolarHBondContact O-N 3.38Å; N499-I501 PolarHBondContact O-N 3.31Å; I501-Y505 VanDerWaalsContact O-CB 3.32Å; I501-Y505 WeakPolarHBondContact O-CB 3.48Å; I501-Y505 PolarHBondContact O-N 3.26Å; I501-Y505 VanDerWaalsContact O-N 3.14Å
502	Y	94.9	Very high	93.8	Very high	9 Å²	9	74.1 Å²	74.1	4%	0.035	39%	0.391	C	S	.	.	H	α-helix	trans	-60.2	-54.5	-179.8	-179.3	-93.1	0	0	0	112	Y251 A305 Y309 F498 N499 L504 Y505 Y506	Y251-Y502 AromaticContact CE1-CE1 3.79Å; Y251-Y502 HydrophobicContact CE1-CE1 3.79Å; Y251-Y502 PolarHBondContact OH-OH 3.46Å; A305-Y502 WeakPolarHBondContact O-CE2 3.31Å; A305-Y502 PolarHBondContact O-OH 3.45Å; Y309-Y502 AromaticContact CD2-CD1 3.67Å; Y309-Y502 HydrophobicContact CD2-CD1 3.67Å; Y309-Y502 AromaticContact CD2-CD2 3.94Å; Y309-Y502 HydrophobicContact CD2-CD2 3.94Å; Y309-Y502 AromaticContact CD2-CE1 3.73Å; Y309-Y502 HydrophobicContact CD2-CE1 3.73Å; Y309-Y502 AromaticContact CD2-CE2 3.99Å; Y309-Y502 HydrophobicContact CD2-CE2 3.99Å; Y309-Y502 AromaticContact CD2-CG 3.78Å; Y309-Y502 HydrophobicContact CD2-CG 3.78Å; Y309-Y502 AromaticContact CD2-CZ 3.9Å; Y309-Y502 HydrophobicContact CE2-CD1 4.14Å; Y309-Y502 HydrophobicContact CE2-CE1 4.46Å; Y309-Y502 HydrophobicContact CE2-CG 4.4Å; Y309-Y502 HydrophobicContact CG-CE1 4.33Å; Y309-Y502 HydrophobicContact CG-CE2 4.33Å; F498-Y502 VanDerWaalsContact O-CB 3.25Å; F498-Y502 WeakPolarHBondContact O-CB 3.43Å; F498-Y502 PolarHBondContact O-N 3.36Å; N499-Y502 PolarHBondContact O-N 3.13Å; Y502-L504 PolarHBondContact O-N 3Å; Y502-Y505 PolarHBondContact O-N 3.1Å; Y502-Y506 HydrophobicContact CD1-CD2 4.47Å; Y502-Y506 AromaticContact CD2-CD2 3.59Å; Y502-Y506 HydrophobicContact CD2-CD2 3.59Å; Y502-Y506 AromaticContact CD2-CE2 3.65Å; Y502-Y506 HydrophobicContact CD2-CE2 3.65Å; Y502-Y506 HydrophobicContact CE1-CD2 4.3Å; Y502-Y506 AromaticContact CE2-CD2 3.37Å; Y502-Y506 HydrophobicContact CE2-CD2 3.37Å; Y502-Y506 AromaticContact CE2-CE2 3.41Å; Y502-Y506 HydrophobicContact CE2-CE2 3.41Å; Y502-Y506 VanDerWaalsContact CE2-CE2 3.41Å; Y502-Y506 HydrophobicContact CE2-CG 4.44Å; Y502-Y506 HydrophobicContact CG-CD2 4.13Å; Y502-Y506 AromaticContact CZ-CD2 3.75Å; Y502-Y506 WeakPolarHBondContact O-CD2 3.47Å; Y502-Y506 PolarHBondContact O-N 3.31Å; Y502-Y506 VanDerWaalsContact O-N 3.13Å
503	W	93.3	Very high	93.8	Very high	76 Å²	76	76.1 Å²	76.1	29%	0.288	40%	0.398	S	S	.	.	H	α-helix	trans	-67.5	-36.6	-177.3	-69.4	109.5	0	0	0	111.7	L170 Y251 N499 Y505 V507	L170-W503 HydrophobicContact CD1-CE3 4.48Å; L170-W503 HydrophobicContact CD1-CZ3 4.19Å; Y251-W503 HydrophobicContact CD1-CH2 4.14Å; Y251-W503 AromaticContact CD1-CZ2 3.77Å; Y251-W503 HydrophobicContact CD1-CZ2 3.77Å; Y251-W503 HydrophobicContact CD2-CH2 4.27Å; Y251-W503 HydrophobicContact CE1-CH2 4.08Å; Y251-W503 AromaticContact CE1-CZ2 3.99Å; Y251-W503 HydrophobicContact CE1-CZ2 3.99Å; Y251-W503 HydrophobicContact CE2-CH2 4.2Å; Y251-W503 HydrophobicContact CG-CH2 4.25Å; Y251-W503 HydrophobicContact CG-CZ2 4.1Å; N499-W503 PolarHBondContact O-N 3.05Å; W503-Y505 VanDerWaalsContact C-N 3.28Å; W503-Y505 PolarHBondContact O-N 3.13Å; W503-V507 HydrophobicContact CE3-CG2 3.68Å; W503-V507 HydrophobicContact CZ3-CG2 4.25Å; W503-V507 VanDerWaalsContact O-CB 3.31Å; W503-V507 WeakPolarHBondContact O-CB 3.28Å; W503-V507 PolarHBondContact O-N 3.19Å; W503-V507 VanDerWaalsContact O-N 3.13Å
504	L	93.3	Very high	93.8	Very high	130 Å²	130	76.6 Å²	76.6	68%	0.681	39%	0.392	S	S	*	.	H	α-helix	trans	-69.3	-18.9	175	-73.1	174.3	0	0	0	114.8	L500 Y502	L500-L504 HydrophobicContact CD1-CD1 3.82Å; L500-L504 HydrophobicContact CD1-CG 4.28Å; L500-L504 HydrophobicContact CG-CD1 3.9Å; L500-L504 VanDerWaalsContact O-CB 3.28Å; L500-L504 WeakPolarHBondContact O-CB 3.38Å; L500-L504 WeakPolarHBondContact O-CG 3.42Å; L500-L504 PolarHBondContact O-N 2.94Å; L500-L504 VanDerWaalsContact O-N 3.07Å; Y502-L504 PolarHBondContact O-N 3Å
505	Y	93.6	Very high	93.7	Very high	148 Å²	148	77.6 Å²	77.6	58%	0.58	39%	0.393	S	S	*	.	H	α-helix	trans	-95.3	-33.4	-179.6	179.6	-95.9	0	0	0	113	I501 Y502 W503	I501-Y505 VanDerWaalsContact O-CB 3.32Å; I501-Y505 WeakPolarHBondContact O-CB 3.48Å; I501-Y505 PolarHBondContact O-N 3.26Å; I501-Y505 VanDerWaalsContact O-N 3.14Å; Y502-Y505 PolarHBondContact O-N 3.1Å; W503-Y505 VanDerWaalsContact C-N 3.28Å; W503-Y505 PolarHBondContact O-N 3.13Å
506	Y	89.3	Confident	93.5	Very high	40 Å²	40	83 Å²	83	16%	0.157	42%	0.421	C	S	.	.	H	α-helix	trans	-101.3	-17.6	-174.4	-71.2	-68.9	0	0	0	115.2	R167 A305 Y502	R167-Y506 HydrophobicContact CG-CD1 4.49Å; A305-Y506 HydrophobicContact CB-CD1 3.56Å; A305-Y506 HydrophobicContact CB-CD2 4.28Å; A305-Y506 HydrophobicContact CB-CE1 3.35Å; A305-Y506 HydrophobicContact CB-CE2 4.1Å; A305-Y506 HydrophobicContact CB-CG 4.03Å; Y502-Y506 HydrophobicContact CD1-CD2 4.47Å; Y502-Y506 AromaticContact CD2-CD2 3.59Å; Y502-Y506 HydrophobicContact CD2-CD2 3.59Å; Y502-Y506 AromaticContact CD2-CE2 3.65Å; Y502-Y506 HydrophobicContact CD2-CE2 3.65Å; Y502-Y506 HydrophobicContact CE1-CD2 4.3Å; Y502-Y506 AromaticContact CE2-CD2 3.37Å; Y502-Y506 HydrophobicContact CE2-CD2 3.37Å; Y502-Y506 AromaticContact CE2-CE2 3.41Å; Y502-Y506 HydrophobicContact CE2-CE2 3.41Å; Y502-Y506 VanDerWaalsContact CE2-CE2 3.41Å; Y502-Y506 HydrophobicContact CE2-CG 4.44Å; Y502-Y506 HydrophobicContact CG-CD2 4.13Å; Y502-Y506 AromaticContact CZ-CD2 3.75Å; Y502-Y506 WeakPolarHBondContact O-CD2 3.47Å; Y502-Y506 PolarHBondContact O-N 3.31Å; Y502-Y506 VanDerWaalsContact O-N 3.13Å
507	V	85.8	Confident	93.4	Very high	138 Å²	138	83.4 Å²	83.4	84%	0.836	41%	0.409	S	S	*	.			trans	-97.4	0	171.9	-177.1	0	0	0	0	110.4	L170 W503	L170-V507 HydrophobicContact CD1-CG2 4.09Å; L170-V507 HydrophobicContact CD2-CG2 4.16Å; W503-V507 HydrophobicContact CE3-CG2 3.68Å; W503-V507 HydrophobicContact CZ3-CG2 4.25Å; W503-V507 VanDerWaalsContact O-CB 3.31Å; W503-V507 WeakPolarHBondContact O-CB 3.28Å; W503-V507 PolarHBondContact O-N 3.19Å; W503-V507 VanDerWaalsContact O-N 3.13Å

Retrieved 507 of 507 residues in 323.9 ms (Link to these results)

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