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Exocyst complex component 8

Component of the exocyst complex involved in the docking of exocytic vesicles with fusion sites on the plasma membrane.

AlphaFold DB , UniProt , Accession A0A060WBI0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 689 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	46.2	Very low	61.7	Low	203 Å²	203	113.8 Å²	113.8	100%	1	56%	0.56	S	S	*	*				0	-42	0	-76.9	-151.4	-84.1	0	0	113.9	E3 Q4 A5	M1-E3 PolarHBondContact O-N 3.43Å; M1-Q4 PolarHBondContact O-N 3.44Å; M1-A5 PolarHBondContact O-N 3.21Å
2	A	46.7	Very low	62.6	Low	79 Å²	79	109.2 Å²	109.2	65%	0.653	54%	0.538	S	S	*	.	H	α-helix	trans	-63.2	-34.9	-179.2	0	0	0	0	0	115.1	N6	A2-N6 PolarHBondContact O-N 3.01Å; A2-N6 VanDerWaalsContact O-N 3.15Å
3	E	53.3	Low	63.5	Low	153 Å²	153	110.2 Å²	110.2	72%	0.715	54%	0.541	S	S	*	.	H	α-helix	trans	-68.5	-35.3	176.6	-79.4	-173.8	132.4	0	0	113.6	M1 R7	M1-E3 PolarHBondContact O-N 3.43Å; E3-R7 WeakPolarHBondContact O-CG 3.47Å; E3-R7 PolarHBondContact O-N 2.9Å
4	Q	56.3	Low	64.5	Low	144 Å²	144	106.3 Å²	106.3	67%	0.673	53%	0.53	S	S	*	.	H	α-helix	trans	-70.9	-39.7	177.5	-82.2	173.9	-24.7	0	0	111.6	M1 R7 L8	M1-Q4 PolarHBondContact O-N 3.44Å; Q4-R7 PolarHBondContact O-N 3.28Å; Q4-L8 PolarHBondContact O-N 3.13Å
5	A	58	Low	64.8	Low	45 Å²	45	106.3 Å²	106.3	37%	0.372	55%	0.554	S	S	.	*	H	α-helix	trans	-63.4	-40	174.7	0	0	0	0	0	112.2	M1 L8 R9	M1-A5 PolarHBondContact O-N 3.21Å; A5-L8 PolarHBondContact O-N 2.79Å; A5-R9 WeakPolarHBondContact O-CB 3.46Å; A5-R9 PolarHBondContact O-N 3.29Å
6	N	63.8	Low	65.3	Low	97 Å²	97	109.8 Å²	109.8	52%	0.519	57%	0.573	S	S	.	*	H	α-helix	trans	-69.5	-33.9	175.5	-92.4	-21.9	0	0	0	113.5	A2 K10	A2-N6 PolarHBondContact O-N 3.01Å; A2-N6 VanDerWaalsContact O-N 3.15Å; N6-K10 WeakPolarHBondContact O-CB 3.39Å; N6-K10 WeakPolarHBondContact O-CG 3.29Å; N6-K10 PolarHBondContact O-N 2.86Å
7	R	67.8	Low	66.2	Low	169 Å²	169	107.3 Å²	107.3	64%	0.638	56%	0.557	S	S	*	*	H	α-helix	trans	-66.7	-42.6	172.9	-77	180	-175	-175.2	3.6	111.6	E3 Q4 K10 Q11	E3-R7 WeakPolarHBondContact O-CG 3.47Å; E3-R7 PolarHBondContact O-N 2.9Å; Q4-R7 PolarHBondContact O-N 3.28Å; R7-K10 PolarHBondContact O-N 3.17Å; R7-Q11 WeakPolarHBondContact O-CG 3.44Å; R7-Q11 PolarHBondContact O-N 3.07Å
8	L	70.3	Confident	66.8	Low	23 Å²	23	105.1 Å²	105.1	12%	0.12	55%	0.546	C	S	.	.	H	α-helix	trans	-63.7	-43.3	177.6	-160.7	122.3	0	0	0	111.1	Q4 A5 Q11 L12 Y22 I43 L46	Q4-L8 PolarHBondContact O-N 3.13Å; A5-L8 PolarHBondContact O-N 2.79Å; L8-Q11 PolarHBondContact O-N 3.4Å; L8-L12 HydrophobicContact CD2-CD1 3.76Å; L8-L12 HydrophobicContact CG-CD1 4.43Å; L8-L12 VanDerWaalsContact O-CG 3.3Å; L8-L12 WeakPolarHBondContact O-CG 3.4Å; L8-L12 PolarHBondContact O-N 3.37Å; L8-Y22 WeakPolarHBondContact CD1-OH 3.42Å; L8-I43 HydrophobicContact CD2-CG1 4.06Å; L8-L46 HydrophobicContact CD2-CD1 3.53Å
9	R	70.7	Confident	67.3	Low	71 Å²	71	103.7 Å²	103.7	27%	0.268	54%	0.544	S	S	.	.	H	α-helix	trans	-59.7	-46.8	174.2	-172.8	171.1	-177.1	164	0.6	112.8	A5 Q11 L12 E13	A5-R9 WeakPolarHBondContact O-CB 3.46Å; A5-R9 PolarHBondContact O-N 3.29Å; R9-Q11 VanDerWaalsContact C-N 3.33Å; R9-Q11 PolarHBondContact O-N 2.92Å; R9-L12 PolarHBondContact O-N 3.5Å; R9-E13 HydrophobicContact CG-CG 4.38Å; R9-E13 VanDerWaalsContact CG-OE1 3.22Å; R9-E13 WeakPolarHBondContact CG-OE1 3.42Å; R9-E13 IonicContact CZ-OE1 3.87Å; R9-E13 IonicContact NE-OE1 2.93Å; R9-E13 PolarHBondContact NE-OE1 3.25Å; R9-E13 IonicContact NH2-OE1 3.9Å; R9-E13 WeakPolarHBondContact O-CB 3.47Å; R9-E13 VanDerWaalsContact O-CG 3.31Å; R9-E13 WeakPolarHBondContact O-CG 3.41Å; R9-E13 PolarHBondContact O-N 2.92Å
10	K	72.4	Confident	67.8	Low	159 Å²	159	106.5 Å²	106.5	69%	0.691	55%	0.554	S	S	*	*	H	α-helix	trans	-64.7	-31.9	176.8	-77	-177.5	177.7	-175.4	0	113.9	N6 R7	N6-K10 WeakPolarHBondContact O-CB 3.39Å; N6-K10 WeakPolarHBondContact O-CG 3.29Å; N6-K10 PolarHBondContact O-N 2.86Å; R7-K10 PolarHBondContact O-N 3.17Å
11	Q	72.8	Confident	68.3	Low	109 Å²	109	105.6 Å²	105.6	51%	0.509	55%	0.55	S	S	.	*	H	α-helix	trans	-70.7	-41.1	175	-78.2	178.4	-22.7	0	0	111.6	R7 L8 R9 S14 F17	R7-Q11 WeakPolarHBondContact O-CG 3.44Å; R7-Q11 PolarHBondContact O-N 3.07Å; L8-Q11 PolarHBondContact O-N 3.4Å; R9-Q11 VanDerWaalsContact C-N 3.33Å; R9-Q11 PolarHBondContact O-N 2.92Å; Q11-S14 PolarHBondContact O-N 3.05Å; Q11-S14 PolarHBondContact O-OG 3.23Å; Q11-F17 WeakPolarHBondContact O-CD2 3.43Å
12	L	73.3	Confident	69.8	Low	58 Å²	58	97.9 Å²	97.9	30%	0.304	51%	0.51	S	S	.	.	H	α-helix	trans	-72.2	-31.1	178.3	-66.5	171.9	0	0	0	113.2	L8 R9 S14 F17	L8-L12 HydrophobicContact CD2-CD1 3.76Å; L8-L12 HydrophobicContact CG-CD1 4.43Å; L8-L12 VanDerWaalsContact O-CG 3.3Å; L8-L12 WeakPolarHBondContact O-CG 3.4Å; L8-L12 PolarHBondContact O-N 3.37Å; R9-L12 PolarHBondContact O-N 3.5Å; L12-S14 VanDerWaalsContact C-N 3.26Å; L12-S14 PolarHBondContact O-N 3.01Å; L12-F17 HydrophobicContact CD2-CE1 4Å; L12-F17 HydrophobicContact CD2-CE2 3.77Å; L12-F17 HydrophobicContact CD2-CZ 3.46Å; L12-F17 VanDerWaalsContact CD2-CZ 3.46Å
13	E	73.8	Confident	71.3	Confident	122 Å²	122	98.5 Å²	98.5	57%	0.57	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	0.2	177.9	-71.2	171.8	178	0	0	113.4	R9	R9-E13 HydrophobicContact CG-CG 4.38Å; R9-E13 VanDerWaalsContact CG-OE1 3.22Å; R9-E13 WeakPolarHBondContact CG-OE1 3.42Å; R9-E13 IonicContact CZ-OE1 3.87Å; R9-E13 IonicContact NE-OE1 2.93Å; R9-E13 PolarHBondContact NE-OE1 3.25Å; R9-E13 IonicContact NH2-OE1 3.9Å; R9-E13 WeakPolarHBondContact O-CB 3.47Å; R9-E13 VanDerWaalsContact O-CG 3.31Å; R9-E13 WeakPolarHBondContact O-CG 3.41Å; R9-E13 PolarHBondContact O-N 2.92Å
14	S	78.2	Confident	72.4	Confident	56 Å²	56	96.9 Å²	96.9	39%	0.392	50%	0.496	S	S	.	.			trans	-74.8	135.9	-178.9	71	0	0	0	0	112.3	Q11 L12 N16 F17	Q11-S14 PolarHBondContact O-N 3.05Å; Q11-S14 PolarHBondContact O-OG 3.23Å; L12-S14 VanDerWaalsContact C-N 3.26Å; L12-S14 PolarHBondContact O-N 3.01Å; S14-N16 PolarHBondContact O-N 3.46Å; S14-N16 VanDerWaalsContact O-N 3.11Å; S14-F17 WeakPolarHBondContact O-CB 3.43Å; S14-F17 PolarHBondContact O-N 2.98Å
15	A	68.1	Low	73.4	Confident	107 Å²	107	94.1 Å²	94.1	88%	0.884	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.4	-174.1	0	0	0	0	0	114.9
16	N	73.1	Confident	74.1	Confident	162 Å²	162	93.3 Å²	93.3	87%	0.866	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	27.6	179.2	-68.3	-18.3	0	0	0	112.3	S14 D18	S14-N16 PolarHBondContact O-N 3.46Å; S14-N16 VanDerWaalsContact O-N 3.11Å; N16-D18 PolarHBondContact O-N 3.04Å
17	F	80.3	Confident	74.5	Confident	67 Å²	67	91.7 Å²	91.7	29%	0.294	47%	0.472	S	S	.	.			trans	-69.8	123.4	-179.4	-179.1	-103	0	0	0	111.7	Q11 L12 S14 P19 Y22	Q11-F17 WeakPolarHBondContact O-CD2 3.43Å; L12-F17 HydrophobicContact CD2-CE1 4Å; L12-F17 HydrophobicContact CD2-CE2 3.77Å; L12-F17 HydrophobicContact CD2-CZ 3.46Å; L12-F17 VanDerWaalsContact CD2-CZ 3.46Å; S14-F17 WeakPolarHBondContact O-CB 3.43Å; S14-F17 PolarHBondContact O-N 2.98Å; F17-P19 HydrophobicContact CD1-CG 4.14Å; F17-P19 HydrophobicContact CE1-CB 4.14Å; F17-P19 HydrophobicContact CE1-CG 3.92Å; F17-Y22 HydrophobicContact CE2-CD1 4.27Å; F17-Y22 AromaticContact CE2-CD2 3.74Å; F17-Y22 HydrophobicContact CE2-CD2 3.74Å; F17-Y22 HydrophobicContact CE2-CE2 4.39Å; F17-Y22 AromaticContact CE2-CG 3.65Å; F17-Y22 HydrophobicContact CE2-CG 3.65Å; F17-Y22 AromaticContact CZ-CD1 3.84Å; F17-Y22 HydrophobicContact CZ-CD1 3.84Å; F17-Y22 HydrophobicContact CZ-CD2 4.17Å; F17-Y22 AromaticContact CZ-CG 3.63Å; F17-Y22 HydrophobicContact CZ-CG 3.63Å
18	D	76.8	Confident	74.9	Confident	68 Å²	68	90.1 Å²	90.1	36%	0.364	47%	0.472	S	S	.	.			trans	-105.8	109.9	172.2	-179.8	1.8	0	0	0	110.7	N16 Q20 N21 Y22	N16-D18 PolarHBondContact O-N 3.04Å; D18-Q20 VanDerWaalsContact C-N 3.27Å; D18-Q20 PolarHBondContact O-N 3.09Å; D18-Q20 PolarHBondContact OD1-N 2.93Å; D18-N21 HydrophobicContact CB-CB 4.29Å; D18-N21 PolarHBondContact OD2-ND2 3.35Å; D18-Y22 WeakPolarHBondContact O-CB 3.29Å; D18-Y22 PolarHBondContact O-N 3.47Å; D18-Y22 VanDerWaalsContact O-N 3.11Å
19	P	77.3	Confident	74.9	Confident	78 Å²	78	96.8 Å²	96.8	51%	0.506	50%	0.502	S	S	.	.	H	α-helix	trans	-59.8	-34.3	-179	-22.6	32.5	0	0	0	113.7	F17 V23	F17-P19 HydrophobicContact CD1-CG 4.14Å; F17-P19 HydrophobicContact CE1-CB 4.14Å; F17-P19 HydrophobicContact CE1-CG 3.92Å; P19-V23 VanDerWaalsContact O-CG2 3.3Å; P19-V23 WeakPolarHBondContact O-CG2 3.39Å; P19-V23 PolarHBondContact O-N 3.06Å
20	Q	77.7	Confident	74.8	Confident	159 Å²	159	94.5 Å²	94.5	74%	0.743	50%	0.497	S	S	*	.	H	α-helix	trans	-74.7	-43.4	-173.2	-67.7	178.7	-4.6	0	0	111.1	D18 Y22 K24	D18-Q20 VanDerWaalsContact C-N 3.27Å; D18-Q20 PolarHBondContact O-N 3.09Å; D18-Q20 PolarHBondContact OD1-N 2.93Å; Q20-Y22 VanDerWaalsContact C-N 3.34Å; Q20-K24 WeakPolarHBondContact O-CB 3.31Å; Q20-K24 PolarHBondContact O-N 2.87Å
21	N	77.3	Confident	74.4	Confident	89 Å²	89	94.9 Å²	94.9	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-67.4	-35	174.4	-81.6	-37.4	0	0	0	112.3	D18 K24 N25	D18-N21 HydrophobicContact CB-CB 4.29Å; D18-N21 PolarHBondContact OD2-ND2 3.35Å; N21-K24 PolarHBondContact O-N 3.46Å; N21-N25 PolarHBondContact O-N 3.03Å; N21-N25 PolarHBondContact O-ND2 3.49Å
22	Y	78.5	Confident	74.4	Confident	41 Å²	41	91.2 Å²	91.2	16%	0.161	50%	0.498	C	S	.	.	H	α-helix	trans	-63.6	-48.9	175.4	-179.1	-101	0	0	0	112.4	L8 F17 D18 Q20 K24 N25 L26 I43	L8-Y22 WeakPolarHBondContact CD1-OH 3.42Å; F17-Y22 HydrophobicContact CE2-CD1 4.27Å; F17-Y22 AromaticContact CE2-CD2 3.74Å; F17-Y22 HydrophobicContact CE2-CD2 3.74Å; F17-Y22 HydrophobicContact CE2-CE2 4.39Å; F17-Y22 AromaticContact CE2-CG 3.65Å; F17-Y22 HydrophobicContact CE2-CG 3.65Å; F17-Y22 AromaticContact CZ-CD1 3.84Å; F17-Y22 HydrophobicContact CZ-CD1 3.84Å; F17-Y22 HydrophobicContact CZ-CD2 4.17Å; F17-Y22 AromaticContact CZ-CG 3.63Å; F17-Y22 HydrophobicContact CZ-CG 3.63Å; D18-Y22 WeakPolarHBondContact O-CB 3.29Å; D18-Y22 PolarHBondContact O-N 3.47Å; D18-Y22 VanDerWaalsContact O-N 3.11Å; Q20-Y22 VanDerWaalsContact C-N 3.34Å; Y22-K24 VanDerWaalsContact C-N 3.31Å; Y22-K24 PolarHBondContact O-N 3.06Å; Y22-N25 PolarHBondContact O-N 3.26Å; Y22-L26 WeakPolarHBondContact O-CB 3.48Å; Y22-L26 PolarHBondContact O-N 3.15Å; Y22-I43 HydrophobicContact CE1-CD1 4.3Å
23	V	77.2	Confident	74.4	Confident	91 Å²	91	94.4 Å²	94.4	55%	0.552	52%	0.515	S	S	*	.	H	α-helix	trans	-64.7	-37.1	177.8	173.8	0	0	0	0	111.1	P19 L26 S27	P19-V23 VanDerWaalsContact O-CG2 3.3Å; P19-V23 WeakPolarHBondContact O-CG2 3.39Å; P19-V23 PolarHBondContact O-N 3.06Å; V23-L26 PolarHBondContact O-N 3.47Å; V23-S27 WeakPolarHBondContact O-CB 3.15Å; V23-S27 PolarHBondContact O-N 2.7Å; V23-S27 PolarHBondContact O-OG 3Å
24	K	77	Confident	74.4	Confident	119 Å²	119	97.2 Å²	97.2	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-62.4	-47.1	176.4	-167.9	176.2	-178.2	-179.6	0	111.9	Q20 N21 Y22 S27 Q28	Q20-K24 WeakPolarHBondContact O-CB 3.31Å; Q20-K24 PolarHBondContact O-N 2.87Å; N21-K24 PolarHBondContact O-N 3.46Å; Y22-K24 VanDerWaalsContact C-N 3.31Å; Y22-K24 PolarHBondContact O-N 3.06Å; K24-S27 PolarHBondContact O-N 2.98Å; K24-S27 PolarHBondContact O-OG 3.34Å; K24-Q28 WeakPolarHBondContact O-CG 3.39Å; K24-Q28 PolarHBondContact O-N 2.69Å; K24-Q28 VanDerWaalsContact O-N 3.12Å
25	N	76.3	Confident	74.2	Confident	86 Å²	86	97.4 Å²	97.4	46%	0.46	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-38.1	176.1	-71.2	-18.6	0	0	0	112.3	N21 Y22 S27 Q28 Q29	N21-N25 PolarHBondContact O-N 3.03Å; N21-N25 PolarHBondContact O-ND2 3.49Å; Y22-N25 PolarHBondContact O-N 3.26Å; N25-S27 VanDerWaalsContact C-N 3.35Å; N25-Q28 PolarHBondContact O-N 3.32Å; N25-Q29 WeakPolarHBondContact O-CG 3.46Å; N25-Q29 PolarHBondContact O-N 3.11Å
26	L	74.6	Confident	74.6	Confident	29 Å²	29	95.3 Å²	95.3	15%	0.152	49%	0.491	C	S	.	.	H	α-helix	trans	-63.3	-41.5	176	-164.5	81.1	0	0	0	111.3	Y22 V23 Q28 Q29 S30 L36 H39	Y22-L26 WeakPolarHBondContact O-CB 3.48Å; Y22-L26 PolarHBondContact O-N 3.15Å; V23-L26 PolarHBondContact O-N 3.47Å; L26-Q28 VanDerWaalsContact C-N 3.32Å; L26-Q28 PolarHBondContact O-N 3.08Å; L26-Q29 PolarHBondContact O-N 3.18Å; L26-S30 WeakPolarHBondContact O-CB 3.35Å; L26-S30 PolarHBondContact O-N 3.47Å; L26-S30 PolarHBondContact O-OG 2.57Å; L26-L36 HydrophobicContact CD2-CD2 4.04Å; L26-L36 HydrophobicContact CG-CD2 4.18Å; L26-H39 HydrophobicContact CD2-CB 4.27Å
27	S	71.8	Confident	74.9	Confident	63 Å²	63	93.3 Å²	93.3	44%	0.441	48%	0.476	S	S	.	.	H	α-helix	trans	-68.6	-27.9	177.2	72.8	0	0	0	0	113.7	V23 K24 N25	V23-S27 WeakPolarHBondContact O-CB 3.15Å; V23-S27 PolarHBondContact O-N 2.7Å; V23-S27 PolarHBondContact O-OG 3Å; K24-S27 PolarHBondContact O-N 2.98Å; K24-S27 PolarHBondContact O-OG 3.34Å; N25-S27 VanDerWaalsContact C-N 3.35Å
28	Q	74.9	Confident	74.9	Confident	136 Å²	136	94.1 Å²	94.1	64%	0.636	48%	0.481	S	S	*	.	H	α-helix	trans	-80.1	-21.9	178	-75.3	179.7	-7.7	0	0	113.5	K24 N25 L26	K24-Q28 WeakPolarHBondContact O-CG 3.39Å; K24-Q28 PolarHBondContact O-N 2.69Å; K24-Q28 VanDerWaalsContact O-N 3.12Å; N25-Q28 PolarHBondContact O-N 3.32Å; L26-Q28 VanDerWaalsContact C-N 3.32Å; L26-Q28 PolarHBondContact O-N 3.08Å
29	Q	70.3	Confident	74.9	Confident	163 Å²	163	93.5 Å²	93.5	76%	0.762	48%	0.476	S	S	*	.	H	α-helix	trans	-99.3	-8.7	-178.6	-70.2	-179.6	-3.4	0	0	113.6	N25 L26	N25-Q29 WeakPolarHBondContact O-CG 3.46Å; N25-Q29 PolarHBondContact O-N 3.11Å; L26-Q29 PolarHBondContact O-N 3.18Å
30	S	68.8	Low	75.1	Confident	22 Å²	22	98.7 Å²	98.7	15%	0.154	49%	0.485	C	S	.	.			trans	-104.7	115.6	-175.5	-53	0	0	0	0	110.1	L26 G32	L26-S30 WeakPolarHBondContact O-CB 3.35Å; L26-S30 PolarHBondContact O-N 3.47Å; L26-S30 PolarHBondContact O-OG 2.57Å; S30-G32 PolarHBondContact O-N 3.49Å
31	D	64.4	Low	75.4	Confident	168 Å²	168	97.6 Å²	97.6	90%	0.898	48%	0.48	S	S	*	.			trans	-83	9.1	-176.6	-77.5	-29.3	0	0	0	113.7
32	G	72.5	Confident	75.6	Confident	31 Å²	31	98 Å²	98	32%	0.32	48%	0.478	S	S	.	.	S	Bend	trans	-170.9	162.1	176.8	0	0	0	0	0	116	S30 R34 D35	S30-G32 PolarHBondContact O-N 3.49Å; G32-R34 PolarHBondContact O-N 2.83Å; G32-D35 PolarHBondContact O-N 3.14Å
33	D	72.8	Confident	75.8	Confident	125 Å²	125	98.7 Å²	98.7	67%	0.668	48%	0.483	S	S	*	.	H	α-helix	trans	-59.4	-32.9	-179.5	-167	33.6	0	0	0	112.6	D35 L36 Q37	D33-D35 PolarHBondContact O-N 2.98Å; D33-L36 PolarHBondContact O-N 3.31Å; D33-Q37 WeakPolarHBondContact O-CB 3.21Å; D33-Q37 PolarHBondContact O-N 3.42Å
34	R	74.8	Confident	76.2	Confident	181 Å²	181	99.3 Å²	99.3	68%	0.683	48%	0.48	S	S	*	.	H	α-helix	trans	-62.7	-40.8	179.5	-161.4	-177.6	77.6	-169.6	1.4	112.6	G32 Q37 E38	G32-R34 PolarHBondContact O-N 2.83Å; R34-Q37 PolarHBondContact O-N 3.49Å; R34-E38 PolarHBondContact O-N 3.29Å
35	D	74.2	Confident	76.7	Confident	61 Å²	61	97.6 Å²	97.6	33%	0.326	48%	0.48	S	S	.	.	H	α-helix	trans	-72.5	-36.5	-177.1	-66.8	-13.8	0	0	0	111.1	G32 D33 Q37 E38 H39	G32-D35 PolarHBondContact O-N 3.14Å; D33-D35 PolarHBondContact O-N 2.98Å; D35-Q37 VanDerWaalsContact C-N 3.35Å; D35-E38 PolarHBondContact O-N 2.93Å; D35-H39 WeakPolarHBondContact O-CB 3.31Å; D35-H39 PolarHBondContact O-CD2 3.38Å; D35-H39 PolarHBondContact O-N 3.44Å
36	L	76.3	Confident	77.1	Confident	63 Å²	63	94.8 Å²	94.8	33%	0.33	47%	0.465	S	S	.	.	H	α-helix	trans	-65	-39.3	172.9	-70.1	172.8	0	0	0	111.7	L26 D33 H39 R40	L26-L36 HydrophobicContact CD2-CD2 4.04Å; L26-L36 HydrophobicContact CG-CD2 4.18Å; D33-L36 PolarHBondContact O-N 3.31Å; L36-H39 PolarHBondContact O-N 3.17Å; L36-R40 WeakPolarHBondContact O-CB 3.35Å; L36-R40 PolarHBondContact O-N 3.12Å
37	Q	78.5	Confident	77.5	Confident	120 Å²	120	95.4 Å²	95.4	56%	0.561	47%	0.474	S	S	*	.	H	α-helix	trans	-70	-38.9	179.1	-158.4	159.1	7.1	0	0	112	D33 R34 D35 R40 Q41	D33-Q37 WeakPolarHBondContact O-CB 3.21Å; D33-Q37 PolarHBondContact O-N 3.42Å; R34-Q37 PolarHBondContact O-N 3.49Å; D35-Q37 VanDerWaalsContact C-N 3.35Å; Q37-R40 PolarHBondContact O-N 2.85Å; Q37-Q41 WeakPolarHBondContact O-CB 3.33Å; Q37-Q41 PolarHBondContact O-N 3.49Å
38	E	80.6	Confident	78.2	Confident	83 Å²	83	96.4 Å²	96.4	39%	0.388	47%	0.474	S	S	.	.	H	α-helix	trans	-63.5	-42.2	170.8	-76.9	-171.9	-162.1	0	0	112.3	R34 D35 Q41 K42	R34-E38 PolarHBondContact O-N 3.29Å; D35-E38 PolarHBondContact O-N 2.93Å; E38-Q41 PolarHBondContact O-N 2.87Å; E38-K42 VanDerWaalsContact O-CG 3.31Å; E38-K42 WeakPolarHBondContact O-CG 3.39Å; E38-K42 PolarHBondContact O-N 3.31Å; E38-K42 IonicContact OE2-NZ 3.72Å
39	H	77.6	Confident	78.7	Confident	55 Å²	55	94.2 Å²	94.2	26%	0.255	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-40.4	176.3	-93.3	-77.8	0	0	0	112.4	L26 D35 L36 Q41 K42 I43	L26-H39 HydrophobicContact CD2-CB 4.27Å; D35-H39 WeakPolarHBondContact O-CB 3.31Å; D35-H39 PolarHBondContact O-CD2 3.38Å; D35-H39 PolarHBondContact O-N 3.44Å; L36-H39 PolarHBondContact O-N 3.17Å; H39-Q41 VanDerWaalsContact C-N 3.34Å; H39-Q41 PolarHBondContact O-N 3.46Å; H39-K42 PolarHBondContact O-N 3.11Å; H39-I43 WeakPolarHBondContact O-CG1 2.86Å; H39-I43 PolarHBondContact O-N 3.32Å
40	R	81.1	Confident	79.3	Confident	188 Å²	188	88.5 Å²	88.5	71%	0.709	44%	0.44	S	S	*	.	H	α-helix	trans	-60	-44.2	173.1	-178.4	180	174.5	-175.4	-1.3	111.4	L36 Q37 K42 I43 Q44	L36-R40 WeakPolarHBondContact O-CB 3.35Å; L36-R40 PolarHBondContact O-N 3.12Å; Q37-R40 PolarHBondContact O-N 2.85Å; R40-K42 VanDerWaalsContact C-N 3.34Å; R40-K42 PolarHBondContact O-N 2.79Å; R40-I43 PolarHBondContact O-N 2.86Å; R40-Q44 WeakPolarHBondContact O-CB 3.35Å; R40-Q44 PolarHBondContact O-N 2.78Å
41	Q	83.9	Confident	80	Confident	135 Å²	135	89.5 Å²	89.5	63%	0.631	45%	0.45	S	S	*	.	H	α-helix	trans	-65.1	-38	178.5	-166.6	172.8	13.2	0	0	112.1	Q37 E38 H39 Q44 T45	Q37-Q41 WeakPolarHBondContact O-CB 3.33Å; Q37-Q41 PolarHBondContact O-N 3.49Å; E38-Q41 PolarHBondContact O-N 2.87Å; H39-Q41 VanDerWaalsContact C-N 3.34Å; H39-Q41 PolarHBondContact O-N 3.46Å; Q41-Q44 PolarHBondContact O-N 3.46Å; Q41-T45 WeakPolarHBondContact O-CB 3.03Å; Q41-T45 PolarHBondContact O-N 3.3Å; Q41-T45 PolarHBondContact O-OG1 3.48Å
42	K	81.9	Confident	81	Confident	98 Å²	98	87.1 Å²	87.1	43%	0.426	43%	0.434	S	S	.	.	H	α-helix	trans	-62.9	-43.9	173.6	-71.8	165.7	-171.1	160.3	0	111.8	E38 H39 R40 T45 L46	E38-K42 VanDerWaalsContact O-CG 3.31Å; E38-K42 WeakPolarHBondContact O-CG 3.39Å; E38-K42 PolarHBondContact O-N 3.31Å; E38-K42 IonicContact OE2-NZ 3.72Å; H39-K42 PolarHBondContact O-N 3.11Å; R40-K42 VanDerWaalsContact C-N 3.34Å; R40-K42 PolarHBondContact O-N 2.79Å; K42-T45 PolarHBondContact O-N 3.11Å; K42-L46 PolarHBondContact O-N 2.85Å
43	I	82.5	Confident	81.5	Confident	55 Å²	55	88.4 Å²	88.4	28%	0.282	43%	0.433	S	S	.	.	H	α-helix	trans	-64.3	-43.9	176.6	-68.2	168.7	0	0	0	110.8	L8 Y22 H39 R40 T45 L46 A47	L8-I43 HydrophobicContact CD2-CG1 4.06Å; Y22-I43 HydrophobicContact CE1-CD1 4.3Å; H39-I43 WeakPolarHBondContact O-CG1 2.86Å; H39-I43 PolarHBondContact O-N 3.32Å; R40-I43 PolarHBondContact O-N 2.86Å; I43-T45 VanDerWaalsContact C-N 3.32Å; I43-T45 PolarHBondContact O-N 3.41Å; I43-L46 PolarHBondContact O-N 3.22Å; I43-A47 WeakPolarHBondContact O-CB 3.35Å; I43-A47 PolarHBondContact O-N 3.39Å
44	Q	85.2	Confident	81.9	Confident	104 Å²	104	87.9 Å²	87.9	49%	0.486	43%	0.43	S	S	.	.	H	α-helix	trans	-60	-43.8	177.4	-173.2	62	43.7	0	0	111.5	R40 Q41 L46 A47 D48	R40-Q44 WeakPolarHBondContact O-CB 3.35Å; R40-Q44 PolarHBondContact O-N 2.78Å; Q41-Q44 PolarHBondContact O-N 3.46Å; Q44-L46 PolarHBondContact O-N 3.1Å; Q44-A47 WeakPolarHBondContact O-CB 3.41Å; Q44-A47 PolarHBondContact O-N 3.5Å; Q44-D48 PolarHBondContact NE2-OD1 3.16Å; Q44-D48 PolarHBondContact O-N 3.3Å
45	T	86.9	Confident	82.3	Confident	83 Å²	83	85.9 Å²	85.9	51%	0.509	43%	0.426	S	S	.	.	H	α-helix	trans	-64.3	-41.1	178.9	-51.7	0	0	0	0	111.5	Q41 K42 I43 D48 E49	Q41-T45 WeakPolarHBondContact O-CB 3.03Å; Q41-T45 PolarHBondContact O-N 3.3Å; Q41-T45 PolarHBondContact O-OG1 3.48Å; K42-T45 PolarHBondContact O-N 3.11Å; I43-T45 VanDerWaalsContact C-N 3.32Å; I43-T45 PolarHBondContact O-N 3.41Å; T45-D48 PolarHBondContact O-N 2.88Å; T45-E49 WeakPolarHBondContact O-CB 3.3Å; T45-E49 PolarHBondContact O-N 3.39Å
46	L	84.6	Confident	82.8	Confident	27 Å²	27	89.6 Å²	89.6	14%	0.141	44%	0.439	C	S	.	.	H	α-helix	trans	-65.2	-37.1	174.2	-83.7	158.5	0	0	0	112.5	L8 K42 I43 Q44 T50	L8-L46 HydrophobicContact CD2-CD1 3.53Å; K42-L46 PolarHBondContact O-N 2.85Å; I43-L46 PolarHBondContact O-N 3.22Å; Q44-L46 PolarHBondContact O-N 3.1Å; L46-T50 WeakPolarHBondContact O-CB 3.31Å; L46-T50 WeakPolarHBondContact O-CG2 3.5Å; L46-T50 PolarHBondContact O-N 3.48Å; L46-T50 PolarHBondContact O-OG1 2.5Å
47	A	83.5	Confident	83	Confident	43 Å²	43	91.1 Å²	91.1	36%	0.355	45%	0.448	S	S	.	.	H	α-helix	trans	-65.2	-44.2	175.1	0	0	0	0	0	111.4	I43 Q44 T50 A51	I43-A47 WeakPolarHBondContact O-CB 3.35Å; I43-A47 PolarHBondContact O-N 3.39Å; Q44-A47 WeakPolarHBondContact O-CB 3.41Å; Q44-A47 PolarHBondContact O-N 3.5Å; A47-T50 WeakPolarHBondContact CA-OG1 3.25Å; A47-T50 PolarHBondContact O-N 3.11Å; A47-T50 PolarHBondContact O-OG1 2.9Å; A47-A51 VanDerWaalsContact O-CB 3.32Å; A47-A51 WeakPolarHBondContact O-CB 3.35Å; A47-A51 PolarHBondContact O-N 2.76Å
48	D	86.3	Confident	83.1	Confident	83 Å²	83	89.4 Å²	89.4	44%	0.444	45%	0.445	S	S	.	.	H	α-helix	trans	-66.4	-39.9	177.9	-66.2	-27	0	0	0	111.4	Q44 T45 A51 Q52	Q44-D48 PolarHBondContact NE2-OD1 3.16Å; Q44-D48 PolarHBondContact O-N 3.3Å; T45-D48 PolarHBondContact O-N 2.88Å; D48-A51 PolarHBondContact O-N 3.3Å; D48-Q52 WeakPolarHBondContact O-CG 3.29Å; D48-Q52 PolarHBondContact O-N 3.47Å
49	E	86.4	Confident	82.9	Confident	91 Å²	91	94 Å²	94	43%	0.425	46%	0.461	S	S	.	.	H	α-helix	trans	-66.4	-42.3	176.3	-165.8	-170.7	161.4	0	0	112.2	T45 Q52 N53	T45-E49 WeakPolarHBondContact O-CB 3.3Å; T45-E49 PolarHBondContact O-N 3.39Å; E49-Q52 PolarHBondContact O-N 3.47Å; E49-N53 WeakPolarHBondContact O-CB 3.32Å; E49-N53 VanDerWaalsContact O-CG 3.31Å; E49-N53 PolarHBondContact O-N 3.21Å; E49-N53 PolarHBondContact O-ND2 2.95Å
50	T	83	Confident	83	Confident	42 Å²	42	99.2 Å²	99.2	26%	0.258	48%	0.482	S	S	.	.	H	α-helix	trans	-66.9	-40.1	175.9	44.1	0	0	0	0	111.7	L46 A47 Q52 N53 L54	L46-T50 WeakPolarHBondContact O-CB 3.31Å; L46-T50 WeakPolarHBondContact O-CG2 3.5Å; L46-T50 PolarHBondContact O-N 3.48Å; L46-T50 PolarHBondContact O-OG1 2.5Å; A47-T50 WeakPolarHBondContact CA-OG1 3.25Å; A47-T50 PolarHBondContact O-N 3.11Å; A47-T50 PolarHBondContact O-OG1 2.9Å; T50-Q52 PolarHBondContact O-N 2.96Å; T50-N53 PolarHBondContact O-N 3.01Å; T50-L54 WeakPolarHBondContact O-CB 3.15Å; T50-L54 PolarHBondContact O-N 3.36Å
51	A	82.5	Confident	82.9	Confident	43 Å²	43	93 Å²	93	36%	0.355	46%	0.463	S	S	.	.	H	α-helix	trans	-62.1	-41.2	173.9	0	0	0	0	0	112.2	A47 D48 K55	A47-A51 VanDerWaalsContact O-CB 3.32Å; A47-A51 WeakPolarHBondContact O-CB 3.35Å; A47-A51 PolarHBondContact O-N 2.76Å; D48-A51 PolarHBondContact O-N 3.3Å; A51-K55 WeakPolarHBondContact O-CG 3.25Å; A51-K55 PolarHBondContact O-N 2.78Å
52	Q	85.4	Confident	82.7	Confident	118 Å²	118	93 Å²	93	55%	0.551	46%	0.458	S	S	*	.	H	α-helix	trans	-66.7	-40.5	174.6	-75.1	-175.8	10.2	0	0	112.5	D48 E49 T50 K55 K56	D48-Q52 WeakPolarHBondContact O-CG 3.29Å; D48-Q52 PolarHBondContact O-N 3.47Å; E49-Q52 PolarHBondContact O-N 3.47Å; T50-Q52 PolarHBondContact O-N 2.96Å; Q52-K55 PolarHBondContact O-N 3.18Å; Q52-K56 WeakPolarHBondContact O-CG 3.16Å; Q52-K56 PolarHBondContact O-N 2.6Å
53	N	83.8	Confident	82.5	Confident	58 Å²	58	96.8 Å²	96.8	31%	0.31	47%	0.47	S	S	.	.	H	α-helix	trans	-67.4	-39	177.2	-76.8	-31.8	0	0	0	112	E49 T50 K56 N57	E49-N53 WeakPolarHBondContact O-CB 3.32Å; E49-N53 VanDerWaalsContact O-CG 3.31Å; E49-N53 PolarHBondContact O-N 3.21Å; E49-N53 PolarHBondContact O-ND2 2.95Å; T50-N53 PolarHBondContact O-N 3.01Å; N53-K56 PolarHBondContact O-N 2.92Å; N53-N57 WeakPolarHBondContact O-CB 3.43Å; N53-N57 PolarHBondContact O-N 3.08Å
54	L	82	Confident	82.5	Confident	115 Å²	115	100 Å²	100	60%	0.602	48%	0.484	S	S	*	.	H	α-helix	trans	-59.9	-48.5	170.7	-85.1	158.6	0	0	0	110.8	T50 K56 N57 V58	T50-L54 WeakPolarHBondContact O-CB 3.15Å; T50-L54 PolarHBondContact O-N 3.36Å; L54-K56 PolarHBondContact O-N 2.84Å; L54-N57 PolarHBondContact O-N 2.87Å; L54-V58 WeakPolarHBondContact O-CB 3.35Å; L54-V58 VanDerWaalsContact O-CG2 3.27Å; L54-V58 WeakPolarHBondContact O-CG2 3.45Å; L54-V58 PolarHBondContact O-N 2.83Å
55	K	82.4	Confident	82.5	Confident	139 Å²	139	101.6 Å²	101.6	60%	0.604	49%	0.489	S	S	*	.	H	α-helix	trans	-56.6	-48.8	175.1	-75.8	176	-177.9	179.2	0	111.3	A51 Q52 N57 V58 Y59	A51-K55 WeakPolarHBondContact O-CG 3.25Å; A51-K55 PolarHBondContact O-N 2.78Å; Q52-K55 PolarHBondContact O-N 3.18Å; K55-N57 PolarHBondContact O-N 2.99Å; K55-V58 PolarHBondContact O-N 2.68Å; K55-Y59 HydrophobicContact CB-CD2 4.4Å; K55-Y59 HydrophobicContact CB-CE2 4.43Å; K55-Y59 WeakPolarHBondContact O-CB 3.01Å; K55-Y59 WeakPolarHBondContact O-CD2 3.18Å; K55-Y59 PolarHBondContact O-N 3.38Å
56	K	84	Confident	82.3	Confident	138 Å²	138	100.8 Å²	100.8	60%	0.6	48%	0.481	S	S	*	.	H	α-helix	trans	-60.8	-42.7	178.3	-76.4	178.9	-179.5	174	0	112.6	Q52 N53 L54 Y59 K60	Q52-K56 WeakPolarHBondContact O-CG 3.16Å; Q52-K56 PolarHBondContact O-N 2.6Å; N53-K56 PolarHBondContact O-N 2.92Å; L54-K56 PolarHBondContact O-N 2.84Å; K56-Y59 PolarHBondContact O-N 2.87Å; K56-K60 VanDerWaalsContact O-CB 3.32Å; K56-K60 WeakPolarHBondContact O-CB 3.47Å; K56-K60 PolarHBondContact O-N 3.22Å
57	N	81.4	Confident	82.1	Confident	95 Å²	95	103.6 Å²	103.6	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-66.5	-41.8	176.6	-91.2	-26.6	0	0	0	112.1	N53 L54 K55 K60 N61	N53-N57 WeakPolarHBondContact O-CB 3.43Å; N53-N57 PolarHBondContact O-N 3.08Å; L54-N57 PolarHBondContact O-N 2.87Å; K55-N57 PolarHBondContact O-N 2.99Å; N57-K60 PolarHBondContact O-N 3.08Å; N57-N61 WeakPolarHBondContact O-CB 3.31Å; N57-N61 PolarHBondContact O-N 2.89Å; N57-N61 PolarHBondContact O-ND2 2.99Å; N57-N61 VanDerWaalsContact O-ND2 3.14Å
58	V	80.1	Confident	82.3	Confident	84 Å²	84	104.8 Å²	104.8	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-60.8	-51.2	173.7	172.2	0	0	0	0	109.5	L54 K55 K60 N61 Y62	L54-V58 WeakPolarHBondContact O-CB 3.35Å; L54-V58 VanDerWaalsContact O-CG2 3.27Å; L54-V58 WeakPolarHBondContact O-CG2 3.45Å; L54-V58 PolarHBondContact O-N 2.83Å; K55-V58 PolarHBondContact O-N 2.68Å; V58-K60 VanDerWaalsContact C-N 3.34Å; V58-K60 PolarHBondContact O-N 3.46Å; V58-N61 CarbonylContact O-C 3.54Å; V58-N61 PolarHBondContact O-N 3.33Å; V58-Y62 WeakPolarHBondContact O-CA 3.15Å; V58-Y62 WeakPolarHBondContact O-CB 3.17Å; V58-Y62 PolarHBondContact O-N 3.48Å
59	Y	77.2	Confident	82.5	Confident	181 Å²	181	103.6 Å²	103.6	71%	0.71	50%	0.499	S	S	*	.	H	α-helix	trans	-59	-40.7	178.4	-82.9	-66.4	0	0	0	113.4	K55 K56 Y62	K55-Y59 HydrophobicContact CB-CD2 4.4Å; K55-Y59 HydrophobicContact CB-CE2 4.43Å; K55-Y59 WeakPolarHBondContact O-CB 3.01Å; K55-Y59 WeakPolarHBondContact O-CD2 3.18Å; K55-Y59 PolarHBondContact O-N 3.38Å; K56-Y59 PolarHBondContact O-N 2.87Å; Y59-Y62 WeakPolarHBondContact O-CB 3.3Å; Y59-Y62 PolarHBondContact O-N 3.42Å
60	K	77.9	Confident	82.5	Confident	163 Å²	163	106.1 Å²	106.1	71%	0.709	51%	0.508	S	S	*	.	H	α-helix	trans	-65.8	-41	178.9	-170.2	179.1	179.4	-175.8	0	111.9	K56 N57 V58	K56-K60 VanDerWaalsContact O-CB 3.32Å; K56-K60 WeakPolarHBondContact O-CB 3.47Å; K56-K60 PolarHBondContact O-N 3.22Å; N57-K60 PolarHBondContact O-N 3.08Å; V58-K60 VanDerWaalsContact C-N 3.34Å; V58-K60 PolarHBondContact O-N 3.46Å
61	N	79.1	Confident	82.9	Confident	58 Å²	58	110.2 Å²	110.2	31%	0.31	52%	0.524	S	S	.	.	H	α-helix	trans	-87.9	-12.8	179.8	-62.2	-35.2	0	0	0	112.8	N57 V58 R63 Q64 F65	N57-N61 WeakPolarHBondContact O-CB 3.31Å; N57-N61 PolarHBondContact O-N 2.89Å; N57-N61 PolarHBondContact O-ND2 2.99Å; N57-N61 VanDerWaalsContact O-ND2 3.14Å; V58-N61 CarbonylContact O-C 3.54Å; V58-N61 PolarHBondContact O-N 3.33Å; N61-R63 PolarHBondContact O-N 3.4Å; N61-Q64 PolarHBondContact O-N 3.06Å; N61-F65 HydrophobicContact CB-CD2 3.88Å; N61-F65 HydrophobicContact CB-CE2 3.69Å; N61-F65 WeakPolarHBondContact O-CD2 3.48Å; N61-F65 PolarHBondContact O-N 3.14Å
62	Y	80.4	Confident	83.3	Confident	134 Å²	134	113.3 Å²	113.3	53%	0.525	53%	0.534	S	S	.	.	H	α-helix	trans	-58.3	-39.4	-177	-163.3	-112.1	0	0	0	111.7	V58 Y59 F65 I66	V58-Y62 WeakPolarHBondContact O-CA 3.15Å; V58-Y62 WeakPolarHBondContact O-CB 3.17Å; V58-Y62 PolarHBondContact O-N 3.48Å; Y59-Y62 WeakPolarHBondContact O-CB 3.3Å; Y59-Y62 PolarHBondContact O-N 3.42Å; Y62-F65 PolarHBondContact O-N 3.41Å; Y62-I66 HydrophobicContact CD1-CD1 3.62Å; Y62-I66 HydrophobicContact CD1-CG1 4.4Å; Y62-I66 HydrophobicContact CE1-CD1 3.25Å; Y62-I66 HydrophobicContact CE1-CG1 4.26Å; Y62-I66 HydrophobicContact CG-CD1 4.42Å; Y62-I66 WeakPolarHBondContact O-CB 3.3Å; Y62-I66 WeakPolarHBondContact O-CG1 3.09Å; Y62-I66 PolarHBondContact O-N 2.77Å
63	R	77.3	Confident	83.5	Confident	178 Å²	178	111.1 Å²	111.1	67%	0.672	53%	0.531	S	S	*	.	H	α-helix	trans	-63.3	-46	176.3	-173.5	177.2	179.9	127.6	2.2	111.7	N61 I66 E67	N61-R63 PolarHBondContact O-N 3.4Å; R63-I66 PolarHBondContact O-N 2.94Å; R63-E67 IonicContact CZ-OE1 2.64Å; R63-E67 IonicContact NE-OE1 2.69Å; R63-E67 PolarHBondContact NE-OE1 3.45Å; R63-E67 IonicContact NH2-OE1 3.63Å; R63-E67 PolarHBondContact NH2-OE1 2.82Å; R63-E67 WeakPolarHBondContact O-CB 3.46Å; R63-E67 WeakPolarHBondContact O-CG 3.4Å; R63-E67 PolarHBondContact O-N 2.87Å
64	Q	82.3	Confident	83.8	Confident	124 Å²	124	115.3 Å²	115.3	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-66.3	-40.1	178.5	-71.8	179.9	-17	0	0	111.7	N61 E67 T68	N61-Q64 PolarHBondContact O-N 3.06Å; Q64-E67 PolarHBondContact O-N 3.02Å; Q64-T68 PolarHBondContact O-N 2.96Å; Q64-T68 PolarHBondContact O-OG1 3.12Å
65	F	85.3	Confident	84.3	Confident	137 Å²	137	114.9 Å²	114.9	60%	0.601	54%	0.541	S	S	*	.	H	α-helix	trans	-63.9	-39.6	174.6	-78.7	-63.6	0	0	0	112.4	N61 Y62 T68 A69	N61-F65 HydrophobicContact CB-CD2 3.88Å; N61-F65 HydrophobicContact CB-CE2 3.69Å; N61-F65 WeakPolarHBondContact O-CD2 3.48Å; N61-F65 PolarHBondContact O-N 3.14Å; Y62-F65 PolarHBondContact O-N 3.41Å; F65-T68 WeakPolarHBondContact CA-OG1 3.42Å; F65-T68 PolarHBondContact O-OG1 3.26Å; F65-A69 WeakPolarHBondContact O-CB 3.37Å; F65-A69 PolarHBondContact O-N 2.67Å
66	I	82.8	Confident	84.8	Confident	65 Å²	65	112.6 Å²	112.6	33%	0.333	53%	0.533	S	S	.	.	H	α-helix	trans	-68.6	-42.5	175.4	-73.1	-178.8	0	0	0	111	Y62 R63 A69 K70	Y62-I66 HydrophobicContact CD1-CD1 3.62Å; Y62-I66 HydrophobicContact CD1-CG1 4.4Å; Y62-I66 HydrophobicContact CE1-CD1 3.25Å; Y62-I66 HydrophobicContact CE1-CG1 4.26Å; Y62-I66 HydrophobicContact CG-CD1 4.42Å; Y62-I66 WeakPolarHBondContact O-CB 3.3Å; Y62-I66 WeakPolarHBondContact O-CG1 3.09Å; Y62-I66 PolarHBondContact O-N 2.77Å; R63-I66 PolarHBondContact O-N 2.94Å; I66-A69 PolarHBondContact O-N 3.14Å; I66-K70 HydrophobicContact CG2-CD 4.08Å; I66-K70 HydrophobicContact CG2-CG 4.44Å; I66-K70 WeakPolarHBondContact O-CB 3.25Å; I66-K70 VanDerWaalsContact O-CG 3.27Å; I66-K70 WeakPolarHBondContact O-CG 3.25Å; I66-K70 PolarHBondContact O-N 2.73Å
67	E	81.3	Confident	84.9	Confident	86 Å²	86	108.8 Å²	108.8	40%	0.402	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-47	178	-76.4	170.3	-176.6	0	0	110.7	R63 Q64 K70 E71	R63-E67 IonicContact CZ-OE1 2.64Å; R63-E67 IonicContact NE-OE1 2.69Å; R63-E67 PolarHBondContact NE-OE1 3.45Å; R63-E67 IonicContact NH2-OE1 3.63Å; R63-E67 PolarHBondContact NH2-OE1 2.82Å; R63-E67 WeakPolarHBondContact O-CB 3.46Å; R63-E67 WeakPolarHBondContact O-CG 3.4Å; R63-E67 PolarHBondContact O-N 2.87Å; Q64-E67 PolarHBondContact O-N 3.02Å; E67-K70 PolarHBondContact O-N 2.87Å; E67-E71 WeakPolarHBondContact O-CG 3.37Å; E67-E71 PolarHBondContact O-N 3.42Å
68	T	87.6	Confident	85.5	Confident	68 Å²	68	108.1 Å²	108.1	42%	0.417	52%	0.517	S	S	.	.	H	α-helix	trans	-65	-40.8	174.5	33.1	0	0	0	0	113.1	Q64 F65 K70 E71 I72	Q64-T68 PolarHBondContact O-N 2.96Å; Q64-T68 PolarHBondContact O-OG1 3.12Å; F65-T68 WeakPolarHBondContact CA-OG1 3.42Å; F65-T68 PolarHBondContact O-OG1 3.26Å; T68-K70 VanDerWaalsContact C-N 3.29Å; T68-K70 PolarHBondContact O-N 3.43Å; T68-E71 PolarHBondContact O-N 3.27Å; T68-I72 VanDerWaalsContact O-CG1 3.26Å; T68-I72 WeakPolarHBondContact O-CG1 3.2Å; T68-I72 PolarHBondContact O-N 3.03Å
69	A	89.9	Confident	86	Confident	59 Å²	59	109.9 Å²	109.9	49%	0.488	52%	0.522	S	S	.	.	H	α-helix	trans	-63.5	-36.1	175.5	0	0	0	0	0	112.2	F65 I66 S73	F65-A69 WeakPolarHBondContact O-CB 3.37Å; F65-A69 PolarHBondContact O-N 2.67Å; I66-A69 PolarHBondContact O-N 3.14Å; A69-S73 WeakPolarHBondContact O-CB 3.3Å; A69-S73 PolarHBondContact O-N 3Å
70	K	87.6	Confident	86.6	Confident	144 Å²	144	108.3 Å²	108.3	63%	0.626	52%	0.515	S	S	*	.	H	α-helix	trans	-67.6	-42.6	173.5	-78.6	178.1	178.4	-176.4	0	112	I66 E67 T68 S73 Y74	I66-K70 HydrophobicContact CG2-CD 4.08Å; I66-K70 HydrophobicContact CG2-CG 4.44Å; I66-K70 WeakPolarHBondContact O-CB 3.25Å; I66-K70 VanDerWaalsContact O-CG 3.27Å; I66-K70 WeakPolarHBondContact O-CG 3.25Å; I66-K70 PolarHBondContact O-N 2.73Å; E67-K70 PolarHBondContact O-N 2.87Å; T68-K70 VanDerWaalsContact C-N 3.29Å; T68-K70 PolarHBondContact O-N 3.43Å; K70-S73 PolarHBondContact O-N 3.2Å; K70-Y74 WeakPolarHBondContact O-CB 3.38Å; K70-Y74 PolarHBondContact O-N 3.36Å
71	E	90.9	Very high	87.1	Confident	127 Å²	127	106.1 Å²	106.1	59%	0.593	51%	0.508	S	S	*	.	H	α-helix	trans	-62.9	-41.5	175.3	-75.1	-179.2	178.5	0	0	111.7	E67 T68 Y74 L75	E67-E71 WeakPolarHBondContact O-CG 3.37Å; E67-E71 PolarHBondContact O-N 3.42Å; T68-E71 PolarHBondContact O-N 3.27Å; E71-Y74 PolarHBondContact O-N 3.26Å; E71-L75 WeakPolarHBondContact O-CB 3.48Å; E71-L75 PolarHBondContact O-N 3.17Å
72	I	91.7	Very high	87.6	Confident	109 Å²	109	108.3 Å²	108.3	56%	0.559	52%	0.519	S	S	*	.	H	α-helix	trans	-62.1	-44.7	175	-68.9	165	0	0	0	110.8	T68 Y74 L75 E76	T68-I72 VanDerWaalsContact O-CG1 3.26Å; T68-I72 WeakPolarHBondContact O-CG1 3.2Å; T68-I72 PolarHBondContact O-N 3.03Å; I72-Y74 VanDerWaalsContact C-N 3.32Å; I72-Y74 PolarHBondContact O-N 2.85Å; I72-L75 PolarHBondContact O-N 2.92Å; I72-E76 WeakPolarHBondContact O-CB 3.46Å; I72-E76 PolarHBondContact O-N 3.04Å
73	S	89.2	Confident	88.1	Confident	71 Å²	71	105 Å²	105	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-36.9	177.6	179	0	0	0	0	112.4	A69 K70 E76 S77	A69-S73 WeakPolarHBondContact O-CB 3.3Å; A69-S73 PolarHBondContact O-N 3Å; K70-S73 PolarHBondContact O-N 3.2Å; S73-E76 PolarHBondContact O-N 3.12Å; S73-S77 PolarHBondContact O-N 3.11Å; S73-S77 VanDerWaalsContact O-N 3.11Å
74	Y	89.3	Confident	88.8	Confident	146 Å²	146	102.7 Å²	102.7	57%	0.573	51%	0.512	S	S	*	.	H	α-helix	trans	-66.4	-46.3	175.1	-176.3	-95.8	0	0	0	111.4	K70 E71 I72 E76 S77 E78	K70-Y74 WeakPolarHBondContact O-CB 3.38Å; K70-Y74 PolarHBondContact O-N 3.36Å; E71-Y74 PolarHBondContact O-N 3.26Å; I72-Y74 VanDerWaalsContact C-N 3.32Å; I72-Y74 PolarHBondContact O-N 2.85Å; Y74-E76 VanDerWaalsContact C-N 3.32Å; Y74-E76 PolarHBondContact O-N 2.94Å; Y74-S77 WeakPolarHBondContact O-CB 3.48Å; Y74-S77 PolarHBondContact O-N 2.9Å; Y74-E78 HydrophobicContact CD1-CG 4.43Å; Y74-E78 HydrophobicContact CE1-CG 3.94Å; Y74-E78 WeakPolarHBondContact CE1-OE1 3.49Å; Y74-E78 VanDerWaalsContact CZ-OE1 3.25Å; Y74-E78 PolarHBondContact O-N 3.45Å; Y74-E78 PolarHBondContact OH-OE1 3.37Å
75	L	92.9	Very high	89.2	Confident	106 Å²	106	100.6 Å²	100.6	56%	0.555	50%	0.504	S	S	*	.	H	α-helix	trans	-60.1	-39.8	174.3	-85.1	159.6	0	0	0	112.6	E71 I72 S77 E78 M79	E71-L75 WeakPolarHBondContact O-CB 3.48Å; E71-L75 PolarHBondContact O-N 3.17Å; I72-L75 PolarHBondContact O-N 2.92Å; L75-S77 VanDerWaalsContact C-N 3.34Å; L75-S77 PolarHBondContact O-N 3.42Å; L75-E78 PolarHBondContact O-N 2.76Å; L75-M79 WeakPolarHBondContact O-CB 3.48Å; L75-M79 PolarHBondContact O-N 2.86Å
76	E	91.7	Very high	89.4	Confident	92 Å²	92	98.6 Å²	98.6	43%	0.43	50%	0.499	S	S	.	.	H	α-helix	trans	-60.8	-44.3	175.4	-178.5	177.7	-172.7	0	0	111	I72 S73 Y74 M79 Y80	I72-E76 WeakPolarHBondContact O-CB 3.46Å; I72-E76 PolarHBondContact O-N 3.04Å; S73-E76 PolarHBondContact O-N 3.12Å; Y74-E76 VanDerWaalsContact C-N 3.32Å; Y74-E76 PolarHBondContact O-N 2.94Å; E76-M79 PolarHBondContact O-N 2.95Å; E76-Y80 HydrophobicContact CG-CD2 3.85Å; E76-Y80 HydrophobicContact CG-CE2 3.51Å; E76-Y80 WeakPolarHBondContact O-CD2 3.24Å; E76-Y80 PolarHBondContact O-N 3.37Å; E76-Y80 WeakPolarHBondContact OE1-CE2 3.33Å
77	S	87.5	Confident	89.8	Confident	57 Å²	57	99.6 Å²	99.6	40%	0.399	51%	0.508	S	S	.	.	H	α-helix	trans	-61.8	-44.1	175.6	-177.2	0	0	0	0	112.5	S73 Y74 L75 M79 Y80 Q81	S73-S77 PolarHBondContact O-N 3.11Å; S73-S77 VanDerWaalsContact O-N 3.11Å; Y74-S77 WeakPolarHBondContact O-CB 3.48Å; Y74-S77 PolarHBondContact O-N 2.9Å; L75-S77 VanDerWaalsContact C-N 3.34Å; L75-S77 PolarHBondContact O-N 3.42Å; S77-M79 VanDerWaalsContact C-N 3.32Å; S77-M79 PolarHBondContact O-N 2.75Å; S77-Y80 PolarHBondContact O-N 3.45Å; S77-Q81 WeakPolarHBondContact O-CG 3.38Å; S77-Q81 PolarHBondContact O-N 3.17Å
78	E	93.7	Very high	90.1	Very high	81 Å²	81	100.6 Å²	100.6	38%	0.379	51%	0.513	S	S	.	.	H	α-helix	trans	-64.4	-37.7	176	-71.3	-171.8	150.1	0	0	111.6	Y74 L75 Q81 L82	Y74-E78 HydrophobicContact CD1-CG 4.43Å; Y74-E78 HydrophobicContact CE1-CG 3.94Å; Y74-E78 WeakPolarHBondContact CE1-OE1 3.49Å; Y74-E78 VanDerWaalsContact CZ-OE1 3.25Å; Y74-E78 PolarHBondContact O-N 3.45Å; Y74-E78 PolarHBondContact OH-OE1 3.37Å; L75-E78 PolarHBondContact O-N 2.76Å; E78-Q81 PolarHBondContact O-N 3.43Å; E78-L82 WeakPolarHBondContact O-CB 3.5Å; E78-L82 PolarHBondContact O-N 3.04Å
79	M	91.3	Very high	90.1	Very high	122 Å²	122	102.7 Å²	102.7	60%	0.601	52%	0.518	S	S	*	.	H	α-helix	trans	-65.5	-39.3	176.5	-166.8	-174.4	71.2	0	0	111.9	L75 E76 S77 L82 S83	L75-M79 WeakPolarHBondContact O-CB 3.48Å; L75-M79 PolarHBondContact O-N 2.86Å; E76-M79 PolarHBondContact O-N 2.95Å; S77-M79 VanDerWaalsContact C-N 3.32Å; S77-M79 PolarHBondContact O-N 2.75Å; M79-L82 PolarHBondContact O-N 3.44Å; M79-S83 WeakPolarHBondContact O-CB 3.41Å; M79-S83 PolarHBondContact O-N 3.28Å
80	Y	90.1	Very high	90	Very high	147 Å²	147	106 Å²	106	58%	0.576	52%	0.521	S	S	*	.	H	α-helix	trans	-64.2	-41.2	173	-82.9	-67.4	0	0	0	112.2	E76 S77 S83 H84	E76-Y80 HydrophobicContact CG-CD2 3.85Å; E76-Y80 HydrophobicContact CG-CE2 3.51Å; E76-Y80 WeakPolarHBondContact O-CD2 3.24Å; E76-Y80 PolarHBondContact O-N 3.37Å; E76-Y80 WeakPolarHBondContact OE1-CE2 3.33Å; S77-Y80 PolarHBondContact O-N 3.45Å; Y80-S83 PolarHBondContact O-N 2.85Å; Y80-H84 WeakPolarHBondContact O-CB 3.4Å; Y80-H84 PolarHBondContact O-N 2.85Å
81	Q	87.7	Confident	89.8	Confident	117 Å²	117	102.5 Å²	102.5	55%	0.547	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-44.9	175	-71.2	174	5.6	0	0	111.3	S77 E78 S83 H84 I85	S77-Q81 WeakPolarHBondContact O-CG 3.38Å; S77-Q81 PolarHBondContact O-N 3.17Å; E78-Q81 PolarHBondContact O-N 3.43Å; Q81-S83 PolarHBondContact O-N 2.77Å; Q81-H84 WeakPolarHBondContact O-CB 3.45Å; Q81-H84 PolarHBondContact O-N 3.45Å; Q81-I85 WeakPolarHBondContact O-CG1 3.28Å; Q81-I85 PolarHBondContact O-N 2.82Å
82	L	90.1	Very high	89.7	Confident	104 Å²	104	100.6 Å²	100.6	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-43.2	176.4	-168.8	76.6	0	0	0	111.6	E78 M79 H84 I85 L86	E78-L82 WeakPolarHBondContact O-CB 3.5Å; E78-L82 PolarHBondContact O-N 3.04Å; M79-L82 PolarHBondContact O-N 3.44Å; L82-H84 VanDerWaalsContact C-N 3.27Å; L82-H84 PolarHBondContact O-N 3Å; L82-I85 PolarHBondContact O-N 2.8Å; L82-L86 HydrophobicContact CG-CD1 4.3Å; L82-L86 WeakPolarHBondContact O-CB 3.25Å; L82-L86 WeakPolarHBondContact O-CG 3.31Å; L82-L86 PolarHBondContact O-N 3.12Å
83	S	90.6	Very high	89.2	Confident	65 Å²	65	101.5 Å²	101.5	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-59.9	-39.6	175	-174.8	0	0	0	0	111.6	M79 Y80 Q81 T87	M79-S83 WeakPolarHBondContact O-CB 3.41Å; M79-S83 PolarHBondContact O-N 3.28Å; Y80-S83 PolarHBondContact O-N 2.85Å; Q81-S83 PolarHBondContact O-N 2.77Å; S83-T87 WeakPolarHBondContact O-CB 3.49Å; S83-T87 PolarHBondContact O-N 3.28Å; S83-T87 PolarHBondContact O-OG1 2.93Å
84	H	91.4	Very high	88.8	Confident	129 Å²	129	102.8 Å²	102.8	60%	0.597	51%	0.51	S	S	*	.	H	α-helix	trans	-65.1	-48.3	177.1	-167.7	62.9	0	0	0	111.3	Y80 Q81 L82 L86 T87 E88	Y80-H84 WeakPolarHBondContact O-CB 3.4Å; Y80-H84 PolarHBondContact O-N 2.85Å; Q81-H84 WeakPolarHBondContact O-CB 3.45Å; Q81-H84 PolarHBondContact O-N 3.45Å; L82-H84 VanDerWaalsContact C-N 3.27Å; L82-H84 PolarHBondContact O-N 3Å; H84-L86 VanDerWaalsContact C-N 3.32Å; H84-L86 PolarHBondContact O-N 2.79Å; H84-T87 WeakPolarHBondContact O-CB 3.2Å; H84-T87 PolarHBondContact O-N 3.28Å; H84-T87 VanDerWaalsContact O-N 3.09Å; H84-E88 WeakPolarHBondContact O-CB 3Å; H84-E88 PolarHBondContact O-N 3.2Å
85	I	90.7	Very high	88.3	Confident	80 Å²	80	99.2 Å²	99.2	41%	0.41	51%	0.506	S	S	.	.	H	α-helix	trans	-59.4	-42.4	176.8	-66.2	166.5	0	0	0	111.1	Q81 L82 T87 E88 Q89	Q81-I85 WeakPolarHBondContact O-CG1 3.28Å; Q81-I85 PolarHBondContact O-N 2.82Å; L82-I85 PolarHBondContact O-N 2.8Å; I85-T87 VanDerWaalsContact C-N 3.32Å; I85-T87 PolarHBondContact O-N 2.88Å; I85-E88 PolarHBondContact O-N 2.9Å; I85-Q89 HydrophobicContact CG2-CG 4.41Å; I85-Q89 WeakPolarHBondContact O-CB 3.33Å; I85-Q89 WeakPolarHBondContact O-CG 3.39Å; I85-Q89 PolarHBondContact O-N 3.38Å
86	L	90.1	Very high	87.7	Confident	96 Å²	96	98.6 Å²	98.6	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-65	-36.6	176.5	-74.6	171.3	0	0	0	112.3	L82 H84 K90	L82-L86 HydrophobicContact CG-CD1 4.3Å; L82-L86 WeakPolarHBondContact O-CB 3.25Å; L82-L86 WeakPolarHBondContact O-CG 3.31Å; L82-L86 PolarHBondContact O-N 3.12Å; H84-L86 VanDerWaalsContact C-N 3.32Å; H84-L86 PolarHBondContact O-N 2.79Å; L86-K90 WeakPolarHBondContact O-CB 3.46Å; L86-K90 PolarHBondContact O-N 3.35Å
87	T	90.7	Very high	87	Confident	86 Å²	86	97.6 Å²	97.6	53%	0.528	50%	0.503	S	S	.	.	H	α-helix	trans	-68.3	-40.9	176.3	-52.2	0	0	0	0	110.9	S83 H84 I85 K90 S91	S83-T87 WeakPolarHBondContact O-CB 3.49Å; S83-T87 PolarHBondContact O-N 3.28Å; S83-T87 PolarHBondContact O-OG1 2.93Å; H84-T87 WeakPolarHBondContact O-CB 3.2Å; H84-T87 PolarHBondContact O-N 3.28Å; H84-T87 VanDerWaalsContact O-N 3.09Å; I85-T87 VanDerWaalsContact C-N 3.32Å; I85-T87 PolarHBondContact O-N 2.88Å; T87-K90 PolarHBondContact O-N 3.02Å; T87-S91 PolarHBondContact O-N 3.1Å
88	E	88.6	Confident	86.3	Confident	107 Å²	107	101.5 Å²	101.5	50%	0.5	52%	0.515	S	S	.	.	H	α-helix	trans	-66	-45.9	176	-167.2	176.4	-165.5	0	0	111.3	H84 I85 K90 S91 I92	H84-E88 WeakPolarHBondContact O-CB 3Å; H84-E88 PolarHBondContact O-N 3.2Å; I85-E88 PolarHBondContact O-N 2.9Å; E88-K90 VanDerWaalsContact C-N 3.31Å; E88-K90 PolarHBondContact O-N 2.96Å; E88-S91 WeakPolarHBondContact O-CB 3.33Å; E88-S91 PolarHBondContact O-N 3Å; E88-S91 VanDerWaalsContact O-N 3.14Å; E88-I92 HydrophobicContact CG-CD1 4.23Å; E88-I92 VanDerWaalsContact O-CG1 3.3Å; E88-I92 WeakPolarHBondContact O-CG1 3.48Å; E88-I92 PolarHBondContact O-N 3.31Å
89	Q	87	Confident	85	Confident	111 Å²	111	101.4 Å²	101.4	52%	0.519	52%	0.523	S	S	.	.	H	α-helix	trans	-60.5	-39.7	174.1	-75.8	-174.1	1.2	0	0	112.4	I85 I92 M93	I85-Q89 HydrophobicContact CG2-CG 4.41Å; I85-Q89 WeakPolarHBondContact O-CB 3.33Å; I85-Q89 WeakPolarHBondContact O-CG 3.39Å; I85-Q89 PolarHBondContact O-N 3.38Å; Q89-I92 PolarHBondContact O-N 2.94Å; Q89-M93 WeakPolarHBondContact O-CB 3.35Å; Q89-M93 PolarHBondContact O-N 3.15Å
90	K	87.8	Confident	83.7	Confident	129 Å²	129	101.6 Å²	101.6	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-62.2	-45.2	173.8	-176.5	-177.6	173.9	-171.8	0	111.1	L86 T87 E88 I92 M93 E94	L86-K90 WeakPolarHBondContact O-CB 3.46Å; L86-K90 PolarHBondContact O-N 3.35Å; T87-K90 PolarHBondContact O-N 3.02Å; E88-K90 VanDerWaalsContact C-N 3.31Å; E88-K90 PolarHBondContact O-N 2.96Å; K90-I92 PolarHBondContact O-N 3.37Å; K90-M93 PolarHBondContact O-N 3.02Å; K90-E94 WeakPolarHBondContact CE-OE1 3.23Å; K90-E94 IonicContact NZ-OE1 3.45Å; K90-E94 WeakPolarHBondContact O-CG 3.49Å; K90-E94 PolarHBondContact O-N 3.14Å
91	S	83.4	Confident	82.3	Confident	70 Å²	70	101.4 Å²	101.4	49%	0.49	53%	0.534	S	S	.	.	H	α-helix	trans	-62.4	-41.9	177.1	178.7	0	0	0	0	112.3	T87 E88 M93 E94 S95	T87-S91 PolarHBondContact O-N 3.1Å; E88-S91 WeakPolarHBondContact O-CB 3.33Å; E88-S91 PolarHBondContact O-N 3Å; E88-S91 VanDerWaalsContact O-N 3.14Å; S91-M93 VanDerWaalsContact C-N 3.35Å; S91-E94 PolarHBondContact O-N 3.3Å; S91-S95 WeakPolarHBondContact O-CB 3.05Å; S91-S95 PolarHBondContact O-N 3.27Å
92	I	87.6	Confident	80.6	Confident	88 Å²	88	100 Å²	100	45%	0.451	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-44.5	174.7	-68	164.9	0	0	0	110.2	E88 Q89 K90 E94 S95 I96	E88-I92 HydrophobicContact CG-CD1 4.23Å; E88-I92 VanDerWaalsContact O-CG1 3.3Å; E88-I92 WeakPolarHBondContact O-CG1 3.48Å; E88-I92 PolarHBondContact O-N 3.31Å; Q89-I92 PolarHBondContact O-N 2.94Å; K90-I92 PolarHBondContact O-N 3.37Å; I92-E94 PolarHBondContact O-N 2.94Å; I92-S95 WeakPolarHBondContact O-CB 3.06Å; I92-S95 PolarHBondContact O-N 2.65Å; I92-I96 HydrophobicContact CG2-CD1 3.75Å; I92-I96 HydrophobicContact CG2-CG1 4.36Å; I92-I96 VanDerWaalsContact O-CG1 3.29Å; I92-I96 WeakPolarHBondContact O-CG1 3.49Å; I92-I96 PolarHBondContact O-N 3.13Å
93	M	81.4	Confident	78.5	Confident	127 Å²	127	100.8 Å²	100.8	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-64.1	-40.3	178.2	-167.8	-176	-57.6	0	0	112	Q89 K90 S91 I96 T97	Q89-M93 WeakPolarHBondContact O-CB 3.35Å; Q89-M93 PolarHBondContact O-N 3.15Å; K90-M93 PolarHBondContact O-N 3.02Å; S91-M93 VanDerWaalsContact C-N 3.35Å; M93-I96 PolarHBondContact O-N 3.08Å; M93-T97 WeakPolarHBondContact O-CB 3.24Å; M93-T97 PolarHBondContact O-N 2.94Å; M93-T97 PolarHBondContact O-OG1 3.49Å
94	E	80.8	Confident	76.5	Confident	99 Å²	99	104.8 Å²	104.8	46%	0.463	56%	0.562	S	S	.	*	H	α-helix	trans	-63.6	-41.4	173.4	-75.1	173.7	176.5	0	0	111.4	K90 S91 I92 T97 Q98	K90-E94 WeakPolarHBondContact CE-OE1 3.23Å; K90-E94 IonicContact NZ-OE1 3.45Å; K90-E94 WeakPolarHBondContact O-CG 3.49Å; K90-E94 PolarHBondContact O-N 3.14Å; S91-E94 PolarHBondContact O-N 3.3Å; I92-E94 PolarHBondContact O-N 2.94Å; E94-T97 PolarHBondContact O-N 3.44Å; E94-Q98 WeakPolarHBondContact O-CB 3.45Å; E94-Q98 WeakPolarHBondContact O-CG 3.38Å; E94-Q98 PolarHBondContact O-N 3.08Å
95	S	80.1	Confident	74.3	Confident	71 Å²	71	107.4 Å²	107.4	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-64.2	-45.2	175.5	178	0	0	0	0	112.4	S91 I92 T97 Q98 S99	S91-S95 WeakPolarHBondContact O-CB 3.05Å; S91-S95 PolarHBondContact O-N 3.27Å; I92-S95 WeakPolarHBondContact O-CB 3.06Å; I92-S95 PolarHBondContact O-N 2.65Å; S95-T97 VanDerWaalsContact C-N 3.32Å; S95-T97 PolarHBondContact O-N 3.43Å; S95-Q98 PolarHBondContact O-N 3.31Å; S95-S99 WeakPolarHBondContact O-CB 3.18Å; S95-S99 PolarHBondContact O-N 3.2Å
96	I	80	Confident	72.5	Confident	93 Å²	93	110.6 Å²	110.6	48%	0.477	59%	0.59	S	S	.	*	H	α-helix	trans	-62	-43.4	175	-69	167.6	0	0	0	110.1	I92 M93 Q98 S99 L100	I92-I96 HydrophobicContact CG2-CD1 3.75Å; I92-I96 HydrophobicContact CG2-CG1 4.36Å; I92-I96 VanDerWaalsContact O-CG1 3.29Å; I92-I96 WeakPolarHBondContact O-CG1 3.49Å; I92-I96 PolarHBondContact O-N 3.13Å; M93-I96 PolarHBondContact O-N 3.08Å; I96-Q98 PolarHBondContact O-N 3.45Å; I96-S99 PolarHBondContact O-N 3.42Å; I96-L100 HydrophobicContact CG2-CD1 3.79Å; I96-L100 HydrophobicContact CG2-CG 4.36Å; I96-L100 WeakPolarHBondContact O-CB 3.28Å; I96-L100 VanDerWaalsContact O-CG 3.25Å; I96-L100 WeakPolarHBondContact O-CG 3.49Å; I96-L100 PolarHBondContact O-N 3.02Å
97	T	77.5	Confident	70.4	Confident	71 Å²	71	114.4 Å²	114.4	44%	0.436	61%	0.605	S	S	.	*	H	α-helix	trans	-63.7	-42	178.9	-54.1	0	0	0	0	111.3	M93 E94 S95 L100 L101	M93-T97 WeakPolarHBondContact O-CB 3.24Å; M93-T97 PolarHBondContact O-N 2.94Å; M93-T97 PolarHBondContact O-OG1 3.49Å; E94-T97 PolarHBondContact O-N 3.44Å; S95-T97 VanDerWaalsContact C-N 3.32Å; S95-T97 PolarHBondContact O-N 3.43Å; T97-L100 PolarHBondContact O-N 2.85Å; T97-L101 HydrophobicContact CG2-CD1 4.03Å; T97-L101 WeakPolarHBondContact O-CD1 3.31Å; T97-L101 VanDerWaalsContact O-CG 3.27Å; T97-L101 WeakPolarHBondContact O-CG 3.43Å; T97-L101 PolarHBondContact O-N 3.39Å; T97-L101 VanDerWaalsContact O-N 3.14Å
98	Q	71.4	Confident	68.2	Low	139 Å²	139	115 Å²	115	65%	0.65	61%	0.609	S	S	*	*	H	α-helix	trans	-67	-36.1	174	-74.8	-179.4	-3.8	0	0	112.7	E94 S95 I96 L100 L101 S102	E94-Q98 WeakPolarHBondContact O-CB 3.45Å; E94-Q98 WeakPolarHBondContact O-CG 3.38Å; E94-Q98 PolarHBondContact O-N 3.08Å; S95-Q98 PolarHBondContact O-N 3.31Å; I96-Q98 PolarHBondContact O-N 3.45Å; Q98-L100 VanDerWaalsContact C-N 3.34Å; Q98-L101 PolarHBondContact O-N 2.85Å; Q98-S102 WeakPolarHBondContact O-CB 3.22Å; Q98-S102 PolarHBondContact O-N 3.15Å; Q98-S102 PolarHBondContact O-OG 3.04Å
99	S	66.8	Low	66	Low	78 Å²	78	111.9 Å²	111.9	55%	0.545	60%	0.602	S	S	.	*	H	α-helix	trans	-67.2	-34.8	175.6	-171.4	0	0	0	0	112.2	S95 I96 L101 S102	S95-S99 WeakPolarHBondContact O-CB 3.18Å; S95-S99 PolarHBondContact O-N 3.2Å; I96-S99 PolarHBondContact O-N 3.42Å; S99-L101 VanDerWaalsContact C-N 3.33Å; S99-S102 WeakPolarHBondContact CA-OG 3.38Å; S99-S102 PolarHBondContact O-OG 3.4Å
100	L	63.2	Low	64	Low	126 Å²	126	115 Å²	115	66%	0.66	61%	0.613	S	S	*	*	H	α-helix	trans	-75.1	-24.1	176	-69.7	166.1	0	0	0	112.5	I96 T97 Q98	I96-L100 HydrophobicContact CG2-CD1 3.79Å; I96-L100 HydrophobicContact CG2-CG 4.36Å; I96-L100 WeakPolarHBondContact O-CB 3.28Å; I96-L100 VanDerWaalsContact O-CG 3.25Å; I96-L100 WeakPolarHBondContact O-CG 3.49Å; I96-L100 PolarHBondContact O-N 3.02Å; T97-L100 PolarHBondContact O-N 2.85Å; Q98-L100 VanDerWaalsContact C-N 3.34Å
101	L	61.4	Low	61.9	Low	143 Å²	143	116.9 Å²	116.9	75%	0.749	62%	0.624	S	S	*	*	H	α-helix	trans	-88.7	-7.2	178.4	-72.1	164	0	0	0	113.7	T97 Q98 S99	T97-L101 HydrophobicContact CG2-CD1 4.03Å; T97-L101 WeakPolarHBondContact O-CD1 3.31Å; T97-L101 VanDerWaalsContact O-CG 3.27Å; T97-L101 WeakPolarHBondContact O-CG 3.43Å; T97-L101 PolarHBondContact O-N 3.39Å; T97-L101 VanDerWaalsContact O-N 3.14Å; Q98-L101 PolarHBondContact O-N 2.85Å; S99-L101 VanDerWaalsContact C-N 3.33Å
102	S	52.1	Low	59.9	Low	87 Å²	87	119.5 Å²	119.5	61%	0.608	63%	0.63	S	S	*	*			trans	-106.5	9.2	-174.3	46.2	0	0	0	0	115.1	Q98 S99 D104	Q98-S102 WeakPolarHBondContact O-CB 3.22Å; Q98-S102 PolarHBondContact O-N 3.15Å; Q98-S102 PolarHBondContact O-OG 3.04Å; S99-S102 WeakPolarHBondContact CA-OG 3.38Å; S99-S102 PolarHBondContact O-OG 3.4Å; S102-D104 PolarHBondContact O-N 3.49Å
103	T	45.6	Very low	57.8	Low	122 Å²	122	121.7 Å²	121.7	75%	0.748	64%	0.642	S	S	*	*			trans	-82.3	79.3	172.7	55.9	0	0	0	0	111.2
104	D	49.3	Very low	56.1	Low	149 Å²	149	119.6 Å²	119.6	80%	0.797	65%	0.645	S	S	*	*			trans	-134.6	82.7	158.3	-155.1	9.1	0	0	0	108.7	S102	S102-D104 PolarHBondContact O-N 3.49Å
105	K	44.4	Very low	54.2	Low	183 Å²	183	118.2 Å²	118.2	80%	0.796	65%	0.65	S	S	*	*			trans	-179.2	98.1	159.6	-99.8	163.8	-171.8	-172.1	0	108.9	E107	K105-E107 PolarHBondContact O-N 3.12Å
106	D	52.7	Low	52.2	Low	148 Å²	148	121.9 Å²	121.9	79%	0.791	66%	0.658	S	S	*	*			trans	-86.8	12.9	-155.5	-125.1	-10.9	0	0	0	116.1
107	E	46.3	Very low	50.5	Low	176 Å²	176	121.6 Å²	121.6	82%	0.822	66%	0.662	S	S	*	*	S	Bend	trans	-109.9	-31.4	-178.1	-86	-156.6	134.5	0	0	115.1	K105 A109	K105-E107 PolarHBondContact O-N 3.12Å; E107-A109 VanDerWaalsContact C-N 3.35Å; E107-A109 PolarHBondContact O-N 3.46Å
108	T	44	Very low	48.9	Very low	97 Å²	97	126 Å²	126	60%	0.595	68%	0.675	S	S	*	*	S	Bend	trans	-82.8	-11.9	-179.3	45.6	0	0	0	0	113.8
109	A	43.5	Very low	47.7	Very low	43 Å²	43	124.4 Å²	124.4	36%	0.355	67%	0.671	S	S	.	*	H	α-helix	trans	-75.5	-30.5	-177.9	0	0	0	0	0	113.2	E107 L113	E107-A109 VanDerWaalsContact C-N 3.35Å; E107-A109 PolarHBondContact O-N 3.46Å; A109-L113 WeakPolarHBondContact O-CB 3.26Å; A109-L113 WeakPolarHBondContact O-CD1 3.43Å; A109-L113 WeakPolarHBondContact O-CG 3.44Å; A109-L113 PolarHBondContact O-N 2.9Å; A109-L113 VanDerWaalsContact O-N 3.17Å
110	K	45.1	Very low	47.2	Very low	175 Å²	175	124.7 Å²	124.7	76%	0.761	67%	0.669	S	S	*	*	H	α-helix	trans	-71.9	-30.7	-179.1	-87.2	177.6	177.1	168.3	0	113.4
111	E	42.8	Very low	46.8	Very low	169 Å²	169	122.5 Å²	122.5	79%	0.79	66%	0.656	S	S	*	*	H	α-helix	trans	-82.7	-29.6	178.1	-71.8	-176.4	158.6	0	0	112.8
112	M	42.8	Very low	46.6	Very low	125 Å²	125	120 Å²	120	62%	0.616	64%	0.64	S	S	*	*	H	α-helix	trans	-80.1	-23.5	174.7	-76.1	-163.2	-56.8	0	0	114.4	A114 A115	M112-A114 PolarHBondContact O-N 3.46Å; M112-A115 PolarHBondContact O-N 2.9Å; M112-A115 VanDerWaalsContact O-N 3.14Å
113	L	42.8	Very low	47.1	Very low	135 Å²	135	120 Å²	120	71%	0.707	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-16.4	175.6	-78.3	166.1	0	0	0	113.4	A109 A115	A109-L113 WeakPolarHBondContact O-CB 3.26Å; A109-L113 WeakPolarHBondContact O-CD1 3.43Å; A109-L113 WeakPolarHBondContact O-CG 3.44Å; A109-L113 PolarHBondContact O-N 2.9Å; A109-L113 VanDerWaalsContact O-N 3.17Å; L113-A115 VanDerWaalsContact C-N 3.33Å
114	A	45.4	Very low	48	Very low	83 Å²	83	118.5 Å²	118.5	69%	0.686	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-17.3	172.2	0	0	0	0	0	113.1	M112	M112-A114 PolarHBondContact O-N 3.46Å
115	A	41.9	Very low	48.8	Very low	69 Å²	69	114.5 Å²	114.5	57%	0.57	60%	0.596	S	S	*	*	S	Bend	trans	-97.6	-7.9	-173.6	0	0	0	0	0	114.7	M112 L113	M112-A115 PolarHBondContact O-N 2.9Å; M112-A115 VanDerWaalsContact O-N 3.14Å; L113-A115 VanDerWaalsContact C-N 3.33Å
116	F	37.7	Very low	49.8	Very low	149 Å²	149	113.7 Å²	113.7	65%	0.654	59%	0.588	S	S	*	*			trans	-133	73.1	-179.8	-74.2	-86.5	0	0	0	114.3
117	P	43.4	Very low	50.6	Low	86 Å²	86	110 Å²	110	56%	0.558	57%	0.57	S	S	*	*			trans	-85.5	-11.2	171.4	-7.9	26.3	0	0	0	114.4
118	K	43.8	Very low	51.9	Low	164 Å²	164	102.1 Å²	102.1	71%	0.713	53%	0.534	S	S	*	.	H	α-helix	trans	-80.5	-33.4	-166	-78.2	-175.2	173.4	-179.3	0	115	T120 E122	K118-T120 PolarHBondContact O-N 2.83Å; K118-E122 PolarHBondContact O-N 2.7Å
119	D	47	Very low	53.3	Low	106 Å²	106	100.4 Å²	100.4	57%	0.567	52%	0.524	S	S	*	.	H	α-helix	trans	-73.7	-26.9	-175.7	-71.4	-23.4	0	0	0	113.2	V123	D119-V123 VanDerWaalsContact O-CG2 3.31Å; D119-V123 WeakPolarHBondContact O-CG2 3.26Å; D119-V123 PolarHBondContact O-N 3.46Å
120	T	55.1	Low	54.7	Low	83 Å²	83	101.9 Å²	101.9	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-77.3	-32.6	-179.2	-25.2	0	0	0	0	112.7	K118 K124	K118-T120 PolarHBondContact O-N 2.83Å; T120-K124 VanDerWaalsContact O-CG 3.28Å; T120-K124 WeakPolarHBondContact O-CG 3.44Å; T120-K124 PolarHBondContact O-N 2.86Å
121	E	56.2	Low	55.9	Low	81 Å²	81	95.3 Å²	95.3	38%	0.379	50%	0.501	S	S	.	.	H	α-helix	trans	-73.6	-38.6	177.2	-69.5	-160.3	161.7	0	0	111.6	V123 K124 Q125	E121-V123 PolarHBondContact O-N 3.37Å; E121-K124 PolarHBondContact O-N 3.27Å; E121-Q125 WeakPolarHBondContact O-CB 3.44Å; E121-Q125 VanDerWaalsContact O-CG 3.3Å; E121-Q125 WeakPolarHBondContact O-CG 3.39Å; E121-Q125 PolarHBondContact O-N 3.11Å
122	E	56.9	Low	57.2	Low	90 Å²	90	87.5 Å²	87.5	42%	0.421	47%	0.465	S	S	.	.	H	α-helix	trans	-64.4	-40.2	176.6	-72.7	-170.5	-167.9	0	0	112.6	K118 Q125 R126	K118-E122 PolarHBondContact O-N 2.7Å; E122-Q125 PolarHBondContact O-N 2.88Å; E122-R126 VanDerWaalsContact O-CG 3.31Å; E122-R126 WeakPolarHBondContact O-CG 3.48Å; E122-R126 PolarHBondContact O-N 3.03Å; E122-R126 IonicContact OE2-NH2 2.79Å
123	V	63.3	Low	58.6	Low	86 Å²	86	87.6 Å²	87.6	52%	0.521	46%	0.464	S	S	.	.	H	α-helix	trans	-64	-43.6	175.3	173.3	0	0	0	0	110.9	D119 E121 Q125 R126 T127	D119-V123 VanDerWaalsContact O-CG2 3.31Å; D119-V123 WeakPolarHBondContact O-CG2 3.26Å; D119-V123 PolarHBondContact O-N 3.46Å; E121-V123 PolarHBondContact O-N 3.37Å; V123-Q125 VanDerWaalsContact C-N 3.34Å; V123-Q125 PolarHBondContact O-N 3.25Å; V123-R126 PolarHBondContact O-N 2.75Å; V123-T127 PolarHBondContact O-N 2.79Å; V123-T127 PolarHBondContact O-OG1 2.78Å; V123-T127 VanDerWaalsContact O-OG1 3.06Å
124	K	63.5	Low	59.8	Low	92 Å²	92	84.9 Å²	84.9	40%	0.4	45%	0.447	S	S	.	.	H	α-helix	trans	-66.2	-33.6	177.1	-70.2	175.2	-178.4	179.5	0	112.6	T120 E121 L128 Y148	T120-K124 VanDerWaalsContact O-CG 3.28Å; T120-K124 WeakPolarHBondContact O-CG 3.44Å; T120-K124 PolarHBondContact O-N 2.86Å; E121-K124 PolarHBondContact O-N 3.27Å; K124-L128 WeakPolarHBondContact O-CB 3.3Å; K124-L128 PolarHBondContact O-N 2.64Å; K124-Y148 HydrophobicContact CD-CD2 4.06Å
125	Q	65.8	Low	61	Low	65 Å²	65	81.3 Å²	81.3	30%	0.304	42%	0.416	S	S	.	.	H	α-helix	trans	-67.8	-41	172.8	-77.9	175.3	10.9	0	0	112.2	E121 E122 V123 L128 T129 R147	E121-Q125 WeakPolarHBondContact O-CB 3.44Å; E121-Q125 VanDerWaalsContact O-CG 3.3Å; E121-Q125 WeakPolarHBondContact O-CG 3.39Å; E121-Q125 PolarHBondContact O-N 3.11Å; E122-Q125 PolarHBondContact O-N 2.88Å; V123-Q125 VanDerWaalsContact C-N 3.34Å; V123-Q125 PolarHBondContact O-N 3.25Å; Q125-L128 PolarHBondContact O-N 3.27Å; Q125-T129 PolarHBondContact O-N 3.5Å; Q125-T129 PolarHBondContact O-OG1 3.3Å; Q125-R147 WeakPolarHBondContact CG-O 3.41Å
126	R	66.6	Low	62.3	Low	165 Å²	165	83 Å²	83	62%	0.623	41%	0.412	S	S	*	.	H	α-helix	trans	-63.5	-43.7	174.2	-70.3	174.8	-165.4	-178.9	9.3	111.6	E122 V123 L128 T129 T130	E122-R126 VanDerWaalsContact O-CG 3.31Å; E122-R126 WeakPolarHBondContact O-CG 3.48Å; E122-R126 PolarHBondContact O-N 3.03Å; E122-R126 IonicContact OE2-NH2 2.79Å; V123-R126 PolarHBondContact O-N 2.75Å; R126-L128 PolarHBondContact O-N 3.29Å; R126-T129 WeakPolarHBondContact O-CB 3.33Å; R126-T129 PolarHBondContact O-N 3.36Å; R126-T130 PolarHBondContact O-N 3.01Å; R126-T130 VanDerWaalsContact O-N 3.12Å; R126-T130 PolarHBondContact O-OG1 3.41Å
127	T	69.1	Low	63.5	Low	70 Å²	70	78.9 Å²	78.9	43%	0.429	41%	0.411	S	S	.	.	H	α-helix	trans	-62.5	-41.4	175.6	-51.1	0	0	0	0	112.3	V123 T129 T130 L131	V123-T127 PolarHBondContact O-N 2.79Å; V123-T127 PolarHBondContact O-OG1 2.78Å; V123-T127 VanDerWaalsContact O-OG1 3.06Å; T127-T129 VanDerWaalsContact C-N 3.33Å; T127-T129 PolarHBondContact O-N 2.88Å; T127-T130 PolarHBondContact O-N 2.81Å; T127-L131 HydrophobicContact CG2-CD1 4.12Å; T127-L131 WeakPolarHBondContact O-CG 3.31Å; T127-L131 PolarHBondContact O-N 3.11Å; T127-L131 VanDerWaalsContact O-N 3.12Å
128	L	73.5	Confident	64.2	Low	11 Å²	11	75.2 Å²	75.2	6%	0.058	39%	0.388	C	S	.	.	H	α-helix	trans	-59	-44.8	174.5	-179.9	66.5	0	0	0	111.3	K124 Q125 R126 T130 L131 L132 R147 L149 M174	K124-L128 WeakPolarHBondContact O-CB 3.3Å; K124-L128 PolarHBondContact O-N 2.64Å; Q125-L128 PolarHBondContact O-N 3.27Å; R126-L128 PolarHBondContact O-N 3.29Å; L128-T130 PolarHBondContact O-N 2.8Å; L128-L131 PolarHBondContact O-N 3.34Å; L128-L132 HydrophobicContact CD1-CD1 3.91Å; L128-L132 HydrophobicContact CD1-CG 4.08Å; L128-L132 HydrophobicContact CD2-CD1 4.42Å; L128-L132 HydrophobicContact CG-CD1 3.82Å; L128-L132 HydrophobicContact CG-CG 4.33Å; L128-L132 WeakPolarHBondContact O-CB 3.43Å; L128-L132 WeakPolarHBondContact O-CG 3.31Å; L128-L132 PolarHBondContact O-N 3.09Å; L128-R147 HydrophobicContact CD2-CB 4.22Å; L128-R147 WeakPolarHBondContact CD2-O 3.49Å; L128-L149 HydrophobicContact CB-CB 4.19Å; L128-L149 HydrophobicContact CD1-CB 4.06Å; L128-L149 HydrophobicContact CD1-CD1 4.03Å; L128-M174 HydrophobicContact CD1-CG 4.1Å; L128-M174 HydrophobicContact CD1-SD 4.14Å; L128-M174 HydrophobicContact CD2-CG 4.46Å; L128-M174 HydrophobicContact CD2-SD 4.24Å
129	T	72.4	Confident	64.7	Low	61 Å²	61	75.7 Å²	75.7	37%	0.374	39%	0.39	S	S	.	.	H	α-helix	trans	-60	-48.2	179.6	-51.4	0	0	0	0	111.3	Q125 R126 T127 L131 L132 E133 M142	Q125-T129 PolarHBondContact O-N 3.5Å; Q125-T129 PolarHBondContact O-OG1 3.3Å; R126-T129 WeakPolarHBondContact O-CB 3.33Å; R126-T129 PolarHBondContact O-N 3.36Å; T127-T129 VanDerWaalsContact C-N 3.33Å; T127-T129 PolarHBondContact O-N 2.88Å; T129-L131 VanDerWaalsContact C-N 3.28Å; T129-L131 PolarHBondContact O-N 3.47Å; T129-L132 PolarHBondContact O-N 3.06Å; T129-E133 WeakPolarHBondContact O-CG 3.47Å; T129-E133 PolarHBondContact O-N 2.96Å; T129-E133 VanDerWaalsContact O-N 3.07Å; T129-M142 HydrophobicContact CG2-CE 3.9Å
130	T	72.8	Confident	65.1	Low	75 Å²	75	77.2 Å²	77.2	46%	0.46	40%	0.398	S	S	.	.	H	α-helix	trans	-64.3	-29.1	178	-50.5	0	0	0	0	113.7	R126 T127 L128	R126-T130 PolarHBondContact O-N 3.01Å; R126-T130 VanDerWaalsContact O-N 3.12Å; R126-T130 PolarHBondContact O-OG1 3.41Å; T127-T130 PolarHBondContact O-N 2.81Å; L128-T130 PolarHBondContact O-N 2.8Å
131	L	70.6	Confident	65.3	Low	36 Å²	36	74 Å²	74	19%	0.188	38%	0.378	C	S	.	.	H	α-helix	trans	-80.9	-39.4	177.7	-72.9	171.8	0	0	0	112	T127 L128 T129 E133 K134 L149 F172	T127-L131 HydrophobicContact CG2-CD1 4.12Å; T127-L131 WeakPolarHBondContact O-CG 3.31Å; T127-L131 PolarHBondContact O-N 3.11Å; T127-L131 VanDerWaalsContact O-N 3.12Å; L128-L131 PolarHBondContact O-N 3.34Å; T129-L131 VanDerWaalsContact C-N 3.28Å; T129-L131 PolarHBondContact O-N 3.47Å; L131-E133 VanDerWaalsContact C-N 3.33Å; L131-E133 PolarHBondContact O-N 2.99Å; L131-K134 WeakPolarHBondContact O-CB 3.42Å; L131-K134 PolarHBondContact O-N 2.79Å; L131-K134 VanDerWaalsContact O-N 3.16Å; L131-L149 HydrophobicContact CD1-CD2 3.63Å; L131-F172 HydrophobicContact CB-CE1 4.03Å; L131-F172 HydrophobicContact CD1-CE1 4.47Å
132	L	71	Confident	65.2	Low	6 Å²	6	74.5 Å²	74.5	3%	0.031	38%	0.381	C	S	.	.	H	α-helix	trans	-69	-28.2	176.9	-71.6	176.4	0	0	0	112.8	L128 T129 K134 V135 C138 M142 L179	L128-L132 HydrophobicContact CD1-CD1 3.91Å; L128-L132 HydrophobicContact CD1-CG 4.08Å; L128-L132 HydrophobicContact CD2-CD1 4.42Å; L128-L132 HydrophobicContact CG-CD1 3.82Å; L128-L132 HydrophobicContact CG-CG 4.33Å; L128-L132 WeakPolarHBondContact O-CB 3.43Å; L128-L132 WeakPolarHBondContact O-CG 3.31Å; L128-L132 PolarHBondContact O-N 3.09Å; T129-L132 PolarHBondContact O-N 3.06Å; L132-K134 PolarHBondContact O-N 3.08Å; L132-K134 VanDerWaalsContact O-N 3.15Å; L132-V135 PolarHBondContact O-N 3.06Å; L132-C138 HydrophobicContact CD2-CB 4.35Å; L132-M142 HydrophobicContact CB-CE 3.65Å; L132-M142 HydrophobicContact CD1-CE 4.43Å; L132-M142 HydrophobicContact CD1-CG 4.41Å; L132-L179 HydrophobicContact CD2-CD2 3.57Å
133	E	71.1	Confident	65.1	Low	126 Å²	126	76.6 Å²	76.6	59%	0.589	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-23.1	170.2	-78.3	175.2	179.3	0	0	113.4	T129 L131 V135	T129-E133 WeakPolarHBondContact O-CG 3.47Å; T129-E133 PolarHBondContact O-N 2.96Å; T129-E133 VanDerWaalsContact O-N 3.07Å; L131-E133 VanDerWaalsContact C-N 3.33Å; L131-E133 PolarHBondContact O-N 2.99Å; E133-V135 VanDerWaalsContact C-N 3.34Å
134	K	68.3	Low	64.8	Low	79 Å²	79	75.3 Å²	75.3	34%	0.343	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-3.7	177.5	-60.6	172.9	-175.8	166.3	0	113	L131 L132 K192 Y193	L131-K134 WeakPolarHBondContact O-CB 3.42Å; L131-K134 PolarHBondContact O-N 2.79Å; L131-K134 VanDerWaalsContact O-N 3.16Å; L132-K134 PolarHBondContact O-N 3.08Å; L132-K134 VanDerWaalsContact O-N 3.15Å; K134-K192 PolarHBondContact O-N 2.87Å; K134-Y193 PolarHBondContact O-N 3.46Å
135	V	72	Confident	64.4	Low	8 Å²	8	76.9 Å²	76.9	5%	0.048	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	118.3	-178.5	-170.4	0	0	0	0	110.2	L132 E133 G137 C138 F172 A181 Y193	L132-V135 PolarHBondContact O-N 3.06Å; E133-V135 VanDerWaalsContact C-N 3.34Å; V135-G137 PolarHBondContact O-N 3.26Å; V135-C138 WeakPolarHBondContact CG1-SG 3.31Å; V135-F172 HydrophobicContact CG2-CE2 3.72Å; V135-F172 HydrophobicContact CG2-CZ 3.9Å; V135-A181 HydrophobicContact CG1-CB 3.85Å; V135-Y193 CarbonylContact C-O 3.56Å; V135-Y193 WeakPolarHBondContact CA-O 3.32Å; V135-Y193 HydrophobicContact CG2-CD2 4.43Å
136	E	68.3	Low	64.2	Low	104 Å²	104	75.6 Å²	75.6	49%	0.486	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	129.1	176.6	-143.5	179.1	151.6	0	0	110.7	V191 Y193 Y195	E136-V191 HydrophobicContact CB-CG1 3.59Å; E136-V191 HydrophobicContact CG-CG1 4.04Å; E136-Y193 PolarHBondContact N-O 2.79Å; E136-Y195 WeakPolarHBondContact O-CB 3.46Å; E136-Y195 PolarHBondContact O-N 3.11Å
137	G	63.6	Low	64.5	Low	62 Å²	62	69.6 Å²	69.6	64%	0.639	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.8	2.9	172.4	0	0	0	0	0	116.6	V135 K139	V135-G137 PolarHBondContact O-N 3.26Å; G137-K139 VanDerWaalsContact C-N 3.35Å; G137-K139 PolarHBondContact O-N 2.72Å
138	C	57.5	Low	64.7	Low	10 Å²	10	68.2 Å²	68.2	7%	0.068	38%	0.376	C	S	.	.			trans	-88.5	41.4	-175.2	-67.9	0	0	0	0	115.2	L132 V135	L132-C138 HydrophobicContact CD2-CB 4.35Å; V135-C138 WeakPolarHBondContact CG1-SG 3.31Å
139	K	54.8	Low	64.9	Low	173 Å²	173	68.6 Å²	68.6	75%	0.752	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-43.1	179.7	-68.5	-174.5	178.3	-177.6	0	112.8	G137 I141	G137-K139 VanDerWaalsContact C-N 3.35Å; G137-K139 PolarHBondContact O-N 2.72Å; K139-I141 VanDerWaalsContact C-N 3.27Å; K139-I141 PolarHBondContact O-N 2.69Å
140	N	55.5	Low	65.3	Low	139 Å²	139	68.3 Å²	68.3	74%	0.743	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-9.3	-173.4	-62.4	10.4	0	0	0	114.5
141	I	59.1	Low	65.6	Low	16 Å²	16	67.1 Å²	67.1	8%	0.082	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-24.1	-175.3	-59.5	166.5	0	0	0	111	K139 D143 R147 M174 L179 Y195 L198	K139-I141 VanDerWaalsContact C-N 3.27Å; K139-I141 PolarHBondContact O-N 2.69Å; I141-D143 VanDerWaalsContact C-N 3.3Å; I141-R147 PolarHBondContact O-NH1 2.81Å; I141-M174 HydrophobicContact CG2-CE 4.32Å; I141-M174 HydrophobicContact CG2-SD 4.37Å; I141-L179 HydrophobicContact CD1-CD1 4.15Å; I141-Y195 HydrophobicContact CD1-CD2 4.07Å; I141-Y195 HydrophobicContact CD1-CE2 3.63Å; I141-L198 HydrophobicContact CD1-CD1 3.52Å; I141-L198 HydrophobicContact CG1-CD1 3.77Å; I141-L198 HydrophobicContact CG2-CD1 4.11Å
142	M	53.7	Low	66.3	Low	90 Å²	90	68.3 Å²	68.3	44%	0.443	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-19.5	177.6	-72.1	-170.7	159.6	0	0	113.2	T129 L132 T144	T129-M142 HydrophobicContact CG2-CE 3.9Å; L132-M142 HydrophobicContact CB-CE 3.65Å; L132-M142 HydrophobicContact CD1-CE 4.43Å; L132-M142 HydrophobicContact CD1-CG 4.41Å; M142-T144 VanDerWaalsContact C-N 3.31Å; M142-T144 PolarHBondContact O-N 2.92Å
143	D	55.5	Low	66.9	Low	134 Å²	134	68.7 Å²	68.7	72%	0.717	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-6.1	-175.4	-69.4	-27.4	0	0	0	114	I141 P145	I141-D143 VanDerWaalsContact C-N 3.3Å; D143-P145 WeakPolarHBondContact O-CD 3.37Å
144	T	55.6	Low	67.6	Low	60 Å²	60	67.1 Å²	67.1	37%	0.368	37%	0.371	S	S	.	.	S	Bend	trans	-92.2	111.1	179.8	-43.9	0	0	0	0	111.1	M142 R147	M142-T144 VanDerWaalsContact C-N 3.31Å; M142-T144 PolarHBondContact O-N 2.92Å; T144-R147 PolarHBondContact OG1-NH1 2.77Å; T144-R147 VanDerWaalsContact OG1-NH1 3.11Å
145	P	55.1	Low	68.4	Low	125 Å²	125	63.8 Å²	63.8	81%	0.812	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	136.5	-177.1	27.3	-33.5	0	0	0	111.5	D143	D143-P145 WeakPolarHBondContact O-CD 3.37Å
146	G	62.8	Low	69.1	Low	37 Å²	37	64.8 Å²	64.8	38%	0.381	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.4	5.5	175.2	0	0	0	0	0	115.9	N175	G146-N175 PolarHBondContact O-ND2 2.9Å
147	R	71.9	Confident	69.8	Low	39 Å²	39	60.2 Å²	60.2	15%	0.147	34%	0.341	C	S	.	.			trans	-78.9	126.4	173.5	-72.8	-174.8	173.6	152.1	1.6	112	Q125 L128 I141 T144 N175 D176	Q125-R147 WeakPolarHBondContact CG-O 3.41Å; L128-R147 HydrophobicContact CD2-CB 4.22Å; L128-R147 WeakPolarHBondContact CD2-O 3.49Å; I141-R147 PolarHBondContact O-NH1 2.81Å; T144-R147 PolarHBondContact OG1-NH1 2.77Å; T144-R147 VanDerWaalsContact OG1-NH1 3.11Å; R147-N175 WeakPolarHBondContact CA-OD1 3.31Å; R147-D176 IonicContact CZ-OD2 3.46Å; R147-D176 VanDerWaalsContact CZ-OD2 3.29Å; R147-D176 VanDerWaalsContact NE-CG 3.35Å; R147-D176 IonicContact NE-OD1 3.76Å; R147-D176 PolarHBondContact NE-OD1 3.5Å; R147-D176 IonicContact NE-OD2 3.99Å; R147-D176 PolarHBondContact NE-OD2 3.06Å; R147-D176 IonicContact NH2-OD2 2.56Å; R147-D176 PolarHBondContact NH2-OD2 3.2Å
148	Y	73.8	Confident	70.8	Confident	42 Å²	42	58.9 Å²	58.9	17%	0.165	32%	0.317	C	S	.	.			trans	-129.8	151.9	172.3	65.6	-95.9	0	0	0	111	K124 V150 M174 N175	K124-Y148 HydrophobicContact CD-CD2 4.06Å; Y148-V150 HydrophobicContact CD2-CG2 4.31Å; Y148-V150 HydrophobicContact CE2-CG2 3.89Å; Y148-M174 WeakPolarHBondContact O-CA 3.45Å; Y148-N175 HydrophobicContact CD1-CB 4.16Å; Y148-N175 HydrophobicContact CE1-CB 3.78Å; Y148-N175 HydrophobicContact CE2-CB 4.31Å; Y148-N175 PolarHBondContact O-N 2.87Å
149	L	77.8	Confident	71.8	Confident	19 Å²	19	60.4 Å²	60.4	10%	0.099	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	128.1	178.3	-171.4	70.7	0	0	0	110.4	L128 L131 N152 F172	L128-L149 HydrophobicContact CB-CB 4.19Å; L128-L149 HydrophobicContact CD1-CB 4.06Å; L128-L149 HydrophobicContact CD1-CD1 4.03Å; L131-L149 HydrophobicContact CD1-CD2 3.63Å; L149-N152 HydrophobicContact CD1-CB 4.38Å; L149-N152 HydrophobicContact CD2-CB 4.32Å; L149-F172 HydrophobicContact CD1-CB 4.22Å; L149-F172 HydrophobicContact CD1-CD1 4.26Å
150	V	80.3	Confident	72.7	Confident	54 Å²	54	54.3 Å²	54.3	33%	0.327	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-48.5	173.7	-178.1	0	0	0	0	110.2	Y148 L173 I244 T248	Y148-V150 HydrophobicContact CD2-CG2 4.31Å; Y148-V150 HydrophobicContact CE2-CG2 3.89Å; V150-L173 HydrophobicContact CB-CD2 4.44Å; V150-L173 HydrophobicContact CB-CG 4.22Å; V150-L173 HydrophobicContact CG1-CD2 4.36Å; V150-L173 PolarHBondContact N-O 2.69Å; V150-I244 HydrophobicContact CG1-CG2 3.84Å; V150-T248 HydrophobicContact CG2-CG2 4.18Å
151	Y	80.5	Confident	73.5	Confident	50 Å²	50	54.3 Å²	54.3	20%	0.196	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	153.7	-179.5	-167.4	-107.9	0	0	0	111.8	L173 E240 W241 I244	Y151-L173 PolarHBondContact N-O 2.82Å; Y151-L173 WeakPolarHBondContact O-CB 3.45Å; Y151-L173 PolarHBondContact O-N 2.93Å; Y151-E240 PolarHBondContact OH-OE2 3.12Å; Y151-W241 AromaticContact CD1-CD2 3.91Å; Y151-W241 HydrophobicContact CD1-CD2 3.91Å; Y151-W241 AromaticContact CD1-CE2 3.75Å; Y151-W241 AromaticContact CD1-CE3 3.99Å; Y151-W241 HydrophobicContact CD1-CE3 3.99Å; Y151-W241 AromaticContact CD1-CH2 3.79Å; Y151-W241 HydrophobicContact CD1-CH2 3.79Å; Y151-W241 AromaticContact CD1-CZ2 3.7Å; Y151-W241 HydrophobicContact CD1-CZ2 3.7Å; Y151-W241 AromaticContact CD1-CZ3 3.94Å; Y151-W241 HydrophobicContact CD1-CZ3 3.94Å; Y151-W241 AromaticContact CE1-CD2 3.83Å; Y151-W241 HydrophobicContact CE1-CD2 3.83Å; Y151-W241 AromaticContact CE1-CE2 3.51Å; Y151-W241 HydrophobicContact CE1-CE3 4.37Å; Y151-W241 HydrophobicContact CE1-CG 4.19Å; Y151-W241 HydrophobicContact CE1-CH2 4.38Å; Y151-W241 AromaticContact CE1-CZ2 3.83Å; Y151-W241 HydrophobicContact CE1-CZ2 3.83Å; Y151-W241 AromaticContact CE1-NE1 3.66Å; Y151-I244 HydrophobicContact CD1-CD1 4.31Å; Y151-I244 HydrophobicContact CD2-CD1 3.44Å; Y151-I244 VanDerWaalsContact CD2-CD1 3.44Å; Y151-I244 HydrophobicContact CE1-CD1 4.48Å; Y151-I244 HydrophobicContact CE2-CD1 3.64Å; Y151-I244 HydrophobicContact CG-CD1 3.79Å; Y151-I244 HydrophobicContact CG-CG2 4.5Å
152	N	83.9	Confident	74	Confident	62 Å²	62	59.5 Å²	59.5	33%	0.332	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147.4	175	73	-60.3	0	0	0	111.4	L149 H170 A171 F172	L149-N152 HydrophobicContact CD1-CB 4.38Å; L149-N152 HydrophobicContact CD2-CB 4.32Å; N152-H170 PolarHBondContact ND2-NE2 2.98Å; N152-A171 VanDerWaalsContact CA-O 3.31Å; N152-A171 WeakPolarHBondContact CA-O 3.37Å; N152-F172 HydrophobicContact CB-CD1 3.92Å; N152-F172 HydrophobicContact CB-CE1 4.42Å
153	G	83.5	Confident	74.8	Confident	13 Å²	13	57.5 Å²	57.5	13%	0.134	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	158.6	-178.8	0	0	0	0	0	114	A171	G153-A171 PolarHBondContact N-O 3.2Å; G153-A171 VanDerWaalsContact N-O 3.08Å; G153-A171 PolarHBondContact O-N 3.28Å
154	D	85.5	Confident	75.7	Confident	93 Å²	93	53.5 Å²	53.5	50%	0.497	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	135.6	176	-67	-49.8	0	0	0	111	H170	D154-H170 IonicContact OD1-CE1 2.64Å; D154-H170 IonicContact OD1-CG 2.75Å; D154-H170 IonicContact OD1-ND1 2.88Å; D154-H170 PolarHBondContact OD1-ND1 2.99Å
155	L	86.5	Confident	76.9	Confident	10 Å²	10	56.1 Å²	56.1	5%	0.052	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	157.8	-179.3	-64.5	174	0	0	0	110.4	V169 A171 F219 F230 A232 W241	L155-V169 PolarHBondContact N-O 2.99Å; L155-V169 PolarHBondContact O-N 2.89Å; L155-A171 HydrophobicContact CD1-CB 3.76Å; L155-F219 HydrophobicContact CD1-CE1 4.42Å; L155-F219 HydrophobicContact CD1-CZ 3.78Å; L155-F219 HydrophobicContact CD2-CE1 3.94Å; L155-F219 HydrophobicContact CD2-CZ 4.13Å; L155-F230 HydrophobicContact CB-CB 4.45Å; L155-F230 HydrophobicContact CB-CD1 4.34Å; L155-F230 HydrophobicContact CD1-CB 4.27Å; L155-F230 HydrophobicContact CD1-CG 4.37Å; L155-A232 HydrophobicContact CD2-CB 4.24Å; L155-W241 HydrophobicContact CD1-CZ2 4.32Å
156	V	85.6	Confident	78.1	Confident	28 Å²	28	54.8 Å²	54.8	17%	0.17	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	125	174	-177.1	0	0	0	0	109.4	Y158 Q165 K168 F230 Q231	V156-Y158 HydrophobicContact CB-CE2 4.23Å; V156-Y158 HydrophobicContact CG1-CD2 4.29Å; V156-Y158 HydrophobicContact CG1-CE2 3.75Å; V156-Q165 HydrophobicContact CG1-CG 3.64Å; V156-Q165 VanDerWaalsContact CG1-NE2 3.32Å; V156-K168 HydrophobicContact CG2-CG 4.4Å; V156-F230 CarbonylContact O-C 3.58Å; V156-F230 WeakPolarHBondContact O-CA 3.45Å; V156-Q231 HydrophobicContact CB-CB 4.38Å; V156-Q231 PolarHBondContact N-O 3.49Å; V156-Q231 PolarHBondContact O-N 3.39Å
157	E	84.4	Confident	79.1	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.037	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	136.6	178.9	-170.2	-177.5	178.1	0	0	111.3	L166 Q167 V169 R228 I229 F230	E157-L166 HydrophobicContact CG-CD1 4.21Å; E157-L166 PolarHBondContact O-N 2.84Å; E157-Q167 HydrophobicContact CB-CG 4.17Å; E157-Q167 PolarHBondContact N-O 3.22Å; E157-Q167 WeakPolarHBondContact OE2-CG 3.47Å; E157-Q167 PolarHBondContact OE2-NE2 3.31Å; E157-V169 HydrophobicContact CB-CG2 3.75Å; E157-R228 IonicContact OE1-CZ 3.26Å; E157-R228 IonicContact OE1-NE 3.15Å; E157-R228 PolarHBondContact OE1-NE 3.2Å; E157-R228 IonicContact OE1-NH2 2.65Å; E157-R228 PolarHBondContact OE1-NH2 3.28Å; E157-R228 IonicContact OE2-CZ 3.17Å; E157-R228 IonicContact OE2-NH2 3.81Å; E157-R228 PolarHBondContact OE2-NH2 3.24Å; E157-I229 WeakPolarHBondContact CA-O 3.19Å; E157-F230 HydrophobicContact CB-CD1 4.15Å; E157-F230 HydrophobicContact CB-CE1 3.98Å; E157-F230 HydrophobicContact CG-CD1 4.37Å; E157-F230 HydrophobicContact CG-CE1 3.91Å
158	Y	83.4	Confident	79.6	Confident	35 Å²	35	60.7 Å²	60.7	14%	0.137	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	145.1	177	-79.8	-97.8	0	0	0	111.2	V156 M163 A164 Q165 M218 I229 Q231	V156-Y158 HydrophobicContact CB-CE2 4.23Å; V156-Y158 HydrophobicContact CG1-CD2 4.29Å; V156-Y158 HydrophobicContact CG1-CE2 3.75Å; Y158-M163 WeakPolarHBondContact CD1-O 3.35Å; Y158-A164 WeakPolarHBondContact CA-O 3.46Å; Y158-Q165 HydrophobicContact CE1-CB 4.06Å; Y158-M218 HydrophobicContact CD1-CE 4.28Å; Y158-M218 HydrophobicContact CD2-CE 4.02Å; Y158-M218 HydrophobicContact CE1-CE 4.1Å; Y158-M218 HydrophobicContact CE2-CE 3.84Å; Y158-M218 HydrophobicContact CG-CE 4.25Å; Y158-I229 PolarHBondContact N-O 3.12Å; Y158-Q231 HydrophobicContact CD2-CB 4.04Å; Y158-Q231 HydrophobicContact CE2-CB 3.65Å; Y158-Q231 HydrophobicContact CE2-CG 4.45Å; Y158-Q231 VanDerWaalsContact CE2-OE1 3.31Å; Y158-Q231 PolarHBondContact OH-OE1 3.48Å
159	D	78.8	Confident	80.2	Confident	41 Å²	41	58.9 Å²	58.9	22%	0.219	31%	0.309	C	S	.	.			trans	-67	137.3	172.7	-173.6	10.7	0	0	0	110.9	D161 N162 M163 A164 L166	D159-D161 PolarHBondContact OD1-N 3.03Å; D159-N162 WeakPolarHBondContact OD2-CB 3.49Å; D159-N162 PolarHBondContact OD2-ND2 3.47Å; D159-M163 WeakPolarHBondContact O-CA 3.25Å; D159-M163 PolarHBondContact O-N 3.33Å; D159-M163 VanDerWaalsContact O-N 3.12Å; D159-A164 PolarHBondContact N-O 3Å; D159-L166 HydrophobicContact CB-CD1 4.07Å; D159-L166 HydrophobicContact CB-CD2 4.14Å; D159-L166 HydrophobicContact CB-CG 4.05Å
160	V	73.6	Confident	80.6	Confident	46 Å²	46	58.5 Å²	58.5	28%	0.279	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-33.1	-177.7	179.8	0	0	0	0	111.7	S227 I229	V160-S227 WeakPolarHBondContact CG2-O 3.4Å; V160-I229 HydrophobicContact CG2-CD1 4.48Å; V160-I229 HydrophobicContact CG2-CG1 4.43Å
161	D	72.3	Confident	80.8	Confident	139 Å²	139	56.1 Å²	56.1	74%	0.743	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-40.5	-172.6	-64	-32.6	0	0	0	112.1	D159	D159-D161 PolarHBondContact OD1-N 3.03Å
162	N	69.9	Low	80.9	Confident	124 Å²	124	53.9 Å²	53.9	66%	0.663	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-5	-174.7	-60.4	-57.2	0	0	0	114.9	D159 A164	D159-N162 WeakPolarHBondContact OD2-CB 3.49Å; D159-N162 PolarHBondContact OD2-ND2 3.47Å; N162-A164 HydrophobicContact CB-CB 4.42Å; N162-A164 PolarHBondContact O-N 3.02Å
163	M	69.6	Low	80.9	Confident	49 Å²	49	50.9 Å²	50.9	24%	0.241	27%	0.269	C	S	.	.			trans	50.8	26.9	-174.7	-64.6	-64.7	-62	0	0	113.6	Y158 D159 M215 M218 I229	Y158-M163 WeakPolarHBondContact CD1-O 3.35Å; D159-M163 WeakPolarHBondContact O-CA 3.25Å; D159-M163 PolarHBondContact O-N 3.33Å; D159-M163 VanDerWaalsContact O-N 3.12Å; M163-M215 HydrophobicContact CE-CE 3.63Å; M163-M215 HydrophobicContact CE-CG 3.58Å; M163-M215 HydrophobicContact CE-SD 4.28Å; M163-M215 HydrophobicContact CG-CE 4.24Å; M163-M215 HydrophobicContact SD-CE 3.8Å; M163-M218 HydrophobicContact CE-CE 4.41Å; M163-M218 HydrophobicContact CE-SD 3.87Å; M163-I229 HydrophobicContact SD-CD1 3.95Å
164	A	75	Confident	81	Confident	50 Å²	50	50.3 Å²	50.3	41%	0.413	26%	0.262	S	S	.	.			trans	-84.3	143.9	175.6	0	0	0	0	0	110	Y158 D159 N162 L166	Y158-A164 WeakPolarHBondContact CA-O 3.46Å; D159-A164 PolarHBondContact N-O 3Å; N162-A164 HydrophobicContact CB-CB 4.42Å; N162-A164 PolarHBondContact O-N 3.02Å; A164-L166 PolarHBondContact O-N 3.14Å
165	Q	81.2	Confident	80.7	Confident	115 Å²	115	47.7 Å²	47.7	54%	0.537	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	118.1	176.1	-177.9	176.1	11.2	0	0	109.7	V156 Y158	V156-Q165 HydrophobicContact CG1-CG 3.64Å; V156-Q165 VanDerWaalsContact CG1-NE2 3.32Å; Y158-Q165 HydrophobicContact CE1-CB 4.06Å
166	L	80.6	Confident	80.2	Confident	97 Å²	97	48.9 Å²	48.9	51%	0.508	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-63.5	-178.9	-70	174.4	0	0	0	111.2	E157 D159 A164	E157-L166 HydrophobicContact CG-CD1 4.21Å; E157-L166 PolarHBondContact O-N 2.84Å; D159-L166 HydrophobicContact CB-CD1 4.07Å; D159-L166 HydrophobicContact CB-CD2 4.14Å; D159-L166 HydrophobicContact CB-CG 4.05Å; A164-L166 PolarHBondContact O-N 3.14Å
167	Q	82.5	Confident	80	Confident	68 Å²	68	47.6 Å²	47.6	32%	0.318	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	157.3	-171.3	51.6	-176.3	-6.5	0	0	112.8	E157 V169 T182	E157-Q167 HydrophobicContact CB-CG 4.17Å; E157-Q167 PolarHBondContact N-O 3.22Å; E157-Q167 WeakPolarHBondContact OE2-CG 3.47Å; E157-Q167 PolarHBondContact OE2-NE2 3.31Å; Q167-V169 HydrophobicContact CG-CG2 3.95Å; Q167-V169 WeakPolarHBondContact O-CG2 3.38Å; Q167-T182 HydrophobicContact CG-CG2 4.37Å
168	K	83.3	Confident	79.9	Confident	132 Å²	132	47.4 Å²	47.4	57%	0.574	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	133.2	168.8	-66.9	-171.5	176.9	-174	0	109.5	V156 W183	V156-K168 HydrophobicContact CG2-CG 4.4Å; K168-W183 HydrophobicContact CB-CB 4.31Å; K168-W183 PolarHBondContact O-N 2.92Å
169	V	87.1	Confident	79.9	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	144.5	-169.1	-148	0	0	0	0	109.5	L155 E157 Q167 I180 A181 T182	L155-V169 PolarHBondContact N-O 2.99Å; L155-V169 PolarHBondContact O-N 2.89Å; E157-V169 HydrophobicContact CB-CG2 3.75Å; Q167-V169 HydrophobicContact CG-CG2 3.95Å; Q167-V169 WeakPolarHBondContact O-CG2 3.38Å; V169-I180 HydrophobicContact CB-CG2 4.34Å; V169-I180 HydrophobicContact CG1-CB 4.5Å; V169-I180 HydrophobicContact CG1-CG2 3.14Å; V169-A181 CarbonylContact C-O 3.52Å; V169-A181 WeakPolarHBondContact CA-O 3.37Å; V169-A181 WeakPolarHBondContact CG1-O 3.33Å; V169-T182 HydrophobicContact CG1-CG2 4.03Å
170	H	84.7	Confident	80.2	Confident	12 Å²	12	43.9 Å²	43.9	6%	0.056	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.5	172.1	-161.5	87.1	0	0	0	108.4	N152 D154 F172 A181 Y193	N152-H170 PolarHBondContact ND2-NE2 2.98Å; D154-H170 IonicContact OD1-CE1 2.64Å; D154-H170 IonicContact OD1-CG 2.75Å; D154-H170 IonicContact OD1-ND1 2.88Å; D154-H170 PolarHBondContact OD1-ND1 2.99Å; H170-F172 HydrophobicContact CB-CE2 4.44Å; H170-F172 AromaticContact CD2-CD1 3.9Å; H170-F172 AromaticContact CD2-CD2 3.91Å; H170-F172 AromaticContact CD2-CE1 3.42Å; H170-F172 VanDerWaalsContact CD2-CE1 3.42Å; H170-F172 WeakPolarHBondContact CD2-CE1 3.27Å; H170-F172 AromaticContact CD2-CE2 3.45Å; H170-F172 VanDerWaalsContact CD2-CE2 3.45Å; H170-F172 WeakPolarHBondContact CD2-CE2 3.37Å; H170-F172 AromaticContact CD2-CZ 3.19Å; H170-F172 WeakPolarHBondContact CD2-CZ 3.47Å; H170-F172 AromaticContact NE2-CE1 3.58Å; H170-F172 AromaticContact NE2-CZ 3.79Å; H170-A181 PolarHBondContact N-O 3.15Å; H170-A181 PolarHBondContact O-N 3.33Å; H170-Y193 HydrophobicContact CB-CD1 3.78Å; H170-Y193 HydrophobicContact CB-CE1 3.55Å; H170-Y193 AromaticContact CG-CE1 4Å
171	A	84.6	Confident	80.7	Confident	4 Å²	4	41.7 Å²	41.7	3%	0.033	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	132	178.1	0	0	0	0	0	110	N152 G153 L155 L178 L179 W241	N152-A171 VanDerWaalsContact CA-O 3.31Å; N152-A171 WeakPolarHBondContact CA-O 3.37Å; G153-A171 PolarHBondContact N-O 3.2Å; G153-A171 VanDerWaalsContact N-O 3.08Å; G153-A171 PolarHBondContact O-N 3.28Å; L155-A171 HydrophobicContact CD1-CB 3.76Å; A171-L178 HydrophobicContact CB-CD1 4.37Å; A171-L179 CarbonylContact C-O 3.5Å; A171-L179 WeakPolarHBondContact CA-O 3.22Å; A171-W241 HydrophobicContact CB-CH2 3.52Å; A171-W241 HydrophobicContact CB-CZ2 3.85Å; A171-W241 HydrophobicContact CB-CZ3 4.35Å
172	F	84.1	Confident	81.3	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.009	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	113.5	173.7	-58.9	-86.8	0	0	0	108.7	L131 V135 L149 N152 H170 L179 A181	L131-F172 HydrophobicContact CB-CE1 4.03Å; L131-F172 HydrophobicContact CD1-CE1 4.47Å; V135-F172 HydrophobicContact CG2-CE2 3.72Å; V135-F172 HydrophobicContact CG2-CZ 3.9Å; L149-F172 HydrophobicContact CD1-CB 4.22Å; L149-F172 HydrophobicContact CD1-CD1 4.26Å; N152-F172 HydrophobicContact CB-CD1 3.92Å; N152-F172 HydrophobicContact CB-CE1 4.42Å; H170-F172 HydrophobicContact CB-CE2 4.44Å; H170-F172 AromaticContact CD2-CD1 3.9Å; H170-F172 AromaticContact CD2-CD2 3.91Å; H170-F172 AromaticContact CD2-CE1 3.42Å; H170-F172 VanDerWaalsContact CD2-CE1 3.42Å; H170-F172 WeakPolarHBondContact CD2-CE1 3.27Å; H170-F172 AromaticContact CD2-CE2 3.45Å; H170-F172 VanDerWaalsContact CD2-CE2 3.45Å; H170-F172 WeakPolarHBondContact CD2-CE2 3.37Å; H170-F172 AromaticContact CD2-CZ 3.19Å; H170-F172 WeakPolarHBondContact CD2-CZ 3.47Å; H170-F172 AromaticContact NE2-CE1 3.58Å; H170-F172 AromaticContact NE2-CZ 3.79Å; F172-L179 HydrophobicContact CB-CB 4.16Å; F172-L179 HydrophobicContact CB-CD2 4.34Å; F172-L179 HydrophobicContact CD2-CD2 3.8Å; F172-L179 HydrophobicContact CD2-CG 4.17Å; F172-L179 HydrophobicContact CE2-CD2 4.5Å; F172-L179 HydrophobicContact CG-CD2 4.37Å; F172-L179 PolarHBondContact N-O 3.37Å; F172-L179 PolarHBondContact O-N 2.97Å; F172-A181 HydrophobicContact CE2-CB 4.14Å
173	L	83.4	Confident	81.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	116.6	175.1	179.8	61	0	0	0	109.5	V150 Y151 L178 L201 W241 I244 L245	V150-L173 HydrophobicContact CB-CD2 4.44Å; V150-L173 HydrophobicContact CB-CG 4.22Å; V150-L173 HydrophobicContact CG1-CD2 4.36Å; V150-L173 PolarHBondContact N-O 2.69Å; Y151-L173 PolarHBondContact N-O 2.82Å; Y151-L173 WeakPolarHBondContact O-CB 3.45Å; Y151-L173 PolarHBondContact O-N 2.93Å; L173-L178 HydrophobicContact CB-CD1 4.13Å; L173-L178 HydrophobicContact CD1-CB 4.37Å; L173-L178 HydrophobicContact CD1-CD1 4.16Å; L173-L201 HydrophobicContact CD1-CD2 4.01Å; L173-W241 HydrophobicContact CB-CZ3 4.11Å; L173-I244 HydrophobicContact CD2-CG2 3.74Å; L173-L245 HydrophobicContact CD1-CD2 3.53Å; L173-L245 HydrophobicContact CD2-CD2 3.65Å; L173-L245 HydrophobicContact CD2-CG 4.09Å; L173-L245 HydrophobicContact CG-CD2 4.16Å
174	M	84.3	Confident	82.1	Confident	1 Å²	1	35 Å²	35	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	174.9	172.6	-64.9	170.8	-85.5	0	0	110.2	L128 I141 Y148 D176 C177 L179 L198	L128-M174 HydrophobicContact CD1-CG 4.1Å; L128-M174 HydrophobicContact CD1-SD 4.14Å; L128-M174 HydrophobicContact CD2-CG 4.46Å; L128-M174 HydrophobicContact CD2-SD 4.24Å; I141-M174 HydrophobicContact CG2-CE 4.32Å; I141-M174 HydrophobicContact CG2-SD 4.37Å; Y148-M174 WeakPolarHBondContact O-CA 3.45Å; M174-D176 VanDerWaalsContact C-N 3.26Å; M174-D176 PolarHBondContact O-N 3.47Å; M174-C177 WeakPolarHBondContact CA-O 3.45Å; M174-C177 WeakPolarHBondContact CB-O 3.36Å; M174-C177 WeakPolarHBondContact CE-SG 3.29Å; M174-C177 PolarHBondContact N-O 3.26Å; M174-L179 HydrophobicContact CE-CB 3.68Å; M174-L198 HydrophobicContact CE-CD1 4.46Å
175	N	79.3	Confident	81.5	Confident	38 Å²	38	37.5 Å²	37.5	20%	0.203	19%	0.194	C	C	.	.	S	Bend	trans	-64.2	-25.3	179	62.5	-28.1	0	0	0	114.4	G146 R147 Y148 L201	G146-N175 PolarHBondContact O-ND2 2.9Å; R147-N175 WeakPolarHBondContact CA-OD1 3.31Å; Y148-N175 HydrophobicContact CD1-CB 4.16Å; Y148-N175 HydrophobicContact CE1-CB 3.78Å; Y148-N175 HydrophobicContact CE2-CB 4.31Å; Y148-N175 PolarHBondContact O-N 2.87Å; N175-L201 VanDerWaalsContact O-CD1 3.29Å; N175-L201 WeakPolarHBondContact O-CD1 3.36Å
176	D	77.5	Confident	80.4	Confident	35 Å²	35	38.4 Å²	38.4	19%	0.187	20%	0.203	C	C	.	.	S	Bend	trans	-120.6	-22.7	-176.1	67	-23.7	0	0	0	114.2	R147 M174 L201	R147-D176 IonicContact CZ-OD2 3.46Å; R147-D176 VanDerWaalsContact CZ-OD2 3.29Å; R147-D176 VanDerWaalsContact NE-CG 3.35Å; R147-D176 IonicContact NE-OD1 3.76Å; R147-D176 PolarHBondContact NE-OD1 3.5Å; R147-D176 IonicContact NE-OD2 3.99Å; R147-D176 PolarHBondContact NE-OD2 3.06Å; R147-D176 IonicContact NH2-OD2 2.56Å; R147-D176 PolarHBondContact NH2-OD2 3.2Å; M174-D176 VanDerWaalsContact C-N 3.26Å; M174-D176 PolarHBondContact O-N 3.47Å; D176-L201 WeakPolarHBondContact O-CG 3.22Å; D176-L201 PolarHBondContact O-N 3.05Å
177	C	80.9	Confident	79.4	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	159.3	-175.4	58.4	0	0	0	0	114.1	M174 L198 Y199	M174-C177 WeakPolarHBondContact CA-O 3.45Å; M174-C177 WeakPolarHBondContact CB-O 3.36Å; M174-C177 WeakPolarHBondContact CE-SG 3.29Å; M174-C177 PolarHBondContact N-O 3.26Å; C177-L198 HydrophobicContact CB-CD1 4.45Å; C177-L198 HydrophobicContact CB-CD2 4Å; C177-L198 HydrophobicContact CB-CG 4.11Å; C177-Y199 CarbonylContact C-O 3.59Å; C177-Y199 WeakPolarHBondContact CA-O 3.32Å; C177-Y199 VanDerWaalsContact CB-O 3.31Å; C177-Y199 WeakPolarHBondContact CB-O 3.4Å
178	L	82.5	Confident	77.9	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	114.7	173.5	176.8	67	0	0	0	109	A171 L173 Y199 F204 I221 W241 L245	A171-L178 HydrophobicContact CB-CD1 4.37Å; L173-L178 HydrophobicContact CB-CD1 4.13Å; L173-L178 HydrophobicContact CD1-CB 4.37Å; L173-L178 HydrophobicContact CD1-CD1 4.16Å; L178-Y199 PolarHBondContact N-O 3.36Å; L178-Y199 PolarHBondContact O-N 2.9Å; L178-F204 HydrophobicContact CB-CE1 4.05Å; L178-F204 HydrophobicContact CB-CZ 3.93Å; L178-F204 HydrophobicContact CD2-CE1 4.39Å; L178-F204 HydrophobicContact CD2-CE2 4.14Å; L178-F204 HydrophobicContact CD2-CZ 3.79Å; L178-I221 HydrophobicContact CD2-CD1 3.75Å; L178-W241 HydrophobicContact CD1-CZ3 4.26Å; L178-L245 HydrophobicContact CD1-CD2 4.5Å; L178-L245 HydrophobicContact CD2-CD2 4.49Å
179	L	83.1	Confident	76.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	134.6	176.9	169.6	72.5	0	0	0	110.3	L132 I141 A171 F172 M174 Y195 L198	L132-L179 HydrophobicContact CD2-CD2 3.57Å; I141-L179 HydrophobicContact CD1-CD1 4.15Å; A171-L179 CarbonylContact C-O 3.5Å; A171-L179 WeakPolarHBondContact CA-O 3.22Å; F172-L179 HydrophobicContact CB-CB 4.16Å; F172-L179 HydrophobicContact CB-CD2 4.34Å; F172-L179 HydrophobicContact CD2-CD2 3.8Å; F172-L179 HydrophobicContact CD2-CG 4.17Å; F172-L179 HydrophobicContact CE2-CD2 4.5Å; F172-L179 HydrophobicContact CG-CD2 4.37Å; F172-L179 PolarHBondContact N-O 3.37Å; F172-L179 PolarHBondContact O-N 2.97Å; M174-L179 HydrophobicContact CE-CB 3.68Å; L179-Y195 HydrophobicContact CD1-CD2 3.39Å; L179-Y195 HydrophobicContact CD1-CE2 3.29Å; L179-L198 HydrophobicContact CD1-CB 4.42Å
180	I	84.3	Confident	75.4	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123.4	177.4	-60.6	-159.1	0	0	0	108.7	V169 N196 A197 Y199 F230	V169-I180 HydrophobicContact CB-CG2 4.34Å; V169-I180 HydrophobicContact CG1-CB 4.5Å; V169-I180 HydrophobicContact CG1-CG2 3.14Å; I180-N196 WeakPolarHBondContact O-CB 3.36Å; I180-N196 PolarHBondContact O-N 3.33Å; I180-A197 PolarHBondContact N-O 3.27Å; I180-A197 PolarHBondContact O-N 3.08Å; I180-A197 VanDerWaalsContact O-N 3.09Å; I180-Y199 HydrophobicContact CD1-CD2 4.18Å; I180-Y199 HydrophobicContact CD1-CE2 3.67Å; I180-Y199 HydrophobicContact CG1-CD2 4.29Å; I180-Y199 HydrophobicContact CG1-CE2 4.03Å; I180-F230 HydrophobicContact CD1-CE1 4.15Å; I180-F230 HydrophobicContact CD1-CE2 4.01Å; I180-F230 HydrophobicContact CD1-CZ 3.45Å; I180-F230 VanDerWaalsContact CD1-CZ 3.45Å
181	A	85.6	Confident	74.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.1	-179	0	0	0	0	0	111.7	V135 V169 H170 F172 K194	V135-A181 HydrophobicContact CG1-CB 3.85Å; V169-A181 CarbonylContact C-O 3.52Å; V169-A181 WeakPolarHBondContact CA-O 3.37Å; V169-A181 WeakPolarHBondContact CG1-O 3.33Å; H170-A181 PolarHBondContact N-O 3.15Å; H170-A181 PolarHBondContact O-N 3.33Å; F172-A181 HydrophobicContact CE2-CB 4.14Å; A181-K194 CarbonylContact C-O 3.47Å; A181-K194 VanDerWaalsContact CA-O 3.22Å; A181-K194 WeakPolarHBondContact CA-O 3.24Å
182	T	84.3	Confident	73.9	Confident	18 Å²	18	59.4 Å²	59.4	11%	0.11	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	148.6	-176.5	52.7	0	0	0	0	112	Q167 V169 L184 Y193 K194 N196	Q167-T182 HydrophobicContact CG-CG2 4.37Å; V169-T182 HydrophobicContact CG1-CG2 4.03Å; T182-L184 PolarHBondContact O-N 3.39Å; T182-Y193 CarbonylContact O-C 3.54Å; T182-Y193 WeakPolarHBondContact O-CA 3.42Å; T182-K194 PolarHBondContact N-O 3.24Å; T182-K194 PolarHBondContact O-N 3.4Å; T182-K194 PolarHBondContact OG1-O 3.06Å; T182-N196 HydrophobicContact CG2-CB 3.7Å; T182-N196 VanDerWaalsContact CG2-ND2 3.32Å; T182-N196 WeakPolarHBondContact CG2-ND2 3.48Å
183	W	80.3	Confident	73.6	Confident	111 Å²	111	60.7 Å²	60.7	42%	0.42	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128.2	-178.8	-165.1	-79.6	0	0	0	111.8	K168 Y193	K168-W183 HydrophobicContact CB-CB 4.31Å; K168-W183 PolarHBondContact O-N 2.92Å; W183-Y193 HydrophobicContact CD2-CE1 4.27Å; W183-Y193 HydrophobicContact CE3-CD1 4.02Å; W183-Y193 AromaticContact CE3-CE1 3.32Å; W183-Y193 HydrophobicContact CE3-CE1 3.32Å; W183-Y193 HydrophobicContact CH2-CE1 4.37Å; W183-Y193 HydrophobicContact CZ3-CD1 4.43Å; W183-Y193 AromaticContact CZ3-CE1 3.39Å; W183-Y193 HydrophobicContact CZ3-CE1 3.39Å; W183-Y193 AromaticContact CZ3-CZ 3.68Å; W183-Y193 WeakPolarHBondContact CZ3-OH 3.5Å
184	L	76	Confident	73.4	Confident	43 Å²	43	66 Å²	66	23%	0.225	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-86.7	120.6	177.5	-145.5	88.3	0	0	0	110.7	T182 N186 K192 K194	T182-L184 PolarHBondContact O-N 3.39Å; L184-N186 WeakPolarHBondContact CD2-O 3.4Å; L184-K192 PolarHBondContact N-O 3.08Å; L184-K194 HydrophobicContact CD1-CB 3.74Å; L184-K194 HydrophobicContact CD1-CD 4.21Å; L184-K194 HydrophobicContact CD1-CG 4.39Å
185	A	61.5	Low	73.2	Confident	102 Å²	102	70 Å²	70	84%	0.843	35%	0.354	S	S	*	.	S	Bend	trans	-72.3	-27.8	178.8	0	0	0	0	0	113.4
186	N	58	Low	73.2	Confident	134 Å²	134	70.9 Å²	70.9	72%	0.717	36%	0.358	S	S	*	.	S	Bend	trans	-109.2	95.1	-171.8	-132.8	2.1	0	0	0	111	L184 R188	L184-N186 WeakPolarHBondContact CD2-O 3.4Å; N186-R188 PolarHBondContact O-N 3.29Å
187	R	59.3	Low	73.2	Confident	202 Å²	202	69.9 Å²	69.9	76%	0.762	36%	0.355	S	S	*	.			trans	-72.1	114.4	-170.4	-61	178.8	-177.5	177.7	1.2	111.9
188	R	51.9	Low	73.2	Confident	219 Å²	219	72.1 Å²	72.1	83%	0.826	37%	0.367	S	S	*	.			trans	-115.2	102.2	164	-71.7	-172.5	-171.3	-160.1	3.3	109.1	N186	N186-R188 PolarHBondContact O-N 3.29Å
189	G	60.7	Low	73	Confident	75 Å²	75	73 Å²	73	77%	0.773	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	-141.2	174.2	0	0	0	0	0	114.8	V191	G189-V191 VanDerWaalsContact C-N 3.34Å
190	T	58.2	Low	72.8	Confident	113 Å²	113	77 Å²	77	69%	0.693	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-11.7	-172.9	46	0	0	0	0	114.5
191	V	67.9	Low	72.4	Confident	35 Å²	35	77.1 Å²	77.1	21%	0.212	39%	0.392	C	S	.	.			trans	-83.5	120	-176.7	-174.9	0	0	0	0	110.1	E136 G189	E136-V191 HydrophobicContact CB-CG1 3.59Å; E136-V191 HydrophobicContact CG-CG1 4.04Å; G189-V191 VanDerWaalsContact C-N 3.34Å
192	K	68.1	Low	71.8	Confident	114 Å²	114	83.7 Å²	83.7	50%	0.496	42%	0.423	S	S	.	.			trans	-111.8	-22.1	-176.2	-67.4	-173.5	179.8	-177.2	0	113.5	K134 L184	K134-K192 PolarHBondContact O-N 2.87Å; L184-K192 PolarHBondContact N-O 3.08Å
193	Y	78.9	Confident	71.2	Confident	28 Å²	28	85.9 Å²	85.9	11%	0.11	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152.6	-175	-51.8	-85.1	0	0	0	110.7	K134 V135 E136 H170 T182 W183	K134-Y193 PolarHBondContact O-N 3.46Å; V135-Y193 CarbonylContact C-O 3.56Å; V135-Y193 WeakPolarHBondContact CA-O 3.32Å; V135-Y193 HydrophobicContact CG2-CD2 4.43Å; E136-Y193 PolarHBondContact N-O 2.79Å; H170-Y193 HydrophobicContact CB-CD1 3.78Å; H170-Y193 HydrophobicContact CB-CE1 3.55Å; H170-Y193 AromaticContact CG-CE1 4Å; T182-Y193 CarbonylContact O-C 3.54Å; T182-Y193 WeakPolarHBondContact O-CA 3.42Å; W183-Y193 HydrophobicContact CD2-CE1 4.27Å; W183-Y193 HydrophobicContact CE3-CD1 4.02Å; W183-Y193 AromaticContact CE3-CE1 3.32Å; W183-Y193 HydrophobicContact CE3-CE1 3.32Å; W183-Y193 HydrophobicContact CH2-CE1 4.37Å; W183-Y193 HydrophobicContact CZ3-CD1 4.43Å; W183-Y193 AromaticContact CZ3-CE1 3.39Å; W183-Y193 HydrophobicContact CZ3-CE1 3.39Å; W183-Y193 AromaticContact CZ3-CZ 3.68Å; W183-Y193 WeakPolarHBondContact CZ3-OH 3.5Å
194	K	78.9	Confident	71.1	Confident	113 Å²	113	81 Å²	81	49%	0.491	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.5	171.9	-169.4	178.6	177.4	-177.4	0	109.6	A181 T182 L184 N196	A181-K194 CarbonylContact C-O 3.47Å; A181-K194 VanDerWaalsContact CA-O 3.22Å; A181-K194 WeakPolarHBondContact CA-O 3.24Å; T182-K194 PolarHBondContact N-O 3.24Å; T182-K194 PolarHBondContact O-N 3.4Å; T182-K194 PolarHBondContact OG1-O 3.06Å; L184-K194 HydrophobicContact CD1-CB 3.74Å; L184-K194 HydrophobicContact CD1-CD 4.21Å; L184-K194 HydrophobicContact CD1-CG 4.39Å; K194-N196 PolarHBondContact O-N 3.16Å
195	Y	79.4	Confident	71.1	Confident	85 Å²	85	81.4 Å²	81.4	33%	0.333	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	128.1	170.5	176.3	-91.6	0	0	0	110.9	E136 I141 L179 L198	E136-Y195 WeakPolarHBondContact O-CB 3.46Å; E136-Y195 PolarHBondContact O-N 3.11Å; I141-Y195 HydrophobicContact CD1-CD2 4.07Å; I141-Y195 HydrophobicContact CD1-CE2 3.63Å; L179-Y195 HydrophobicContact CD1-CD2 3.39Å; L179-Y195 HydrophobicContact CD1-CE2 3.29Å; Y195-L198 HydrophobicContact CE2-CB 4.11Å; Y195-L198 VanDerWaalsContact OH-CB 3.31Å; Y195-L198 WeakPolarHBondContact OH-CB 3.43Å; Y195-L198 PolarHBondContact OH-N 3.35Å
196	N	80.6	Confident	71.8	Confident	55 Å²	55	78.7 Å²	78.7	29%	0.294	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-57.5	176.4	-177.2	14.4	0	0	0	111.1	I180 T182 K194	I180-N196 WeakPolarHBondContact O-CB 3.36Å; I180-N196 PolarHBondContact O-N 3.33Å; T182-N196 HydrophobicContact CG2-CB 3.7Å; T182-N196 VanDerWaalsContact CG2-ND2 3.32Å; T182-N196 WeakPolarHBondContact CG2-ND2 3.48Å; K194-N196 PolarHBondContact O-N 3.16Å
197	A	76.9	Confident	72.8	Confident	15 Å²	15	75.2 Å²	75.2	12%	0.124	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	152.2	-179.1	0	0	0	0	0	112.7	I180 Y199	I180-A197 PolarHBondContact N-O 3.27Å; I180-A197 PolarHBondContact O-N 3.08Å; I180-A197 VanDerWaalsContact O-N 3.09Å; A197-Y199 HydrophobicContact CB-CE1 4.09Å; A197-Y199 HydrophobicContact CB-CE2 3.91Å; A197-Y199 WeakPolarHBondContact CB-OH 3.18Å
198	L	80.8	Confident	73.8	Confident	46 Å²	46	70 Å²	70	24%	0.241	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130	171.7	-179.1	143	0	0	0	108.8	I141 M174 C177 L179 Y195	I141-L198 HydrophobicContact CD1-CD1 3.52Å; I141-L198 HydrophobicContact CG1-CD1 3.77Å; I141-L198 HydrophobicContact CG2-CD1 4.11Å; M174-L198 HydrophobicContact CE-CD1 4.46Å; C177-L198 HydrophobicContact CB-CD1 4.45Å; C177-L198 HydrophobicContact CB-CD2 4Å; C177-L198 HydrophobicContact CB-CG 4.11Å; L179-L198 HydrophobicContact CD1-CB 4.42Å; Y195-L198 HydrophobicContact CE2-CB 4.11Å; Y195-L198 VanDerWaalsContact OH-CB 3.31Å; Y195-L198 WeakPolarHBondContact OH-CB 3.43Å; Y195-L198 PolarHBondContact OH-N 3.35Å
199	Y	79.4	Confident	75	Confident	22 Å²	22	60.9 Å²	60.9	9%	0.086	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.2	-178.2	-57.3	-60.7	0	0	0	110.9	C177 L178 I180 A197 M223 R228	C177-Y199 CarbonylContact C-O 3.59Å; C177-Y199 WeakPolarHBondContact CA-O 3.32Å; C177-Y199 VanDerWaalsContact CB-O 3.31Å; C177-Y199 WeakPolarHBondContact CB-O 3.4Å; L178-Y199 PolarHBondContact N-O 3.36Å; L178-Y199 PolarHBondContact O-N 2.9Å; I180-Y199 HydrophobicContact CD1-CD2 4.18Å; I180-Y199 HydrophobicContact CD1-CE2 3.67Å; I180-Y199 HydrophobicContact CG1-CD2 4.29Å; I180-Y199 HydrophobicContact CG1-CE2 4.03Å; A197-Y199 HydrophobicContact CB-CE1 4.09Å; A197-Y199 HydrophobicContact CB-CE2 3.91Å; A197-Y199 WeakPolarHBondContact CB-OH 3.18Å; Y199-M223 HydrophobicContact CD1-CE 4.11Å; Y199-M223 HydrophobicContact CD1-SD 4.31Å; Y199-M223 HydrophobicContact CE1-CE 3.14Å; Y199-M223 HydrophobicContact CE1-SD 3.56Å; Y199-M223 VanDerWaalsContact CE1-SD 3.56Å; Y199-M223 HydrophobicContact CE2-SD 4.23Å; Y199-M223 VanDerWaalsContact CZ-CE 3.5Å; Y199-M223 WeakPolarHBondContact OH-CE 3.21Å; Y199-M223 PolarHBondContact OH-SD 3.37Å; Y199-R228 PolarHBondContact OH-NH1 3.4Å
200	D	78.2	Confident	75.3	Confident	85 Å²	85	65.3 Å²	65.3	46%	0.455	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	143.5	170.8	-69.9	-29.9	0	0	0	110.2	E202 S203 F204	D200-E202 PolarHBondContact O-N 3.06Å; D200-S203 PolarHBondContact O-N 3.38Å; D200-S203 PolarHBondContact O-OG 2.9Å; D200-F204 WeakPolarHBondContact O-CD1 3.39Å; D200-F204 WeakPolarHBondContact O-CE1 3.4Å
201	L	76.5	Confident	75.8	Confident	4 Å²	4	63.9 Å²	63.9	2%	0.021	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-21	-175.9	-72.6	172.8	0	0	0	114.4	L173 N175 D176 F204 T248 K249 K252	L173-L201 HydrophobicContact CD1-CD2 4.01Å; N175-L201 VanDerWaalsContact O-CD1 3.29Å; N175-L201 WeakPolarHBondContact O-CD1 3.36Å; D176-L201 WeakPolarHBondContact O-CG 3.22Å; D176-L201 PolarHBondContact O-N 3.05Å; L201-F204 HydrophobicContact CD2-CE1 4.25Å; L201-F204 HydrophobicContact CD2-CZ 3.96Å; L201-T248 HydrophobicContact CD1-CG2 3.95Å; L201-K249 HydrophobicContact CB-CG 4.37Å; L201-K249 HydrophobicContact CD2-CG 4.26Å; L201-K249 WeakPolarHBondContact O-CE 3.46Å; L201-K249 PolarHBondContact O-NZ 3.5Å; L201-K252 HydrophobicContact CB-CD 4.31Å; L201-K252 HydrophobicContact CD1-CD 4.16Å
202	E	71.6	Confident	75.5	Confident	139 Å²	139	68.4 Å²	68.4	65%	0.65	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-21.5	177.5	-72.6	163.5	-129.5	0	0	113.5	D200 F204 K252	D200-E202 PolarHBondContact O-N 3.06Å; E202-F204 PolarHBondContact O-N 3.35Å; E202-K252 VanDerWaalsContact OE1-CE 3.29Å; E202-K252 WeakPolarHBondContact OE1-CE 3.36Å; E202-K252 IonicContact OE1-NZ 2.69Å; E202-K252 PolarHBondContact OE1-NZ 2.81Å
203	S	72.3	Confident	74.9	Confident	64 Å²	64	69.1 Å²	69.1	45%	0.448	36%	0.361	S	S	.	.	S	Bend	trans	-87.2	-6.2	-168.6	76.7	0	0	0	0	114.3	D200	D200-S203 PolarHBondContact O-N 3.38Å; D200-S203 PolarHBondContact O-OG 2.9Å
204	F	78	Confident	73.9	Confident	8 Å²	8	73 Å²	73	4%	0.035	39%	0.39	C	S	.	.			trans	-135.7	150.3	-177	68.1	-91.1	0	0	0	113.4	L178 D200 L201 E202 I206 I221 L222 M223 K249	L178-F204 HydrophobicContact CB-CE1 4.05Å; L178-F204 HydrophobicContact CB-CZ 3.93Å; L178-F204 HydrophobicContact CD2-CE1 4.39Å; L178-F204 HydrophobicContact CD2-CE2 4.14Å; L178-F204 HydrophobicContact CD2-CZ 3.79Å; D200-F204 WeakPolarHBondContact O-CD1 3.39Å; D200-F204 WeakPolarHBondContact O-CE1 3.4Å; L201-F204 HydrophobicContact CD2-CE1 4.25Å; L201-F204 HydrophobicContact CD2-CZ 3.96Å; E202-F204 PolarHBondContact O-N 3.35Å; F204-I206 HydrophobicContact CD2-CG1 4Å; F204-I206 HydrophobicContact CE2-CD1 3.98Å; F204-I206 HydrophobicContact CE2-CG1 3.85Å; F204-I221 HydrophobicContact CB-CG2 3.66Å; F204-I221 HydrophobicContact CD2-CG2 3.63Å; F204-I221 HydrophobicContact CE2-CG2 4.49Å; F204-I221 HydrophobicContact CG-CG2 3.87Å; F204-L222 CarbonylContact C-O 3.58Å; F204-L222 WeakPolarHBondContact CA-O 3.39Å; F204-L222 WeakPolarHBondContact CB-O 3.47Å; F204-M223 HydrophobicContact CB-CB 4.21Å; F204-K249 PolarHBondContact O-NZ 3.42Å
205	A	75.5	Confident	73.2	Confident	51 Å²	51	70.6 Å²	70.6	42%	0.421	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	144	172.3	0	0	0	0	0	110.5	I221 L222	A205-I221 CarbonylContact O-C 3.41Å; A205-I221 WeakPolarHBondContact O-CA 3.39Å; A205-L222 HydrophobicContact CB-CB 4.32Å; A205-L222 PolarHBondContact N-O 2.86Å; A205-L222 PolarHBondContact O-N 3.26Å
206	I	76.9	Confident	72.8	Confident	45 Å²	45	73 Å²	73	23%	0.231	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	127.9	-178	-55.4	156.4	0	0	0	108.6	F204 F219 L242 L245	F204-I206 HydrophobicContact CD2-CG1 4Å; F204-I206 HydrophobicContact CE2-CD1 3.98Å; F204-I206 HydrophobicContact CE2-CG1 3.85Å; I206-F219 HydrophobicContact CG2-CD2 4.34Å; I206-L242 HydrophobicContact CG2-CD2 3.4Å; I206-L242 VanDerWaalsContact CG2-CD2 3.4Å; I206-L245 HydrophobicContact CD1-CB 3.4Å; I206-L245 HydrophobicContact CD1-CD1 3.67Å; I206-L245 HydrophobicContact CD1-CD2 4.33Å; I206-L245 HydrophobicContact CD1-CG 3.99Å; I206-L245 HydrophobicContact CG1-CD1 4.49Å
207	V	79.6	Confident	72.7	Confident	61 Å²	61	71 Å²	71	37%	0.37	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.7	178.3	179.8	0	0	0	0	108.8	V209 K220 L222	V207-V209 PolarHBondContact O-N 3.5Å; V207-K220 HydrophobicContact CB-CB 4.34Å; V207-K220 PolarHBondContact N-O 2.86Å; V207-K220 PolarHBondContact O-N 3.4Å; V207-L222 HydrophobicContact CG2-CD1 3.45Å; V207-L222 VanDerWaalsContact CG2-CD1 3.45Å; V207-L222 HydrophobicContact CG2-CG 4.04Å
208	N	78.7	Confident	72.9	Confident	92 Å²	92	70.5 Å²	70.5	49%	0.492	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	118.1	171.7	-176.1	8.9	0	0	0	109.7	K238 L242	N208-K238 WeakPolarHBondContact OD1-CE 3.01Å; N208-K238 PolarHBondContact OD1-NZ 2.93Å; N208-K238 VanDerWaalsContact OD1-NZ 3.1Å; N208-L242 HydrophobicContact CB-CD1 3.88Å
209	V	77.4	Confident	73.1	Confident	28 Å²	28	68.4 Å²	68.4	17%	0.17	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-82.6	125.1	175.9	-176.3	0	0	0	0	108.1	V207 M215 M218 K220 K238	V207-V209 PolarHBondContact O-N 3.5Å; V209-M215 HydrophobicContact CG1-CB 4.4Å; V209-M215 HydrophobicContact CG1-SD 3.89Å; V209-M218 HydrophobicContact CB-CB 4.38Å; V209-M218 WeakPolarHBondContact CB-O 3.17Å; V209-M218 PolarHBondContact N-O 3.3Å; V209-K220 HydrophobicContact CG2-CB 3.94Å; V209-K238 PolarHBondContact O-NZ 3.34Å
210	K	68.4	Low	73.2	Confident	168 Å²	168	69.8 Å²	69.8	73%	0.73	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-67.4	138.3	177.7	-69.6	-176.9	179.5	178.6	0	110.1	H212	K210-H212 PolarHBondContact O-N 3.4Å; K210-H212 VanDerWaalsContact O-N 3.14Å
211	D	67.5	Low	73.4	Confident	84 Å²	84	66 Å²	66	45%	0.449	35%	0.353	S	S	.	.			trans	-70.7	109.4	-175.4	-57.8	-46.8	0	0	0	110.7	M215 D217 K238	D211-M215 CarbonylContact C-O 3.36Å; D211-M215 WeakPolarHBondContact CA-O 3.34Å; D211-D217 PolarHBondContact OD1-N 3.11Å; D211-K238 IonicContact OD1-NZ 3.26Å; D211-K238 PolarHBondContact OD1-NZ 3.21Å
212	H	61.8	Low	73.4	Confident	130 Å²	130	69.1 Å²	69.1	60%	0.602	37%	0.369	S	S	*	.	B	Isolated β-bridge	trans	-138.8	123.3	173.2	-83.4	-68.3	0	0	0	108	K210 M215	K210-H212 PolarHBondContact O-N 3.4Å; K210-H212 VanDerWaalsContact O-N 3.14Å; H212-M215 CarbonylContact C-O 3.31Å; H212-M215 PolarHBondContact N-O 3.09Å; H212-M215 CarbonylContact O-C 3.46Å; H212-M215 VanDerWaalsContact O-CA 3.25Å; H212-M215 WeakPolarHBondContact O-CA 3.32Å; H212-M215 VanDerWaalsContact O-CB 3.25Å; H212-M215 WeakPolarHBondContact O-CB 3.37Å; H212-M215 PolarHBondContact O-N 3.03Å; H212-M215 VanDerWaalsContact O-O 3.08Å
213	P	55.1	Low	73.6	Confident	129 Å²	129	63.7 Å²	63.7	84%	0.838	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	128.1	-179.8	-21.6	31.3	0	0	0	110.9
214	P	57.9	Low	72.9	Confident	108 Å²	108	70.7 Å²	70.7	70%	0.701	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.8	3	13.2	35.5	-36.1	0	0	0	116.7	K216	P214-K216 PolarHBondContact O-N 2.88Å
215	M	65.2	Low	71.9	Confident	63 Å²	63	75.6 Å²	75.6	31%	0.31	40%	0.4	S	S	.	.	B	Isolated β-bridge	trans	-84.1	97.6	178.5	-56.5	173.3	-176.9	0	0	111.2	M163 V209 D211 H212 M218	M163-M215 HydrophobicContact CE-CE 3.63Å; M163-M215 HydrophobicContact CE-CG 3.58Å; M163-M215 HydrophobicContact CE-SD 4.28Å; M163-M215 HydrophobicContact CG-CE 4.24Å; M163-M215 HydrophobicContact SD-CE 3.8Å; V209-M215 HydrophobicContact CG1-CB 4.4Å; V209-M215 HydrophobicContact CG1-SD 3.89Å; D211-M215 CarbonylContact C-O 3.36Å; D211-M215 WeakPolarHBondContact CA-O 3.34Å; H212-M215 CarbonylContact C-O 3.31Å; H212-M215 PolarHBondContact N-O 3.09Å; H212-M215 CarbonylContact O-C 3.46Å; H212-M215 VanDerWaalsContact O-CA 3.25Å; H212-M215 WeakPolarHBondContact O-CA 3.32Å; H212-M215 VanDerWaalsContact O-CB 3.25Å; H212-M215 WeakPolarHBondContact O-CB 3.37Å; H212-M215 PolarHBondContact O-N 3.03Å; H212-M215 VanDerWaalsContact O-O 3.08Å; M215-M218 HydrophobicContact CB-SD 3.93Å; M215-M218 HydrophobicContact CG-SD 4.09Å
216	K	71.3	Confident	71.7	Confident	137 Å²	137	79 Å²	79	60%	0.596	41%	0.407	S	S	*	.			trans	-122.4	130.3	173.3	-172.4	-176.8	175.4	-172.7	0	109.9	P214 M218 Q231	P214-K216 PolarHBondContact O-N 2.88Å; K216-M218 VanDerWaalsContact C-N 3.29Å; K216-M218 PolarHBondContact O-N 3.38Å; K216-Q231 PolarHBondContact O-NE2 3.19Å
217	D	78.4	Confident	71.8	Confident	13 Å²	13	78.4 Å²	78.4	7%	0.07	41%	0.406	C	S	.	.	S	Bend	trans	59.7	36.8	175.5	-59.2	-41.8	0	0	0	113.6	D211 A232 S235 K238	D211-D217 PolarHBondContact OD1-N 3.11Å; D217-A232 PolarHBondContact O-N 2.8Å; D217-S235 VanDerWaalsContact CG-N 3.27Å; D217-S235 WeakPolarHBondContact OD1-CA 3.38Å; D217-S235 WeakPolarHBondContact OD1-CB 3.31Å; D217-S235 PolarHBondContact OD1-N 2.99Å; D217-S235 PolarHBondContact OD1-OG 2.87Å; D217-S235 PolarHBondContact OD2-N 3.47Å; D217-K238 HydrophobicContact CB-CD 4.35Å
218	M	81.6	Confident	71.9	Confident	4 Å²	4	77.1 Å²	77.1	2%	0.02	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	148.5	178.9	-63.8	175.9	177.5	0	0	113.3	Y158 M163 V209 M215 K216 I229 F230 Q231 K238	Y158-M218 HydrophobicContact CD1-CE 4.28Å; Y158-M218 HydrophobicContact CD2-CE 4.02Å; Y158-M218 HydrophobicContact CE1-CE 4.1Å; Y158-M218 HydrophobicContact CE2-CE 3.84Å; Y158-M218 HydrophobicContact CG-CE 4.25Å; M163-M218 HydrophobicContact CE-CE 4.41Å; M163-M218 HydrophobicContact CE-SD 3.87Å; V209-M218 HydrophobicContact CB-CB 4.38Å; V209-M218 WeakPolarHBondContact CB-O 3.17Å; V209-M218 PolarHBondContact N-O 3.3Å; M215-M218 HydrophobicContact CB-SD 3.93Å; M215-M218 HydrophobicContact CG-SD 4.09Å; K216-M218 VanDerWaalsContact C-N 3.29Å; K216-M218 PolarHBondContact O-N 3.38Å; M218-I229 HydrophobicContact CB-CG2 4.19Å; M218-I229 HydrophobicContact CG-CG2 4.47Å; M218-I229 HydrophobicContact SD-CG2 4.21Å; M218-F230 CarbonylContact C-O 3.52Å; M218-F230 VanDerWaalsContact CA-O 3.23Å; M218-F230 WeakPolarHBondContact CA-O 3.08Å; M218-Q231 HydrophobicContact CE-CB 4.27Å; M218-Q231 HydrophobicContact CE-CG 4.3Å; M218-Q231 HydrophobicContact CG-CB 3.91Å; M218-Q231 HydrophobicContact CG-CG 4.01Å; M218-K238 WeakPolarHBondContact O-CE 3.32Å; M218-K238 PolarHBondContact O-NZ 3.4Å
219	F	83.3	Confident	72.2	Confident	2 Å²	2	73.3 Å²	73.3	1%	0.009	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	151.5	167.7	64.4	-86.9	0	0	0	110.1	L155 I206 I221 F230 W241 L242	L155-F219 HydrophobicContact CD1-CE1 4.42Å; L155-F219 HydrophobicContact CD1-CZ 3.78Å; L155-F219 HydrophobicContact CD2-CE1 3.94Å; L155-F219 HydrophobicContact CD2-CZ 4.13Å; I206-F219 HydrophobicContact CG2-CD2 4.34Å; F219-I221 HydrophobicContact CD2-CG1 4.31Å; F219-I221 HydrophobicContact CE2-CD1 4.2Å; F219-I221 HydrophobicContact CE2-CG1 4.2Å; F219-F230 HydrophobicContact CD1-CB 4.49Å; F219-F230 HydrophobicContact CE1-CB 4.01Å; F219-F230 HydrophobicContact CE2-CB 4.05Å; F219-F230 HydrophobicContact CE2-CD2 4.08Å; F219-F230 HydrophobicContact CE2-CG 4.46Å; F219-F230 HydrophobicContact CZ-CB 3.78Å; F219-F230 HydrophobicContact CZ-CD2 4.49Å; F219-F230 HydrophobicContact CZ-CG 4.44Å; F219-F230 PolarHBondContact N-O 2.88Å; F219-F230 PolarHBondContact O-N 3.43Å; F219-W241 HydrophobicContact CE1-CB 4.4Å; F219-W241 HydrophobicContact CZ-CB 4.48Å; F219-W241 HydrophobicContact CZ-CG 4.49Å; F219-L242 HydrophobicContact CB-CD2 4.13Å
220	K	81.6	Confident	72.6	Confident	51 Å²	51	72.1 Å²	72.1	22%	0.222	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.8	-175.4	-176	172.1	-174.9	174.3	0	110.1	V207 V209 L222 S227 R228 I229	V207-K220 HydrophobicContact CB-CB 4.34Å; V207-K220 PolarHBondContact N-O 2.86Å; V207-K220 PolarHBondContact O-N 3.4Å; V209-K220 HydrophobicContact CG2-CB 3.94Å; K220-L222 HydrophobicContact CD-CD2 4.02Å; K220-L222 HydrophobicContact CG-CD2 4.24Å; K220-S227 WeakPolarHBondContact CE-OG 3.42Å; K220-S227 PolarHBondContact NZ-OG 3.25Å; K220-S227 VanDerWaalsContact NZ-OG 3.08Å; K220-R228 CarbonylContact C-O 3.4Å; K220-R228 WeakPolarHBondContact CA-O 3.35Å; K220-I229 HydrophobicContact CB-CG1 4.3Å; K220-I229 HydrophobicContact CD-CG1 4.18Å; K220-I229 HydrophobicContact CG-CG1 4.03Å
221	I	83.4	Confident	73.3	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.021	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	117.3	170	-62.1	-173.3	0	0	0	107.6	L178 F204 A205 F219 S227 R228 F230	L178-I221 HydrophobicContact CD2-CD1 3.75Å; F204-I221 HydrophobicContact CB-CG2 3.66Å; F204-I221 HydrophobicContact CD2-CG2 3.63Å; F204-I221 HydrophobicContact CE2-CG2 4.49Å; F204-I221 HydrophobicContact CG-CG2 3.87Å; A205-I221 CarbonylContact O-C 3.41Å; A205-I221 WeakPolarHBondContact O-CA 3.39Å; F219-I221 HydrophobicContact CD2-CG1 4.31Å; F219-I221 HydrophobicContact CE2-CD1 4.2Å; F219-I221 HydrophobicContact CE2-CG1 4.2Å; I221-S227 WeakPolarHBondContact O-CA 3.5Å; I221-R228 PolarHBondContact N-O 2.93Å; I221-R228 PolarHBondContact O-N 3.48Å; I221-F230 HydrophobicContact CB-CE2 4.3Å; I221-F230 HydrophobicContact CD1-CD2 4Å; I221-F230 HydrophobicContact CD1-CE2 3.78Å; I221-F230 HydrophobicContact CG1-CD2 4.11Å; I221-F230 HydrophobicContact CG1-CE2 4.08Å
222	L	76.6	Confident	74.2	Confident	70 Å²	70	62.5 Å²	62.5	37%	0.366	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	123.4	176.3	-65.5	175.5	0	0	0	109.1	F204 A205 V207 K220	F204-L222 CarbonylContact C-O 3.58Å; F204-L222 WeakPolarHBondContact CA-O 3.39Å; F204-L222 WeakPolarHBondContact CB-O 3.47Å; A205-L222 HydrophobicContact CB-CB 4.32Å; A205-L222 PolarHBondContact N-O 2.86Å; A205-L222 PolarHBondContact O-N 3.26Å; V207-L222 HydrophobicContact CG2-CD1 3.45Å; V207-L222 VanDerWaalsContact CG2-CD1 3.45Å; V207-L222 HydrophobicContact CG2-CG 4.04Å; K220-L222 HydrophobicContact CD-CD2 4.02Å; K220-L222 HydrophobicContact CG-CD2 4.24Å
223	M	75.1	Confident	75.1	Confident	25 Å²	25	63.7 Å²	63.7	12%	0.123	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	103.3	-172.7	43.3	-176.5	-79.5	0	0	108.5	Y199 F204 P225 E226 R228	Y199-M223 HydrophobicContact CD1-CE 4.11Å; Y199-M223 HydrophobicContact CD1-SD 4.31Å; Y199-M223 HydrophobicContact CE1-CE 3.14Å; Y199-M223 HydrophobicContact CE1-SD 3.56Å; Y199-M223 VanDerWaalsContact CE1-SD 3.56Å; Y199-M223 HydrophobicContact CE2-SD 4.23Å; Y199-M223 VanDerWaalsContact CZ-CE 3.5Å; Y199-M223 WeakPolarHBondContact OH-CE 3.21Å; Y199-M223 PolarHBondContact OH-SD 3.37Å; F204-M223 HydrophobicContact CB-CB 4.21Å; M223-P225 CarbonylContact O-C 3.55Å; M223-P225 VanDerWaalsContact O-N 3.16Å; M223-E226 CarbonylContact C-O 3.6Å; M223-E226 VanDerWaalsContact C-O 3.31Å; M223-E226 HydrophobicContact CE-CB 4.35Å; M223-E226 HydrophobicContact CG-CB 4.39Å; M223-E226 VanDerWaalsContact CG-O 3.25Å; M223-E226 WeakPolarHBondContact CG-O 3.48Å; M223-E226 PolarHBondContact N-O 2.91Å; M223-E226 CarbonylContact O-C 3.55Å; M223-E226 WeakPolarHBondContact O-CA 3.22Å; M223-E226 PolarHBondContact O-N 2.64Å; M223-R228 HydrophobicContact SD-CG 4.06Å
224	F	58.1	Low	76.4	Confident	211 Å²	211	61.7 Å²	61.7	93%	0.925	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	124.9	-173.1	-174.2	-93.5	0	0	0	111.7
225	P	56.9	Low	77.4	Confident	112 Å²	112	58.9 Å²	58.9	73%	0.727	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	cis	-99.3	3.4	8.9	37.6	-32.6	0	0	0	116.1	M223	M223-P225 CarbonylContact O-C 3.55Å; M223-P225 VanDerWaalsContact O-N 3.16Å
226	E	70.9	Confident	78.1	Confident	123 Å²	123	63.7 Å²	63.7	58%	0.575	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	166.2	-174.6	-62.9	-175.3	168.3	0	0	113.7	M223	M223-E226 CarbonylContact C-O 3.6Å; M223-E226 VanDerWaalsContact C-O 3.31Å; M223-E226 HydrophobicContact CE-CB 4.35Å; M223-E226 HydrophobicContact CG-CB 4.39Å; M223-E226 VanDerWaalsContact CG-O 3.25Å; M223-E226 WeakPolarHBondContact CG-O 3.48Å; M223-E226 PolarHBondContact N-O 2.91Å; M223-E226 CarbonylContact O-C 3.55Å; M223-E226 WeakPolarHBondContact O-CA 3.22Å; M223-E226 PolarHBondContact O-N 2.64Å
227	S	79.1	Confident	78.6	Confident	31 Å²	31	59 Å²	59	22%	0.217	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	146.5	168.1	69.6	0	0	0	0	110.3	V160 K220 I221	V160-S227 WeakPolarHBondContact CG2-O 3.4Å; K220-S227 WeakPolarHBondContact CE-OG 3.42Å; K220-S227 PolarHBondContact NZ-OG 3.25Å; K220-S227 VanDerWaalsContact NZ-OG 3.08Å; I221-S227 WeakPolarHBondContact O-CA 3.5Å
228	R	81.8	Confident	78.7	Confident	34 Å²	34	58.7 Å²	58.7	13%	0.128	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	137.7	-178.2	-56.3	-174.7	92.3	155.4	14.7	110	E157 Y199 K220 I221 M223 F230	E157-R228 IonicContact OE1-CZ 3.26Å; E157-R228 IonicContact OE1-NE 3.15Å; E157-R228 PolarHBondContact OE1-NE 3.2Å; E157-R228 IonicContact OE1-NH2 2.65Å; E157-R228 PolarHBondContact OE1-NH2 3.28Å; E157-R228 IonicContact OE2-CZ 3.17Å; E157-R228 IonicContact OE2-NH2 3.81Å; E157-R228 PolarHBondContact OE2-NH2 3.24Å; Y199-R228 PolarHBondContact OH-NH1 3.4Å; K220-R228 CarbonylContact C-O 3.4Å; K220-R228 WeakPolarHBondContact CA-O 3.35Å; I221-R228 PolarHBondContact N-O 2.93Å; I221-R228 PolarHBondContact O-N 3.48Å; M223-R228 HydrophobicContact SD-CG 4.06Å; R228-F230 HydrophobicContact CB-CE2 3.77Å; R228-F230 HydrophobicContact CB-CZ 3.85Å
229	I	84.8	Confident	78.7	Confident	13 Å²	13	64.5 Å²	64.5	7%	0.067	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.1	179.5	-61	173	0	0	0	108.5	E157 Y158 V160 M163 M218 K220	E157-I229 WeakPolarHBondContact CA-O 3.19Å; Y158-I229 PolarHBondContact N-O 3.12Å; V160-I229 HydrophobicContact CG2-CD1 4.48Å; V160-I229 HydrophobicContact CG2-CG1 4.43Å; M163-I229 HydrophobicContact SD-CD1 3.95Å; M218-I229 HydrophobicContact CB-CG2 4.19Å; M218-I229 HydrophobicContact CG-CG2 4.47Å; M218-I229 HydrophobicContact SD-CG2 4.21Å; K220-I229 HydrophobicContact CB-CG1 4.3Å; K220-I229 HydrophobicContact CD-CG1 4.18Å; K220-I229 HydrophobicContact CG-CG1 4.03Å
230	F	85.4	Confident	78.7	Confident	2 Å²	2	68.3 Å²	68.3	1%	0.009	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.2	177.9	-61.3	-74	0	0	0	110.6	L155 V156 E157 I180 M218 F219 I221 R228	L155-F230 HydrophobicContact CB-CB 4.45Å; L155-F230 HydrophobicContact CB-CD1 4.34Å; L155-F230 HydrophobicContact CD1-CB 4.27Å; L155-F230 HydrophobicContact CD1-CG 4.37Å; V156-F230 CarbonylContact O-C 3.58Å; V156-F230 WeakPolarHBondContact O-CA 3.45Å; E157-F230 HydrophobicContact CB-CD1 4.15Å; E157-F230 HydrophobicContact CB-CE1 3.98Å; E157-F230 HydrophobicContact CG-CD1 4.37Å; E157-F230 HydrophobicContact CG-CE1 3.91Å; I180-F230 HydrophobicContact CD1-CE1 4.15Å; I180-F230 HydrophobicContact CD1-CE2 4.01Å; I180-F230 HydrophobicContact CD1-CZ 3.45Å; I180-F230 VanDerWaalsContact CD1-CZ 3.45Å; M218-F230 CarbonylContact C-O 3.52Å; M218-F230 VanDerWaalsContact CA-O 3.23Å; M218-F230 WeakPolarHBondContact CA-O 3.08Å; F219-F230 HydrophobicContact CD1-CB 4.49Å; F219-F230 HydrophobicContact CE1-CB 4.01Å; F219-F230 HydrophobicContact CE2-CB 4.05Å; F219-F230 HydrophobicContact CE2-CD2 4.08Å; F219-F230 HydrophobicContact CE2-CG 4.46Å; F219-F230 HydrophobicContact CZ-CB 3.78Å; F219-F230 HydrophobicContact CZ-CD2 4.49Å; F219-F230 HydrophobicContact CZ-CG 4.44Å; F219-F230 PolarHBondContact N-O 2.88Å; F219-F230 PolarHBondContact O-N 3.43Å; I221-F230 HydrophobicContact CB-CE2 4.3Å; I221-F230 HydrophobicContact CD1-CD2 4Å; I221-F230 HydrophobicContact CD1-CE2 3.78Å; I221-F230 HydrophobicContact CG1-CD2 4.11Å; I221-F230 HydrophobicContact CG1-CE2 4.08Å; R228-F230 HydrophobicContact CB-CE2 3.77Å; R228-F230 HydrophobicContact CB-CZ 3.85Å
231	Q	84.7	Confident	78.9	Confident	47 Å²	47	65.9 Å²	65.9	22%	0.22	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	128.4	170.1	-171.7	177.8	37.6	0	0	109.8	V156 Y158 K216 M218	V156-Q231 HydrophobicContact CB-CB 4.38Å; V156-Q231 PolarHBondContact N-O 3.49Å; V156-Q231 PolarHBondContact O-N 3.39Å; Y158-Q231 HydrophobicContact CD2-CB 4.04Å; Y158-Q231 HydrophobicContact CE2-CB 3.65Å; Y158-Q231 HydrophobicContact CE2-CG 4.45Å; Y158-Q231 VanDerWaalsContact CE2-OE1 3.31Å; Y158-Q231 PolarHBondContact OH-OE1 3.48Å; K216-Q231 PolarHBondContact O-NE2 3.19Å; M218-Q231 HydrophobicContact CE-CB 4.27Å; M218-Q231 HydrophobicContact CE-CG 4.3Å; M218-Q231 HydrophobicContact CG-CB 3.91Å; M218-Q231 HydrophobicContact CG-CG 4.01Å
232	A	84.6	Confident	78.9	Confident	4 Å²	4	67.3 Å²	67.3	3%	0.033	33%	0.332	C	S	.	.			trans	-87.2	156	170.4	0	0	0	0	0	110.6	L155 D217 N234 I237 K238	L155-A232 HydrophobicContact CD2-CB 4.24Å; D217-A232 PolarHBondContact O-N 2.8Å; A232-N234 VanDerWaalsContact C-N 3.28Å; A232-N234 PolarHBondContact O-N 3.25Å; A232-I237 HydrophobicContact CB-CB 4.4Å; A232-I237 HydrophobicContact CB-CG2 4.13Å; A232-K238 HydrophobicContact CB-CB 3.96Å
233	E	81.5	Confident	79.3	Confident	154 Å²	154	70.1 Å²	70.1	72%	0.72	34%	0.343	S	S	*	.	S	Bend	trans	-62.6	-34.3	-179.3	-175.6	178.4	-174.6	0	0	112.8	I237	E233-I237 HydrophobicContact CB-CD1 4.03Å
234	N	81.5	Confident	79.7	Confident	88 Å²	88	70.6 Å²	70.6	47%	0.471	35%	0.346	S	S	.	.	S	Bend	trans	-146.1	155.4	-179	-73.1	-45.2	0	0	0	111.9	A232 K236 I237 K238	A232-N234 VanDerWaalsContact C-N 3.28Å; A232-N234 PolarHBondContact O-N 3.25Å; N234-K236 PolarHBondContact O-N 3.49Å; N234-K236 VanDerWaalsContact O-N 3.1Å; N234-I237 HydrophobicContact CB-CD1 4.37Å; N234-I237 PolarHBondContact O-N 3.15Å; N234-K238 PolarHBondContact O-N 2.91Å
235	S	78.9	Confident	80.8	Confident	49 Å²	49	60.6 Å²	60.6	34%	0.343	30%	0.302	S	S	.	.	H	α-helix	trans	-53.6	-30.5	173.7	-162.2	0	0	0	0	114.2	D217 K239	D217-S235 VanDerWaalsContact CG-N 3.27Å; D217-S235 WeakPolarHBondContact OD1-CA 3.38Å; D217-S235 WeakPolarHBondContact OD1-CB 3.31Å; D217-S235 PolarHBondContact OD1-N 2.99Å; D217-S235 PolarHBondContact OD1-OG 2.87Å; D217-S235 PolarHBondContact OD2-N 3.47Å; S235-K239 WeakPolarHBondContact O-CG 3.48Å; S235-K239 PolarHBondContact O-N 3.32Å; S235-K239 VanDerWaalsContact O-N 3.14Å
236	K	79.9	Confident	81.9	Confident	164 Å²	164	58.9 Å²	58.9	71%	0.713	29%	0.287	S	S	*	.	H	α-helix	trans	-65.9	-50.1	174.2	-67	-175.8	179	-177.7	0	111.8	N234 K238 K239 E240	N234-K236 PolarHBondContact O-N 3.49Å; N234-K236 VanDerWaalsContact O-N 3.1Å; K236-K238 VanDerWaalsContact C-N 3.31Å; K236-K238 PolarHBondContact O-N 3.37Å; K236-K239 PolarHBondContact O-N 2.97Å; K236-K239 VanDerWaalsContact O-N 3.12Å; K236-E240 WeakPolarHBondContact O-CG 3.39Å; K236-E240 PolarHBondContact O-N 2.8Å
237	I	82.1	Confident	82.4	Confident	38 Å²	38	58.5 Å²	58.5	20%	0.195	29%	0.285	C	S	.	.	H	α-helix	trans	-65.1	-36.2	179.3	-65	164.6	0	0	0	110.6	A232 E233 N234 E240 W241	A232-I237 HydrophobicContact CB-CB 4.4Å; A232-I237 HydrophobicContact CB-CG2 4.13Å; E233-I237 HydrophobicContact CB-CD1 4.03Å; N234-I237 HydrophobicContact CB-CD1 4.37Å; N234-I237 PolarHBondContact O-N 3.15Å; I237-E240 PolarHBondContact O-N 3.5Å; I237-W241 WeakPolarHBondContact O-CB 3.29Å; I237-W241 VanDerWaalsContact O-CD1 3.29Å; I237-W241 PolarHBondContact O-N 2.75Å
238	K	81.7	Confident	82.4	Confident	7 Å²	7	57.6 Å²	57.6	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-59	-46.1	171.6	173.1	175.2	168.2	175.9	0	112	N208 V209 D211 D217 M218 A232 N234 K236 W241 L242	N208-K238 WeakPolarHBondContact OD1-CE 3.01Å; N208-K238 PolarHBondContact OD1-NZ 2.93Å; N208-K238 VanDerWaalsContact OD1-NZ 3.1Å; V209-K238 PolarHBondContact O-NZ 3.34Å; D211-K238 IonicContact OD1-NZ 3.26Å; D211-K238 PolarHBondContact OD1-NZ 3.21Å; D217-K238 HydrophobicContact CB-CD 4.35Å; M218-K238 WeakPolarHBondContact O-CE 3.32Å; M218-K238 PolarHBondContact O-NZ 3.4Å; A232-K238 HydrophobicContact CB-CB 3.96Å; N234-K238 PolarHBondContact O-N 2.91Å; K236-K238 VanDerWaalsContact C-N 3.31Å; K236-K238 PolarHBondContact O-N 3.37Å; K238-W241 PolarHBondContact O-N 2.84Å; K238-L242 HydrophobicContact CG-CD1 4.18Å; K238-L242 VanDerWaalsContact O-CG 3.3Å; K238-L242 WeakPolarHBondContact O-CG 3.35Å; K238-L242 PolarHBondContact O-N 3.48Å; K238-L242 VanDerWaalsContact O-N 3.08Å
239	K	81.5	Confident	82.3	Confident	125 Å²	125	58.1 Å²	58.1	54%	0.543	28%	0.281	S	S	.	.	H	α-helix	trans	-64.7	-44.2	177.7	-73.1	179.1	-177.7	-175.4	0	111.4	S235 K236 W241 L242 E243	S235-K239 WeakPolarHBondContact O-CG 3.48Å; S235-K239 PolarHBondContact O-N 3.32Å; S235-K239 VanDerWaalsContact O-N 3.14Å; K236-K239 PolarHBondContact O-N 2.97Å; K236-K239 VanDerWaalsContact O-N 3.12Å; K239-W241 PolarHBondContact O-N 3.47Å; K239-L242 PolarHBondContact O-N 3.23Å; K239-E243 WeakPolarHBondContact O-CB 3.33Å; K239-E243 WeakPolarHBondContact O-CG 3.38Å; K239-E243 PolarHBondContact O-N 2.69Å
240	E	82.9	Confident	82	Confident	82 Å²	82	63.2 Å²	63.2	38%	0.383	30%	0.303	S	S	.	.	H	α-helix	trans	-57.6	-47.7	175.1	-72.6	172.6	-159.3	0	0	111.8	Y151 K236 I237 L242 E243 I244	Y151-E240 PolarHBondContact OH-OE2 3.12Å; K236-E240 WeakPolarHBondContact O-CG 3.39Å; K236-E240 PolarHBondContact O-N 2.8Å; I237-E240 PolarHBondContact O-N 3.5Å; E240-L242 PolarHBondContact O-N 3.34Å; E240-E243 PolarHBondContact O-N 2.82Å; E240-I244 HydrophobicContact CB-CD1 4.44Å; E240-I244 VanDerWaalsContact O-CB 3.31Å; E240-I244 WeakPolarHBondContact O-CB 3.19Å; E240-I244 WeakPolarHBondContact O-CG1 3.34Å; E240-I244 PolarHBondContact O-N 2.89Å
241	W	85.6	Confident	81.6	Confident	1 Å²	1	67 Å²	67	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-59.1	-45	176.2	-90.6	109.4	0	0	0	112.5	Y151 L155 A171 L173 L178 F219 I237 K238 K239 L245	Y151-W241 AromaticContact CD1-CD2 3.91Å; Y151-W241 HydrophobicContact CD1-CD2 3.91Å; Y151-W241 AromaticContact CD1-CE2 3.75Å; Y151-W241 AromaticContact CD1-CE3 3.99Å; Y151-W241 HydrophobicContact CD1-CE3 3.99Å; Y151-W241 AromaticContact CD1-CH2 3.79Å; Y151-W241 HydrophobicContact CD1-CH2 3.79Å; Y151-W241 AromaticContact CD1-CZ2 3.7Å; Y151-W241 HydrophobicContact CD1-CZ2 3.7Å; Y151-W241 AromaticContact CD1-CZ3 3.94Å; Y151-W241 HydrophobicContact CD1-CZ3 3.94Å; Y151-W241 AromaticContact CE1-CD2 3.83Å; Y151-W241 HydrophobicContact CE1-CD2 3.83Å; Y151-W241 AromaticContact CE1-CE2 3.51Å; Y151-W241 HydrophobicContact CE1-CE3 4.37Å; Y151-W241 HydrophobicContact CE1-CG 4.19Å; Y151-W241 HydrophobicContact CE1-CH2 4.38Å; Y151-W241 AromaticContact CE1-CZ2 3.83Å; Y151-W241 HydrophobicContact CE1-CZ2 3.83Å; Y151-W241 AromaticContact CE1-NE1 3.66Å; L155-W241 HydrophobicContact CD1-CZ2 4.32Å; A171-W241 HydrophobicContact CB-CH2 3.52Å; A171-W241 HydrophobicContact CB-CZ2 3.85Å; A171-W241 HydrophobicContact CB-CZ3 4.35Å; L173-W241 HydrophobicContact CB-CZ3 4.11Å; L178-W241 HydrophobicContact CD1-CZ3 4.26Å; F219-W241 HydrophobicContact CE1-CB 4.4Å; F219-W241 HydrophobicContact CZ-CB 4.48Å; F219-W241 HydrophobicContact CZ-CG 4.49Å; I237-W241 WeakPolarHBondContact O-CB 3.29Å; I237-W241 VanDerWaalsContact O-CD1 3.29Å; I237-W241 PolarHBondContact O-N 2.75Å; K238-W241 PolarHBondContact O-N 2.84Å; K239-W241 PolarHBondContact O-N 3.47Å; W241-L245 HydrophobicContact CE3-CD1 3.85Å; W241-L245 HydrophobicContact CE3-CG 4.08Å; W241-L245 WeakPolarHBondContact O-CB 3.46Å; W241-L245 VanDerWaalsContact O-CD1 3.3Å; W241-L245 WeakPolarHBondContact O-CD1 3.5Å; W241-L245 WeakPolarHBondContact O-CG 3.43Å; W241-L245 PolarHBondContact O-N 2.67Å
242	L	83.6	Confident	81	Confident	34 Å²	34	67.1 Å²	67.1	18%	0.178	32%	0.323	C	S	.	.	H	α-helix	trans	-65.8	-43.5	179.5	-70.2	174.3	0	0	0	112.2	I206 N208 F219 K238 K239 E240 D246	I206-L242 HydrophobicContact CG2-CD2 3.4Å; I206-L242 VanDerWaalsContact CG2-CD2 3.4Å; N208-L242 HydrophobicContact CB-CD1 3.88Å; F219-L242 HydrophobicContact CB-CD2 4.13Å; K238-L242 HydrophobicContact CG-CD1 4.18Å; K238-L242 VanDerWaalsContact O-CG 3.3Å; K238-L242 WeakPolarHBondContact O-CG 3.35Å; K238-L242 PolarHBondContact O-N 3.48Å; K238-L242 VanDerWaalsContact O-N 3.08Å; K239-L242 PolarHBondContact O-N 3.23Å; E240-L242 PolarHBondContact O-N 3.34Å; L242-D246 WeakPolarHBondContact O-CB 3.23Å; L242-D246 PolarHBondContact O-N 3.08Å; L242-D246 VanDerWaalsContact O-N 3.11Å
243	E	84.1	Confident	80.4	Confident	128 Å²	128	70.7 Å²	70.7	60%	0.598	34%	0.344	S	S	*	.	H	α-helix	trans	-65.7	-50.9	179.2	-74.4	171.6	-166.1	0	0	111.1	K239 E240 L245 D246 E247	K239-E243 WeakPolarHBondContact O-CB 3.33Å; K239-E243 WeakPolarHBondContact O-CG 3.38Å; K239-E243 PolarHBondContact O-N 2.69Å; E240-E243 PolarHBondContact O-N 2.82Å; E243-L245 PolarHBondContact O-N 2.88Å; E243-D246 PolarHBondContact O-N 3.35Å; E243-E247 VanDerWaalsContact O-CB 3.31Å; E243-E247 WeakPolarHBondContact O-CB 3.46Å; E243-E247 PolarHBondContact O-N 3.5Å
244	I	83.3	Confident	79.8	Confident	35 Å²	35	66.4 Å²	66.4	18%	0.179	33%	0.329	C	S	.	.	H	α-helix	trans	-66.4	-40	-177.9	-63.3	169.3	0	0	0	110.7	V150 Y151 L173 E240 E247 T248	V150-I244 HydrophobicContact CG1-CG2 3.84Å; Y151-I244 HydrophobicContact CD1-CD1 4.31Å; Y151-I244 HydrophobicContact CD2-CD1 3.44Å; Y151-I244 VanDerWaalsContact CD2-CD1 3.44Å; Y151-I244 HydrophobicContact CE1-CD1 4.48Å; Y151-I244 HydrophobicContact CE2-CD1 3.64Å; Y151-I244 HydrophobicContact CG-CD1 3.79Å; Y151-I244 HydrophobicContact CG-CG2 4.5Å; L173-I244 HydrophobicContact CD2-CG2 3.74Å; E240-I244 HydrophobicContact CB-CD1 4.44Å; E240-I244 VanDerWaalsContact O-CB 3.31Å; E240-I244 WeakPolarHBondContact O-CB 3.19Å; E240-I244 WeakPolarHBondContact O-CG1 3.34Å; E240-I244 PolarHBondContact O-N 2.89Å; I244-E247 PolarHBondContact O-N 3.29Å; I244-T248 WeakPolarHBondContact O-CB 3.24Å; I244-T248 PolarHBondContact O-N 3.44Å; I244-T248 PolarHBondContact O-OG1 2.93Å
245	L	81.6	Confident	79.1	Confident	1 Å²	1	68 Å²	68	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-65.4	-40.7	176.9	-76.7	165.6	0	0	0	112.3	L173 L178 I206 W241 E243 K249	L173-L245 HydrophobicContact CD1-CD2 3.53Å; L173-L245 HydrophobicContact CD2-CD2 3.65Å; L173-L245 HydrophobicContact CD2-CG 4.09Å; L173-L245 HydrophobicContact CG-CD2 4.16Å; L178-L245 HydrophobicContact CD1-CD2 4.5Å; L178-L245 HydrophobicContact CD2-CD2 4.49Å; I206-L245 HydrophobicContact CD1-CB 3.4Å; I206-L245 HydrophobicContact CD1-CD1 3.67Å; I206-L245 HydrophobicContact CD1-CD2 4.33Å; I206-L245 HydrophobicContact CD1-CG 3.99Å; I206-L245 HydrophobicContact CG1-CD1 4.49Å; W241-L245 HydrophobicContact CE3-CD1 3.85Å; W241-L245 HydrophobicContact CE3-CG 4.08Å; W241-L245 WeakPolarHBondContact O-CB 3.46Å; W241-L245 VanDerWaalsContact O-CD1 3.3Å; W241-L245 WeakPolarHBondContact O-CD1 3.5Å; W241-L245 WeakPolarHBondContact O-CG 3.43Å; W241-L245 PolarHBondContact O-N 2.67Å; E243-L245 PolarHBondContact O-N 2.88Å; L245-K249 WeakPolarHBondContact O-CG 3.3Å; L245-K249 PolarHBondContact O-N 2.94Å; L245-K249 VanDerWaalsContact O-N 3.12Å
246	D	80.9	Confident	78.4	Confident	76 Å²	76	70.1 Å²	70.1	41%	0.406	34%	0.336	S	S	.	.	H	α-helix	trans	-68.6	-40.5	176.9	-169.3	40.7	0	0	0	111.4	L242 E243 K249 K250	L242-D246 WeakPolarHBondContact O-CB 3.23Å; L242-D246 PolarHBondContact O-N 3.08Å; L242-D246 VanDerWaalsContact O-N 3.11Å; E243-D246 PolarHBondContact O-N 3.35Å; D246-K249 PolarHBondContact O-N 2.89Å; D246-K250 WeakPolarHBondContact O-CB 3.34Å; D246-K250 WeakPolarHBondContact O-CG 3.38Å; D246-K250 PolarHBondContact O-N 2.86Å; D246-K250 IonicContact OD1-NZ 3.98Å; D246-K250 WeakPolarHBondContact OD2-CE 3.3Å; D246-K250 IonicContact OD2-NZ 2.7Å; D246-K250 PolarHBondContact OD2-NZ 3.33Å
247	E	81.4	Confident	77.4	Confident	116 Å²	116	68.4 Å²	68.4	54%	0.542	33%	0.328	S	S	.	.	H	α-helix	trans	-63.2	-42.9	174.9	-169.8	179	-175.5	0	0	111.8	E243 I244 K249 K250 N251	E243-E247 VanDerWaalsContact O-CB 3.31Å; E243-E247 WeakPolarHBondContact O-CB 3.46Å; E243-E247 PolarHBondContact O-N 3.5Å; I244-E247 PolarHBondContact O-N 3.29Å; E247-K249 VanDerWaalsContact C-N 3.34Å; E247-K249 PolarHBondContact O-N 3.01Å; E247-K250 PolarHBondContact O-N 3.35Å; E247-N251 VanDerWaalsContact O-CB 3.31Å; E247-N251 WeakPolarHBondContact O-CB 3.45Å; E247-N251 VanDerWaalsContact O-CG 3.25Å; E247-N251 PolarHBondContact O-N 3.42Å; E247-N251 PolarHBondContact O-ND2 3.39Å
248	T	79.2	Confident	76	Confident	12 Å²	12	72.2 Å²	72.2	7%	0.074	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-39.2	178.6	-47.8	0	0	0	0	111.1	V150 L201 I244 N251 K252	V150-T248 HydrophobicContact CG2-CG2 4.18Å; L201-T248 HydrophobicContact CD1-CG2 3.95Å; I244-T248 WeakPolarHBondContact O-CB 3.24Å; I244-T248 PolarHBondContact O-N 3.44Å; I244-T248 PolarHBondContact O-OG1 2.93Å; T248-N251 PolarHBondContact O-N 3.1Å; T248-K252 PolarHBondContact O-N 3.02Å; T248-K252 VanDerWaalsContact O-N 3.08Å
249	K	79.1	Confident	74.6	Confident	44 Å²	44	79.8 Å²	79.8	19%	0.191	38%	0.378	C	S	.	.	H	α-helix	trans	-65.9	-44.8	173.8	-75	-175.4	178.9	-140.7	0	112.6	L201 F204 L245 D246 E247 N251 K252 V253	L201-K249 HydrophobicContact CB-CG 4.37Å; L201-K249 HydrophobicContact CD2-CG 4.26Å; L201-K249 WeakPolarHBondContact O-CE 3.46Å; L201-K249 PolarHBondContact O-NZ 3.5Å; F204-K249 PolarHBondContact O-NZ 3.42Å; L245-K249 WeakPolarHBondContact O-CG 3.3Å; L245-K249 PolarHBondContact O-N 2.94Å; L245-K249 VanDerWaalsContact O-N 3.12Å; D246-K249 PolarHBondContact O-N 2.89Å; E247-K249 VanDerWaalsContact C-N 3.34Å; E247-K249 PolarHBondContact O-N 3.01Å; K249-N251 VanDerWaalsContact C-N 3.33Å; K249-N251 PolarHBondContact O-N 3.06Å; K249-K252 PolarHBondContact O-N 3.33Å; K249-V253 WeakPolarHBondContact O-CG2 3.45Å; K249-V253 PolarHBondContact O-N 3.42Å; K249-V253 VanDerWaalsContact O-N 3.15Å
250	K	78.4	Confident	73	Confident	121 Å²	121	81.2 Å²	81.2	53%	0.526	38%	0.384	S	S	.	.	H	α-helix	trans	-60.5	-42.8	175.7	-78.1	169.6	176.7	158.9	0	111.7	D246 E247 K252 V253 T254	D246-K250 WeakPolarHBondContact O-CB 3.34Å; D246-K250 WeakPolarHBondContact O-CG 3.38Å; D246-K250 PolarHBondContact O-N 2.86Å; D246-K250 IonicContact OD1-NZ 3.98Å; D246-K250 WeakPolarHBondContact OD2-CE 3.3Å; D246-K250 IonicContact OD2-NZ 2.7Å; D246-K250 PolarHBondContact OD2-NZ 3.33Å; E247-K250 PolarHBondContact O-N 3.35Å; K250-K252 VanDerWaalsContact C-N 3.35Å; K250-K252 PolarHBondContact O-N 3.1Å; K250-V253 PolarHBondContact O-N 3.37Å; K250-T254 PolarHBondContact O-N 3.03Å; K250-T254 PolarHBondContact O-OG1 3.16Å; K250-T254 VanDerWaalsContact O-OG1 3.09Å
251	N	76.8	Confident	71.1	Confident	81 Å²	81	83.5 Å²	83.5	43%	0.433	40%	0.395	S	S	.	.	H	α-helix	trans	-65.8	-33.3	178.8	-75.7	-18.3	0	0	0	113.3	E247 T248 K249 T254 K255	E247-N251 VanDerWaalsContact O-CB 3.31Å; E247-N251 WeakPolarHBondContact O-CB 3.45Å; E247-N251 VanDerWaalsContact O-CG 3.25Å; E247-N251 PolarHBondContact O-N 3.42Å; E247-N251 PolarHBondContact O-ND2 3.39Å; T248-N251 PolarHBondContact O-N 3.1Å; K249-N251 VanDerWaalsContact C-N 3.33Å; K249-N251 PolarHBondContact O-N 3.06Å; N251-T254 VanDerWaalsContact CA-OG1 3.29Å; N251-T254 WeakPolarHBondContact CA-OG1 3.38Å; N251-T254 PolarHBondContact O-OG1 2.93Å; N251-T254 VanDerWaalsContact O-OG1 3.06Å; N251-K255 WeakPolarHBondContact O-CB 3.5Å; N251-K255 WeakPolarHBondContact O-CG 3.43Å; N251-K255 PolarHBondContact O-N 3Å
252	K	72.1	Confident	69.1	Low	49 Å²	49	91.9 Å²	91.9	21%	0.213	43%	0.434	C	S	.	.	H	α-helix	trans	-67.4	-45	172.3	-171.2	178.9	171.1	-169.1	0	111.2	L201 E202 T248 K249 K250 T254 K255 E256	L201-K252 HydrophobicContact CB-CD 4.31Å; L201-K252 HydrophobicContact CD1-CD 4.16Å; E202-K252 VanDerWaalsContact OE1-CE 3.29Å; E202-K252 WeakPolarHBondContact OE1-CE 3.36Å; E202-K252 IonicContact OE1-NZ 2.69Å; E202-K252 PolarHBondContact OE1-NZ 2.81Å; T248-K252 PolarHBondContact O-N 3.02Å; T248-K252 VanDerWaalsContact O-N 3.08Å; K249-K252 PolarHBondContact O-N 3.33Å; K250-K252 VanDerWaalsContact C-N 3.35Å; K250-K252 PolarHBondContact O-N 3.1Å; K252-T254 PolarHBondContact O-N 3.47Å; K252-K255 PolarHBondContact O-N 3.43Å; K252-E256 PolarHBondContact O-N 3.45Å
253	V	72.8	Confident	67.2	Low	79 Å²	79	95.8 Å²	95.8	48%	0.479	46%	0.459	S	S	.	.	H	α-helix	trans	-64	-39.2	177.9	175.2	0	0	0	0	112	K249 K250 K257	K249-V253 WeakPolarHBondContact O-CG2 3.45Å; K249-V253 PolarHBondContact O-N 3.42Å; K249-V253 VanDerWaalsContact O-N 3.15Å; K250-V253 PolarHBondContact O-N 3.37Å; V253-K257 WeakPolarHBondContact O-CG 3.43Å; V253-K257 PolarHBondContact O-N 3.45Å
254	T	68.8	Low	64.8	Low	64 Å²	64	97.4 Å²	97.4	39%	0.393	47%	0.467	S	S	.	.	H	α-helix	trans	-70.3	-39.8	176	48.2	0	0	0	0	112.2	K250 N251 K252 E256 K257 H258	K250-T254 PolarHBondContact O-N 3.03Å; K250-T254 PolarHBondContact O-OG1 3.16Å; K250-T254 VanDerWaalsContact O-OG1 3.09Å; N251-T254 VanDerWaalsContact CA-OG1 3.29Å; N251-T254 WeakPolarHBondContact CA-OG1 3.38Å; N251-T254 PolarHBondContact O-OG1 2.93Å; N251-T254 VanDerWaalsContact O-OG1 3.06Å; K252-T254 PolarHBondContact O-N 3.47Å; T254-E256 VanDerWaalsContact C-N 3.33Å; T254-E256 PolarHBondContact O-N 2.89Å; T254-K257 PolarHBondContact O-N 3Å; T254-H258 PolarHBondContact O-CD2 3.24Å; T254-H258 VanDerWaalsContact O-CD2 3.23Å; T254-H258 PolarHBondContact O-N 3.01Å
255	K	66.4	Low	62.4	Low	121 Å²	121	102.5 Å²	102.5	53%	0.526	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-37.8	173.2	-81	-175.1	175.2	-176.3	0	112.3	N251 K252 K259	N251-K255 WeakPolarHBondContact O-CB 3.5Å; N251-K255 WeakPolarHBondContact O-CG 3.43Å; N251-K255 PolarHBondContact O-N 3Å; K252-K255 PolarHBondContact O-N 3.43Å; K255-K259 WeakPolarHBondContact O-CB 3.4Å; K255-K259 PolarHBondContact O-N 2.98Å
256	E	63.7	Low	60.5	Low	95 Å²	95	107.4 Å²	107.4	44%	0.444	53%	0.531	S	S	.	.	H	α-helix	trans	-69.8	-34.3	174.1	-74.8	-165.8	167.2	0	0	113.6	K252 T254 K259 K260	K252-E256 PolarHBondContact O-N 3.45Å; T254-E256 VanDerWaalsContact C-N 3.33Å; T254-E256 PolarHBondContact O-N 2.89Å; E256-K259 PolarHBondContact O-N 3.35Å; E256-K260 PolarHBondContact O-N 3.02Å; E256-K260 VanDerWaalsContact O-N 3.17Å
257	K	58.9	Low	58	Low	127 Å²	127	112 Å²	112	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-66.4	-45.2	172.5	-77.6	-176.9	176.5	-173.5	0	111.9	V253 T254 K259 K260 E261	V253-K257 WeakPolarHBondContact O-CG 3.43Å; V253-K257 PolarHBondContact O-N 3.45Å; T254-K257 PolarHBondContact O-N 3Å; K257-K259 VanDerWaalsContact C-N 3.31Å; K257-K259 PolarHBondContact O-N 3.39Å; K257-K260 PolarHBondContact O-N 3.43Å; K257-E261 WeakPolarHBondContact O-CG 3.39Å; K257-E261 PolarHBondContact O-N 3.26Å
258	H	52.3	Low	55.5	Low	119 Å²	119	111.8 Å²	111.8	55%	0.551	57%	0.567	S	S	*	*	H	α-helix	trans	-62.6	-36.6	175.1	-81.2	-65	0	0	0	112.7	T254 K260 E261 E262	T254-H258 PolarHBondContact O-CD2 3.24Å; T254-H258 VanDerWaalsContact O-CD2 3.23Å; T254-H258 PolarHBondContact O-N 3.01Å; H258-K260 VanDerWaalsContact C-N 3.25Å; H258-K260 PolarHBondContact O-N 2.85Å; H258-E261 PolarHBondContact O-N 3.49Å; H258-E262 PolarHBondContact O-N 3.45Å
259	K	54.1	Low	53.4	Low	165 Å²	165	117.2 Å²	117.2	72%	0.717	60%	0.603	S	S	*	*	H	α-helix	trans	-69.3	-20.9	175	-142.9	176.8	-173.1	-177.2	0	113.5	K255 E256 K257 V263	K255-K259 WeakPolarHBondContact O-CB 3.4Å; K255-K259 PolarHBondContact O-N 2.98Å; E256-K259 PolarHBondContact O-N 3.35Å; K257-K259 VanDerWaalsContact C-N 3.31Å; K257-K259 PolarHBondContact O-N 3.39Å; K259-V263 WeakPolarHBondContact O-CG2 3.3Å
260	K	47.1	Very low	51.3	Low	156 Å²	156	121.4 Å²	121.4	68%	0.678	63%	0.632	S	S	*	*	H	α-helix	trans	-87.2	-32.4	171.3	-77.1	178	176.2	175.4	0	112.4	E256 K257 H258	E256-K260 PolarHBondContact O-N 3.02Å; E256-K260 VanDerWaalsContact O-N 3.17Å; K257-K260 PolarHBondContact O-N 3.43Å; H258-K260 VanDerWaalsContact C-N 3.25Å; H258-K260 PolarHBondContact O-N 2.85Å
261	E	43.5	Very low	48.9	Very low	129 Å²	129	127.1 Å²	127.1	60%	0.603	65%	0.65	S	S	*	*	H	α-helix	trans	-79.4	-27.4	-180	-74.2	172.9	178.5	0	0	113.7	K257 H258 V263	K257-E261 WeakPolarHBondContact O-CG 3.39Å; K257-E261 PolarHBondContact O-N 3.26Å; H258-E261 PolarHBondContact O-N 3.49Å; E261-V263 PolarHBondContact O-N 3.29Å
262	E	42.7	Very low	46.9	Very low	177 Å²	177	128.3 Å²	128.3	83%	0.827	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-6.1	172.4	-80.7	-174.4	159.5	0	0	114.1	H258	H258-E262 PolarHBondContact O-N 3.45Å
263	V	43.7	Very low	45	Very low	117 Å²	117	135.6 Å²	135.6	71%	0.709	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-4.7	-179.6	-178.3	0	0	0	0	112.7	K259 E261	K259-V263 WeakPolarHBondContact O-CG2 3.3Å; E261-V263 PolarHBondContact O-N 3.29Å
264	E	34.8	Very low	43	Very low	161 Å²	161	135.8 Å²	135.8	75%	0.752	71%	0.707	S	S	*	*			trans	-125.6	95.2	-173.9	-74.8	-167.7	152.3	0	0	115.2
265	V	32.2	Very low	41.2	Very low	142 Å²	142	138 Å²	138	86%	0.861	73%	0.725	S	S	*	*			trans	-163.4	146	134.3	-142.7	0	0	0	0	110.2
266	P	41.6	Very low	39.9	Very low	105 Å²	105	138.9 Å²	138.9	68%	0.682	74%	0.74	S	S	*	*				-124.3	143.7	-54	36.3	-21.8	0	0	0	112.4
267	N	28.6	Very low	38.5	Very low	173 Å²	173	139 Å²	139	93%	0.925	75%	0.752	S	S	*	*	S	Bend	trans	-137.9	119.7	142	-104.4	-18	0	0	0	108.3
268	S	29.8	Very low	37.6	Very low	111 Å²	111	139 Å²	139	78%	0.776	76%	0.762	S	S	*	*			trans	-55.7	174.8	-172.9	-49.9	0	0	0	0	115.4
269	P	34.7	Very low	36.8	Very low	126 Å²	126	140.1 Å²	140.1	82%	0.818	77%	0.772	S	S	*	*				-117.3	157.4	-61.6	33.4	-19.2	0	0	0	111.2
270	V	33.8	Very low	36.1	Very low	132 Å²	132	137.5 Å²	137.5	80%	0.8	77%	0.772	S	S	*	*			trans	-50.1	140.5	178.4	176.6	0	0	0	0	113.9
271	R	28.2	Very low	35.7	Very low	240 Å²	240	139.6 Å²	139.6	91%	0.906	78%	0.781	S	S	*	*			trans	-125.9	134.1	141.7	-142.3	174.8	-172.7	-173.2	1.2	108.8
272	P	35	Very low	35.2	Very low	106 Å²	106	141.4 Å²	141.4	69%	0.688	80%	0.795	S	S	*	*			trans	-86.5	134.3	-163.5	14	2.5	0	0	0	111.3
273	E	32.3	Very low	35.1	Very low	203 Å²	203	140.2 Å²	140.2	95%	0.949	80%	0.795	S	S	*	*			trans	-82.6	114.2	157	-72.5	-165.1	171.8	0	0	108.9
274	A	31.3	Very low	34.8	Very low	83 Å²	83	143.3 Å²	143.3	69%	0.686	80%	0.799	S	S	*	*			trans	-142	135.5	157.4	0	0	0	0	0	110.3
275	S	31.2	Very low	34.8	Very low	110 Å²	110	143.7 Å²	143.7	77%	0.769	80%	0.8	S	S	*	*			trans	70.4	108	152.7	59.8	0	0	0	0	118.5	S277	S275-S277 PolarHBondContact O-N 3.09Å
276	V	38.7	Very low	34.8	Very low	140 Å²	140	143.3 Å²	143.3	85%	0.848	80%	0.799	S	S	*	*			trans	-32.5	113.6	141.4	-178.2	0	0	0	0	110.9
277	S	33.4	Very low	34.3	Very low	98 Å²	98	146.1 Å²	146.1	69%	0.685	81%	0.808	S	S	*	*			trans	-131.8	112.3	153.5	77.7	0	0	0	0	108.9	S275 N279	S275-S277 PolarHBondContact O-N 3.09Å; S277-N279 PolarHBondContact O-N 2.95Å
278	T	40.4	Very low	34.8	Very low	125 Å²	125	143.1 Å²	143.1	77%	0.767	80%	0.798	S	S	*	*			trans	-57.5	120.1	175.7	-31.7	0	0	0	0	110.9
279	N	35	Very low	34.9	Very low	144 Å²	144	147 Å²	147	77%	0.77	80%	0.801	S	S	*	*			trans	-124.2	120.7	164.3	-95.7	-16.1	0	0	0	109.2	S277 F281	S277-N279 PolarHBondContact O-N 2.95Å; N279-F281 PolarHBondContact O-N 3.49Å
280	P	41.2	Very low	34.8	Very low	110 Å²	110	148.7 Å²	148.7	71%	0.714	80%	0.803	S	S	*	*			trans	-96.3	32.8	-168.4	38.3	-35.8	0	0	0	114.7
281	F	38.1	Very low	34.8	Very low	199 Å²	199	147.2 Å²	147.2	87%	0.873	80%	0.799	S	S	*	*			trans	-150.3	89.8	175.4	-86	-86.3	0	0	0	110.1	N279	N279-F281 PolarHBondContact O-N 3.49Å
282	D	33.5	Very low	35.4	Very low	167 Å²	167	144.6 Å²	144.6	89%	0.893	80%	0.797	S	S	*	*			trans	-158	94.6	148	-137.4	1.4	0	0	0	110.2
283	D	40.3	Very low	35.5	Very low	153 Å²	153	148.4 Å²	148.4	82%	0.818	81%	0.805	S	S	*	*			trans	-80.8	118.6	162.1	-86.2	-43.1	0	0	0	107.6
284	K	37.9	Very low	35.9	Very low	182 Å²	182	143.1 Å²	143.1	79%	0.791	80%	0.797	S	S	*	*			trans	174.1	132.1	131.9	-95.4	163.8	-172.5	-172.4	0	114.6
285	E	32.8	Very low	36.5	Very low	168 Å²	168	140.4 Å²	140.4	79%	0.785	77%	0.771	S	S	*	*			trans	78.9	97.4	143.4	-67	174	-166.7	0	0	119.1
286	T	33.8	Very low	37.2	Very low	135 Å²	135	139.9 Å²	139.9	83%	0.828	76%	0.76	S	S	*	*			trans	-39.1	130.7	150.4	39.2	0	0	0	0	114.5
287	N	30.1	Very low	37.8	Very low	163 Å²	163	134.5 Å²	134.5	87%	0.872	73%	0.726	S	S	*	*			trans	-128.1	122.8	151.8	-99.2	-24.7	0	0	0	109.3
288	P	39.7	Very low	38.5	Very low	111 Å²	111	133.7 Å²	133.7	72%	0.721	72%	0.72	S	S	*	*			trans	-100.6	77.4	-170.2	37.1	-32.6	0	0	0	113.1
289	F	31.5	Very low	39.2	Very low	193 Å²	193	130.7 Å²	130.7	85%	0.846	70%	0.7	S	S	*	*			trans	-149.4	66.8	169.6	-92.6	-82	0	0	0	111.2
290	D	33.4	Very low	40.2	Very low	160 Å²	160	131 Å²	131	86%	0.856	70%	0.697	S	S	*	*			trans	-128.5	93.3	154.3	-98.8	-26.8	0	0	0	107
291	S	34.3	Very low	41.6	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	68%	0.677	S	S	*	*			trans	-137.5	72	160.9	41.2	0	0	0	0	106.5	E293	S291-E293 PolarHBondContact O-N 3.46Å; S291-E293 VanDerWaalsContact O-N 3.13Å
292	E	38.7	Very low	42.9	Very low	186 Å²	186	120.3 Å²	120.3	87%	0.869	64%	0.636	S	S	*	*			trans	-55	114	148.7	-73.1	-172.7	158.8	0	0	105.7	A294	E292-A294 VanDerWaalsContact C-N 3.32Å; E292-A294 PolarHBondContact O-N 3.35Å
293	E	39.1	Very low	44.5	Very low	185 Å²	185	118.8 Å²	118.8	86%	0.864	62%	0.624	S	S	*	*			trans	-54.5	99.6	175.1	-72.8	178.8	155.6	0	0	108.3	S291 V295	S291-E293 PolarHBondContact O-N 3.46Å; S291-E293 VanDerWaalsContact O-N 3.13Å; E293-V295 PolarHBondContact O-N 3.49Å
294	A	39.8	Very low	46	Very low	93 Å²	93	116.4 Å²	116.4	77%	0.769	61%	0.608	S	S	*	*			trans	-61.1	104.3	171.1	0	0	0	0	0	106.9	E292 D296	E292-A294 VanDerWaalsContact C-N 3.32Å; E292-A294 PolarHBondContact O-N 3.35Å; A294-D296 PolarHBondContact O-N 3Å
295	V	42.9	Very low	47.8	Very low	25 Å²	25	107.8 Å²	107.8	15%	0.152	57%	0.571	C	S	.	*			trans	-54.2	114.2	165.7	176.9	0	0	0	0	107	E293 L297 Q335 P336	E293-V295 PolarHBondContact O-N 3.49Å; V295-L297 VanDerWaalsContact C-N 3.31Å; V295-L297 HydrophobicContact CG1-CG 4.2Å; V295-L297 PolarHBondContact O-N 2.9Å; V295-Q335 VanDerWaalsContact CG2-OE1 3.23Å; V295-P336 HydrophobicContact CG2-CG 3.86Å
296	D	47	Very low	49.6	Very low	99 Å²	99	100.8 Å²	100.8	53%	0.529	54%	0.539	S	S	.	.			trans	-71.5	87.4	-179.4	-166.7	12.6	0	0	0	109.8	A294 S298 L299	A294-D296 PolarHBondContact O-N 3Å; D296-S298 PolarHBondContact O-N 3.34Å; D296-S298 WeakPolarHBondContact OD1-CB 3.43Å; D296-S298 PolarHBondContact OD1-N 3.49Å; D296-S298 PolarHBondContact OD1-OG 3.49Å; D296-L299 WeakPolarHBondContact O-CD1 3.32Å
297	L	51.3	Low	51.6	Low	28 Å²	28	100.8 Å²	100.8	15%	0.147	53%	0.53	C	S	.	.			trans	-82.1	15.4	171.2	-74.6	154.8	0	0	0	111.7	V295 L299 R340 V341	V295-L297 VanDerWaalsContact C-N 3.31Å; V295-L297 HydrophobicContact CG1-CG 4.2Å; V295-L297 PolarHBondContact O-N 2.9Å; L297-L299 VanDerWaalsContact C-N 3.27Å; L297-L299 PolarHBondContact O-N 2.94Å; L297-R340 HydrophobicContact CD1-CB 3.67Å; L297-V341 HydrophobicContact CD1-CG2 4.16Å; L297-V341 HydrophobicContact CD2-CG2 4.27Å
298	S	48.5	Very low	53.9	Low	80 Å²	80	96 Å²	96	56%	0.559	50%	0.504	S	S	*	.			trans	-85.7	7.2	178.7	-34	0	0	0	0	113.3	D296 E300	D296-S298 PolarHBondContact O-N 3.34Å; D296-S298 WeakPolarHBondContact OD1-CB 3.43Å; D296-S298 PolarHBondContact OD1-N 3.49Å; D296-S298 PolarHBondContact OD1-OG 3.49Å; S298-E300 PolarHBondContact O-N 3.4Å; S298-E300 VanDerWaalsContact O-N 3.11Å
299	L	55.4	Low	55.7	Low	63 Å²	63	90.9 Å²	90.9	33%	0.33	47%	0.471	S	S	.	.			trans	-66	114.3	171.5	-82.1	97.4	0	0	0	109	D296 L297 W301 I302	D296-L299 WeakPolarHBondContact O-CD1 3.32Å; L297-L299 VanDerWaalsContact C-N 3.27Å; L297-L299 PolarHBondContact O-N 2.94Å; L299-W301 PolarHBondContact O-N 2.78Å; L299-W301 VanDerWaalsContact O-N 3.12Å; L299-I302 HydrophobicContact CB-CD1 4.16Å; L299-I302 HydrophobicContact CB-CG1 4.21Å; L299-I302 WeakPolarHBondContact O-CB 3.37Å; L299-I302 PolarHBondContact O-N 3.45Å
300	E	56	Low	57.9	Low	151 Å²	151	84.2 Å²	84.2	71%	0.706	44%	0.444	S	S	*	.	H	α-helix	trans	-49.2	-39.9	-177.3	-69.8	175	157.9	0	0	112	S298 I302 Q303 E304	S298-E300 PolarHBondContact O-N 3.4Å; S298-E300 VanDerWaalsContact O-N 3.11Å; E300-I302 VanDerWaalsContact C-N 3.25Å; E300-I302 PolarHBondContact O-N 3.31Å; E300-Q303 PolarHBondContact O-N 3.07Å; E300-E304 WeakPolarHBondContact O-CG 3.46Å; E300-E304 PolarHBondContact O-N 3.25Å
301	W	69.3	Low	60.2	Low	79 Å²	79	79.9 Å²	79.9	30%	0.299	42%	0.423	S	S	.	.	H	α-helix	trans	-63.3	-24.1	179.3	78.1	-91.3	0	0	0	114.6	L299 L305 Y331	L299-W301 PolarHBondContact O-N 2.78Å; L299-W301 VanDerWaalsContact O-N 3.12Å; W301-L305 HydrophobicContact CE3-CD1 3.87Å; W301-L305 HydrophobicContact CZ3-CD1 3.81Å; W301-L305 WeakPolarHBondContact O-CB 3.38Å; W301-L305 PolarHBondContact O-N 3.18Å; W301-Y331 HydrophobicContact CZ2-CD2 4.5Å; W301-Y331 HydrophobicContact CZ2-CG 4.33Å
302	I	66.4	Low	62.3	Low	5 Å²	5	75.9 Å²	75.9	3%	0.026	40%	0.395	C	S	.	.	H	α-helix	trans	-79.6	-31.5	176.6	-60.2	-179.1	0	0	0	110.5	L299 E300 Y331 L344	L299-I302 HydrophobicContact CB-CD1 4.16Å; L299-I302 HydrophobicContact CB-CG1 4.21Å; L299-I302 WeakPolarHBondContact O-CB 3.37Å; L299-I302 PolarHBondContact O-N 3.45Å; E300-I302 VanDerWaalsContact C-N 3.25Å; E300-I302 PolarHBondContact O-N 3.31Å; I302-Y331 HydrophobicContact CD1-CD1 4.05Å; I302-Y331 HydrophobicContact CD1-CE1 3.74Å; I302-L344 HydrophobicContact CG2-CD1 4.2Å; I302-L344 HydrophobicContact CG2-CD2 3.35Å; I302-L344 HydrophobicContact CG2-CG 4.42Å
303	Q	66.6	Low	64.1	Low	134 Å²	134	68.3 Å²	68.3	63%	0.626	36%	0.36	S	S	*	.	H	α-helix	trans	-76.7	-35.8	175.4	-63.5	-170.9	4.6	0	0	111.6	E300 P306	E300-Q303 PolarHBondContact O-N 3.07Å; Q303-P306 VanDerWaalsContact O-CD 3.24Å; Q303-P306 WeakPolarHBondContact O-CD 3.1Å
304	E	72.4	Confident	66	Low	104 Å²	104	63.5 Å²	63.5	49%	0.486	35%	0.352	S	S	.	.	H	α-helix	trans	-79	-20.8	176.3	-66.3	-178.5	162.3	0	0	112.7	E300 P306 E307 D308	E300-E304 WeakPolarHBondContact O-CG 3.46Å; E300-E304 PolarHBondContact O-N 3.25Å; E304-P306 VanDerWaalsContact O-N 3.14Å; E304-E307 CarbonylContact O-C 3.52Å; E304-E307 WeakPolarHBondContact O-CA 3.4Å; E304-E307 WeakPolarHBondContact O-CB 3.19Å; E304-E307 PolarHBondContact O-N 2.81Å; E304-D308 PolarHBondContact O-N 3.15Å
305	L	74.9	Confident	67.8	Low	1 Å²	1	65.8 Å²	65.8	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-47.8	-44.4	-178.6	-160.5	91.7	0	0	0	115.1	W301 E307 D308 L309 L324 L328 V348	W301-L305 HydrophobicContact CE3-CD1 3.87Å; W301-L305 HydrophobicContact CZ3-CD1 3.81Å; W301-L305 WeakPolarHBondContact O-CB 3.38Å; W301-L305 PolarHBondContact O-N 3.18Å; L305-E307 VanDerWaalsContact C-N 3.3Å; L305-E307 PolarHBondContact O-N 2.83Å; L305-D308 PolarHBondContact O-N 3.16Å; L305-L309 HydrophobicContact CD2-CD1 4.33Å; L305-L309 HydrophobicContact CG-CD1 4.34Å; L305-L309 WeakPolarHBondContact O-CB 3.33Å; L305-L309 WeakPolarHBondContact O-CG 3.48Å; L305-L309 PolarHBondContact O-N 3.49Å; L305-L324 HydrophobicContact CD1-CB 4.09Å; L305-L324 HydrophobicContact CD1-CD2 4.27Å; L305-L328 HydrophobicContact CD2-CB 4.07Å; L305-L328 HydrophobicContact CD2-CD1 4.1Å; L305-L328 HydrophobicContact CD2-CD2 3.62Å; L305-L328 HydrophobicContact CD2-CG 4.11Å; L305-V348 HydrophobicContact CD2-CG2 4.07Å
306	P	71.3	Confident	69.2	Low	20 Å²	20	70.7 Å²	70.7	13%	0.13	36%	0.363	C	S	.	.	H	α-helix	trans	-66.4	-33.1	178.5	-18.3	33.6	0	0	0	112.9	Q303 E304 D310 R351	Q303-P306 VanDerWaalsContact O-CD 3.24Å; Q303-P306 WeakPolarHBondContact O-CD 3.1Å; E304-P306 VanDerWaalsContact O-N 3.14Å; P306-D310 PolarHBondContact O-N 2.99Å; P306-R351 PolarHBondContact O-NH1 3.32Å; P306-R351 VanDerWaalsContact O-NH1 3.11Å
307	E	75.6	Confident	70.8	Confident	136 Å²	136	69.4 Å²	69.4	64%	0.636	36%	0.356	S	S	*	.	H	α-helix	trans	-75.9	-41.4	176.7	-61.5	-175.1	-175.6	0	0	110.4	E304 L305 L309 D310 V311	E304-E307 CarbonylContact O-C 3.52Å; E304-E307 WeakPolarHBondContact O-CA 3.4Å; E304-E307 WeakPolarHBondContact O-CB 3.19Å; E304-E307 PolarHBondContact O-N 2.81Å; L305-E307 VanDerWaalsContact C-N 3.3Å; L305-E307 PolarHBondContact O-N 2.83Å; E307-L309 VanDerWaalsContact C-N 3.31Å; E307-L309 PolarHBondContact O-N 2.92Å; E307-D310 WeakPolarHBondContact O-CB 3.39Å; E307-D310 PolarHBondContact O-N 3.21Å; E307-D310 VanDerWaalsContact O-N 3.11Å; E307-V311 WeakPolarHBondContact O-CG2 3.36Å; E307-V311 PolarHBondContact O-N 2.9Å
308	D	78.4	Confident	72	Confident	61 Å²	61	69.3 Å²	69.3	33%	0.326	35%	0.354	S	S	.	.	H	α-helix	trans	-61.4	-39.4	173.7	-74.8	-21.4	0	0	0	111.9	E304 L305 D310 V311 C312 L324	E304-D308 PolarHBondContact O-N 3.15Å; L305-D308 PolarHBondContact O-N 3.16Å; D308-D310 VanDerWaalsContact C-N 3.35Å; D308-D310 PolarHBondContact O-N 3.2Å; D308-V311 PolarHBondContact O-N 3.48Å; D308-C312 WeakPolarHBondContact O-CB 3.47Å; D308-C312 PolarHBondContact O-N 3.06Å; D308-C312 PolarHBondContact O-SG 3.25Å; D308-C312 VanDerWaalsContact O-SG 3.35Å; D308-L324 HydrophobicContact CB-CD1 4.09Å
309	L	76.8	Confident	73.5	Confident	4 Å²	4	69.2 Å²	69.2	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-63.5	-39.3	173.4	-74.9	170.3	0	0	0	111.9	L305 E307 V311 C312 I313 G321 L324 L325 V348	L305-L309 HydrophobicContact CD2-CD1 4.33Å; L305-L309 HydrophobicContact CG-CD1 4.34Å; L305-L309 WeakPolarHBondContact O-CB 3.33Å; L305-L309 WeakPolarHBondContact O-CG 3.48Å; L305-L309 PolarHBondContact O-N 3.49Å; E307-L309 VanDerWaalsContact C-N 3.31Å; E307-L309 PolarHBondContact O-N 2.92Å; L309-V311 VanDerWaalsContact C-N 3.35Å; L309-C312 PolarHBondContact O-N 3.24Å; L309-I313 WeakPolarHBondContact O-CB 3.15Å; L309-I313 WeakPolarHBondContact O-CD1 3.42Å; L309-I313 WeakPolarHBondContact O-CG1 3.43Å; L309-I313 PolarHBondContact O-N 3.43Å; L309-G321 WeakPolarHBondContact CD2-O 3.47Å; L309-L324 HydrophobicContact CD2-CB 4.41Å; L309-L325 HydrophobicContact CD1-CD2 3.85Å; L309-L325 HydrophobicContact CD1-CG 4.48Å; L309-L325 HydrophobicContact CD2-CD1 4.42Å; L309-L325 HydrophobicContact CD2-CD2 4.28Å; L309-L325 HydrophobicContact CD2-CG 4.01Å; L309-V348 HydrophobicContact CD1-CG1 4.49Å
310	D	77.9	Confident	74.7	Confident	53 Å²	53	67.1 Å²	67.1	28%	0.283	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-40.5	173.9	-76.4	-18	0	0	0	111.7	P306 E307 D308 I313 A314 R351	P306-D310 PolarHBondContact O-N 2.99Å; E307-D310 WeakPolarHBondContact O-CB 3.39Å; E307-D310 PolarHBondContact O-N 3.21Å; E307-D310 VanDerWaalsContact O-N 3.11Å; D308-D310 VanDerWaalsContact C-N 3.35Å; D308-D310 PolarHBondContact O-N 3.2Å; D310-I313 PolarHBondContact O-N 2.86Å; D310-A314 VanDerWaalsContact O-CB 3.31Å; D310-A314 WeakPolarHBondContact O-CB 3.37Å; D310-A314 PolarHBondContact O-N 3.5Å; D310-R351 VanDerWaalsContact CG-CZ 3.41Å; D310-R351 WeakPolarHBondContact OD1-CD 3.4Å; D310-R351 IonicContact OD1-CZ 3.73Å; D310-R351 IonicContact OD1-NE 3.88Å; D310-R351 PolarHBondContact OD1-NE 3.35Å; D310-R351 IonicContact OD1-NH1 2.95Å; D310-R351 PolarHBondContact OD1-NH1 3.38Å; D310-R351 IonicContact OD1-NH2 2.92Å; D310-R351 IonicContact OD2-CZ 3.29Å; D310-R351 IonicContact OD2-NH1 2.75Å; D310-R351 PolarHBondContact OD2-NH1 2.89Å; D310-R351 IonicContact OD2-NH2 3Å; D310-R351 PolarHBondContact OD2-NH2 2.87Å
311	V	81.9	Confident	75.9	Confident	69 Å²	69	60 Å²	60	42%	0.418	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-45.6	175.5	174.7	0	0	0	0	110.5	E307 D308 L309 I313 A314 Q315	E307-V311 WeakPolarHBondContact O-CG2 3.36Å; E307-V311 PolarHBondContact O-N 2.9Å; D308-V311 PolarHBondContact O-N 3.48Å; L309-V311 VanDerWaalsContact C-N 3.35Å; V311-I313 PolarHBondContact O-N 3.14Å; V311-A314 PolarHBondContact O-N 2.95Å; V311-Q315 HydrophobicContact CG1-CG 4.29Å; V311-Q315 VanDerWaalsContact CG1-NE2 3.3Å; V311-Q315 WeakPolarHBondContact O-CB 3.49Å; V311-Q315 VanDerWaalsContact O-CG 3.3Å; V311-Q315 WeakPolarHBondContact O-CG 3.37Å; V311-Q315 PolarHBondContact O-N 3.38Å
312	C	77.5	Confident	76.4	Confident	17 Å²	17	56.2 Å²	56.2	12%	0.115	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-43.4	175.5	-73.6	0	0	0	0	112.1	D308 L309 Q315 R316 D317	D308-C312 WeakPolarHBondContact O-CB 3.47Å; D308-C312 PolarHBondContact O-N 3.06Å; D308-C312 PolarHBondContact O-SG 3.25Å; D308-C312 VanDerWaalsContact O-SG 3.35Å; L309-C312 PolarHBondContact O-N 3.24Å; C312-Q315 PolarHBondContact O-N 2.89Å; C312-R316 PolarHBondContact O-N 3.26Å; C312-D317 PolarHBondContact O-N 3.36Å
313	I	77.1	Confident	77.2	Confident	28 Å²	28	59.2 Å²	59.2	14%	0.144	31%	0.307	C	S	.	.	H	α-helix	trans	-62.6	-43.8	175.9	-68.6	163.3	0	0	0	110.5	L309 D310 V311 R316 L355 V358	L309-I313 WeakPolarHBondContact O-CB 3.15Å; L309-I313 WeakPolarHBondContact O-CD1 3.42Å; L309-I313 WeakPolarHBondContact O-CG1 3.43Å; L309-I313 PolarHBondContact O-N 3.43Å; D310-I313 PolarHBondContact O-N 2.86Å; V311-I313 PolarHBondContact O-N 3.14Å; I313-R316 PolarHBondContact O-N 3.29Å; I313-L355 HydrophobicContact CD1-CB 4.11Å; I313-L355 HydrophobicContact CG1-CB 4.23Å; I313-L355 HydrophobicContact CG1-CD1 3.93Å; I313-V358 HydrophobicContact CG2-CG2 4.2Å
314	A	78	Confident	77.8	Confident	83 Å²	83	54.5 Å²	54.5	69%	0.686	29%	0.286	S	S	*	.	H	α-helix	trans	-66.5	-39.4	179	0	0	0	0	0	112.7	D310 V311 R316	D310-A314 VanDerWaalsContact O-CB 3.31Å; D310-A314 WeakPolarHBondContact O-CB 3.37Å; D310-A314 PolarHBondContact O-N 3.5Å; V311-A314 PolarHBondContact O-N 2.95Å; A314-R316 PolarHBondContact O-N 3Å
315	Q	77.8	Confident	78.1	Confident	141 Å²	141	49.9 Å²	49.9	66%	0.659	27%	0.265	S	S	*	.	H	α-helix	trans	-78	-7.8	177.4	-67.9	-176.9	14.2	0	0	113.3	V311 C312 D317	V311-Q315 HydrophobicContact CG1-CG 4.29Å; V311-Q315 VanDerWaalsContact CG1-NE2 3.3Å; V311-Q315 WeakPolarHBondContact O-CB 3.49Å; V311-Q315 VanDerWaalsContact O-CG 3.3Å; V311-Q315 WeakPolarHBondContact O-CG 3.37Å; V311-Q315 PolarHBondContact O-N 3.38Å; C312-Q315 PolarHBondContact O-N 2.89Å; Q315-D317 PolarHBondContact O-N 3.03Å
316	R	73.6	Confident	78.3	Confident	128 Å²	128	52.2 Å²	52.2	48%	0.483	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	26.1	-172	-55.9	176.3	166	-132.4	-14.5	113.2	C312 I313 A314 F318 E362	C312-R316 PolarHBondContact O-N 3.26Å; I313-R316 PolarHBondContact O-N 3.29Å; A314-R316 PolarHBondContact O-N 3Å; R316-F318 HydrophobicContact CB-CE2 4.2Å; R316-F318 HydrophobicContact CB-CZ 4.05Å; R316-F318 HydrophobicContact CG-CZ 4.34Å; R316-F318 PolarHBondContact O-N 3.36Å; R316-E362 IonicContact CZ-OE1 3.08Å; R316-E362 IonicContact CZ-OE2 3.62Å; R316-E362 IonicContact NH1-OE1 2.81Å; R316-E362 PolarHBondContact NH1-OE1 2.93Å; R316-E362 IonicContact NH1-OE2 3.92Å; R316-E362 PolarHBondContact NH1-OE2 3.44Å; R316-E362 IonicContact NH2-OE1 2.81Å; R316-E362 PolarHBondContact NH2-OE1 3.4Å
317	D	79.4	Confident	78.8	Confident	72 Å²	72	57.4 Å²	57.4	39%	0.385	30%	0.298	S	S	.	.			trans	-88.4	80.1	170.8	-175.1	10.6	0	0	0	109.5	C312 Q315 E319 G320 G321	C312-D317 PolarHBondContact O-N 3.36Å; Q315-D317 PolarHBondContact O-N 3.03Å; D317-E319 VanDerWaalsContact C-N 3.3Å; D317-E319 PolarHBondContact OD1-N 3.34Å; D317-G320 PolarHBondContact OD1-N 3.07Å; D317-G320 VanDerWaalsContact OD1-N 3.1Å; D317-G321 PolarHBondContact O-N 3.5Å
318	F	77.8	Confident	78.8	Confident	27 Å²	27	51.1 Å²	51.1	12%	0.118	27%	0.268	C	S	.	.	H	α-helix	trans	-72.5	-24.7	-179.4	-51	-56.8	0	0	0	112.4	R316 V322 L355 V358 L359 E362 Q382	R316-F318 HydrophobicContact CB-CE2 4.2Å; R316-F318 HydrophobicContact CB-CZ 4.05Å; R316-F318 HydrophobicContact CG-CZ 4.34Å; R316-F318 PolarHBondContact O-N 3.36Å; F318-V322 VanDerWaalsContact O-CG2 3.22Å; F318-V322 WeakPolarHBondContact O-CG2 3.47Å; F318-V322 PolarHBondContact O-N 3.04Å; F318-V322 VanDerWaalsContact O-N 3.08Å; F318-L355 HydrophobicContact CD1-CD1 3.45Å; F318-L355 VanDerWaalsContact CD1-CD1 3.45Å; F318-L355 HydrophobicContact CE1-CD1 4.1Å; F318-L355 HydrophobicContact CG-CD1 4.4Å; F318-V358 HydrophobicContact CE1-CG1 3.76Å; F318-V358 HydrophobicContact CZ-CG1 3.8Å; F318-L359 HydrophobicContact CB-CD2 3.99Å; F318-L359 HydrophobicContact CD1-CD2 4.07Å; F318-L359 HydrophobicContact CD1-CG 4.22Å; F318-L359 HydrophobicContact CD2-CD2 3.6Å; F318-L359 HydrophobicContact CE1-CD2 4.43Å; F318-L359 HydrophobicContact CE1-CG 4.49Å; F318-L359 HydrophobicContact CE2-CD2 4.03Å; F318-L359 HydrophobicContact CG-CD2 3.61Å; F318-L359 HydrophobicContact CG-CG 4.24Å; F318-L359 HydrophobicContact CZ-CD2 4.42Å; F318-E362 HydrophobicContact CE2-CG 4.46Å; F318-E362 HydrophobicContact CZ-CG 4.33Å; F318-Q382 HydrophobicContact CB-CG 4.18Å
319	E	80.4	Confident	78.7	Confident	78 Å²	78	51.6 Å²	51.6	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-70.7	-48.5	178.8	-49.7	-165.9	154.4	0	0	109.9	D317 G321 V322 D323 R378 Q382	D317-E319 VanDerWaalsContact C-N 3.3Å; D317-E319 PolarHBondContact OD1-N 3.34Å; E319-G321 VanDerWaalsContact C-N 3.32Å; E319-G321 PolarHBondContact O-N 2.94Å; E319-V322 PolarHBondContact O-N 3.26Å; E319-D323 WeakPolarHBondContact O-CB 3.24Å; E319-D323 PolarHBondContact O-N 2.9Å; E319-R378 WeakPolarHBondContact OE1-CD 3.42Å; E319-R378 WeakPolarHBondContact OE1-CG 3.41Å; E319-R378 IonicContact OE1-NE 3.7Å; E319-Q382 HydrophobicContact CG-CG 4.47Å
320	G	79.1	Confident	78.8	Confident	18 Å²	18	55.7 Å²	55.7	19%	0.186	29%	0.293	C	S	.	.	H	α-helix	trans	-59.4	-41.1	174.6	0	0	0	0	0	112.7	D317 D323 L324	D317-G320 PolarHBondContact OD1-N 3.07Å; D317-G320 VanDerWaalsContact OD1-N 3.1Å; G320-D323 PolarHBondContact O-N 3.47Å; G320-L324 WeakPolarHBondContact O-CG 3.35Å; G320-L324 PolarHBondContact O-N 3.38Å
321	G	81.1	Confident	78.6	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-63.1	-43.3	176.6	0	0	0	0	0	113.6	L309 D317 E319 L324 L325	L309-G321 WeakPolarHBondContact CD2-O 3.47Å; D317-G321 PolarHBondContact O-N 3.5Å; E319-G321 VanDerWaalsContact C-N 3.32Å; E319-G321 PolarHBondContact O-N 2.94Å; G321-L324 PolarHBondContact O-N 3.36Å; G321-L325 WeakPolarHBondContact O-CG 3.2Å; G321-L325 PolarHBondContact O-N 3.46Å
322	V	79.6	Confident	77.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-71.5	-34.8	176.8	178.8	0	0	0	0	111.8	F318 E319 L324 L325 D326 L355 Q382 R385 L386	F318-V322 VanDerWaalsContact O-CG2 3.22Å; F318-V322 WeakPolarHBondContact O-CG2 3.47Å; F318-V322 PolarHBondContact O-N 3.04Å; F318-V322 VanDerWaalsContact O-N 3.08Å; E319-V322 PolarHBondContact O-N 3.26Å; V322-L324 VanDerWaalsContact C-N 3.3Å; V322-L324 PolarHBondContact O-N 2.71Å; V322-L325 WeakPolarHBondContact O-CB 3.43Å; V322-L325 PolarHBondContact O-N 3.34Å; V322-L325 VanDerWaalsContact O-N 3.15Å; V322-D326 PolarHBondContact O-N 2.56Å; V322-L355 HydrophobicContact CG2-CD2 4.21Å; V322-Q382 VanDerWaalsContact CB-OE1 3.27Å; V322-Q382 HydrophobicContact CG2-CB 3.96Å; V322-Q382 HydrophobicContact CG2-CG 4.27Å; V322-R385 HydrophobicContact CG1-CB 3.61Å; V322-R385 HydrophobicContact CG1-CG 4.46Å; V322-L386 HydrophobicContact CG2-CD1 4.26Å; V322-L386 HydrophobicContact CG2-CD2 3.9Å; V322-L386 HydrophobicContact CG2-CG 3.96Å
323	D	83.2	Confident	77.4	Confident	69 Å²	69	60.9 Å²	60.9	37%	0.369	30%	0.304	S	S	.	.	H	α-helix	trans	-63.3	-36.8	175	-71.2	-7.5	0	0	0	112.1	E319 G320 D326 K327 R385	E319-D323 WeakPolarHBondContact O-CB 3.24Å; E319-D323 PolarHBondContact O-N 2.9Å; G320-D323 PolarHBondContact O-N 3.47Å; D323-D326 PolarHBondContact O-N 2.87Å; D323-K327 WeakPolarHBondContact O-CB 3.22Å; D323-K327 VanDerWaalsContact O-CG 3.28Å; D323-K327 WeakPolarHBondContact O-CG 3.47Å; D323-K327 PolarHBondContact O-N 3.48Å; D323-R385 IonicContact OD1-CZ 3.02Å; D323-R385 IonicContact OD1-NH1 2.78Å; D323-R385 PolarHBondContact OD1-NH1 2.86Å; D323-R385 IonicContact OD1-NH2 3.04Å; D323-R385 PolarHBondContact OD1-NH2 3.43Å
324	L	80.2	Confident	76.8	Confident	35 Å²	35	66.6 Å²	66.6	18%	0.183	34%	0.335	C	S	.	.	H	α-helix	trans	-65.8	-38.7	172.8	-72	171.8	0	0	0	111.9	L305 D308 L309 G320 G321 V322 L328	L305-L324 HydrophobicContact CD1-CB 4.09Å; L305-L324 HydrophobicContact CD1-CD2 4.27Å; D308-L324 HydrophobicContact CB-CD1 4.09Å; L309-L324 HydrophobicContact CD2-CB 4.41Å; G320-L324 WeakPolarHBondContact O-CG 3.35Å; G320-L324 PolarHBondContact O-N 3.38Å; G321-L324 PolarHBondContact O-N 3.36Å; V322-L324 VanDerWaalsContact C-N 3.3Å; V322-L324 PolarHBondContact O-N 2.71Å; L324-L328 WeakPolarHBondContact O-CB 3.27Å; L324-L328 PolarHBondContact O-N 3.14Å
325	L	78.5	Confident	76	Confident	7 Å²	7	65.5 Å²	65.5	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-67.9	-39.5	175.3	-69.1	168.7	0	0	0	112.5	L309 G321 V322 L328 N329 V348 V352 L355 L386	L309-L325 HydrophobicContact CD1-CD2 3.85Å; L309-L325 HydrophobicContact CD1-CG 4.48Å; L309-L325 HydrophobicContact CD2-CD1 4.42Å; L309-L325 HydrophobicContact CD2-CD2 4.28Å; L309-L325 HydrophobicContact CD2-CG 4.01Å; G321-L325 WeakPolarHBondContact O-CG 3.2Å; G321-L325 PolarHBondContact O-N 3.46Å; V322-L325 WeakPolarHBondContact O-CB 3.43Å; V322-L325 PolarHBondContact O-N 3.34Å; V322-L325 VanDerWaalsContact O-N 3.15Å; L325-L328 PolarHBondContact O-N 3.26Å; L325-N329 WeakPolarHBondContact O-CB 3.26Å; L325-N329 PolarHBondContact O-N 3.42Å; L325-N329 PolarHBondContact O-ND2 2.94Å; L325-V348 HydrophobicContact CD2-CG1 3.36Å; L325-V352 HydrophobicContact CD1-CG2 3.71Å; L325-V352 HydrophobicContact CD2-CG2 3.66Å; L325-V352 HydrophobicContact CG-CG2 4.35Å; L325-L355 HydrophobicContact CD1-CD2 3.99Å; L325-L386 HydrophobicContact CD1-CD2 3.51Å
326	D	80.3	Confident	74.9	Confident	49 Å²	49	62.4 Å²	62.4	26%	0.262	31%	0.308	S	S	.	.	H	α-helix	trans	-66.4	-43.3	176.7	-77.3	-12.4	0	0	0	110.8	V322 D323 L328 N329 D330 R385	V322-D326 PolarHBondContact O-N 2.56Å; D323-D326 PolarHBondContact O-N 2.87Å; D326-L328 VanDerWaalsContact C-N 3.33Å; D326-L328 PolarHBondContact O-N 3.31Å; D326-N329 PolarHBondContact O-N 3.13Å; D326-D330 PolarHBondContact O-N 3.48Å; D326-R385 IonicContact OD2-CZ 3.88Å; D326-R385 VanDerWaalsContact OD2-CZ 3.26Å; D326-R385 IonicContact OD2-NE 2.7Å; D326-R385 PolarHBondContact OD2-NE 3.36Å; D326-R385 VanDerWaalsContact OD2-NE 3.15Å; D326-R385 IonicContact OD2-NH2 2.94Å; D326-R385 PolarHBondContact OD2-NH2 3.41Å
327	K	80.6	Confident	74.1	Confident	130 Å²	130	60.9 Å²	60.9	57%	0.565	31%	0.313	S	S	*	.	H	α-helix	trans	-59.1	-42.4	172.7	-74.7	172	-175.5	174	0	112.4	D323 Y331	D323-K327 WeakPolarHBondContact O-CB 3.22Å; D323-K327 VanDerWaalsContact O-CG 3.28Å; D323-K327 WeakPolarHBondContact O-CG 3.47Å; D323-K327 PolarHBondContact O-N 3.48Å; K327-Y331 WeakPolarHBondContact O-CB 3.48Å; K327-Y331 PolarHBondContact O-N 3.37Å
328	L	76.2	Confident	73.3	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-63.6	-47.3	175	179.5	72.5	0	0	0	110.7	L305 L324 L325 D326 D330 Y331 L332 L344 V348	L305-L328 HydrophobicContact CD2-CB 4.07Å; L305-L328 HydrophobicContact CD2-CD1 4.1Å; L305-L328 HydrophobicContact CD2-CD2 3.62Å; L305-L328 HydrophobicContact CD2-CG 4.11Å; L324-L328 WeakPolarHBondContact O-CB 3.27Å; L324-L328 PolarHBondContact O-N 3.14Å; L325-L328 PolarHBondContact O-N 3.26Å; D326-L328 VanDerWaalsContact C-N 3.33Å; D326-L328 PolarHBondContact O-N 3.31Å; L328-D330 VanDerWaalsContact C-N 3.32Å; L328-D330 PolarHBondContact O-N 3.35Å; L328-Y331 PolarHBondContact O-N 3.02Å; L328-L332 HydrophobicContact CD1-CD1 3.93Å; L328-L332 HydrophobicContact CD1-CG 4.05Å; L328-L332 HydrophobicContact CD2-CD1 4.09Å; L328-L332 HydrophobicContact CG-CD1 3.7Å; L328-L332 HydrophobicContact CG-CG 4.14Å; L328-L332 VanDerWaalsContact O-CB 3.3Å; L328-L332 WeakPolarHBondContact O-CB 3.43Å; L328-L332 WeakPolarHBondContact O-CG 3.16Å; L328-L332 PolarHBondContact O-N 2.89Å; L328-L344 HydrophobicContact CD1-CD2 4.03Å; L328-V348 HydrophobicContact CD2-CB 4.27Å; L328-V348 HydrophobicContact CD2-CG1 3.87Å; L328-V348 HydrophobicContact CD2-CG2 3.78Å
329	N	76.9	Confident	72.3	Confident	71 Å²	71	66.1 Å²	66.1	38%	0.38	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-37.3	-178.5	-81.3	-35.7	0	0	0	112.4	L325 D326 L332 K333	L325-N329 WeakPolarHBondContact O-CB 3.26Å; L325-N329 PolarHBondContact O-N 3.42Å; L325-N329 PolarHBondContact O-ND2 2.94Å; D326-N329 PolarHBondContact O-N 3.13Å; N329-L332 PolarHBondContact O-N 3.12Å; N329-K333 WeakPolarHBondContact O-CG 3.45Å; N329-K333 PolarHBondContact O-N 3.32Å; N329-K333 VanDerWaalsContact O-N 3.11Å
330	D	77.9	Confident	71.3	Confident	90 Å²	90	71.6 Å²	71.6	48%	0.481	36%	0.359	S	S	.	.	H	α-helix	trans	-69.1	-41.2	174.7	-74.4	-19.1	0	0	0	111.8	D326 L328 L332 K333	D326-D330 PolarHBondContact O-N 3.48Å; L328-D330 VanDerWaalsContact C-N 3.32Å; L328-D330 PolarHBondContact O-N 3.35Å; D330-L332 VanDerWaalsContact C-N 3.31Å; D330-L332 PolarHBondContact O-N 2.93Å; D330-K333 PolarHBondContact O-N 2.89Å; D330-K333 IonicContact OD1-NZ 2.73Å; D330-K333 PolarHBondContact OD1-NZ 3.5Å
331	Y	72.9	Confident	70.6	Confident	77 Å²	77	71.1 Å²	71.1	30%	0.302	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-34.8	174.4	-167.6	-99	0	0	0	112.8	W301 I302 K327 L328 Q335	W301-Y331 HydrophobicContact CZ2-CD2 4.5Å; W301-Y331 HydrophobicContact CZ2-CG 4.33Å; I302-Y331 HydrophobicContact CD1-CD1 4.05Å; I302-Y331 HydrophobicContact CD1-CE1 3.74Å; K327-Y331 WeakPolarHBondContact O-CB 3.48Å; K327-Y331 PolarHBondContact O-N 3.37Å; L328-Y331 PolarHBondContact O-N 3.02Å; Y331-Q335 HydrophobicContact CE1-CG 4.43Å; Y331-Q335 WeakPolarHBondContact O-CG 3.35Å
332	L	68.5	Low	69.9	Low	19 Å²	19	76.8 Å²	76.8	10%	0.099	38%	0.376	C	S	.	.	H	α-helix	trans	-80	-13.2	178.7	-70.6	-178.8	0	0	0	114.1	L328 N329 D330 D334 V341	L328-L332 HydrophobicContact CD1-CD1 3.93Å; L328-L332 HydrophobicContact CD1-CG 4.05Å; L328-L332 HydrophobicContact CD2-CD1 4.09Å; L328-L332 HydrophobicContact CG-CD1 3.7Å; L328-L332 HydrophobicContact CG-CG 4.14Å; L328-L332 VanDerWaalsContact O-CB 3.3Å; L328-L332 WeakPolarHBondContact O-CB 3.43Å; L328-L332 WeakPolarHBondContact O-CG 3.16Å; L328-L332 PolarHBondContact O-N 2.89Å; N329-L332 PolarHBondContact O-N 3.12Å; D330-L332 VanDerWaalsContact C-N 3.31Å; D330-L332 PolarHBondContact O-N 2.93Å; L332-D334 VanDerWaalsContact C-N 3.33Å; L332-V341 HydrophobicContact CD2-CG1 3.63Å; L332-V341 HydrophobicContact CD2-CG2 4.47Å
333	K	67.3	Low	69.5	Low	151 Å²	151	81.5 Å²	81.5	66%	0.657	40%	0.402	S	S	*	.	H	α-helix	trans	-69.4	-31.8	174.6	-83.3	169.2	-167.9	159.7	0	112.4	N329 D330	N329-K333 WeakPolarHBondContact O-CG 3.45Å; N329-K333 PolarHBondContact O-N 3.32Å; N329-K333 VanDerWaalsContact O-N 3.11Å; D330-K333 PolarHBondContact O-N 2.89Å; D330-K333 IonicContact OD1-NZ 2.73Å; D330-K333 PolarHBondContact OD1-NZ 3.5Å
334	D	63.7	Low	68.9	Low	148 Å²	148	79.5 Å²	79.5	79%	0.791	39%	0.391	S	S	*	.	S	Bend	trans	-94.9	-1.1	-174	-68	-24.4	0	0	0	113.6	L332	L332-D334 VanDerWaalsContact C-N 3.33Å
335	Q	60.5	Low	68.5	Low	61 Å²	61	83.3 Å²	83.3	29%	0.285	40%	0.403	S	S	.	.	S	Bend	trans	-112.8	141.6	-172	-70.3	-74.2	-17.7	0	0	112.9	V295 Y331	V295-Q335 VanDerWaalsContact CG2-OE1 3.23Å; Y331-Q335 HydrophobicContact CE1-CG 4.43Å; Y331-Q335 WeakPolarHBondContact O-CG 3.35Å
336	P	54.9	Low	68.5	Low	76 Å²	76	87.2 Å²	87.2	49%	0.494	43%	0.427	S	S	.	.			trans	-66.9	141.4	176	26.8	-32.2	0	0	0	111.7	V295 N338	V295-P336 HydrophobicContact CG2-CG 3.86Å; P336-N338 PolarHBondContact O-N 3.43Å
337	V	56.1	Low	68.2	Low	95 Å²	95	91.4 Å²	91.4	58%	0.576	44%	0.443	S	S	*	.			trans	-74.8	83.3	-173.2	-171.5	0	0	0	0	111.2	K342	V337-K342 HydrophobicContact CG1-CD 4.42Å; V337-K342 HydrophobicContact CG1-CG 3.9Å
338	N	63.9	Low	68.1	Low	69 Å²	69	85.5 Å²	85.5	37%	0.369	42%	0.418	S	S	.	.			trans	-79.9	160.8	174.9	-73.2	-16.2	0	0	0	112.7	P336 R340 V341 K342	P336-N338 PolarHBondContact O-N 3.43Å; N338-R340 PolarHBondContact O-N 3.26Å; N338-V341 HydrophobicContact CB-CG2 4.33Å; N338-V341 WeakPolarHBondContact O-CB 3.35Å; N338-V341 PolarHBondContact O-N 3.42Å; N338-K342 PolarHBondContact O-N 3.1Å
339	L	57.4	Low	68.3	Low	140 Å²	140	89.5 Å²	89.5	73%	0.733	44%	0.439	S	S	*	.	H	α-helix	trans	-57	-33.1	178.8	-153.4	83.6	0	0	0	112.7	K342 N343	L339-K342 PolarHBondContact O-N 3.08Å; L339-N343 PolarHBondContact O-N 3.39Å; L339-N343 VanDerWaalsContact O-N 3.11Å; L339-N343 PolarHBondContact O-ND2 3.02Å
340	R	59.1	Low	68.5	Low	194 Å²	194	90.9 Å²	90.9	73%	0.732	44%	0.443	S	S	*	.	H	α-helix	trans	-71	-37	175.6	-67.9	-173.5	177.9	172.3	0.4	113	L297 N338 K342 N343 L344	L297-R340 HydrophobicContact CD1-CB 3.67Å; N338-R340 PolarHBondContact O-N 3.26Å; R340-K342 VanDerWaalsContact C-N 3.32Å; R340-N343 PolarHBondContact O-N 3.47Å; R340-L344 PolarHBondContact O-N 3.29Å
341	V	64.2	Low	68.4	Low	8 Å²	8	89.6 Å²	89.6	5%	0.048	43%	0.431	C	S	.	.	H	α-helix	trans	-65.3	-38.4	173.6	175.8	0	0	0	0	110.4	L297 L332 N338 L344 R345	L297-V341 HydrophobicContact CD1-CG2 4.16Å; L297-V341 HydrophobicContact CD2-CG2 4.27Å; L332-V341 HydrophobicContact CD2-CG1 3.63Å; L332-V341 HydrophobicContact CD2-CG2 4.47Å; N338-V341 HydrophobicContact CB-CG2 4.33Å; N338-V341 WeakPolarHBondContact O-CB 3.35Å; N338-V341 PolarHBondContact O-N 3.42Å; V341-L344 PolarHBondContact O-N 3.46Å; V341-R345 VanDerWaalsContact O-CB 3.3Å; V341-R345 WeakPolarHBondContact O-CB 3.49Å; V341-R345 PolarHBondContact O-N 3.19Å
342	K	66.8	Low	68.8	Low	119 Å²	119	87.4 Å²	87.4	52%	0.517	43%	0.426	S	S	.	.	H	α-helix	trans	-63	-45.2	173.4	-69.6	-175.4	-179.8	178.9	0	112.3	V337 N338 L339 R340 R345 V346	V337-K342 HydrophobicContact CG1-CD 4.42Å; V337-K342 HydrophobicContact CG1-CG 3.9Å; N338-K342 PolarHBondContact O-N 3.1Å; L339-K342 PolarHBondContact O-N 3.08Å; R340-K342 VanDerWaalsContact C-N 3.32Å; K342-R345 PolarHBondContact O-N 2.93Å; K342-V346 WeakPolarHBondContact O-CG2 3.34Å; K342-V346 PolarHBondContact O-N 3.46Å
343	N	70.9	Confident	69.4	Low	100 Å²	100	92.6 Å²	92.6	54%	0.535	44%	0.444	S	S	.	.	H	α-helix	trans	-64.5	-39.8	177.6	-79.4	-32.6	0	0	0	112.9	L339 R340 V346 K347	L339-N343 PolarHBondContact O-N 3.39Å; L339-N343 VanDerWaalsContact O-N 3.11Å; L339-N343 PolarHBondContact O-ND2 3.02Å; R340-N343 PolarHBondContact O-N 3.47Å; N343-V346 PolarHBondContact O-N 2.91Å; N343-K347 PolarHBondContact O-N 3.45Å
344	L	69.3	Low	70.1	Confident	26 Å²	26	88.6 Å²	88.6	14%	0.136	43%	0.428	C	S	.	.	H	α-helix	trans	-63.9	-45.1	173.8	-174.8	75.7	0	0	0	110.8	I302 L328 R340 V341 V346 K347 V348	I302-L344 HydrophobicContact CG2-CD1 4.2Å; I302-L344 HydrophobicContact CG2-CD2 3.35Å; I302-L344 HydrophobicContact CG2-CG 4.42Å; L328-L344 HydrophobicContact CD1-CD2 4.03Å; R340-L344 PolarHBondContact O-N 3.29Å; V341-L344 PolarHBondContact O-N 3.46Å; L344-V346 VanDerWaalsContact C-N 3.32Å; L344-V346 PolarHBondContact O-N 2.81Å; L344-K347 PolarHBondContact O-N 3.04Å; L344-K347 VanDerWaalsContact O-N 3.16Å; L344-V348 HydrophobicContact CG-CG2 4.32Å; L344-V348 WeakPolarHBondContact O-CB 3.42Å; L344-V348 VanDerWaalsContact O-CG2 3.31Å; L344-V348 WeakPolarHBondContact O-CG2 3.36Å; L344-V348 PolarHBondContact O-N 3.04Å
345	R	73.1	Confident	70.9	Confident	115 Å²	115	81.7 Å²	81.7	43%	0.434	39%	0.391	S	S	.	.	H	α-helix	trans	-59.7	-41.2	177.8	-170.9	177	-95.2	-177.7	-5.9	111.6	V341 K342 K347 V348 D349	V341-R345 VanDerWaalsContact O-CB 3.3Å; V341-R345 WeakPolarHBondContact O-CB 3.49Å; V341-R345 PolarHBondContact O-N 3.19Å; K342-R345 PolarHBondContact O-N 2.93Å; R345-K347 PolarHBondContact O-N 3.41Å; R345-V348 PolarHBondContact O-N 3.35Å; R345-D349 VanDerWaalsContact O-CB 3.25Å; R345-D349 WeakPolarHBondContact O-CB 3.42Å; R345-D349 PolarHBondContact O-N 2.83Å
346	V	77.8	Confident	71.9	Confident	90 Å²	90	79 Å²	79	55%	0.545	38%	0.378	S	S	.	.	H	α-helix	trans	-61.1	-44.2	174.6	172.4	0	0	0	0	112.1	K342 N343 L344 D349 E350	K342-V346 WeakPolarHBondContact O-CG2 3.34Å; K342-V346 PolarHBondContact O-N 3.46Å; N343-V346 PolarHBondContact O-N 2.91Å; L344-V346 VanDerWaalsContact C-N 3.32Å; L344-V346 PolarHBondContact O-N 2.81Å; V346-D349 PolarHBondContact O-N 3.33Å; V346-E350 PolarHBondContact O-N 2.7Å; V346-E350 VanDerWaalsContact O-N 3.11Å
347	K	75.2	Confident	73.2	Confident	137 Å²	137	80 Å²	80	60%	0.596	38%	0.377	S	S	*	.	H	α-helix	trans	-64.7	-41.3	176.9	-72.5	-176.9	176.7	-174.4	0	112	N343 L344 R345 R351	N343-K347 PolarHBondContact O-N 3.45Å; L344-K347 PolarHBondContact O-N 3.04Å; L344-K347 VanDerWaalsContact O-N 3.16Å; R345-K347 PolarHBondContact O-N 3.41Å; K347-R351 WeakPolarHBondContact O-CG 3.44Å; K347-R351 PolarHBondContact O-N 2.88Å
348	V	78	Confident	74.3	Confident	6 Å²	6	77.8 Å²	77.8	4%	0.036	36%	0.363	C	S	.	.	H	α-helix	trans	-68.1	-42.2	177.5	172.8	0	0	0	0	110.7	L305 L309 L325 L328 L344 R345 E350 R351 V352	L305-V348 HydrophobicContact CD2-CG2 4.07Å; L309-V348 HydrophobicContact CD1-CG1 4.49Å; L325-V348 HydrophobicContact CD2-CG1 3.36Å; L328-V348 HydrophobicContact CD2-CB 4.27Å; L328-V348 HydrophobicContact CD2-CG1 3.87Å; L328-V348 HydrophobicContact CD2-CG2 3.78Å; L344-V348 HydrophobicContact CG-CG2 4.32Å; L344-V348 WeakPolarHBondContact O-CB 3.42Å; L344-V348 VanDerWaalsContact O-CG2 3.31Å; L344-V348 WeakPolarHBondContact O-CG2 3.36Å; L344-V348 PolarHBondContact O-N 3.04Å; R345-V348 PolarHBondContact O-N 3.35Å; V348-E350 VanDerWaalsContact C-N 3.3Å; V348-E350 PolarHBondContact O-N 2.79Å; V348-R351 CarbonylContact O-C 3.59Å; V348-R351 WeakPolarHBondContact O-CA 3.34Å; V348-R351 PolarHBondContact O-N 3.17Å; V348-V352 HydrophobicContact CG1-CG2 4.11Å; V348-V352 VanDerWaalsContact O-CG2 3.31Å; V348-V352 WeakPolarHBondContact O-CG2 3.27Å; V348-V352 PolarHBondContact O-N 3.05Å
349	D	79.4	Confident	74.9	Confident	88 Å²	88	74.5 Å²	74.5	47%	0.471	35%	0.345	S	S	.	.	H	α-helix	trans	-61.4	-38	178.4	-72.9	-19	0	0	0	111.8	R345 V346 R351 V352 R353	R345-D349 VanDerWaalsContact O-CB 3.25Å; R345-D349 WeakPolarHBondContact O-CB 3.42Å; R345-D349 PolarHBondContact O-N 2.83Å; V346-D349 PolarHBondContact O-N 3.33Å; D349-R351 VanDerWaalsContact C-N 3.3Å; D349-R351 PolarHBondContact O-N 3.17Å; D349-V352 PolarHBondContact O-N 3.44Å; D349-R353 WeakPolarHBondContact O-CB 3.45Å; D349-R353 PolarHBondContact O-N 2.94Å
350	E	81.4	Confident	76	Confident	99 Å²	99	69 Å²	69	46%	0.463	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-37.4	173.9	-175.7	133.7	-141.4	0	0	111.8	V346 V348 R353 Q354	V346-E350 PolarHBondContact O-N 2.7Å; V346-E350 VanDerWaalsContact O-N 3.11Å; V348-E350 VanDerWaalsContact C-N 3.3Å; V348-E350 PolarHBondContact O-N 2.79Å; E350-R353 WeakPolarHBondContact O-CB 3.44Å; E350-R353 PolarHBondContact O-N 3.34Å; E350-R353 IonicContact OE1-NH2 3.95Å; E350-Q354 WeakPolarHBondContact O-CG 3.42Å; E350-Q354 PolarHBondContact O-N 2.87Å
351	R	76.4	Confident	76.9	Confident	64 Å²	64	65 Å²	65	24%	0.242	31%	0.306	C	S	.	.	H	α-helix	trans	-79.5	-31	176.9	-60.7	-56.5	175.6	72.5	-26.1	113.8	P306 D310 K347 V348 D349 R353 Q354 L355	P306-R351 PolarHBondContact O-NH1 3.32Å; P306-R351 VanDerWaalsContact O-NH1 3.11Å; D310-R351 VanDerWaalsContact CG-CZ 3.41Å; D310-R351 WeakPolarHBondContact OD1-CD 3.4Å; D310-R351 IonicContact OD1-CZ 3.73Å; D310-R351 IonicContact OD1-NE 3.88Å; D310-R351 PolarHBondContact OD1-NE 3.35Å; D310-R351 IonicContact OD1-NH1 2.95Å; D310-R351 PolarHBondContact OD1-NH1 3.38Å; D310-R351 IonicContact OD1-NH2 2.92Å; D310-R351 IonicContact OD2-CZ 3.29Å; D310-R351 IonicContact OD2-NH1 2.75Å; D310-R351 PolarHBondContact OD2-NH1 2.89Å; D310-R351 IonicContact OD2-NH2 3Å; D310-R351 PolarHBondContact OD2-NH2 2.87Å; K347-R351 WeakPolarHBondContact O-CG 3.44Å; K347-R351 PolarHBondContact O-N 2.88Å; V348-R351 CarbonylContact O-C 3.59Å; V348-R351 WeakPolarHBondContact O-CA 3.34Å; V348-R351 PolarHBondContact O-N 3.17Å; D349-R351 VanDerWaalsContact C-N 3.3Å; D349-R351 PolarHBondContact O-N 3.17Å; R351-R353 VanDerWaalsContact C-N 3.26Å; R351-R353 PolarHBondContact O-N 3.47Å; R351-Q354 PolarHBondContact O-N 3.09Å; R351-L355 VanDerWaalsContact O-CB 3.26Å; R351-L355 WeakPolarHBondContact O-CB 3.33Å; R351-L355 PolarHBondContact O-N 3.14Å
352	V	79.9	Confident	77.3	Confident	30 Å²	30	67.3 Å²	67.3	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-60.1	-40.4	165.9	170.4	0	0	0	0	109.9	L325 V348 D349 T356 L386	L325-V352 HydrophobicContact CD1-CG2 3.71Å; L325-V352 HydrophobicContact CD2-CG2 3.66Å; L325-V352 HydrophobicContact CG-CG2 4.35Å; V348-V352 HydrophobicContact CG1-CG2 4.11Å; V348-V352 VanDerWaalsContact O-CG2 3.31Å; V348-V352 WeakPolarHBondContact O-CG2 3.27Å; V348-V352 PolarHBondContact O-N 3.05Å; D349-V352 PolarHBondContact O-N 3.44Å; V352-T356 VanDerWaalsContact O-CB 3.26Å; V352-T356 WeakPolarHBondContact O-CB 3.48Å; V352-T356 PolarHBondContact O-N 2.83Å; V352-T356 PolarHBondContact O-OG1 3.18Å; V352-L386 HydrophobicContact CG1-CD2 4.34Å
353	R	82.7	Confident	77.5	Confident	129 Å²	129	61.8 Å²	61.8	49%	0.487	29%	0.292	S	S	.	.	H	α-helix	trans	-63.6	-46.2	174.3	-170.4	179.7	71.2	98.7	-9.8	111.6	D349 E350 R351 T356 E357	D349-R353 WeakPolarHBondContact O-CB 3.45Å; D349-R353 PolarHBondContact O-N 2.94Å; E350-R353 WeakPolarHBondContact O-CB 3.44Å; E350-R353 PolarHBondContact O-N 3.34Å; E350-R353 IonicContact OE1-NH2 3.95Å; R351-R353 VanDerWaalsContact C-N 3.26Å; R351-R353 PolarHBondContact O-N 3.47Å; R353-T356 WeakPolarHBondContact O-CB 3.37Å; R353-T356 PolarHBondContact O-N 3.33Å; R353-E357 IonicContact CZ-OE1 3.63Å; R353-E357 IonicContact NH1-OE1 2.79Å; R353-E357 PolarHBondContact NH1-OE1 2.92Å; R353-E357 WeakPolarHBondContact O-CG 3.49Å; R353-E357 PolarHBondContact O-N 2.97Å
354	Q	81.9	Confident	77.5	Confident	66 Å²	66	58.6 Å²	58.6	31%	0.308	28%	0.278	S	S	.	.	H	α-helix	trans	-62	-46.6	176.3	-70.1	178.7	5.6	0	0	112.1	E350 R351 T356 E357 V358	E350-Q354 WeakPolarHBondContact O-CG 3.42Å; E350-Q354 PolarHBondContact O-N 2.87Å; R351-Q354 PolarHBondContact O-N 3.09Å; Q354-T356 VanDerWaalsContact C-N 3.3Å; Q354-T356 PolarHBondContact O-N 3.23Å; Q354-E357 PolarHBondContact O-N 3.35Å; Q354-V358 WeakPolarHBondContact O-CG2 3.39Å; Q354-V358 PolarHBondContact O-N 3.4Å
355	L	80.4	Confident	77	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-57.7	-44.1	174.8	177.3	64.3	0	0	0	111.3	I313 F318 V322 L325 R351 V358 L359 L386	I313-L355 HydrophobicContact CD1-CB 4.11Å; I313-L355 HydrophobicContact CG1-CB 4.23Å; I313-L355 HydrophobicContact CG1-CD1 3.93Å; F318-L355 HydrophobicContact CD1-CD1 3.45Å; F318-L355 VanDerWaalsContact CD1-CD1 3.45Å; F318-L355 HydrophobicContact CE1-CD1 4.1Å; F318-L355 HydrophobicContact CG-CD1 4.4Å; V322-L355 HydrophobicContact CG2-CD2 4.21Å; L325-L355 HydrophobicContact CD1-CD2 3.99Å; R351-L355 VanDerWaalsContact O-CB 3.26Å; R351-L355 WeakPolarHBondContact O-CB 3.33Å; R351-L355 PolarHBondContact O-N 3.14Å; L355-V358 PolarHBondContact O-N 2.94Å; L355-L359 HydrophobicContact CD1-CD1 4.22Å; L355-L359 HydrophobicContact CD1-CG 4.46Å; L355-L359 HydrophobicContact CG-CD1 4.03Å; L355-L359 WeakPolarHBondContact O-CB 3.28Å; L355-L359 WeakPolarHBondContact O-CG 3.38Å; L355-L359 PolarHBondContact O-N 2.99Å; L355-L386 HydrophobicContact CD2-CD1 3.9Å; L355-L386 HydrophobicContact CD2-CD2 4.05Å; L355-L386 HydrophobicContact CG-CD1 4.14Å
356	T	80.1	Confident	76.2	Confident	4 Å²	4	61.8 Å²	61.8	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-44.5	176.2	-60	0	0	0	0	111.3	V352 R353 Q354 L359 V360 L383	V352-T356 VanDerWaalsContact O-CB 3.26Å; V352-T356 WeakPolarHBondContact O-CB 3.48Å; V352-T356 PolarHBondContact O-N 2.83Å; V352-T356 PolarHBondContact O-OG1 3.18Å; R353-T356 WeakPolarHBondContact O-CB 3.37Å; R353-T356 PolarHBondContact O-N 3.33Å; Q354-T356 VanDerWaalsContact C-N 3.3Å; Q354-T356 PolarHBondContact O-N 3.23Å; T356-L359 PolarHBondContact O-N 3.39Å; T356-V360 HydrophobicContact CG2-CG2 4.19Å; T356-V360 WeakPolarHBondContact O-CB 3.28Å; T356-V360 WeakPolarHBondContact O-CG2 3.27Å; T356-V360 PolarHBondContact O-N 3.45Å; T356-L383 HydrophobicContact CG2-CD2 4.08Å
357	E	82.4	Confident	75.2	Confident	99 Å²	99	66.4 Å²	66.4	46%	0.463	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-42.8	177.1	-77.5	174.4	-166.7	0	0	111.9	R353 Q354 V360 F361	R353-E357 IonicContact CZ-OE1 3.63Å; R353-E357 IonicContact NH1-OE1 2.79Å; R353-E357 PolarHBondContact NH1-OE1 2.92Å; R353-E357 WeakPolarHBondContact O-CG 3.49Å; R353-E357 PolarHBondContact O-N 2.97Å; Q354-E357 PolarHBondContact O-N 3.35Å; E357-V360 PolarHBondContact O-N 3.21Å; E357-F361 WeakPolarHBondContact O-CB 3.37Å; E357-F361 PolarHBondContact O-N 2.82Å
358	V	80.9	Confident	74	Confident	47 Å²	47	61.6 Å²	61.6	29%	0.285	30%	0.298	S	S	.	.	H	α-helix	trans	-65.4	-43.6	176.2	175.4	0	0	0	0	111.3	I313 F318 Q354 L355 V360 F361 E362	I313-V358 HydrophobicContact CG2-CG2 4.2Å; F318-V358 HydrophobicContact CE1-CG1 3.76Å; F318-V358 HydrophobicContact CZ-CG1 3.8Å; Q354-V358 WeakPolarHBondContact O-CG2 3.39Å; Q354-V358 PolarHBondContact O-N 3.4Å; L355-V358 PolarHBondContact O-N 2.94Å; V358-V360 PolarHBondContact O-N 2.9Å; V358-F361 PolarHBondContact O-N 3Å; V358-E362 WeakPolarHBondContact O-CG 3.26Å; V358-E362 PolarHBondContact O-N 3.3Å
359	L	76.4	Confident	72.6	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-62.2	-42.4	175.6	-80	167.7	0	0	0	112	F318 L355 T356 F361 E362 L363 A379 Q382 L383 L386	F318-L359 HydrophobicContact CB-CD2 3.99Å; F318-L359 HydrophobicContact CD1-CD2 4.07Å; F318-L359 HydrophobicContact CD1-CG 4.22Å; F318-L359 HydrophobicContact CD2-CD2 3.6Å; F318-L359 HydrophobicContact CE1-CD2 4.43Å; F318-L359 HydrophobicContact CE1-CG 4.49Å; F318-L359 HydrophobicContact CE2-CD2 4.03Å; F318-L359 HydrophobicContact CG-CD2 3.61Å; F318-L359 HydrophobicContact CG-CG 4.24Å; F318-L359 HydrophobicContact CZ-CD2 4.42Å; L355-L359 HydrophobicContact CD1-CD1 4.22Å; L355-L359 HydrophobicContact CD1-CG 4.46Å; L355-L359 HydrophobicContact CG-CD1 4.03Å; L355-L359 WeakPolarHBondContact O-CB 3.28Å; L355-L359 WeakPolarHBondContact O-CG 3.38Å; L355-L359 PolarHBondContact O-N 2.99Å; T356-L359 PolarHBondContact O-N 3.39Å; L359-F361 VanDerWaalsContact C-N 3.31Å; L359-F361 PolarHBondContact O-N 3.43Å; L359-E362 PolarHBondContact O-N 2.96Å; L359-L363 WeakPolarHBondContact O-CB 3.35Å; L359-L363 WeakPolarHBondContact O-CD1 3.35Å; L359-L363 PolarHBondContact O-N 2.86Å; L359-A379 HydrophobicContact CD2-CB 3.99Å; L359-Q382 HydrophobicContact CD1-CB 4.3Å; L359-L383 HydrophobicContact CB-CD1 4.48Å; L359-L383 HydrophobicContact CB-CD2 3.81Å; L359-L383 HydrophobicContact CB-CG 4.08Å; L359-L383 HydrophobicContact CD1-CD2 3.9Å; L359-L383 HydrophobicContact CD1-CG 4.17Å; L359-L386 HydrophobicContact CD1-CD1 3.62Å
360	V	79.8	Confident	71.1	Confident	26 Å²	26	76.4 Å²	76.4	16%	0.158	36%	0.359	C	S	.	.	H	α-helix	trans	-62.7	-40.7	175.8	168.2	0	0	0	0	110.9	T356 E357 V358 L363 S364 K391 L395	T356-V360 HydrophobicContact CG2-CG2 4.19Å; T356-V360 WeakPolarHBondContact O-CB 3.28Å; T356-V360 WeakPolarHBondContact O-CG2 3.27Å; T356-V360 PolarHBondContact O-N 3.45Å; E357-V360 PolarHBondContact O-N 3.21Å; V358-V360 PolarHBondContact O-N 2.9Å; V360-L363 PolarHBondContact O-N 2.79Å; V360-S364 PolarHBondContact O-N 2.68Å; V360-S364 PolarHBondContact O-OG 3Å; V360-K391 HydrophobicContact CG2-CD 4.09Å; V360-L395 HydrophobicContact CB-CD1 3.94Å; V360-L395 HydrophobicContact CG1-CD1 3.71Å; V360-L395 HydrophobicContact CG1-CD2 4.34Å; V360-L395 HydrophobicContact CG2-CD1 3.62Å
361	F	77	Confident	69.9	Low	109 Å²	109	72.6 Å²	72.6	48%	0.478	35%	0.347	S	S	.	.	H	α-helix	trans	-66.5	-39.8	177	-174	-100.8	0	0	0	112.3	E357 V358 L359 S364	E357-F361 WeakPolarHBondContact O-CB 3.37Å; E357-F361 PolarHBondContact O-N 2.82Å; V358-F361 PolarHBondContact O-N 3Å; L359-F361 VanDerWaalsContact C-N 3.31Å; L359-F361 PolarHBondContact O-N 3.43Å; F361-S364 WeakPolarHBondContact O-CB 3.48Å; F361-S364 PolarHBondContact O-N 2.82Å
362	E	73.1	Confident	69.3	Low	57 Å²	57	72 Å²	72	27%	0.266	36%	0.36	S	S	.	.	H	α-helix	trans	-69.9	-31.2	176.2	-71.8	-68.6	137.9	0	0	113.1	R316 F318 V358 L359 S364	R316-E362 IonicContact CZ-OE1 3.08Å; R316-E362 IonicContact CZ-OE2 3.62Å; R316-E362 IonicContact NH1-OE1 2.81Å; R316-E362 PolarHBondContact NH1-OE1 2.93Å; R316-E362 IonicContact NH1-OE2 3.92Å; R316-E362 PolarHBondContact NH1-OE2 3.44Å; R316-E362 IonicContact NH2-OE1 2.81Å; R316-E362 PolarHBondContact NH2-OE1 3.4Å; F318-E362 HydrophobicContact CE2-CG 4.46Å; F318-E362 HydrophobicContact CZ-CG 4.33Å; V358-E362 WeakPolarHBondContact O-CG 3.26Å; V358-E362 PolarHBondContact O-N 3.3Å; L359-E362 PolarHBondContact O-N 2.96Å; E362-S364 VanDerWaalsContact C-N 3.29Å
363	L	71.2	Confident	68.5	Low	2 Å²	2	74.2 Å²	74.2	1%	0.01	38%	0.375	C	S	.	.	H	α-helix	trans	-78.6	-12.6	175.9	-82.9	157.7	0	0	0	113.6	L359 V360 T376 A379 V380 L383 L395 N399	L359-L363 WeakPolarHBondContact O-CB 3.35Å; L359-L363 WeakPolarHBondContact O-CD1 3.35Å; L359-L363 PolarHBondContact O-N 2.86Å; V360-L363 PolarHBondContact O-N 2.79Å; L363-T376 HydrophobicContact CD2-CG2 3.67Å; L363-A379 HydrophobicContact CD1-CB 3.74Å; L363-A379 HydrophobicContact CD2-CB 4.04Å; L363-A379 HydrophobicContact CG-CB 3.75Å; L363-V380 HydrophobicContact CD1-CG2 4.33Å; L363-V380 HydrophobicContact CD2-CG2 3.81Å; L363-L383 HydrophobicContact CD1-CD1 3.31Å; L363-L383 HydrophobicContact CD1-CG 4.34Å; L363-L395 HydrophobicContact CB-CB 4.33Å; L363-N399 PolarHBondContact O-ND2 2.96Å
364	S	70.3	Confident	67.8	Low	33 Å²	33	75.2 Å²	75.2	23%	0.231	38%	0.383	C	S	.	.	S	Bend	trans	-70.4	138.5	-177.1	-68.1	0	0	0	0	111.7	V360 F361 E362 D366	V360-S364 PolarHBondContact O-N 2.68Å; V360-S364 PolarHBondContact O-OG 3Å; F361-S364 WeakPolarHBondContact O-CB 3.48Å; F361-S364 PolarHBondContact O-N 2.82Å; E362-S364 VanDerWaalsContact C-N 3.29Å; S364-D366 PolarHBondContact O-N 3.3Å; S364-D366 VanDerWaalsContact O-N 3.14Å
365	P	60	Low	67.2	Low	58 Å²	58	74.2 Å²	74.2	38%	0.377	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-24.1	-170.2	22.7	-32.2	0	0	0	114	R367 A402	P365-R367 VanDerWaalsContact C-N 3.31Å; P365-R367 PolarHBondContact O-N 3.47Å; P365-A402 HydrophobicContact CB-CB 3.72Å
366	D	56.6	Low	66.9	Low	150 Å²	150	74.6 Å²	74.6	80%	0.802	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-13.4	-173	-62.4	-42.2	0	0	0	115	S364	S364-D366 PolarHBondContact O-N 3.3Å; S364-D366 VanDerWaalsContact O-N 3.14Å
367	R	56.9	Low	66.6	Low	187 Å²	187	78.1 Å²	78.1	71%	0.706	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.4	6.7	177.9	-78.8	-167.5	175.8	-167.1	1.3	115.5	P365 L369	P365-R367 VanDerWaalsContact C-N 3.31Å; P365-R367 PolarHBondContact O-N 3.47Å; R367-L369 PolarHBondContact O-N 3.46Å
368	S	49.6	Very low	66.4	Low	37 Å²	37	80.7 Å²	80.7	26%	0.259	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	30	179.7	-168.4	0	0	0	0	114.6	R370	S368-R370 VanDerWaalsContact C-N 3.3Å
369	L	47.2	Very low	66.3	Low	175 Å²	175	78.9 Å²	78.9	92%	0.916	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.3	170.2	-77.8	161.6	0	0	0	112.8	R367	R367-L369 PolarHBondContact O-N 3.46Å
370	R	48.6	Very low	66.5	Low	229 Å²	229	78.9 Å²	78.9	86%	0.864	40%	0.397	S	S	*	.	S	Bend	trans	-101.2	-12.2	-173.6	-109.5	-177	178.5	-142.9	-0.7	116	S368	S368-R370 VanDerWaalsContact C-N 3.3Å
371	G	55.7	Low	66.7	Low	20 Å²	20	79.7 Å²	79.7	21%	0.206	40%	0.403	C	S	.	.			trans	-132.7	106.3	-177.6	0	0	0	0	0	111
372	G	64.4	Low	66.9	Low	50 Å²	50	74.9 Å²	74.9	52%	0.515	38%	0.383	S	S	.	.			trans	-60.9	-174.1	172.2	0	0	0	0	0	112.7	K374 A375	G372-K374 PolarHBondContact O-N 3.04Å; G372-A375 WeakPolarHBondContact O-CB 3.29Å; G372-A375 PolarHBondContact O-N 2.84Å
373	P	64.3	Low	67.4	Low	77 Å²	77	72.2 Å²	72.2	50%	0.5	37%	0.37	S	S	.	.	H	α-helix	trans	-54	-20.7	-172.9	-26.9	33.5	0	0	0	115.9	R377	P373-R377 PolarHBondContact O-N 3.46Å; P373-R377 PolarHBondContact O-NE 2.94Å
374	K	66.9	Low	68	Low	150 Å²	150	73.8 Å²	73.8	65%	0.652	38%	0.378	S	S	*	.	H	α-helix	trans	-74.8	-36.2	174.7	-67.2	-176.3	177.8	-177.6	0	113.1	G372 R378	G372-K374 PolarHBondContact O-N 3.04Å; K374-R378 WeakPolarHBondContact O-CG 3.47Å; K374-R378 PolarHBondContact O-N 3.44Å; K374-R378 VanDerWaalsContact O-N 3.13Å
375	A	69.9	Low	68.5	Low	45 Å²	45	76.8 Å²	76.8	37%	0.372	38%	0.384	S	S	.	.	H	α-helix	trans	-71.8	-41.7	180	0	0	0	0	0	111.2	G372 R377 R378 A379	G372-A375 WeakPolarHBondContact O-CB 3.29Å; G372-A375 PolarHBondContact O-N 2.84Å; A375-R377 PolarHBondContact O-N 3Å; A375-R378 PolarHBondContact O-N 2.89Å; A375-A379 PolarHBondContact O-N 2.83Å
376	T	73.4	Confident	69.5	Low	12 Å²	12	75.4 Å²	75.4	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-58.4	-46.7	174.1	-45.2	0	0	0	0	111.2	L363 A379 V380 F396	L363-T376 HydrophobicContact CD2-CG2 3.67Å; T376-A379 PolarHBondContact O-N 3.28Å; T376-V380 VanDerWaalsContact O-CG2 3.3Å; T376-V380 WeakPolarHBondContact O-CG2 3.35Å; T376-V380 PolarHBondContact O-N 3.5Å; T376-F396 HydrophobicContact CG2-CD2 4.29Å
377	R	75.1	Confident	70.5	Confident	78 Å²	78	71 Å²	71	29%	0.294	36%	0.364	S	S	.	.	H	α-helix	trans	-58.9	-50.9	176.2	-82.5	-173.8	-70.9	-177	-5.8	112.6	P373 A375 A379 V380 S381 E438	P373-R377 PolarHBondContact O-N 3.46Å; P373-R377 PolarHBondContact O-NE 2.94Å; A375-R377 PolarHBondContact O-N 3Å; R377-A379 VanDerWaalsContact C-N 3.31Å; R377-A379 PolarHBondContact O-N 3.14Å; R377-V380 PolarHBondContact O-N 3.46Å; R377-V380 VanDerWaalsContact O-N 3.1Å; R377-S381 PolarHBondContact O-N 3.1Å; R377-S381 PolarHBondContact O-OG 3.4Å; R377-S381 VanDerWaalsContact O-OG 3.06Å; R377-E438 WeakPolarHBondContact CD-OE2 3.26Å; R377-E438 WeakPolarHBondContact CG-OE2 3.42Å
378	R	77.4	Confident	71.7	Confident	152 Å²	152	65.3 Å²	65.3	57%	0.574	35%	0.345	S	S	*	.	H	α-helix	trans	-55.1	-47.8	178.4	-73.6	178.1	178.4	-179.6	-5.2	111.9	E319 K374 A375 V380 S381 Q382	E319-R378 WeakPolarHBondContact OE1-CD 3.42Å; E319-R378 WeakPolarHBondContact OE1-CG 3.41Å; E319-R378 IonicContact OE1-NE 3.7Å; K374-R378 WeakPolarHBondContact O-CG 3.47Å; K374-R378 PolarHBondContact O-N 3.44Å; K374-R378 VanDerWaalsContact O-N 3.13Å; A375-R378 PolarHBondContact O-N 2.89Å; R378-V380 VanDerWaalsContact C-N 3.33Å; R378-V380 PolarHBondContact O-N 2.82Å; R378-S381 PolarHBondContact O-N 2.99Å; R378-Q382 WeakPolarHBondContact O-CG 3.17Å; R378-Q382 PolarHBondContact O-N 3.49Å
379	A	78.3	Confident	73.2	Confident	10 Å²	10	64.9 Å²	64.9	8%	0.083	34%	0.341	C	S	.	.	H	α-helix	trans	-62.7	-38.1	178.8	0	0	0	0	0	112.6	L359 L363 A375 T376 R377 L383	L359-A379 HydrophobicContact CD2-CB 3.99Å; L363-A379 HydrophobicContact CD1-CB 3.74Å; L363-A379 HydrophobicContact CD2-CB 4.04Å; L363-A379 HydrophobicContact CG-CB 3.75Å; A375-A379 PolarHBondContact O-N 2.83Å; T376-A379 PolarHBondContact O-N 3.28Å; R377-A379 VanDerWaalsContact C-N 3.31Å; R377-A379 PolarHBondContact O-N 3.14Å; A379-L383 WeakPolarHBondContact O-CG 3.38Å; A379-L383 PolarHBondContact O-N 2.92Å
380	V	81.9	Confident	75	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-67	-47.2	175.3	170.8	0	0	0	0	111.6	L363 T376 R377 R378 Q382 L383 I384 A392 F396 D442 F443	L363-V380 HydrophobicContact CD1-CG2 4.33Å; L363-V380 HydrophobicContact CD2-CG2 3.81Å; T376-V380 VanDerWaalsContact O-CG2 3.3Å; T376-V380 WeakPolarHBondContact O-CG2 3.35Å; T376-V380 PolarHBondContact O-N 3.5Å; R377-V380 PolarHBondContact O-N 3.46Å; R377-V380 VanDerWaalsContact O-N 3.1Å; R378-V380 VanDerWaalsContact C-N 3.33Å; R378-V380 PolarHBondContact O-N 2.82Å; V380-Q382 VanDerWaalsContact C-N 3.27Å; V380-Q382 PolarHBondContact O-N 3.21Å; V380-L383 PolarHBondContact O-N 3.38Å; V380-L383 VanDerWaalsContact O-N 3.15Å; V380-I384 HydrophobicContact CG1-CD1 3.88Å; V380-I384 HydrophobicContact CG1-CG1 4.43Å; V380-I384 WeakPolarHBondContact O-CG1 3.49Å; V380-I384 PolarHBondContact O-N 3.15Å; V380-A392 HydrophobicContact CG1-CB 4.39Å; V380-F396 HydrophobicContact CG2-CB 3.88Å; V380-F396 HydrophobicContact CG2-CD2 3.89Å; V380-F396 HydrophobicContact CG2-CG 4.28Å; V380-D442 HydrophobicContact CG1-CB 4.39Å; V380-F443 HydrophobicContact CG1-CE2 3.85Å; V380-F443 HydrophobicContact CG1-CZ 3.69Å
381	S	83.2	Confident	76.5	Confident	42 Å²	42	54.6 Å²	54.6	29%	0.294	31%	0.305	S	S	.	.	H	α-helix	trans	-58.3	-41	177.2	-50.5	0	0	0	0	111.5	R377 R378 I384 R385	R377-S381 PolarHBondContact O-N 3.1Å; R377-S381 PolarHBondContact O-OG 3.4Å; R377-S381 VanDerWaalsContact O-OG 3.06Å; R378-S381 PolarHBondContact O-N 2.99Å; S381-I384 PolarHBondContact O-N 3.37Å; S381-R385 WeakPolarHBondContact O-CG 3.3Å; S381-R385 PolarHBondContact O-N 3.23Å
382	Q	81.9	Confident	77.9	Confident	9 Å²	9	53.6 Å²	53.6	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-66.6	-41.4	176	-62.4	-39.3	-38	0	0	112.5	F318 E319 V322 L359 R378 V380 I384 R385 L386	F318-Q382 HydrophobicContact CB-CG 4.18Å; E319-Q382 HydrophobicContact CG-CG 4.47Å; V322-Q382 VanDerWaalsContact CB-OE1 3.27Å; V322-Q382 HydrophobicContact CG2-CB 3.96Å; V322-Q382 HydrophobicContact CG2-CG 4.27Å; L359-Q382 HydrophobicContact CD1-CB 4.3Å; R378-Q382 WeakPolarHBondContact O-CG 3.17Å; R378-Q382 PolarHBondContact O-N 3.49Å; V380-Q382 VanDerWaalsContact C-N 3.27Å; V380-Q382 PolarHBondContact O-N 3.21Å; Q382-I384 VanDerWaalsContact C-N 3.29Å; Q382-I384 PolarHBondContact O-N 2.98Å; Q382-R385 PolarHBondContact O-N 3.11Å; Q382-R385 VanDerWaalsContact OE1-NH1 3.1Å; Q382-L386 VanDerWaalsContact O-CG 3.29Å; Q382-L386 WeakPolarHBondContact O-CG 3.33Å; Q382-L386 PolarHBondContact O-N 3.48Å
383	L	82.3	Confident	78.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-33.9	175.1	-76.3	175.8	0	0	0	113.3	T356 L359 L363 A379 V380 L386 Q388 A392	T356-L383 HydrophobicContact CG2-CD2 4.08Å; L359-L383 HydrophobicContact CB-CD1 4.48Å; L359-L383 HydrophobicContact CB-CD2 3.81Å; L359-L383 HydrophobicContact CB-CG 4.08Å; L359-L383 HydrophobicContact CD1-CD2 3.9Å; L359-L383 HydrophobicContact CD1-CG 4.17Å; L363-L383 HydrophobicContact CD1-CD1 3.31Å; L363-L383 HydrophobicContact CD1-CG 4.34Å; A379-L383 WeakPolarHBondContact O-CG 3.38Å; A379-L383 PolarHBondContact O-N 2.92Å; V380-L383 PolarHBondContact O-N 3.38Å; V380-L383 VanDerWaalsContact O-N 3.15Å; L383-L386 HydrophobicContact CD2-CD1 4.46Å; L383-L386 PolarHBondContact O-N 3.29Å; L383-Q388 PolarHBondContact O-N 2.98Å; L383-Q388 VanDerWaalsContact O-N 3.12Å; L383-A392 HydrophobicContact CB-CB 3.63Å; L383-A392 HydrophobicContact CD1-CB 4.09Å
384	I	83.3	Confident	79.9	Confident	35 Å²	35	52.6 Å²	52.6	18%	0.179	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-43.6	174.6	-66.3	170.1	0	0	0	110	V380 S381 Q382 L386 G387 A392 D442 F443	V380-I384 HydrophobicContact CG1-CD1 3.88Å; V380-I384 HydrophobicContact CG1-CG1 4.43Å; V380-I384 WeakPolarHBondContact O-CG1 3.49Å; V380-I384 PolarHBondContact O-N 3.15Å; S381-I384 PolarHBondContact O-N 3.37Å; Q382-I384 VanDerWaalsContact C-N 3.29Å; Q382-I384 PolarHBondContact O-N 2.98Å; I384-L386 VanDerWaalsContact C-N 3.31Å; I384-L386 PolarHBondContact O-N 2.91Å; I384-G387 PolarHBondContact O-N 3.16Å; I384-G387 VanDerWaalsContact O-N 3.08Å; I384-A392 HydrophobicContact CG1-CB 4.08Å; I384-D442 HydrophobicContact CD1-CB 4.25Å; I384-D442 VanDerWaalsContact CD1-O 3.22Å; I384-D442 WeakPolarHBondContact CD1-O 3.32Å; I384-F443 HydrophobicContact CD1-CD1 3.86Å; I384-F443 HydrophobicContact CD1-CD2 4.48Å; I384-F443 HydrophobicContact CD1-CE1 3.56Å; I384-F443 HydrophobicContact CD1-CE2 4.22Å; I384-F443 HydrophobicContact CD1-CG 4.31Å; I384-F443 HydrophobicContact CD1-CZ 3.76Å; I384-F443 HydrophobicContact CG1-CD1 4.48Å; I384-F443 HydrophobicContact CG1-CE1 3.94Å; I384-F443 HydrophobicContact CG1-CZ 4.35Å
385	R	81.1	Confident	80.7	Confident	96 Å²	96	46.4 Å²	46.4	36%	0.362	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-35	175.3	-71.3	176.5	71	-172.4	15.5	112.9	V322 D323 D326 S381 Q382 G387	V322-R385 HydrophobicContact CG1-CB 3.61Å; V322-R385 HydrophobicContact CG1-CG 4.46Å; D323-R385 IonicContact OD1-CZ 3.02Å; D323-R385 IonicContact OD1-NH1 2.78Å; D323-R385 PolarHBondContact OD1-NH1 2.86Å; D323-R385 IonicContact OD1-NH2 3.04Å; D323-R385 PolarHBondContact OD1-NH2 3.43Å; D326-R385 IonicContact OD2-CZ 3.88Å; D326-R385 VanDerWaalsContact OD2-CZ 3.26Å; D326-R385 IonicContact OD2-NE 2.7Å; D326-R385 PolarHBondContact OD2-NE 3.36Å; D326-R385 VanDerWaalsContact OD2-NE 3.15Å; D326-R385 IonicContact OD2-NH2 2.94Å; D326-R385 PolarHBondContact OD2-NH2 3.41Å; S381-R385 WeakPolarHBondContact O-CG 3.3Å; S381-R385 PolarHBondContact O-N 3.23Å; Q382-R385 PolarHBondContact O-N 3.11Å; Q382-R385 VanDerWaalsContact OE1-NH1 3.1Å; R385-G387 PolarHBondContact O-N 3.07Å; R385-G387 VanDerWaalsContact O-N 3.08Å
386	L	80.5	Confident	81.5	Confident	30 Å²	30	44.2 Å²	44.2	16%	0.157	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	4.5	173.4	-66.6	171.3	0	0	0	114.1	V322 L325 V352 L355 L359 Q382 L383 I384 Q388	V322-L386 HydrophobicContact CG2-CD1 4.26Å; V322-L386 HydrophobicContact CG2-CD2 3.9Å; V322-L386 HydrophobicContact CG2-CG 3.96Å; L325-L386 HydrophobicContact CD1-CD2 3.51Å; V352-L386 HydrophobicContact CG1-CD2 4.34Å; L355-L386 HydrophobicContact CD2-CD1 3.9Å; L355-L386 HydrophobicContact CD2-CD2 4.05Å; L355-L386 HydrophobicContact CG-CD1 4.14Å; L359-L386 HydrophobicContact CD1-CD1 3.62Å; Q382-L386 VanDerWaalsContact O-CG 3.29Å; Q382-L386 WeakPolarHBondContact O-CG 3.33Å; Q382-L386 PolarHBondContact O-N 3.48Å; L383-L386 HydrophobicContact CD2-CD1 4.46Å; L383-L386 PolarHBondContact O-N 3.29Å; I384-L386 VanDerWaalsContact C-N 3.31Å; I384-L386 PolarHBondContact O-N 2.91Å; L386-Q388 PolarHBondContact O-N 3.2Å
387	G	78.3	Confident	82.2	Confident	58 Å²	58	44.1 Å²	44.1	60%	0.598	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	16.7	177	0	0	0	0	0	114.4	I384 R385 P389	I384-G387 PolarHBondContact O-N 3.16Å; I384-G387 VanDerWaalsContact O-N 3.08Å; R385-G387 PolarHBondContact O-N 3.07Å; R385-G387 VanDerWaalsContact O-N 3.08Å; G387-P389 WeakPolarHBondContact O-CD 3.34Å
388	Q	81.6	Confident	82.7	Confident	67 Å²	67	45.5 Å²	45.5	31%	0.313	23%	0.234	S	C	.	.			trans	-113.8	57.5	177	-60.5	-157.6	-4.3	0	0	113.6	L383 L386 T390 K391 A392	L383-Q388 PolarHBondContact O-N 2.98Å; L383-Q388 VanDerWaalsContact O-N 3.12Å; L386-Q388 PolarHBondContact O-N 3.2Å; Q388-T390 PolarHBondContact O-N 2.92Å; Q388-K391 HydrophobicContact CB-CB 4.33Å; Q388-K391 PolarHBondContact O-N 3.49Å; Q388-K391 VanDerWaalsContact OE1-CD 3.28Å; Q388-A392 WeakPolarHBondContact O-CB 3.47Å; Q388-A392 PolarHBondContact O-N 3.43Å
389	P	82.6	Confident	83.1	Confident	27 Å²	27	39 Å²	39	18%	0.175	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-33.5	-174.6	28.7	-36	0	0	0	113.6	G387 A392 C393 N446	G387-P389 WeakPolarHBondContact O-CD 3.34Å; P389-A392 PolarHBondContact O-N 2.92Å; P389-C393 VanDerWaalsContact O-CB 3.24Å; P389-C393 WeakPolarHBondContact O-CB 3.33Å; P389-C393 PolarHBondContact O-N 2.68Å; P389-N446 WeakPolarHBondContact CB-ND2 3.47Å
390	T	83.7	Confident	83.4	Confident	108 Å²	108	39.4 Å²	39.4	66%	0.663	21%	0.209	S	C	*	.	H	α-helix	trans	-64.8	-45.3	177.2	26.7	0	0	0	0	112.1	Q388 C393 E394	Q388-T390 PolarHBondContact O-N 2.92Å; T390-C393 WeakPolarHBondContact O-CB 3.49Å; T390-C393 PolarHBondContact O-N 2.98Å; T390-E394 PolarHBondContact O-N 3.5Å
391	K	81.5	Confident	83.6	Confident	80 Å²	80	40.5 Å²	40.5	35%	0.348	22%	0.218	S	C	.	.	H	α-helix	trans	-68.1	-40.4	177.7	-163.2	179.1	-172.8	-178.1	0	111.5	V360 Q388 E394 L395	V360-K391 HydrophobicContact CG2-CD 4.09Å; Q388-K391 HydrophobicContact CB-CB 4.33Å; Q388-K391 PolarHBondContact O-N 3.49Å; Q388-K391 VanDerWaalsContact OE1-CD 3.28Å; K391-E394 PolarHBondContact O-N 3.05Å; K391-L395 HydrophobicContact CG-CD1 4.21Å; K391-L395 WeakPolarHBondContact O-CG 3.24Å; K391-L395 PolarHBondContact O-N 3.46Å; K391-L395 VanDerWaalsContact O-N 3.09Å
392	A	84.8	Confident	83.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-46.4	173.8	0	0	0	0	0	111.6	V380 L383 I384 Q388 P389 L395 F396 F443	V380-A392 HydrophobicContact CG1-CB 4.39Å; L383-A392 HydrophobicContact CB-CB 3.63Å; L383-A392 HydrophobicContact CD1-CB 4.09Å; I384-A392 HydrophobicContact CG1-CB 4.08Å; Q388-A392 WeakPolarHBondContact O-CB 3.47Å; Q388-A392 PolarHBondContact O-N 3.43Å; P389-A392 PolarHBondContact O-N 2.92Å; A392-L395 PolarHBondContact O-N 3.33Å; A392-F396 VanDerWaalsContact O-CB 3.24Å; A392-F396 WeakPolarHBondContact O-CB 3.32Å; A392-F396 PolarHBondContact O-N 2.85Å; A392-F443 HydrophobicContact CB-CE1 4.46Å; A392-F443 HydrophobicContact CB-CZ 4.36Å
393	C	85.6	Confident	83.8	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.02	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-48.5	177.2	179.1	0	0	0	0	111.8	P389 T390 L395 F396 L397 F443 C449	P389-C393 VanDerWaalsContact O-CB 3.24Å; P389-C393 WeakPolarHBondContact O-CB 3.33Å; P389-C393 PolarHBondContact O-N 2.68Å; T390-C393 WeakPolarHBondContact O-CB 3.49Å; T390-C393 PolarHBondContact O-N 2.98Å; C393-L395 PolarHBondContact O-N 3.48Å; C393-F396 PolarHBondContact O-N 3.49Å; C393-L397 WeakPolarHBondContact O-CB 3.28Å; C393-L397 VanDerWaalsContact O-CG 3.23Å; C393-L397 WeakPolarHBondContact O-CG 3.3Å; C393-L397 PolarHBondContact O-N 2.92Å; C393-F443 HydrophobicContact CB-CE1 3.76Å; C393-F443 HydrophobicContact CB-CZ 3.9Å; C393-C449 HydrophobicContact CB-CB 4.21Å
394	E	85.5	Confident	83.9	Confident	103 Å²	103	41.9 Å²	41.9	48%	0.481	23%	0.233	S	C	.	.	H	α-helix	trans	-60.6	-45.6	-179.7	-170.9	-173.4	165.6	0	0	111.8	T390 K391 L397 K398	T390-E394 PolarHBondContact O-N 3.5Å; K391-E394 PolarHBondContact O-N 3.05Å; E394-L397 PolarHBondContact O-N 2.97Å; E394-K398 HydrophobicContact CG-CD 4.4Å; E394-K398 WeakPolarHBondContact O-CB 3.41Å; E394-K398 WeakPolarHBondContact O-CG 3.35Å; E394-K398 PolarHBondContact O-N 3.17Å; E394-K398 WeakPolarHBondContact OE1-CE 3.38Å; E394-K398 IonicContact OE1-NZ 2.67Å; E394-K398 PolarHBondContact OE1-NZ 2.58Å
395	L	83.7	Confident	84	Confident	19 Å²	19	43.8 Å²	43.8	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-69.1	-40.4	-179.7	-69.7	168.8	0	0	0	112.4	V360 L363 K391 A392 C393 L397 K398 N399	V360-L395 HydrophobicContact CB-CD1 3.94Å; V360-L395 HydrophobicContact CG1-CD1 3.71Å; V360-L395 HydrophobicContact CG1-CD2 4.34Å; V360-L395 HydrophobicContact CG2-CD1 3.62Å; L363-L395 HydrophobicContact CB-CB 4.33Å; K391-L395 HydrophobicContact CG-CD1 4.21Å; K391-L395 WeakPolarHBondContact O-CG 3.24Å; K391-L395 PolarHBondContact O-N 3.46Å; K391-L395 VanDerWaalsContact O-N 3.09Å; A392-L395 PolarHBondContact O-N 3.33Å; C393-L395 PolarHBondContact O-N 3.48Å; L395-L397 PolarHBondContact O-N 3.45Å; L395-K398 PolarHBondContact O-N 2.76Å; L395-N399 WeakPolarHBondContact O-CB 3.31Å; L395-N399 PolarHBondContact O-N 3.45Å
396	F	86.1	Confident	84.1	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57	-50.1	173.7	175.3	-104.4	0	0	0	111.1	T376 V380 A392 C393 K398 N399 R400 T435 E438 F439	T376-F396 HydrophobicContact CG2-CD2 4.29Å; V380-F396 HydrophobicContact CG2-CB 3.88Å; V380-F396 HydrophobicContact CG2-CD2 3.89Å; V380-F396 HydrophobicContact CG2-CG 4.28Å; A392-F396 VanDerWaalsContact O-CB 3.24Å; A392-F396 WeakPolarHBondContact O-CB 3.32Å; A392-F396 PolarHBondContact O-N 2.85Å; C393-F396 PolarHBondContact O-N 3.49Å; F396-K398 PolarHBondContact O-N 2.89Å; F396-N399 PolarHBondContact O-N 3.48Å; F396-R400 HydrophobicContact CD1-CG 4.43Å; F396-R400 HydrophobicContact CD2-CG 4.33Å; F396-R400 HydrophobicContact CE1-CG 4.12Å; F396-R400 HydrophobicContact CE2-CG 4.04Å; F396-R400 HydrophobicContact CZ-CG 3.93Å; F396-R400 WeakPolarHBondContact O-CB 3.3Å; F396-R400 VanDerWaalsContact O-CG 3.27Å; F396-R400 WeakPolarHBondContact O-CG 3.25Å; F396-R400 PolarHBondContact O-N 3.4Å; F396-T435 HydrophobicContact CE1-CG2 3.81Å; F396-T435 HydrophobicContact CZ-CG2 4.05Å; F396-E438 HydrophobicContact CZ-CB 4.16Å; F396-F439 HydrophobicContact CD1-CD2 4.14Å; F396-F439 HydrophobicContact CE1-CB 4.37Å; F396-F439 HydrophobicContact CE1-CD2 4.03Å
397	L	87.9	Confident	84.3	Confident	9 Å²	9	42.4 Å²	42.4	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-66.1	-37.9	-179.8	-65.7	174.6	0	0	0	112	C393 E394 L395 R400 A401 F439 A452 F453 W456	C393-L397 WeakPolarHBondContact O-CB 3.28Å; C393-L397 VanDerWaalsContact O-CG 3.23Å; C393-L397 WeakPolarHBondContact O-CG 3.3Å; C393-L397 PolarHBondContact O-N 2.92Å; E394-L397 PolarHBondContact O-N 2.97Å; L395-L397 PolarHBondContact O-N 3.45Å; L397-R400 PolarHBondContact O-N 3.18Å; L397-A401 WeakPolarHBondContact O-CB 3.18Å; L397-A401 PolarHBondContact O-N 2.92Å; L397-F439 HydrophobicContact CD2-CD2 4.48Å; L397-A452 HydrophobicContact CD1-CB 4.11Å; L397-F453 HydrophobicContact CD2-CD2 3.93Å; L397-W456 HydrophobicContact CB-CB 4.3Å; L397-W456 HydrophobicContact CB-CG 3.96Å; L397-W456 HydrophobicContact CD1-CB 3.95Å; L397-W456 HydrophobicContact CD1-CG 4.41Å; L397-W456 HydrophobicContact CD2-CB 4.06Å; L397-W456 HydrophobicContact CD2-CD2 3.79Å; L397-W456 HydrophobicContact CD2-CE3 4.01Å; L397-W456 HydrophobicContact CD2-CG 3.8Å; L397-W456 HydrophobicContact CG-CB 4.32Å; L397-W456 HydrophobicContact CG-CG 4.25Å; L397-W456 PolarHBondContact O-NE1 3.01Å
398	K	85.8	Confident	84.5	Confident	108 Å²	108	40.6 Å²	40.6	47%	0.47	23%	0.225	S	C	.	.	H	α-helix	trans	-63.2	-45.1	173.8	-79	-179.7	-175.9	172	0	112.1	E394 L395 F396 A401 A402	E394-K398 HydrophobicContact CG-CD 4.4Å; E394-K398 WeakPolarHBondContact O-CB 3.41Å; E394-K398 WeakPolarHBondContact O-CG 3.35Å; E394-K398 PolarHBondContact O-N 3.17Å; E394-K398 WeakPolarHBondContact OE1-CE 3.38Å; E394-K398 IonicContact OE1-NZ 2.67Å; E394-K398 PolarHBondContact OE1-NZ 2.58Å; L395-K398 PolarHBondContact O-N 2.76Å; F396-K398 PolarHBondContact O-N 2.89Å; K398-A401 PolarHBondContact O-N 3.48Å; K398-A402 PolarHBondContact O-N 3.3Å
399	N	85.4	Confident	84.5	Confident	15 Å²	15	46.3 Å²	46.3	8%	0.08	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-45.9	177	-169.2	-20.5	0	0	0	110.6	L363 L395 F396 A401 A402 A403	L363-N399 PolarHBondContact O-ND2 2.96Å; L395-N399 WeakPolarHBondContact O-CB 3.31Å; L395-N399 PolarHBondContact O-N 3.45Å; F396-N399 PolarHBondContact O-N 3.48Å; N399-A401 PolarHBondContact O-N 3.35Å; N399-A402 PolarHBondContact O-N 2.74Å; N399-A403 PolarHBondContact O-N 3.32Å
400	R	85.2	Confident	84.5	Confident	18 Å²	18	52 Å²	52	7%	0.068	27%	0.267	C	S	.	.	H	α-helix	trans	-62.3	-39.1	176	-69.7	-72.7	178.1	170.2	-9.5	112.9	F396 L397 A403 V404 T435 E438 W456	F396-R400 HydrophobicContact CD1-CG 4.43Å; F396-R400 HydrophobicContact CD2-CG 4.33Å; F396-R400 HydrophobicContact CE1-CG 4.12Å; F396-R400 HydrophobicContact CE2-CG 4.04Å; F396-R400 HydrophobicContact CZ-CG 3.93Å; F396-R400 WeakPolarHBondContact O-CB 3.3Å; F396-R400 VanDerWaalsContact O-CG 3.27Å; F396-R400 WeakPolarHBondContact O-CG 3.25Å; F396-R400 PolarHBondContact O-N 3.4Å; L397-R400 PolarHBondContact O-N 3.18Å; R400-A403 PolarHBondContact O-N 3.29Å; R400-V404 VanDerWaalsContact O-CG2 3.31Å; R400-V404 WeakPolarHBondContact O-CG2 3.4Å; R400-V404 PolarHBondContact O-N 3.28Å; R400-T435 HydrophobicContact CB-CG2 4.1Å; R400-T435 HydrophobicContact CG-CG2 3.81Å; R400-E438 IonicContact CZ-OE1 3.99Å; R400-E438 IonicContact CZ-OE2 3.83Å; R400-E438 IonicContact NE-OE2 2.85Å; R400-E438 IonicContact NH1-OE1 3.15Å; R400-E438 IonicContact NH2-OE1 2.93Å; R400-E438 PolarHBondContact NH2-OE1 2.93Å; R400-E438 IonicContact NH2-OE2 3.65Å; R400-E438 PolarHBondContact NH2-OE2 3.48Å; R400-W456 HydrophobicContact CB-CZ2 3.89Å
401	A	86.3	Confident	84.4	Confident	23 Å²	23	48.1 Å²	48.1	19%	0.19	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-46.1	173.4	0	0	0	0	0	111.6	L397 K398 N399 V404 Q405 M463	L397-A401 WeakPolarHBondContact O-CB 3.18Å; L397-A401 PolarHBondContact O-N 2.92Å; K398-A401 PolarHBondContact O-N 3.48Å; N399-A401 PolarHBondContact O-N 3.35Å; A401-V404 PolarHBondContact O-N 3.47Å; A401-Q405 WeakPolarHBondContact O-CB 3.23Å; A401-Q405 PolarHBondContact O-N 2.85Å; A401-M463 HydrophobicContact CB-CE 4.43Å
402	A	85.1	Confident	83.9	Confident	26 Å²	26	53.4 Å²	53.4	22%	0.215	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-39.2	177.4	0	0	0	0	0	112.1	P365 K398 N399 Q405 T406	P365-A402 HydrophobicContact CB-CB 3.72Å; K398-A402 PolarHBondContact O-N 3.3Å; N399-A402 PolarHBondContact O-N 2.74Å; A402-Q405 PolarHBondContact O-N 3.29Å; A402-T406 WeakPolarHBondContact O-CB 3.35Å; A402-T406 PolarHBondContact O-N 2.88Å; A402-T406 PolarHBondContact O-OG1 3.4Å
403	A	84.1	Confident	83.2	Confident	49 Å²	49	58.5 Å²	58.5	41%	0.405	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-48	175.9	0	0	0	0	0	111.9	N399 R400 Q405 T406 A407	N399-A403 PolarHBondContact O-N 3.32Å; R400-A403 PolarHBondContact O-N 3.29Å; A403-Q405 PolarHBondContact O-N 3.42Å; A403-T406 PolarHBondContact O-N 2.69Å; A403-A407 WeakPolarHBondContact O-CB 3.46Å; A403-A407 PolarHBondContact O-N 3.43Å
404	V	84.3	Confident	82.2	Confident	5 Å²	5	63.5 Å²	63.5	3%	0.03	31%	0.31	C	S	.	.	H	α-helix	trans	-60.6	-45.7	175.5	171.3	0	0	0	0	110.7	R400 A401 T406 A407 I408 F428 S431	R400-V404 VanDerWaalsContact O-CG2 3.31Å; R400-V404 WeakPolarHBondContact O-CG2 3.4Å; R400-V404 PolarHBondContact O-N 3.28Å; A401-V404 PolarHBondContact O-N 3.47Å; V404-T406 VanDerWaalsContact C-N 3.31Å; V404-T406 PolarHBondContact O-N 3.07Å; V404-A407 PolarHBondContact O-N 2.92Å; V404-I408 HydrophobicContact CG1-CD1 3.81Å; V404-I408 HydrophobicContact CG1-CG1 4.45Å; V404-I408 WeakPolarHBondContact O-CG1 3.35Å; V404-I408 PolarHBondContact O-N 3.31Å; V404-F428 HydrophobicContact CG1-CD2 3.79Å; V404-F428 HydrophobicContact CG1-CE2 4.09Å; V404-S431 WeakPolarHBondContact CG2-OG 3.13Å
405	Q	84.5	Confident	81.4	Confident	76 Å²	76	61.8 Å²	61.8	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-61.6	-40.7	178.6	-171.3	179	28	0	0	111.9	A401 A402 A403 R409	A401-Q405 WeakPolarHBondContact O-CB 3.23Å; A401-Q405 PolarHBondContact O-N 2.85Å; A402-Q405 PolarHBondContact O-N 3.29Å; A403-Q405 PolarHBondContact O-N 3.42Å; Q405-R409 VanDerWaalsContact NE2-NH2 3.14Å; Q405-R409 WeakPolarHBondContact O-CB 3.3Å; Q405-R409 VanDerWaalsContact O-CG 3.3Å; Q405-R409 WeakPolarHBondContact O-CG 3.42Å; Q405-R409 PolarHBondContact O-N 2.95Å
406	T	84.2	Confident	81.1	Confident	66 Å²	66	63.9 Å²	63.9	41%	0.405	34%	0.34	S	S	.	.	H	α-helix	trans	-67.5	-42.3	177.2	-56.5	0	0	0	0	111.1	A402 A403 V404 I408 R409 Q410	A402-T406 WeakPolarHBondContact O-CB 3.35Å; A402-T406 PolarHBondContact O-N 2.88Å; A402-T406 PolarHBondContact O-OG1 3.4Å; A403-T406 PolarHBondContact O-N 2.69Å; V404-T406 VanDerWaalsContact C-N 3.31Å; V404-T406 PolarHBondContact O-N 3.07Å; T406-I408 PolarHBondContact O-N 3Å; T406-R409 PolarHBondContact O-N 3.25Å; T406-Q410 HydrophobicContact CG2-CG 4.36Å; T406-Q410 WeakPolarHBondContact O-CB 3.45Å; T406-Q410 VanDerWaalsContact O-CG 3.3Å; T406-Q410 WeakPolarHBondContact O-CG 3.49Å; T406-Q410 PolarHBondContact O-N 2.92Å
407	A	83.4	Confident	80.7	Confident	30 Å²	30	64.9 Å²	64.9	25%	0.248	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-42.2	176.6	0	0	0	0	0	112.2	A403 V404 Q410 L411 I427	A403-A407 WeakPolarHBondContact O-CB 3.46Å; A403-A407 PolarHBondContact O-N 3.43Å; V404-A407 PolarHBondContact O-N 2.92Å; A407-Q410 PolarHBondContact O-N 2.88Å; A407-L411 PolarHBondContact O-N 3.27Å; A407-I427 HydrophobicContact CB-CG2 3.93Å
408	I	83.4	Confident	80.5	Confident	21 Å²	21	67.6 Å²	67.6	11%	0.108	36%	0.36	C	S	.	.	H	α-helix	trans	-64.1	-43.2	175	-67.4	169.5	0	0	0	110.8	V404 T406 Q410 L411 L424 F428 A467	V404-I408 HydrophobicContact CG1-CD1 3.81Å; V404-I408 HydrophobicContact CG1-CG1 4.45Å; V404-I408 WeakPolarHBondContact O-CG1 3.35Å; V404-I408 PolarHBondContact O-N 3.31Å; T406-I408 PolarHBondContact O-N 3Å; I408-Q410 PolarHBondContact O-N 2.93Å; I408-L411 VanDerWaalsContact O-CB 3.28Å; I408-L411 WeakPolarHBondContact O-CB 3.48Å; I408-L411 PolarHBondContact O-N 3.15Å; I408-L424 HydrophobicContact CB-CD1 4.45Å; I408-L424 HydrophobicContact CG1-CD1 4.06Å; I408-L424 HydrophobicContact CG2-CD1 3.91Å; I408-F428 HydrophobicContact CD1-CD2 4.29Å; I408-A467 HydrophobicContact CG2-CB 4.02Å
409	R	82.6	Confident	80.4	Confident	186 Å²	186	67.4 Å²	67.4	70%	0.702	36%	0.364	S	S	*	.	H	α-helix	trans	-67.4	-33.3	179.1	-76.2	175.8	178.8	-179.4	0.1	113.6	Q405 T406 L411	Q405-R409 VanDerWaalsContact NE2-NH2 3.14Å; Q405-R409 WeakPolarHBondContact O-CB 3.3Å; Q405-R409 VanDerWaalsContact O-CG 3.3Å; Q405-R409 WeakPolarHBondContact O-CG 3.42Å; Q405-R409 PolarHBondContact O-N 2.95Å; T406-R409 PolarHBondContact O-N 3.25Å; R409-L411 PolarHBondContact O-N 2.97Å
410	Q	82.4	Confident	80.4	Confident	146 Å²	146	67.6 Å²	67.6	68%	0.682	36%	0.364	S	S	*	.	H	α-helix	trans	-73.7	-15.2	177.3	-74.5	178.4	-0.7	0	0	112.7	T406 A407 I408 R412	T406-Q410 HydrophobicContact CG2-CG 4.36Å; T406-Q410 WeakPolarHBondContact O-CB 3.45Å; T406-Q410 VanDerWaalsContact O-CG 3.3Å; T406-Q410 WeakPolarHBondContact O-CG 3.49Å; T406-Q410 PolarHBondContact O-N 2.92Å; A407-Q410 PolarHBondContact O-N 2.88Å; I408-Q410 PolarHBondContact O-N 2.93Å; Q410-R412 PolarHBondContact O-N 3.41Å; Q410-R412 VanDerWaalsContact O-N 3.07Å
411	L	80.1	Confident	80.5	Confident	27 Å²	27	66.7 Å²	66.7	14%	0.141	36%	0.36	C	S	.	.			trans	-68.3	107.1	177.6	-168.2	67.7	0	0	0	110	A407 I408 R409 Y420 K423 L424 I427	A407-L411 PolarHBondContact O-N 3.27Å; I408-L411 VanDerWaalsContact O-CB 3.28Å; I408-L411 WeakPolarHBondContact O-CB 3.48Å; I408-L411 PolarHBondContact O-N 3.15Å; R409-L411 PolarHBondContact O-N 2.97Å; L411-Y420 HydrophobicContact CB-CE2 4.26Å; L411-Y420 HydrophobicContact CD2-CD2 3.8Å; L411-Y420 HydrophobicContact CD2-CE1 4.49Å; L411-Y420 HydrophobicContact CD2-CE2 3.33Å; L411-Y420 HydrophobicContact CG-CD2 4.03Å; L411-Y420 HydrophobicContact CG-CE2 3.56Å; L411-K423 HydrophobicContact CD1-CB 4.08Å; L411-K423 HydrophobicContact CD2-CB 4.47Å; L411-L424 HydrophobicContact CD2-CB 3.79Å; L411-L424 HydrophobicContact CD2-CD1 3.96Å; L411-L424 HydrophobicContact CD2-CG 4.49Å; L411-I427 HydrophobicContact CD1-CD1 3.58Å; L411-I427 HydrophobicContact CD2-CD1 4.48Å
412	R	71.6	Confident	80.6	Confident	191 Å²	191	69.4 Å²	69.4	72%	0.721	37%	0.369	S	S	*	.			trans	-70	136.4	173	-69.4	-175.8	166.9	-173	-3.1	110.5	Q410 E414	Q410-R412 PolarHBondContact O-N 3.41Å; Q410-R412 VanDerWaalsContact O-N 3.07Å; R412-E414 VanDerWaalsContact C-N 3.33Å; R412-E414 HydrophobicContact CB-CG 3.9Å; R412-E414 WeakPolarHBondContact CD-OE1 3.46Å; R412-E414 IonicContact NH1-OE1 3.42Å; R412-E414 PolarHBondContact O-N 3.43Å
413	I	71.1	Confident	80.7	Confident	108 Å²	108	73.1 Å²	73.1	55%	0.554	38%	0.38	S	S	*	.			trans	-73.7	92.4	169.3	-54.6	167.7	0	0	0	106.7	Y420	I413-Y420 HydrophobicContact CB-CD2 4.43Å; I413-Y420 HydrophobicContact CB-CE2 4.47Å; I413-Y420 HydrophobicContact CG1-CD2 4.23Å; I413-Y420 HydrophobicContact CG1-CE2 3.81Å
414	E	63.2	Low	80.9	Confident	107 Å²	107	70.8 Å²	70.8	50%	0.5	36%	0.361	S	S	.	.			trans	-123	115.6	178.6	-73.3	178.3	-173.7	0	0	109.7	R412	R412-E414 VanDerWaalsContact C-N 3.33Å; R412-E414 HydrophobicContact CB-CG 3.9Å; R412-E414 WeakPolarHBondContact CD-OE1 3.46Å; R412-E414 IonicContact NH1-OE1 3.42Å; R412-E414 PolarHBondContact O-N 3.43Å
415	G	68.8	Low	81.2	Confident	68 Å²	68	70.5 Å²	70.5	70%	0.701	36%	0.359	S	S	*	.	S	Bend	trans	93.7	-156.4	173.6	0	0	0	0	0	114.6
416	A	77	Confident	81.4	Confident	63 Å²	63	70.9 Å²	70.9	52%	0.521	36%	0.364	S	S	.	.			trans	-66.9	143	179	0	0	0	0	0	111.4	L418 L419 Y420	A416-L418 PolarHBondContact O-N 3.33Å; A416-L419 HydrophobicContact CB-CD1 4.33Å; A416-L419 WeakPolarHBondContact O-CB 3.42Å; A416-L419 PolarHBondContact O-N 3.06Å; A416-Y420 PolarHBondContact O-N 2.57Å
417	T	79.2	Confident	81.6	Confident	21 Å²	21	70.4 Å²	70.4	13%	0.129	36%	0.358	C	S	.	.	H	α-helix	trans	-57.5	-35.5	-175.4	-58.1	0	0	0	0	113.9	L419 Y420 I421 Q471 E477	T417-L419 VanDerWaalsContact C-N 3.3Å; T417-L419 PolarHBondContact O-N 3.38Å; T417-Y420 PolarHBondContact O-N 3.3Å; T417-I421 HydrophobicContact CG2-CD1 3.48Å; T417-I421 VanDerWaalsContact CG2-CD1 3.48Å; T417-I421 HydrophobicContact CG2-CG1 4.35Å; T417-I421 WeakPolarHBondContact O-CB 3.32Å; T417-I421 WeakPolarHBondContact O-CD1 3.22Å; T417-I421 WeakPolarHBondContact O-CG1 3.18Å; T417-I421 PolarHBondContact O-N 2.96Å; T417-Q471 HydrophobicContact CG2-CG 3.94Å; T417-E477 VanDerWaalsContact CB-CD 3.44Å; T417-E477 WeakPolarHBondContact CB-OE1 3.4Å; T417-E477 WeakPolarHBondContact CB-OE2 3.31Å; T417-E477 WeakPolarHBondContact CG2-OE1 3.34Å; T417-E477 WeakPolarHBondContact CG2-OE2 3.22Å; T417-E477 VanDerWaalsContact OG1-CD 3.26Å; T417-E477 PolarHBondContact OG1-OE1 3.29Å; T417-E477 PolarHBondContact OG1-OE2 3.37Å
418	L	82.8	Confident	82	Confident	66 Å²	66	69 Å²	69	35%	0.346	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-38.7	174.6	-171.7	68.1	0	0	0	112.7	A416 I421 H422 E484 V488	A416-L418 PolarHBondContact O-N 3.33Å; L418-I421 PolarHBondContact O-N 3.09Å; L418-H422 PolarHBondContact O-N 3.12Å; L418-H422 PolarHBondContact O-ND1 3.15Å; L418-E484 HydrophobicContact CD1-CB 4.12Å; L418-V488 HydrophobicContact CD1-CG2 4.46Å
419	L	83.9	Confident	82.3	Confident	104 Å²	104	68.4 Å²	68.4	55%	0.545	34%	0.343	S	S	.	.	H	α-helix	trans	-71	-40.3	178.7	-67.3	171.2	0	0	0	111.3	A416 T417 I421 K423	A416-L419 HydrophobicContact CB-CD1 4.33Å; A416-L419 WeakPolarHBondContact O-CB 3.42Å; A416-L419 PolarHBondContact O-N 3.06Å; T417-L419 VanDerWaalsContact C-N 3.3Å; T417-L419 PolarHBondContact O-N 3.38Å; L419-I421 VanDerWaalsContact C-N 3.31Å; L419-K423 WeakPolarHBondContact O-CG 3.3Å; L419-K423 PolarHBondContact O-N 3.33Å; L419-K423 VanDerWaalsContact O-N 3.15Å
420	Y	86.1	Confident	82.6	Confident	18 Å²	18	62.3 Å²	62.3	7%	0.071	33%	0.326	C	S	.	.	H	α-helix	trans	-60.2	-44.2	173.4	172.5	-95.1	0	0	0	110.9	L411 I413 A416 T417 K423 L424 Q471	L411-Y420 HydrophobicContact CB-CE2 4.26Å; L411-Y420 HydrophobicContact CD2-CD2 3.8Å; L411-Y420 HydrophobicContact CD2-CE1 4.49Å; L411-Y420 HydrophobicContact CD2-CE2 3.33Å; L411-Y420 HydrophobicContact CG-CD2 4.03Å; L411-Y420 HydrophobicContact CG-CE2 3.56Å; I413-Y420 HydrophobicContact CB-CD2 4.43Å; I413-Y420 HydrophobicContact CB-CE2 4.47Å; I413-Y420 HydrophobicContact CG1-CD2 4.23Å; I413-Y420 HydrophobicContact CG1-CE2 3.81Å; A416-Y420 PolarHBondContact O-N 2.57Å; T417-Y420 PolarHBondContact O-N 3.3Å; Y420-K423 WeakPolarHBondContact O-CB 3.23Å; Y420-K423 PolarHBondContact O-N 3.35Å; Y420-L424 HydrophobicContact CE1-CB 4.46Å; Y420-L424 HydrophobicContact CE1-CD2 4.15Å; Y420-L424 WeakPolarHBondContact O-CB 3.44Å; Y420-L424 PolarHBondContact O-N 3.33Å; Y420-Q471 HydrophobicContact CD1-CB 4.45Å; Y420-Q471 HydrophobicContact CD1-CG 3.69Å; Y420-Q471 HydrophobicContact CE1-CB 4.08Å; Y420-Q471 HydrophobicContact CE1-CG 3.74Å
421	I	87.1	Confident	82.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-69	-38	-178.5	-74.1	160.5	0	0	0	112.5	T417 L418 L419 K423 L424 C425 F468 V472 C485	T417-I421 HydrophobicContact CG2-CD1 3.48Å; T417-I421 VanDerWaalsContact CG2-CD1 3.48Å; T417-I421 HydrophobicContact CG2-CG1 4.35Å; T417-I421 WeakPolarHBondContact O-CB 3.32Å; T417-I421 WeakPolarHBondContact O-CD1 3.22Å; T417-I421 WeakPolarHBondContact O-CG1 3.18Å; T417-I421 PolarHBondContact O-N 2.96Å; L418-I421 PolarHBondContact O-N 3.09Å; L419-I421 VanDerWaalsContact C-N 3.31Å; I421-K423 VanDerWaalsContact C-N 3.3Å; I421-K423 PolarHBondContact O-N 3.32Å; I421-L424 PolarHBondContact O-N 2.86Å; I421-C425 WeakPolarHBondContact O-CB 3.28Å; I421-C425 PolarHBondContact O-N 3.47Å; I421-C425 PolarHBondContact O-SG 2.83Å; I421-F468 HydrophobicContact CD1-CE2 4.34Å; I421-F468 HydrophobicContact CG1-CD2 4.43Å; I421-F468 HydrophobicContact CG1-CE2 4.42Å; I421-F468 HydrophobicContact CG2-CD2 4.13Å; I421-F468 HydrophobicContact CG2-CE2 3.67Å; I421-V472 HydrophobicContact CD1-CG2 3.14Å; I421-V472 HydrophobicContact CG1-CG2 4.21Å; I421-C485 HydrophobicContact CD1-CB 3.68Å; I421-C485 WeakPolarHBondContact CD1-SG 3.36Å; I421-C485 HydrophobicContact CG2-CB 4.12Å
422	H	88.2	Confident	83.2	Confident	80 Å²	80	55.1 Å²	55.1	37%	0.37	29%	0.294	S	S	.	.	H	α-helix	trans	-58.6	-44.4	170.8	-83.9	81.5	0	0	0	111.3	L418 N426 V488	L418-H422 PolarHBondContact O-N 3.12Å; L418-H422 PolarHBondContact O-ND1 3.15Å; H422-N426 VanDerWaalsContact O-CB 3.22Å; H422-N426 WeakPolarHBondContact O-CB 3.18Å; H422-N426 PolarHBondContact O-N 3.36Å; H422-V488 WeakPolarHBondContact CE1-CG2 3.24Å
423	K	86.8	Confident	84	Confident	103 Å²	103	48.3 Å²	48.3	45%	0.448	27%	0.272	S	S	.	.	H	α-helix	trans	-64.7	-43.8	176.4	-68.6	174.7	-179.5	177.6	0	111.6	L411 L419 Y420 I421 N426 I427	L411-K423 HydrophobicContact CD1-CB 4.08Å; L411-K423 HydrophobicContact CD2-CB 4.47Å; L419-K423 WeakPolarHBondContact O-CG 3.3Å; L419-K423 PolarHBondContact O-N 3.33Å; L419-K423 VanDerWaalsContact O-N 3.15Å; Y420-K423 WeakPolarHBondContact O-CB 3.23Å; Y420-K423 PolarHBondContact O-N 3.35Å; I421-K423 VanDerWaalsContact C-N 3.3Å; I421-K423 PolarHBondContact O-N 3.32Å; K423-N426 PolarHBondContact O-N 3.28Å; K423-I427 WeakPolarHBondContact O-CB 3.36Å; K423-I427 WeakPolarHBondContact O-CD1 3.28Å; K423-I427 VanDerWaalsContact O-CG1 3.24Å; K423-I427 WeakPolarHBondContact O-CG1 3.27Å; K423-I427 PolarHBondContact O-N 3.22Å
424	L	88.9	Confident	84.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-49.1	178.4	-178.1	68	0	0	0	111.4	I408 L411 Y420 I421 I427 F428 F464 F468	I408-L424 HydrophobicContact CB-CD1 4.45Å; I408-L424 HydrophobicContact CG1-CD1 4.06Å; I408-L424 HydrophobicContact CG2-CD1 3.91Å; L411-L424 HydrophobicContact CD2-CB 3.79Å; L411-L424 HydrophobicContact CD2-CD1 3.96Å; L411-L424 HydrophobicContact CD2-CG 4.49Å; Y420-L424 HydrophobicContact CE1-CB 4.46Å; Y420-L424 HydrophobicContact CE1-CD2 4.15Å; Y420-L424 WeakPolarHBondContact O-CB 3.44Å; Y420-L424 PolarHBondContact O-N 3.33Å; I421-L424 PolarHBondContact O-N 2.86Å; L424-I427 PolarHBondContact O-N 3.09Å; L424-F428 WeakPolarHBondContact O-CB 3.34Å; L424-F428 PolarHBondContact O-N 3.41Å; L424-F464 HydrophobicContact CD2-CD2 4.41Å; L424-F464 HydrophobicContact CD2-CE2 4.07Å; L424-F464 HydrophobicContact CG-CD2 4.21Å; L424-F464 HydrophobicContact CG-CE2 3.89Å; L424-F468 HydrophobicContact CD2-CB 4.41Å
425	C	90	Very high	85.8	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.4	-51.4	175.3	-67.3	0	0	0	0	109.8	I421 I427 F428 F429	I421-C425 WeakPolarHBondContact O-CB 3.28Å; I421-C425 PolarHBondContact O-N 3.47Å; I421-C425 PolarHBondContact O-SG 2.83Å; C425-I427 PolarHBondContact O-N 3.08Å; C425-F428 PolarHBondContact O-N 3.16Å; C425-F429 HydrophobicContact CB-CD2 3.89Å; C425-F429 HydrophobicContact CB-CE2 4.08Å; C425-F429 WeakPolarHBondContact O-CB 3.17Å; C425-F429 WeakPolarHBondContact O-CD2 3.41Å; C425-F429 PolarHBondContact O-N 3.46Å
426	N	89.1	Confident	86.7	Confident	84 Å²	84	40.2 Å²	40.2	45%	0.449	22%	0.215	S	C	.	.	H	α-helix	trans	-58.6	-46.8	-178.3	-167.7	21.3	0	0	0	111.9	H422 K423 T430	H422-N426 VanDerWaalsContact O-CB 3.22Å; H422-N426 WeakPolarHBondContact O-CB 3.18Å; H422-N426 PolarHBondContact O-N 3.36Å; K423-N426 PolarHBondContact O-N 3.28Å; N426-T430 VanDerWaalsContact O-CB 3.23Å; N426-T430 WeakPolarHBondContact O-CB 3.32Å; N426-T430 WeakPolarHBondContact O-CG2 3.41Å; N426-T430 PolarHBondContact O-N 2.91Å; N426-T430 PolarHBondContact O-OG1 3.49Å; N426-T430 VanDerWaalsContact OD1-CG2 3.22Å; N426-T430 WeakPolarHBondContact OD1-CG2 3.25Å
427	I	88.5	Confident	87.1	Confident	56 Å²	56	42.4 Å²	42.4	29%	0.287	21%	0.213	S	C	.	.	H	α-helix	trans	-62.8	-47	178.9	-69.2	164.2	0	0	0	111.3	A407 L411 K423 L424 C425 T430 S431	A407-I427 HydrophobicContact CB-CG2 3.93Å; L411-I427 HydrophobicContact CD1-CD1 3.58Å; L411-I427 HydrophobicContact CD2-CD1 4.48Å; K423-I427 WeakPolarHBondContact O-CB 3.36Å; K423-I427 WeakPolarHBondContact O-CD1 3.28Å; K423-I427 VanDerWaalsContact O-CG1 3.24Å; K423-I427 WeakPolarHBondContact O-CG1 3.27Å; K423-I427 PolarHBondContact O-N 3.22Å; L424-I427 PolarHBondContact O-N 3.09Å; C425-I427 PolarHBondContact O-N 3.08Å; I427-T430 PolarHBondContact O-OG1 3.31Å; I427-S431 WeakPolarHBondContact O-CB 3.45Å; I427-S431 PolarHBondContact O-N 3.33Å
428	F	90.9	Very high	87.3	Confident	1 Å²	1	42.3 Å²	42.3	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-67.7	-51.1	-177.5	175.8	-102.1	0	0	0	112.1	V404 I408 L424 C425 S431 L432 S460 M461 F464	V404-F428 HydrophobicContact CG1-CD2 3.79Å; V404-F428 HydrophobicContact CG1-CE2 4.09Å; I408-F428 HydrophobicContact CD1-CD2 4.29Å; L424-F428 WeakPolarHBondContact O-CB 3.34Å; L424-F428 PolarHBondContact O-N 3.41Å; C425-F428 PolarHBondContact O-N 3.16Å; F428-S431 PolarHBondContact O-N 3.09Å; F428-L432 HydrophobicContact CE1-CD2 4.15Å; F428-L432 HydrophobicContact CZ-CD2 4.29Å; F428-L432 WeakPolarHBondContact O-CB 3.34Å; F428-L432 PolarHBondContact O-N 3.45Å; F428-S460 WeakPolarHBondContact CE2-O 3.4Å; F428-M461 HydrophobicContact CE1-CE 3.94Å; F428-M461 HydrophobicContact CE1-SD 4.16Å; F428-F464 HydrophobicContact CB-CD2 3.72Å; F428-F464 HydrophobicContact CB-CE2 4.19Å; F428-F464 HydrophobicContact CD1-CB 3.95Å; F428-F464 HydrophobicContact CD1-CD1 4.34Å; F428-F464 AromaticContact CD1-CD2 3.66Å; F428-F464 HydrophobicContact CD1-CD2 3.66Å; F428-F464 HydrophobicContact CD1-CE2 4.25Å; F428-F464 AromaticContact CD1-CG 3.71Å; F428-F464 HydrophobicContact CD1-CG 3.71Å; F428-F464 HydrophobicContact CD2-CB 3.83Å; F428-F464 HydrophobicContact CD2-CD2 4.24Å; F428-F464 HydrophobicContact CD2-CG 4.33Å; F428-F464 HydrophobicContact CE1-CB 3.86Å; F428-F464 HydrophobicContact CE1-CD1 4.36Å; F428-F464 HydrophobicContact CE1-CD2 4.37Å; F428-F464 AromaticContact CE1-CG 3.94Å; F428-F464 HydrophobicContact CE1-CG 3.94Å; F428-F464 HydrophobicContact CE2-CB 3.72Å; F428-F464 HydrophobicContact CG-CB 3.94Å; F428-F464 AromaticContact CG-CD2 3.59Å; F428-F464 HydrophobicContact CG-CD2 3.59Å; F428-F464 HydrophobicContact CG-CE2 4.37Å; F428-F464 AromaticContact CG-CG 3.92Å; F428-F464 HydrophobicContact CG-CG 3.92Å; F428-F464 HydrophobicContact CZ-CB 3.74Å; F428-F464 HydrophobicContact CZ-CG 4.35Å
429	F	89.6	Confident	87.5	Confident	8 Å²	8	39.3 Å²	39.3	4%	0.035	20%	0.195	C	C	.	.	H	α-helix	trans	-69.5	-37	-176.5	-72.2	-71.7	0	0	0	112.1	C425 L432 L433 M461 F464 H492 C493 L496	C425-F429 HydrophobicContact CB-CD2 3.89Å; C425-F429 HydrophobicContact CB-CE2 4.08Å; C425-F429 WeakPolarHBondContact O-CB 3.17Å; C425-F429 WeakPolarHBondContact O-CD2 3.41Å; C425-F429 PolarHBondContact O-N 3.46Å; F429-L432 PolarHBondContact O-N 2.97Å; F429-L433 VanDerWaalsContact O-CB 3.27Å; F429-L433 WeakPolarHBondContact O-CB 3.32Å; F429-L433 PolarHBondContact O-N 2.99Å; F429-M461 HydrophobicContact CE1-CE 3.99Å; F429-M461 HydrophobicContact CZ-CE 4.35Å; F429-F464 HydrophobicContact CE2-CE1 4.39Å; F429-F464 HydrophobicContact CE2-CE2 4.47Å; F429-F464 HydrophobicContact CE2-CZ 4.03Å; F429-F464 HydrophobicContact CZ-CE1 4.44Å; F429-H492 HydrophobicContact CB-CB 4.29Å; F429-H492 HydrophobicContact CD1-CB 4.35Å; F429-H492 HydrophobicContact CD2-CB 3.26Å; F429-H492 HydrophobicContact CE2-CB 3.56Å; F429-H492 HydrophobicContact CG-CB 3.73Å; F429-H492 HydrophobicContact CZ-CB 4.23Å; F429-C493 HydrophobicContact CE1-CB 3.93Å; F429-C493 HydrophobicContact CZ-CB 3.96Å; F429-L496 HydrophobicContact CD1-CD1 3.48Å; F429-L496 VanDerWaalsContact CD1-CD1 3.48Å; F429-L496 HydrophobicContact CD1-CD2 4.43Å; F429-L496 HydrophobicContact CD1-CG 3.9Å; F429-L496 HydrophobicContact CE1-CD1 3.51Å; F429-L496 HydrophobicContact CE1-CG 4.35Å
430	T	88.4	Confident	87.5	Confident	57 Å²	57	39.7 Å²	39.7	35%	0.35	19%	0.194	S	C	.	.	H	α-helix	trans	-67.5	-42.4	173.1	56	0	0	0	0	111.7	N426 I427 L432 L433 E434	N426-T430 VanDerWaalsContact O-CB 3.23Å; N426-T430 WeakPolarHBondContact O-CB 3.32Å; N426-T430 WeakPolarHBondContact O-CG2 3.41Å; N426-T430 PolarHBondContact O-N 2.91Å; N426-T430 PolarHBondContact O-OG1 3.49Å; N426-T430 VanDerWaalsContact OD1-CG2 3.22Å; N426-T430 WeakPolarHBondContact OD1-CG2 3.25Å; I427-T430 PolarHBondContact O-OG1 3.31Å; T430-L432 VanDerWaalsContact C-N 3.3Å; T430-L432 PolarHBondContact O-N 3.2Å; T430-L433 WeakPolarHBondContact O-CB 3.34Å; T430-L433 PolarHBondContact O-N 3.22Å; T430-E434 WeakPolarHBondContact O-CB 3.11Å; T430-E434 WeakPolarHBondContact O-CG 3.34Å; T430-E434 PolarHBondContact O-N 3.46Å
431	S	87.7	Confident	87.4	Confident	20 Å²	20	45.6 Å²	45.6	14%	0.14	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-38.5	175.7	-171.6	0	0	0	0	112.2	V404 I427 F428 T435	V404-S431 WeakPolarHBondContact CG2-OG 3.13Å; I427-S431 WeakPolarHBondContact O-CB 3.45Å; I427-S431 PolarHBondContact O-N 3.33Å; F428-S431 PolarHBondContact O-N 3.09Å; S431-T435 WeakPolarHBondContact O-CB 3.4Å; S431-T435 PolarHBondContact O-N 3.45Å; S431-T435 PolarHBondContact O-OG1 2.93Å
432	L	88.8	Confident	87.1	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-42.4	174.8	-174.3	61.8	0	0	0	111.6	F428 F429 T430 T435 A436 W456 L496 L503	F428-L432 HydrophobicContact CE1-CD2 4.15Å; F428-L432 HydrophobicContact CZ-CD2 4.29Å; F428-L432 WeakPolarHBondContact O-CB 3.34Å; F428-L432 PolarHBondContact O-N 3.45Å; F429-L432 PolarHBondContact O-N 2.97Å; T430-L432 VanDerWaalsContact C-N 3.3Å; T430-L432 PolarHBondContact O-N 3.2Å; L432-T435 PolarHBondContact O-N 2.93Å; L432-A436 WeakPolarHBondContact O-CB 3.33Å; L432-A436 PolarHBondContact O-N 2.92Å; L432-W456 HydrophobicContact CD1-CE3 4.33Å; L432-W456 HydrophobicContact CD1-CH2 3.73Å; L432-W456 HydrophobicContact CD1-CZ3 3.35Å; L432-L496 HydrophobicContact CB-CD2 4.29Å; L432-L496 HydrophobicContact CD2-CD1 3.66Å; L432-L496 HydrophobicContact CD2-CD2 3.65Å; L432-L496 HydrophobicContact CD2-CG 4.32Å; L432-L496 HydrophobicContact CG-CD2 3.87Å; L432-L503 HydrophobicContact CD2-CD1 3.89Å
433	L	87.1	Confident	86.8	Confident	48 Å²	48	43.4 Å²	43.4	25%	0.251	22%	0.215	S	C	.	.	H	α-helix	trans	-61.3	-46.6	176.1	-163.7	99.2	0	0	0	111.8	F429 T430 A436 K437 I499	F429-L433 VanDerWaalsContact O-CB 3.27Å; F429-L433 WeakPolarHBondContact O-CB 3.32Å; F429-L433 PolarHBondContact O-N 2.99Å; T430-L433 WeakPolarHBondContact O-CB 3.34Å; T430-L433 PolarHBondContact O-N 3.22Å; L433-A436 PolarHBondContact O-N 3.49Å; L433-K437 WeakPolarHBondContact O-CG 3.33Å; L433-K437 PolarHBondContact O-N 3.48Å; L433-I499 HydrophobicContact CB-CD1 4.36Å; L433-I499 HydrophobicContact CD1-CD1 3.14Å; L433-I499 HydrophobicContact CD1-CG1 4.13Å; L433-I499 HydrophobicContact CG-CD1 3.48Å; L433-I499 VanDerWaalsContact CG-CD1 3.48Å
434	E	85.9	Confident	86.2	Confident	105 Å²	105	41.9 Å²	41.9	49%	0.491	22%	0.221	S	C	.	.	H	α-helix	trans	-62.5	-43.9	175.8	-73.5	176.4	177.9	0	0	111	T430 A436 K437 E438	T430-E434 WeakPolarHBondContact O-CB 3.11Å; T430-E434 WeakPolarHBondContact O-CG 3.34Å; T430-E434 PolarHBondContact O-N 3.46Å; E434-A436 VanDerWaalsContact C-N 3.34Å; E434-A436 PolarHBondContact O-N 2.97Å; E434-K437 PolarHBondContact O-N 2.82Å; E434-E438 WeakPolarHBondContact O-CB 3.48Å; E434-E438 WeakPolarHBondContact O-CG 3.34Å; E434-E438 PolarHBondContact O-N 3.16Å
435	T	87.8	Confident	85.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-39	178.1	-53.3	0	0	0	0	111.5	F396 R400 S431 L432 F439 F453 W456	F396-T435 HydrophobicContact CE1-CG2 3.81Å; F396-T435 HydrophobicContact CZ-CG2 4.05Å; R400-T435 HydrophobicContact CB-CG2 4.1Å; R400-T435 HydrophobicContact CG-CG2 3.81Å; S431-T435 WeakPolarHBondContact O-CB 3.4Å; S431-T435 PolarHBondContact O-N 3.45Å; S431-T435 PolarHBondContact O-OG1 2.93Å; L432-T435 PolarHBondContact O-N 2.93Å; T435-F439 WeakPolarHBondContact O-CB 3.41Å; T435-F439 PolarHBondContact O-N 3.4Å; T435-F453 HydrophobicContact CG2-CE2 4.28Å; T435-W456 HydrophobicContact CG2-CH2 3.65Å; T435-W456 HydrophobicContact CG2-CZ2 4.33Å; T435-W456 HydrophobicContact CG2-CZ3 3.87Å
436	A	86.4	Confident	84.6	Confident	8 Å²	8	47.8 Å²	47.8	7%	0.066	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-47.6	175.7	0	0	0	0	0	111.8	L432 L433 E434 E438 F439 E440 F453 I499	L432-A436 WeakPolarHBondContact O-CB 3.33Å; L432-A436 PolarHBondContact O-N 2.92Å; L433-A436 PolarHBondContact O-N 3.49Å; E434-A436 VanDerWaalsContact C-N 3.34Å; E434-A436 PolarHBondContact O-N 2.97Å; A436-E438 PolarHBondContact O-N 3.39Å; A436-F439 PolarHBondContact O-N 3.27Å; A436-E440 PolarHBondContact O-N 3.27Å; A436-F453 HydrophobicContact CB-CE1 4.34Å; A436-F453 HydrophobicContact CB-CE2 4.5Å; A436-F453 HydrophobicContact CB-CZ 3.68Å; A436-I499 HydrophobicContact CB-CD1 4.35Å; A436-I499 HydrophobicContact CB-CG2 4.16Å
437	K	85.3	Confident	83.8	Confident	110 Å²	110	49.6 Å²	49.6	48%	0.478	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-44	177.9	-72.5	175.8	179.9	179.7	0	112	L433 E434 F439 E440 M441	L433-K437 WeakPolarHBondContact O-CG 3.33Å; L433-K437 PolarHBondContact O-N 3.48Å; E434-K437 PolarHBondContact O-N 2.82Å; K437-F439 VanDerWaalsContact C-N 3.34Å; K437-E440 PolarHBondContact O-N 2.89Å; K437-M441 WeakPolarHBondContact O-CG 3.42Å; K437-M441 PolarHBondContact O-N 3.29Å; K437-M441 VanDerWaalsContact O-N 3.08Å
438	E	84.3	Confident	83.1	Confident	19 Å²	19	49.6 Å²	49.6	9%	0.089	30%	0.298	C	S	.	.	H	α-helix	trans	-65.5	-39.3	176.5	-72.7	-172.9	-150.8	0	0	112	R377 F396 R400 E434 A436 M441 D442	R377-E438 WeakPolarHBondContact CD-OE2 3.26Å; R377-E438 WeakPolarHBondContact CG-OE2 3.42Å; F396-E438 HydrophobicContact CZ-CB 4.16Å; R400-E438 IonicContact CZ-OE1 3.99Å; R400-E438 IonicContact CZ-OE2 3.83Å; R400-E438 IonicContact NE-OE2 2.85Å; R400-E438 IonicContact NH1-OE1 3.15Å; R400-E438 IonicContact NH2-OE1 2.93Å; R400-E438 PolarHBondContact NH2-OE1 2.93Å; R400-E438 IonicContact NH2-OE2 3.65Å; R400-E438 PolarHBondContact NH2-OE2 3.48Å; E434-E438 WeakPolarHBondContact O-CB 3.48Å; E434-E438 WeakPolarHBondContact O-CG 3.34Å; E434-E438 PolarHBondContact O-N 3.16Å; A436-E438 PolarHBondContact O-N 3.39Å; E438-M441 PolarHBondContact O-N 3.48Å; E438-D442 PolarHBondContact O-N 3.45Å
439	F	86.2	Confident	82.6	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-42.4	176.9	-169.7	-90.6	0	0	0	112	F396 L397 T435 A436 K437 M441 F443 C449 Y450 F453	F396-F439 HydrophobicContact CD1-CD2 4.14Å; F396-F439 HydrophobicContact CE1-CB 4.37Å; F396-F439 HydrophobicContact CE1-CD2 4.03Å; L397-F439 HydrophobicContact CD2-CD2 4.48Å; T435-F439 WeakPolarHBondContact O-CB 3.41Å; T435-F439 PolarHBondContact O-N 3.4Å; A436-F439 PolarHBondContact O-N 3.27Å; K437-F439 VanDerWaalsContact C-N 3.34Å; F439-M441 VanDerWaalsContact C-N 3.34Å; F439-M441 PolarHBondContact O-N 3.39Å; F439-F443 HydrophobicContact CD1-CB 4.46Å; F439-F443 AromaticContact CD2-CD2 3.58Å; F439-F443 HydrophobicContact CD2-CD2 3.58Å; F439-F443 AromaticContact CD2-CE2 3.91Å; F439-F443 HydrophobicContact CD2-CE2 3.91Å; F439-F443 HydrophobicContact CD2-CG 4.38Å; F439-F443 HydrophobicContact CE1-CB 4.11Å; F439-F443 HydrophobicContact CE1-CG 4.47Å; F439-F443 AromaticContact CE2-CD2 3.58Å; F439-F443 HydrophobicContact CE2-CD2 3.58Å; F439-F443 AromaticContact CE2-CE2 3.88Å; F439-F443 HydrophobicContact CE2-CE2 3.88Å; F439-F443 HydrophobicContact CE2-CG 4Å; F439-F443 HydrophobicContact CG-CD2 4.08Å; F439-F443 HydrophobicContact CZ-CB 4.14Å; F439-F443 HydrophobicContact CZ-CD2 4.07Å; F439-F443 HydrophobicContact CZ-CG 4.05Å; F439-F443 WeakPolarHBondContact O-CB 3.48Å; F439-F443 PolarHBondContact O-N 3.44Å; F439-C449 HydrophobicContact CZ-CB 3.76Å; F439-C449 WeakPolarHBondContact CZ-O 3.44Å; F439-Y450 HydrophobicContact CD1-CD1 4.27Å; F439-Y450 HydrophobicContact CD1-CE1 4.13Å; F439-Y450 AromaticContact CE1-CD1 3.88Å; F439-Y450 HydrophobicContact CE1-CD1 3.88Å; F439-Y450 HydrophobicContact CE1-CD2 4.3Å; F439-Y450 HydrophobicContact CE1-CE1 4.06Å; F439-Y450 HydrophobicContact CE1-CE2 4.47Å; F439-Y450 HydrophobicContact CE1-CG 4.02Å; F439-F453 HydrophobicContact CB-CD2 4.16Å; F439-F453 HydrophobicContact CB-CE2 4.27Å; F439-F453 HydrophobicContact CD1-CB 4.07Å; F439-F453 HydrophobicContact CD1-CD2 4.17Å; F439-F453 HydrophobicContact CD1-CG 4.05Å; F439-F453 HydrophobicContact CD2-CB 4.41Å; F439-F453 HydrophobicContact CD2-CD2 4.02Å; F439-F453 HydrophobicContact CE1-CB 3.75Å; F439-F453 HydrophobicContact CE1-CG 4.24Å; F439-F453 HydrophobicContact CE2-CB 4.11Å; F439-F453 HydrophobicContact CG-CB 4.39Å; F439-F453 AromaticContact CG-CD2 3.83Å; F439-F453 HydrophobicContact CG-CD2 3.83Å; F439-F453 HydrophobicContact CG-CE2 4.42Å; F439-F453 HydrophobicContact CG-CG 4.18Å; F439-F453 HydrophobicContact CZ-CB 3.76Å
440	E	84.3	Confident	82.4	Confident	112 Å²	112	53.3 Å²	53.3	52%	0.523	31%	0.313	S	S	.	.	H	α-helix	trans	-62.6	-40.7	175.5	-169.8	179.5	-178.6	0	0	111.6	A436 K437 A444	A436-E440 PolarHBondContact O-N 3.27Å; K437-E440 PolarHBondContact O-N 2.89Å; E440-A444 WeakPolarHBondContact O-CB 3.41Å; E440-A444 PolarHBondContact O-N 2.91Å
441	M	83.3	Confident	82.3	Confident	143 Å²	143	54.4 Å²	54.4	70%	0.704	32%	0.323	S	S	*	.	H	α-helix	trans	-65.7	-47.3	176.9	-71.7	-177.4	72.2	0	0	112.8	K437 E438 F439	K437-M441 WeakPolarHBondContact O-CG 3.42Å; K437-M441 PolarHBondContact O-N 3.29Å; K437-M441 VanDerWaalsContact O-N 3.08Å; E438-M441 PolarHBondContact O-N 3.48Å; F439-M441 VanDerWaalsContact C-N 3.34Å; F439-M441 PolarHBondContact O-N 3.39Å
442	D	80.8	Confident	82.2	Confident	33 Å²	33	55.3 Å²	55.3	18%	0.176	33%	0.331	C	S	.	.	H	α-helix	trans	-80.3	-30.4	-173.1	-69	-23.1	0	0	0	112.3	V380 I384 E438	V380-D442 HydrophobicContact CG1-CB 4.39Å; I384-D442 HydrophobicContact CD1-CB 4.25Å; I384-D442 VanDerWaalsContact CD1-O 3.22Å; I384-D442 WeakPolarHBondContact CD1-O 3.32Å; E438-D442 PolarHBondContact O-N 3.45Å
443	F	82.1	Confident	82.2	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-114.4	16.8	-173.2	-62	-89.6	0	0	0	114.7	V380 I384 A392 C393 F439 G445 N446 C449	V380-F443 HydrophobicContact CG1-CE2 3.85Å; V380-F443 HydrophobicContact CG1-CZ 3.69Å; I384-F443 HydrophobicContact CD1-CD1 3.86Å; I384-F443 HydrophobicContact CD1-CD2 4.48Å; I384-F443 HydrophobicContact CD1-CE1 3.56Å; I384-F443 HydrophobicContact CD1-CE2 4.22Å; I384-F443 HydrophobicContact CD1-CG 4.31Å; I384-F443 HydrophobicContact CD1-CZ 3.76Å; I384-F443 HydrophobicContact CG1-CD1 4.48Å; I384-F443 HydrophobicContact CG1-CE1 3.94Å; I384-F443 HydrophobicContact CG1-CZ 4.35Å; A392-F443 HydrophobicContact CB-CE1 4.46Å; A392-F443 HydrophobicContact CB-CZ 4.36Å; C393-F443 HydrophobicContact CB-CE1 3.76Å; C393-F443 HydrophobicContact CB-CZ 3.9Å; F439-F443 HydrophobicContact CD1-CB 4.46Å; F439-F443 AromaticContact CD2-CD2 3.58Å; F439-F443 HydrophobicContact CD2-CD2 3.58Å; F439-F443 AromaticContact CD2-CE2 3.91Å; F439-F443 HydrophobicContact CD2-CE2 3.91Å; F439-F443 HydrophobicContact CD2-CG 4.38Å; F439-F443 HydrophobicContact CE1-CB 4.11Å; F439-F443 HydrophobicContact CE1-CG 4.47Å; F439-F443 AromaticContact CE2-CD2 3.58Å; F439-F443 HydrophobicContact CE2-CD2 3.58Å; F439-F443 AromaticContact CE2-CE2 3.88Å; F439-F443 HydrophobicContact CE2-CE2 3.88Å; F439-F443 HydrophobicContact CE2-CG 4Å; F439-F443 HydrophobicContact CG-CD2 4.08Å; F439-F443 HydrophobicContact CZ-CB 4.14Å; F439-F443 HydrophobicContact CZ-CD2 4.07Å; F439-F443 HydrophobicContact CZ-CG 4.05Å; F439-F443 WeakPolarHBondContact O-CB 3.48Å; F439-F443 PolarHBondContact O-N 3.44Å; F443-G445 PolarHBondContact O-N 2.88Å; F443-N446 PolarHBondContact O-N 3.44Å; F443-C449 HydrophobicContact CD1-CB 4.01Å; F443-C449 HydrophobicContact CG-CB 4.46Å
444	A	75.6	Confident	82.3	Confident	71 Å²	71	57.2 Å²	57.2	59%	0.587	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.4	-32.8	179	0	0	0	0	0	114.5	E440	E440-A444 WeakPolarHBondContact O-CB 3.41Å; E440-A444 PolarHBondContact O-N 2.91Å
445	G	70.1	Confident	82.5	Confident	70 Å²	70	57.2 Å²	57.2	72%	0.722	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-10.8	179.5	0	0	0	0	0	116.2	F443	F443-G445 PolarHBondContact O-N 2.88Å
446	N	74.5	Confident	82.7	Confident	55 Å²	55	58.2 Å²	58.2	29%	0.294	35%	0.354	S	S	.	.			trans	-117.5	81.6	-169.9	-73.3	-41.3	0	0	0	111.9	P389 F443 G448 C449	P389-N446 WeakPolarHBondContact CB-ND2 3.47Å; F443-N446 PolarHBondContact O-N 3.44Å; N446-G448 PolarHBondContact O-N 3.49Å; N446-G448 VanDerWaalsContact O-N 3.14Å; N446-C449 PolarHBondContact O-N 3.33Å; N446-C449 VanDerWaalsContact O-N 3.13Å
447	T	71.4	Confident	82.9	Confident	121 Å²	121	57.8 Å²	57.8	74%	0.742	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-29	-177.5	49.8	0	0	0	0	114.1	C449 Y450	T447-C449 VanDerWaalsContact C-N 3.27Å; T447-C449 PolarHBondContact O-N 3.28Å; T447-Y450 PolarHBondContact O-N 3.1Å
448	G	74.8	Confident	83.1	Confident	56 Å²	56	60.5 Å²	60.5	58%	0.577	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-29.7	177.8	0	0	0	0	0	114.4	N446 Y450 S451	N446-G448 PolarHBondContact O-N 3.49Å; N446-G448 VanDerWaalsContact O-N 3.14Å; G448-Y450 PolarHBondContact O-N 3.03Å; G448-S451 PolarHBondContact O-OG 3.12Å
449	C	80.2	Confident	83.4	Confident	6 Å²	6	62.8 Å²	62.8	4%	0.041	38%	0.377	C	S	.	.	H	α-helix	trans	-75.8	-23.2	-175.6	-64.3	0	0	0	0	113	C393 F439 F443 N446 T447 S451 A452 F453	C393-C449 HydrophobicContact CB-CB 4.21Å; F439-C449 HydrophobicContact CZ-CB 3.76Å; F439-C449 WeakPolarHBondContact CZ-O 3.44Å; F443-C449 HydrophobicContact CD1-CB 4.01Å; F443-C449 HydrophobicContact CG-CB 4.46Å; N446-C449 PolarHBondContact O-N 3.33Å; N446-C449 VanDerWaalsContact O-N 3.13Å; T447-C449 VanDerWaalsContact C-N 3.27Å; T447-C449 PolarHBondContact O-N 3.28Å; C449-S451 PolarHBondContact O-N 2.87Å; C449-A452 WeakPolarHBondContact O-CB 3.45Å; C449-A452 PolarHBondContact O-N 2.92Å; C449-A452 VanDerWaalsContact O-N 3.08Å; C449-F453 PolarHBondContact O-N 3.46Å; C449-F453 VanDerWaalsContact O-N 3.16Å
450	Y	84.6	Confident	83.6	Confident	82 Å²	82	62.8 Å²	62.8	32%	0.322	38%	0.377	S	S	.	.	H	α-helix	trans	-62.6	-31.2	179.9	-75.3	-92.6	0	0	0	112.8	F439 T447 G448 A452 F453 V454	F439-Y450 HydrophobicContact CD1-CD1 4.27Å; F439-Y450 HydrophobicContact CD1-CE1 4.13Å; F439-Y450 AromaticContact CE1-CD1 3.88Å; F439-Y450 HydrophobicContact CE1-CD1 3.88Å; F439-Y450 HydrophobicContact CE1-CD2 4.3Å; F439-Y450 HydrophobicContact CE1-CE1 4.06Å; F439-Y450 HydrophobicContact CE1-CE2 4.47Å; F439-Y450 HydrophobicContact CE1-CG 4.02Å; T447-Y450 PolarHBondContact O-N 3.1Å; G448-Y450 PolarHBondContact O-N 3.03Å; Y450-A452 VanDerWaalsContact C-N 3.33Å; Y450-A452 PolarHBondContact O-N 3.47Å; Y450-F453 WeakPolarHBondContact O-CB 3.31Å; Y450-F453 PolarHBondContact O-N 2.87Å; Y450-V454 WeakPolarHBondContact O-CG2 3.41Å; Y450-V454 PolarHBondContact O-N 3.29Å
451	S	87.1	Confident	83.8	Confident	79 Å²	79	57.4 Å²	57.4	55%	0.552	35%	0.352	S	S	*	.	H	α-helix	trans	-61.2	-42.2	173.9	66.3	0	0	0	0	112	G448 C449 F453 V454 V455	G448-S451 PolarHBondContact O-OG 3.12Å; C449-S451 PolarHBondContact O-N 2.87Å; S451-F453 VanDerWaalsContact C-N 3.35Å; S451-V454 PolarHBondContact O-N 3.46Å; S451-V455 WeakPolarHBondContact O-CG2 3.3Å; S451-V455 PolarHBondContact O-N 3.26Å; S451-V455 VanDerWaalsContact O-N 3.11Å
452	A	86.8	Confident	84.2	Confident	39 Å²	39	56.2 Å²	56.2	32%	0.322	34%	0.342	S	S	.	.	H	α-helix	trans	-66.5	-37.4	176.4	0	0	0	0	0	111.7	L397 C449 Y450 V455 W456	L397-A452 HydrophobicContact CD1-CB 4.11Å; C449-A452 WeakPolarHBondContact O-CB 3.45Å; C449-A452 PolarHBondContact O-N 2.92Å; C449-A452 VanDerWaalsContact O-N 3.08Å; Y450-A452 VanDerWaalsContact C-N 3.33Å; Y450-A452 PolarHBondContact O-N 3.47Å; A452-V455 PolarHBondContact O-N 2.76Å; A452-W456 WeakPolarHBondContact O-CB 3.3Å; A452-W456 PolarHBondContact O-N 3.39Å
453	F	88.5	Confident	84.5	Confident	14 Å²	14	57.1 Å²	57.1	6%	0.061	35%	0.346	C	S	.	.	H	α-helix	trans	-59.8	-47.2	173.4	178.9	-102.7	0	0	0	111.7	L397 T435 A436 F439 C449 Y450 S451 V455 W456 S457 L501	L397-F453 HydrophobicContact CD2-CD2 3.93Å; T435-F453 HydrophobicContact CG2-CE2 4.28Å; A436-F453 HydrophobicContact CB-CE1 4.34Å; A436-F453 HydrophobicContact CB-CE2 4.5Å; A436-F453 HydrophobicContact CB-CZ 3.68Å; F439-F453 HydrophobicContact CB-CD2 4.16Å; F439-F453 HydrophobicContact CB-CE2 4.27Å; F439-F453 HydrophobicContact CD1-CB 4.07Å; F439-F453 HydrophobicContact CD1-CD2 4.17Å; F439-F453 HydrophobicContact CD1-CG 4.05Å; F439-F453 HydrophobicContact CD2-CB 4.41Å; F439-F453 HydrophobicContact CD2-CD2 4.02Å; F439-F453 HydrophobicContact CE1-CB 3.75Å; F439-F453 HydrophobicContact CE1-CG 4.24Å; F439-F453 HydrophobicContact CE2-CB 4.11Å; F439-F453 HydrophobicContact CG-CB 4.39Å; F439-F453 AromaticContact CG-CD2 3.83Å; F439-F453 HydrophobicContact CG-CD2 3.83Å; F439-F453 HydrophobicContact CG-CE2 4.42Å; F439-F453 HydrophobicContact CG-CG 4.18Å; F439-F453 HydrophobicContact CZ-CB 3.76Å; C449-F453 PolarHBondContact O-N 3.46Å; C449-F453 VanDerWaalsContact O-N 3.16Å; Y450-F453 WeakPolarHBondContact O-CB 3.31Å; Y450-F453 PolarHBondContact O-N 2.87Å; S451-F453 VanDerWaalsContact C-N 3.35Å; F453-V455 PolarHBondContact O-N 3.26Å; F453-W456 HydrophobicContact CD2-CE3 4.09Å; F453-W456 HydrophobicContact CD2-CZ3 4.39Å; F453-W456 AromaticContact CE2-CE3 3.9Å; F453-W456 HydrophobicContact CE2-CE3 3.9Å; F453-W456 AromaticContact CE2-CZ3 3.76Å; F453-W456 HydrophobicContact CE2-CZ3 3.76Å; F453-W456 HydrophobicContact CZ-CZ3 4.38Å; F453-W456 CarbonylContact O-C 3.46Å; F453-W456 WeakPolarHBondContact O-CB 3.45Å; F453-W456 PolarHBondContact O-N 3.26Å; F453-W456 VanDerWaalsContact O-N 3.16Å; F453-S457 PolarHBondContact O-N 3.25Å; F453-S457 PolarHBondContact O-OG 2.79Å; F453-L501 HydrophobicContact CE1-CD1 4.45Å; F453-L501 HydrophobicContact CE1-CD2 4.18Å
454	V	88.6	Confident	84.9	Confident	76 Å²	76	57.2 Å²	57.2	46%	0.461	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-41.9	178.1	175.3	0	0	0	0	111.8	Y450 S451 W456 S457 R458 L501	Y450-V454 WeakPolarHBondContact O-CG2 3.41Å; Y450-V454 PolarHBondContact O-N 3.29Å; S451-V454 PolarHBondContact O-N 3.46Å; V454-W456 VanDerWaalsContact C-N 3.32Å; V454-W456 PolarHBondContact O-N 3.19Å; V454-S457 PolarHBondContact O-N 2.91Å; V454-R458 PolarHBondContact O-N 3.43Å; V454-L501 HydrophobicContact CG2-CD1 4.47Å
455	V	90.1	Very high	85.7	Confident	105 Å²	105	54 Å²	54	64%	0.636	32%	0.319	S	S	*	.	H	α-helix	trans	-61	-43.3	175.4	172.1	0	0	0	0	110.9	S451 A452 F453 R458 S459	S451-V455 WeakPolarHBondContact O-CG2 3.3Å; S451-V455 PolarHBondContact O-N 3.26Å; S451-V455 VanDerWaalsContact O-N 3.11Å; A452-V455 PolarHBondContact O-N 2.76Å; F453-V455 PolarHBondContact O-N 3.26Å; V455-R458 PolarHBondContact O-N 3.28Å; V455-S459 PolarHBondContact O-N 3.42Å; V455-S459 VanDerWaalsContact O-N 3.09Å
456	W	91.4	Very high	86.6	Confident	21 Å²	21	55.6 Å²	55.6	8%	0.08	31%	0.312	C	S	.	.	H	α-helix	trans	-64.2	-45.8	175.4	172.6	89.4	0	0	0	112	L397 R400 L432 T435 A452 F453 V454 R458 S459 S460	L397-W456 HydrophobicContact CB-CB 4.3Å; L397-W456 HydrophobicContact CB-CG 3.96Å; L397-W456 HydrophobicContact CD1-CB 3.95Å; L397-W456 HydrophobicContact CD1-CG 4.41Å; L397-W456 HydrophobicContact CD2-CB 4.06Å; L397-W456 HydrophobicContact CD2-CD2 3.79Å; L397-W456 HydrophobicContact CD2-CE3 4.01Å; L397-W456 HydrophobicContact CD2-CG 3.8Å; L397-W456 HydrophobicContact CG-CB 4.32Å; L397-W456 HydrophobicContact CG-CG 4.25Å; L397-W456 PolarHBondContact O-NE1 3.01Å; R400-W456 HydrophobicContact CB-CZ2 3.89Å; L432-W456 HydrophobicContact CD1-CE3 4.33Å; L432-W456 HydrophobicContact CD1-CH2 3.73Å; L432-W456 HydrophobicContact CD1-CZ3 3.35Å; T435-W456 HydrophobicContact CG2-CH2 3.65Å; T435-W456 HydrophobicContact CG2-CZ2 4.33Å; T435-W456 HydrophobicContact CG2-CZ3 3.87Å; A452-W456 WeakPolarHBondContact O-CB 3.3Å; A452-W456 PolarHBondContact O-N 3.39Å; F453-W456 HydrophobicContact CD2-CE3 4.09Å; F453-W456 HydrophobicContact CD2-CZ3 4.39Å; F453-W456 AromaticContact CE2-CE3 3.9Å; F453-W456 HydrophobicContact CE2-CE3 3.9Å; F453-W456 AromaticContact CE2-CZ3 3.76Å; F453-W456 HydrophobicContact CE2-CZ3 3.76Å; F453-W456 HydrophobicContact CZ-CZ3 4.38Å; F453-W456 CarbonylContact O-C 3.46Å; F453-W456 WeakPolarHBondContact O-CB 3.45Å; F453-W456 PolarHBondContact O-N 3.26Å; F453-W456 VanDerWaalsContact O-N 3.16Å; V454-W456 VanDerWaalsContact C-N 3.32Å; V454-W456 PolarHBondContact O-N 3.19Å; W456-R458 VanDerWaalsContact C-N 3.26Å; W456-R458 PolarHBondContact O-N 3.07Å; W456-S459 WeakPolarHBondContact O-CB 3.46Å; W456-S459 PolarHBondContact O-N 3.5Å; W456-S460 VanDerWaalsContact CE2-OG 3.24Å; W456-S460 WeakPolarHBondContact CZ2-OG 3.4Å; W456-S460 WeakPolarHBondContact O-CB 3.5Å; W456-S460 PolarHBondContact O-N 2.89Å; W456-S460 PolarHBondContact O-OG 3.4Å
457	S	90.3	Very high	87.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.2	-40	178	-56.6	0	0	0	0	111.7	F453 V454 S460 M461	F453-S457 PolarHBondContact O-N 3.25Å; F453-S457 PolarHBondContact O-OG 2.79Å; V454-S457 PolarHBondContact O-N 2.91Å; S457-S460 PolarHBondContact O-N 2.67Å; S457-M461 WeakPolarHBondContact O-CB 3.43Å; S457-M461 PolarHBondContact O-N 2.87Å
458	R	90.8	Very high	88	Confident	167 Å²	167	48.8 Å²	48.8	63%	0.63	28%	0.275	S	S	*	.	H	α-helix	trans	-64.2	-42.9	174.2	-177.4	177.2	177.4	175.3	0.5	112.3	V454 V455 W456 M461 K462 T506	V454-R458 PolarHBondContact O-N 3.43Å; V455-R458 PolarHBondContact O-N 3.28Å; W456-R458 VanDerWaalsContact C-N 3.26Å; W456-R458 PolarHBondContact O-N 3.07Å; R458-M461 PolarHBondContact O-N 3.35Å; R458-K462 PolarHBondContact O-N 3.31Å; R458-K462 VanDerWaalsContact O-N 3.08Å; R458-T506 HydrophobicContact CG-CG2 4.12Å
459	S	90.5	Very high	88.6	Confident	67 Å²	67	46.6 Å²	46.6	47%	0.469	25%	0.251	S	S	.	.	H	α-helix	trans	-64.9	-44.7	176.5	-171.9	0	0	0	0	111.9	V455 W456 M461 K462 M463	V455-S459 PolarHBondContact O-N 3.42Å; V455-S459 VanDerWaalsContact O-N 3.09Å; W456-S459 WeakPolarHBondContact O-CB 3.46Å; W456-S459 PolarHBondContact O-N 3.5Å; S459-M461 VanDerWaalsContact C-N 3.34Å; S459-M461 PolarHBondContact O-N 3.02Å; S459-K462 WeakPolarHBondContact O-CB 3.07Å; S459-K462 PolarHBondContact O-N 3.41Å; S459-K462 VanDerWaalsContact O-N 3.1Å; S459-M463 PolarHBondContact O-N 3.26Å
460	S	89.2	Confident	88.7	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.007	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-41.7	175.4	-66.1	0	0	0	0	111.8	F428 W456 S457 K462 M463 F464	F428-S460 WeakPolarHBondContact CE2-O 3.4Å; W456-S460 VanDerWaalsContact CE2-OG 3.24Å; W456-S460 WeakPolarHBondContact CZ2-OG 3.4Å; W456-S460 WeakPolarHBondContact O-CB 3.5Å; W456-S460 PolarHBondContact O-N 2.89Å; W456-S460 PolarHBondContact O-OG 3.4Å; S457-S460 PolarHBondContact O-N 2.67Å; S460-K462 VanDerWaalsContact C-N 3.31Å; S460-K462 PolarHBondContact O-N 3.24Å; S460-M463 PolarHBondContact O-N 2.9Å; S460-F464 PolarHBondContact O-N 3.49Å
461	M	90.1	Very high	88.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-40.2	173.3	-174.3	59.4	70.9	0	0	111.6	F428 F429 S457 R458 S459 M463 F464 V465 L503 T506 L507 L510	F428-M461 HydrophobicContact CE1-CE 3.94Å; F428-M461 HydrophobicContact CE1-SD 4.16Å; F429-M461 HydrophobicContact CE1-CE 3.99Å; F429-M461 HydrophobicContact CZ-CE 4.35Å; S457-M461 WeakPolarHBondContact O-CB 3.43Å; S457-M461 PolarHBondContact O-N 2.87Å; R458-M461 PolarHBondContact O-N 3.35Å; S459-M461 VanDerWaalsContact C-N 3.34Å; S459-M461 PolarHBondContact O-N 3.02Å; M461-M463 PolarHBondContact O-N 3.36Å; M461-F464 PolarHBondContact O-N 3.45Å; M461-F464 HydrophobicContact SD-CD1 3.86Å; M461-V465 HydrophobicContact CG-CG2 4.43Å; M461-V465 WeakPolarHBondContact O-CG2 3.09Å; M461-V465 PolarHBondContact O-N 2.87Å; M461-V465 HydrophobicContact SD-CG2 4.35Å; M461-L503 HydrophobicContact CE-CB 3.82Å; M461-L503 HydrophobicContact CE-CD1 3.61Å; M461-L503 HydrophobicContact CE-CG 4.38Å; M461-T506 HydrophobicContact CB-CG2 4.32Å; M461-T506 HydrophobicContact CG-CG2 3.98Å; M461-L507 HydrophobicContact SD-CB 4.41Å; M461-L507 HydrophobicContact SD-CD1 4.09Å; M461-L510 HydrophobicContact CG-CD1 4.14Å
462	K	90.9	Very high	88.3	Confident	117 Å²	117	42 Å²	42	51%	0.509	23%	0.232	S	C	.	.	H	α-helix	trans	-62.4	-41.5	175.2	-170.9	-179.9	-179.7	-177.5	0	112.3	R458 S459 S460 V465 N466 L510	R458-K462 PolarHBondContact O-N 3.31Å; R458-K462 VanDerWaalsContact O-N 3.08Å; S459-K462 WeakPolarHBondContact O-CB 3.07Å; S459-K462 PolarHBondContact O-N 3.41Å; S459-K462 VanDerWaalsContact O-N 3.1Å; S460-K462 VanDerWaalsContact C-N 3.31Å; S460-K462 PolarHBondContact O-N 3.24Å; K462-V465 PolarHBondContact O-N 3.32Å; K462-N466 PolarHBondContact O-N 2.94Å; K462-N466 PolarHBondContact O-ND2 3.43Å; K462-N466 PolarHBondContact O-OD1 2.85Å; K462-L510 HydrophobicContact CB-CD1 4.23Å; K462-L510 HydrophobicContact CG-CD2 4.3Å
463	M	87.8	Confident	88.1	Confident	53 Å²	53	41.9 Å²	41.9	26%	0.261	22%	0.224	S	C	.	.	H	α-helix	trans	-63.2	-42.9	175.1	-67.2	-168.1	-70.8	0	0	112	A401 S459 S460 M461 N466 A467	A401-M463 HydrophobicContact CB-CE 4.43Å; S459-M463 PolarHBondContact O-N 3.26Å; S460-M463 PolarHBondContact O-N 2.9Å; M461-M463 PolarHBondContact O-N 3.36Å; M463-N466 PolarHBondContact O-N 2.95Å; M463-A467 PolarHBondContact O-N 2.89Å
464	F	90.9	Very high	87.5	Confident	1 Å²	1	47.5 Å²	47.5	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-49.6	174.4	166.6	-96.7	0	0	0	111.7	L424 F428 F429 S460 M461 N466 A467 F468 L507	L424-F464 HydrophobicContact CD2-CD2 4.41Å; L424-F464 HydrophobicContact CD2-CE2 4.07Å; L424-F464 HydrophobicContact CG-CD2 4.21Å; L424-F464 HydrophobicContact CG-CE2 3.89Å; F428-F464 HydrophobicContact CB-CD2 3.72Å; F428-F464 HydrophobicContact CB-CE2 4.19Å; F428-F464 HydrophobicContact CD1-CB 3.95Å; F428-F464 HydrophobicContact CD1-CD1 4.34Å; F428-F464 AromaticContact CD1-CD2 3.66Å; F428-F464 HydrophobicContact CD1-CD2 3.66Å; F428-F464 HydrophobicContact CD1-CE2 4.25Å; F428-F464 AromaticContact CD1-CG 3.71Å; F428-F464 HydrophobicContact CD1-CG 3.71Å; F428-F464 HydrophobicContact CD2-CB 3.83Å; F428-F464 HydrophobicContact CD2-CD2 4.24Å; F428-F464 HydrophobicContact CD2-CG 4.33Å; F428-F464 HydrophobicContact CE1-CB 3.86Å; F428-F464 HydrophobicContact CE1-CD1 4.36Å; F428-F464 HydrophobicContact CE1-CD2 4.37Å; F428-F464 AromaticContact CE1-CG 3.94Å; F428-F464 HydrophobicContact CE1-CG 3.94Å; F428-F464 HydrophobicContact CE2-CB 3.72Å; F428-F464 HydrophobicContact CG-CB 3.94Å; F428-F464 AromaticContact CG-CD2 3.59Å; F428-F464 HydrophobicContact CG-CD2 3.59Å; F428-F464 HydrophobicContact CG-CE2 4.37Å; F428-F464 AromaticContact CG-CG 3.92Å; F428-F464 HydrophobicContact CG-CG 3.92Å; F428-F464 HydrophobicContact CZ-CB 3.74Å; F428-F464 HydrophobicContact CZ-CG 4.35Å; F429-F464 HydrophobicContact CE2-CE1 4.39Å; F429-F464 HydrophobicContact CE2-CE2 4.47Å; F429-F464 HydrophobicContact CE2-CZ 4.03Å; F429-F464 HydrophobicContact CZ-CE1 4.44Å; S460-F464 PolarHBondContact O-N 3.49Å; M461-F464 PolarHBondContact O-N 3.45Å; M461-F464 HydrophobicContact SD-CD1 3.86Å; F464-N466 VanDerWaalsContact C-N 3.32Å; F464-N466 PolarHBondContact O-N 3.39Å; F464-A467 PolarHBondContact O-N 2.98Å; F464-A467 VanDerWaalsContact O-N 3.16Å; F464-F468 HydrophobicContact CE1-CB 4.44Å; F464-F468 HydrophobicContact CZ-CB 4.45Å; F464-F468 HydrophobicContact CZ-CD2 4.16Å; F464-F468 WeakPolarHBondContact O-CB 3.17Å; F464-F468 PolarHBondContact O-N 2.85Å; F464-L507 HydrophobicContact CE1-CD1 4.24Å
465	V	90.9	Very high	86.3	Confident	3 Å²	3	46 Å²	46	2%	0.018	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-39.5	-179.9	175	0	0	0	0	111.2	M461 K462 A467 F468 S469 L507 L510 L511	M461-V465 HydrophobicContact CG-CG2 4.43Å; M461-V465 WeakPolarHBondContact O-CG2 3.09Å; M461-V465 PolarHBondContact O-N 2.87Å; M461-V465 HydrophobicContact SD-CG2 4.35Å; K462-V465 PolarHBondContact O-N 3.32Å; V465-A467 VanDerWaalsContact C-N 3.33Å; V465-A467 PolarHBondContact O-N 3.04Å; V465-F468 PolarHBondContact O-N 2.93Å; V465-S469 VanDerWaalsContact O-CB 3.31Å; V465-S469 WeakPolarHBondContact O-CB 3.26Å; V465-S469 PolarHBondContact O-N 3.48Å; V465-S469 PolarHBondContact O-OG 2.98Å; V465-S469 VanDerWaalsContact O-OG 3.12Å; V465-L507 HydrophobicContact CG2-CD1 3.73Å; V465-L510 HydrophobicContact CB-CB 4.19Å; V465-L510 HydrophobicContact CB-CD1 4.24Å; V465-L510 HydrophobicContact CG1-CB 3.84Å; V465-L510 HydrophobicContact CG2-CB 4.04Å; V465-L510 HydrophobicContact CG2-CD1 3.91Å; V465-L511 HydrophobicContact CG1-CD2 3.8Å; V465-L511 HydrophobicContact CG1-CG 4.28Å
466	N	88.8	Confident	85.3	Confident	105 Å²	105	50.8 Å²	50.8	56%	0.561	26%	0.26	S	S	*	.	H	α-helix	trans	-60.2	-42.7	175.4	-70.8	-13.3	0	0	0	112.3	K462 M463 F464 G470	K462-N466 PolarHBondContact O-N 2.94Å; K462-N466 PolarHBondContact O-ND2 3.43Å; K462-N466 PolarHBondContact O-OD1 2.85Å; M463-N466 PolarHBondContact O-N 2.95Å; F464-N466 VanDerWaalsContact C-N 3.32Å; F464-N466 PolarHBondContact O-N 3.39Å; N466-G470 PolarHBondContact O-N 3.43Å
467	A	86.5	Confident	84.3	Confident	31 Å²	31	52.4 Å²	52.4	26%	0.256	27%	0.269	S	S	.	.	H	α-helix	trans	-69.3	-39.3	176.5	0	0	0	0	0	112.1	I408 M463 F464 V465 Q471	I408-A467 HydrophobicContact CG2-CB 4.02Å; M463-A467 PolarHBondContact O-N 2.89Å; F464-A467 PolarHBondContact O-N 2.98Å; F464-A467 VanDerWaalsContact O-N 3.16Å; V465-A467 VanDerWaalsContact C-N 3.33Å; V465-A467 PolarHBondContact O-N 3.04Å; A467-Q471 PolarHBondContact O-N 3.4Å
468	F	89	Confident	83.9	Confident	1 Å²	1	55.2 Å²	55.2	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-50.3	176.3	176.7	-86.7	0	0	0	111.4	I421 L424 F464 V465 G470 Q471 V472 F473 C485 V486 A489 L511	I421-F468 HydrophobicContact CD1-CE2 4.34Å; I421-F468 HydrophobicContact CG1-CD2 4.43Å; I421-F468 HydrophobicContact CG1-CE2 4.42Å; I421-F468 HydrophobicContact CG2-CD2 4.13Å; I421-F468 HydrophobicContact CG2-CE2 3.67Å; L424-F468 HydrophobicContact CD2-CB 4.41Å; F464-F468 HydrophobicContact CE1-CB 4.44Å; F464-F468 HydrophobicContact CZ-CB 4.45Å; F464-F468 HydrophobicContact CZ-CD2 4.16Å; F464-F468 WeakPolarHBondContact O-CB 3.17Å; F464-F468 PolarHBondContact O-N 2.85Å; V465-F468 PolarHBondContact O-N 2.93Å; F468-G470 VanDerWaalsContact C-N 3.34Å; F468-G470 PolarHBondContact O-N 3.23Å; F468-Q471 PolarHBondContact O-N 3.49Å; F468-Q471 VanDerWaalsContact O-N 3.09Å; F468-V472 HydrophobicContact CD1-CB 4.46Å; F468-V472 HydrophobicContact CD1-CG2 4.11Å; F468-V472 HydrophobicContact CD2-CG2 4.22Å; F468-V472 HydrophobicContact CE1-CB 4.15Å; F468-V472 HydrophobicContact CE1-CG1 4.33Å; F468-V472 HydrophobicContact CE1-CG2 3.8Å; F468-V472 HydrophobicContact CE2-CG2 3.94Å; F468-V472 HydrophobicContact CG-CG2 4.3Å; F468-V472 HydrophobicContact CZ-CB 4.47Å; F468-V472 HydrophobicContact CZ-CG2 3.72Å; F468-V472 WeakPolarHBondContact O-CB 3.44Å; F468-V472 WeakPolarHBondContact O-CG2 3.49Å; F468-V472 PolarHBondContact O-N 2.99Å; F468-F473 HydrophobicContact CE1-CE2 4.14Å; F468-C485 HydrophobicContact CE2-CB 4.18Å; F468-C485 HydrophobicContact CZ-CB 4.01Å; F468-V486 HydrophobicContact CE1-CG2 4.06Å; F468-V486 HydrophobicContact CZ-CG2 3.96Å; F468-A489 HydrophobicContact CE2-CB 4.15Å; F468-A489 HydrophobicContact CZ-CB 4.48Å; F468-L511 HydrophobicContact CD1-CD2 3.82Å; F468-L511 HydrophobicContact CE1-CD2 3.84Å
469	S	87.3	Confident	83.5	Confident	11 Å²	11	47.5 Å²	47.5	8%	0.077	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-38.7	-177	-66.6	0	0	0	0	112.1	V465 Q471 V472 F473 D474 D514	V465-S469 VanDerWaalsContact O-CB 3.31Å; V465-S469 WeakPolarHBondContact O-CB 3.26Å; V465-S469 PolarHBondContact O-N 3.48Å; V465-S469 PolarHBondContact O-OG 2.98Å; V465-S469 VanDerWaalsContact O-OG 3.12Å; S469-Q471 PolarHBondContact O-N 3.24Å; S469-V472 PolarHBondContact O-N 2.9Å; S469-F473 PolarHBondContact O-N 3.04Å; S469-D474 PolarHBondContact O-N 3.42Å; S469-D514 VanDerWaalsContact CB-OD2 3.23Å; S469-D514 WeakPolarHBondContact CB-OD2 3.3Å; S469-D514 PolarHBondContact OG-OD2 2.94Å
470	G	83.1	Confident	83.2	Confident	33 Å²	33	46.6 Å²	46.6	34%	0.34	25%	0.253	S	S	.	.	H	α-helix	trans	-62.5	-25.2	174.4	0	0	0	0	0	114	N466 F468 D474	N466-G470 PolarHBondContact O-N 3.43Å; F468-G470 VanDerWaalsContact C-N 3.34Å; F468-G470 PolarHBondContact O-N 3.23Å; G470-D474 WeakPolarHBondContact CA-OD2 3.41Å; G470-D474 WeakPolarHBondContact O-CB 3.45Å
471	Q	80.9	Confident	83	Confident	34 Å²	34	49 Å²	49	16%	0.159	27%	0.268	C	S	.	.	H	α-helix	trans	-97.4	-26.4	178.2	-171.9	60.1	35.4	0	0	113.5	T417 Y420 A467 F468 S469 S475	T417-Q471 HydrophobicContact CG2-CG 3.94Å; Y420-Q471 HydrophobicContact CD1-CB 4.45Å; Y420-Q471 HydrophobicContact CD1-CG 3.69Å; Y420-Q471 HydrophobicContact CE1-CB 4.08Å; Y420-Q471 HydrophobicContact CE1-CG 3.74Å; A467-Q471 PolarHBondContact O-N 3.4Å; F468-Q471 PolarHBondContact O-N 3.49Å; F468-Q471 VanDerWaalsContact O-N 3.09Å; S469-Q471 PolarHBondContact O-N 3.24Å; Q471-S475 VanDerWaalsContact O-CB 3.28Å; Q471-S475 WeakPolarHBondContact O-CB 3.39Å; Q471-S475 PolarHBondContact O-OG 2.94Å
472	V	83	Confident	82.8	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-93.2	-43.4	-176.4	174.4	0	0	0	0	112.7	I421 F468 S469 S475 A482 C485	I421-V472 HydrophobicContact CD1-CG2 3.14Å; I421-V472 HydrophobicContact CG1-CG2 4.21Å; F468-V472 HydrophobicContact CD1-CB 4.46Å; F468-V472 HydrophobicContact CD1-CG2 4.11Å; F468-V472 HydrophobicContact CD2-CG2 4.22Å; F468-V472 HydrophobicContact CE1-CB 4.15Å; F468-V472 HydrophobicContact CE1-CG1 4.33Å; F468-V472 HydrophobicContact CE1-CG2 3.8Å; F468-V472 HydrophobicContact CE2-CG2 3.94Å; F468-V472 HydrophobicContact CG-CG2 4.3Å; F468-V472 HydrophobicContact CZ-CB 4.47Å; F468-V472 HydrophobicContact CZ-CG2 3.72Å; F468-V472 WeakPolarHBondContact O-CB 3.44Å; F468-V472 WeakPolarHBondContact O-CG2 3.49Å; F468-V472 PolarHBondContact O-N 2.99Å; S469-V472 PolarHBondContact O-N 2.9Å; V472-S475 PolarHBondContact O-OG 3.31Å; V472-A482 HydrophobicContact CG1-CB 3.65Å; V472-C485 HydrophobicContact CG2-CB 4.09Å
473	F	81.5	Confident	82.6	Confident	38 Å²	38	43.6 Å²	43.6	17%	0.167	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-33	-170.4	-61.1	-68.3	0	0	0	112.6	F468 S469 A482 V486 L511 D514 I515 A518	F468-F473 HydrophobicContact CE1-CE2 4.14Å; S469-F473 PolarHBondContact O-N 3.04Å; F473-A482 HydrophobicContact CE1-CB 4.24Å; F473-V486 HydrophobicContact CZ-CG2 4.28Å; F473-L511 HydrophobicContact CE2-CD2 4.11Å; F473-D514 HydrophobicContact CD2-CB 3.44Å; F473-D514 VanDerWaalsContact CD2-CB 3.44Å; F473-D514 HydrophobicContact CE2-CB 3.61Å; F473-D514 HydrophobicContact CG-CB 3.96Å; F473-D514 HydrophobicContact CZ-CB 4.25Å; F473-I515 HydrophobicContact CE1-CG1 4.23Å; F473-I515 HydrophobicContact CZ-CG1 3.71Å; F473-A518 HydrophobicContact CD1-CB 3.64Å; F473-A518 HydrophobicContact CE1-CB 3.85Å
474	D	75.3	Confident	82.6	Confident	132 Å²	132	44 Å²	44	71%	0.706	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-19.3	179.1	-64.3	-21	0	0	0	112.9	S469 G470 K476	S469-D474 PolarHBondContact O-N 3.42Å; G470-D474 WeakPolarHBondContact CA-OD2 3.41Å; G470-D474 WeakPolarHBondContact O-CB 3.45Å; D474-K476 VanDerWaalsContact C-N 3.25Å; D474-K476 PolarHBondContact O-N 3Å
475	S	64.4	Low	82.5	Confident	45 Å²	45	44 Å²	44	32%	0.315	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	7.3	-175.3	53	0	0	0	0	115.3	Q471 V472 E477	Q471-S475 VanDerWaalsContact O-CB 3.28Å; Q471-S475 WeakPolarHBondContact O-CB 3.39Å; Q471-S475 PolarHBondContact O-OG 2.94Å; V472-S475 PolarHBondContact O-OG 3.31Å; S475-E477 PolarHBondContact O-N 2.8Å; S475-E477 WeakPolarHBondContact OG-CG 3.29Å; S475-E477 PolarHBondContact OG-OE1 3.45Å; S475-E477 VanDerWaalsContact OG-OE1 3.11Å
476	K	69	Low	82.4	Confident	205 Å²	205	43.9 Å²	43.9	89%	0.891	25%	0.246	S	C	*	.			trans	52.4	31.1	-175.5	-60.6	-174.9	179.1	-177.7	0	113.8	D474	D474-K476 VanDerWaalsContact C-N 3.25Å; D474-K476 PolarHBondContact O-N 3Å
477	E	70.9	Confident	82.4	Confident	54 Å²	54	43.6 Å²	43.6	25%	0.252	24%	0.24	S	C	.	.			trans	-72.3	161.9	179	-81.9	178.9	-144.9	0	0	113.1	T417 S475	T417-E477 VanDerWaalsContact CB-CD 3.44Å; T417-E477 WeakPolarHBondContact CB-OE1 3.4Å; T417-E477 WeakPolarHBondContact CB-OE2 3.31Å; T417-E477 WeakPolarHBondContact CG2-OE1 3.34Å; T417-E477 WeakPolarHBondContact CG2-OE2 3.22Å; T417-E477 VanDerWaalsContact OG1-CD 3.26Å; T417-E477 PolarHBondContact OG1-OE1 3.29Å; T417-E477 PolarHBondContact OG1-OE2 3.37Å; S475-E477 PolarHBondContact O-N 2.8Å; S475-E477 WeakPolarHBondContact OG-CG 3.29Å; S475-E477 PolarHBondContact OG-OE1 3.45Å; S475-E477 VanDerWaalsContact OG-OE1 3.11Å
478	S	80.4	Confident	82.5	Confident	59 Å²	59	42.7 Å²	42.7	41%	0.413	23%	0.231	S	C	.	.			trans	-64.6	147.9	177.8	71.5	0	0	0	0	111.4	S480 T481 A482	S478-S480 PolarHBondContact O-N 2.82Å; S478-S480 VanDerWaalsContact O-N 3.13Å; S478-T481 PolarHBondContact N-OG1 3.22Å; S478-T481 PolarHBondContact O-N 3.18Å; S478-T481 VanDerWaalsContact O-N 3.16Å; S478-T481 PolarHBondContact O-OG1 3.26Å; S478-T481 WeakPolarHBondContact OG-CG2 3.34Å; S478-T481 PolarHBondContact OG-N 3.4Å; S478-T481 VanDerWaalsContact OG-N 3.16Å; S478-T481 PolarHBondContact OG-OG1 3.48Å; S478-A482 PolarHBondContact O-N 3.47Å; S478-A482 VanDerWaalsContact O-N 3.1Å
479	L	83	Confident	82.6	Confident	6 Å²	6	42.6 Å²	42.6	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-57.4	-30.7	175.3	-172.2	64.9	0	0	0	112.3	A482 A483 L519 Y522 F591 E594 L598	L479-A482 PolarHBondContact O-N 2.9Å; L479-A483 WeakPolarHBondContact O-CB 3.33Å; L479-A483 PolarHBondContact O-N 3.43Å; L479-L519 HydrophobicContact CD1-CD2 4.18Å; L479-L519 HydrophobicContact CD2-CD2 4.08Å; L479-Y522 HydrophobicContact CB-CD1 4.36Å; L479-Y522 HydrophobicContact CB-CD2 3.96Å; L479-Y522 HydrophobicContact CB-CE1 4.43Å; L479-Y522 HydrophobicContact CB-CE2 4.09Å; L479-Y522 HydrophobicContact CB-CG 4.09Å; L479-Y522 HydrophobicContact CD2-CD1 3.82Å; L479-Y522 HydrophobicContact CD2-CE1 4.2Å; L479-Y522 HydrophobicContact CD2-CG 4.1Å; L479-F591 HydrophobicContact CD2-CD2 3.68Å; L479-F591 HydrophobicContact CD2-CE2 3.9Å; L479-E594 HydrophobicContact CD2-CB 3.92Å; L479-E594 HydrophobicContact CG-CB 3.96Å; L479-L598 HydrophobicContact CD1-CD1 3.6Å; L479-L598 HydrophobicContact CG-CD1 4.27Å
480	S	85.1	Confident	82.6	Confident	47 Å²	47	44 Å²	44	33%	0.329	24%	0.235	S	C	.	.	H	α-helix	trans	-67.9	-45	177.8	-168.6	0	0	0	0	112.6	S478 A482 A483 E484 E594	S478-S480 PolarHBondContact O-N 2.82Å; S478-S480 VanDerWaalsContact O-N 3.13Å; S480-A482 VanDerWaalsContact C-N 3.33Å; S480-A482 PolarHBondContact O-N 2.9Å; S480-A483 PolarHBondContact O-N 3.15Å; S480-E484 PolarHBondContact O-N 3.47Å; S480-E594 WeakPolarHBondContact CB-OE1 3.3Å; S480-E594 PolarHBondContact OG-OE1 3.11Å
481	T	84.7	Confident	82.8	Confident	51 Å²	51	47.4 Å²	47.4	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-40.7	174.4	48.1	0	0	0	0	111	S478 A483 E484 C485	S478-T481 PolarHBondContact N-OG1 3.22Å; S478-T481 PolarHBondContact O-N 3.18Å; S478-T481 VanDerWaalsContact O-N 3.16Å; S478-T481 PolarHBondContact O-OG1 3.26Å; S478-T481 WeakPolarHBondContact OG-CG2 3.34Å; S478-T481 PolarHBondContact OG-N 3.4Å; S478-T481 VanDerWaalsContact OG-N 3.16Å; S478-T481 PolarHBondContact OG-OG1 3.48Å; T481-A483 PolarHBondContact O-N 3.06Å; T481-E484 PolarHBondContact O-N 2.89Å; T481-C485 WeakPolarHBondContact O-CB 3.48Å; T481-C485 PolarHBondContact O-N 3.46Å; T481-C485 PolarHBondContact O-SG 3.36Å
482	A	86.4	Confident	83.1	Confident	4 Å²	4	47.3 Å²	47.3	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-42	174.5	0	0	0	0	0	112.6	V472 F473 S478 L479 S480 C485 V486	V472-A482 HydrophobicContact CG1-CB 3.65Å; F473-A482 HydrophobicContact CE1-CB 4.24Å; S478-A482 PolarHBondContact O-N 3.47Å; S478-A482 VanDerWaalsContact O-N 3.1Å; L479-A482 PolarHBondContact O-N 2.9Å; S480-A482 VanDerWaalsContact C-N 3.33Å; S480-A482 PolarHBondContact O-N 2.9Å; A482-C485 PolarHBondContact O-N 3.04Å; A482-V486 WeakPolarHBondContact O-CG2 3.36Å; A482-V486 PolarHBondContact O-N 3.47Å
483	A	86.7	Confident	83.3	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-45.1	177.4	0	0	0	0	0	112.7	L479 S480 T481 C485 V486 K487 E594 K597 L598	L479-A483 WeakPolarHBondContact O-CB 3.33Å; L479-A483 PolarHBondContact O-N 3.43Å; S480-A483 PolarHBondContact O-N 3.15Å; T481-A483 PolarHBondContact O-N 3.06Å; A483-C485 VanDerWaalsContact C-N 3.35Å; A483-V486 PolarHBondContact O-N 2.98Å; A483-K487 WeakPolarHBondContact O-CB 3.32Å; A483-K487 PolarHBondContact O-N 3.43Å; A483-E594 VanDerWaalsContact CB-OE2 3.32Å; A483-E594 WeakPolarHBondContact CB-OE2 3.37Å; A483-K597 HydrophobicContact CB-CB 4.13Å; A483-K597 HydrophobicContact CB-CD 4.14Å; A483-L598 HydrophobicContact CB-CD1 4.21Å; A483-L598 HydrophobicContact CB-CD2 4.24Å; A483-L598 HydrophobicContact CB-CG 3.93Å
484	E	87.8	Confident	83.5	Confident	62 Å²	62	52.1 Å²	52.1	29%	0.29	26%	0.262	S	S	.	.	H	α-helix	trans	-64.8	-39.3	175.3	-67	-57.6	155	0	0	111.7	L418 S480 T481 V486 K487 V488 K597	L418-E484 HydrophobicContact CD1-CB 4.12Å; S480-E484 PolarHBondContact O-N 3.47Å; T481-E484 PolarHBondContact O-N 2.89Å; E484-V486 PolarHBondContact O-N 3.45Å; E484-K487 WeakPolarHBondContact O-CB 3.45Å; E484-K487 PolarHBondContact O-N 2.98Å; E484-V488 VanDerWaalsContact O-CG2 3.29Å; E484-V488 WeakPolarHBondContact O-CG2 3.45Å; E484-V488 PolarHBondContact O-N 3.31Å; E484-K597 IonicContact OE1-NZ 3.9Å; E484-K597 PolarHBondContact OE1-NZ 3.47Å; E484-K597 VanDerWaalsContact OE1-NZ 3.08Å
485	C	88	Confident	83.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-63.5	-43	177.1	-68.8	0	0	0	0	112.6	I421 F468 V472 T481 A482 A483 K487 V488 A489	I421-C485 HydrophobicContact CD1-CB 3.68Å; I421-C485 WeakPolarHBondContact CD1-SG 3.36Å; I421-C485 HydrophobicContact CG2-CB 4.12Å; F468-C485 HydrophobicContact CE2-CB 4.18Å; F468-C485 HydrophobicContact CZ-CB 4.01Å; V472-C485 HydrophobicContact CG2-CB 4.09Å; T481-C485 WeakPolarHBondContact O-CB 3.48Å; T481-C485 PolarHBondContact O-N 3.46Å; T481-C485 PolarHBondContact O-SG 3.36Å; A482-C485 PolarHBondContact O-N 3.04Å; A483-C485 VanDerWaalsContact C-N 3.35Å; C485-K487 VanDerWaalsContact C-N 3.31Å; C485-V488 PolarHBondContact O-N 3.5Å; C485-A489 PolarHBondContact O-N 3.24Å; C485-A489 VanDerWaalsContact O-N 3.08Å
486	V	88.6	Confident	84.6	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-36.8	175.5	170.2	0	0	0	0	110.8	F468 F473 A482 A483 E484 A489 K490 L511 I515 L598	F468-V486 HydrophobicContact CE1-CG2 4.06Å; F468-V486 HydrophobicContact CZ-CG2 3.96Å; F473-V486 HydrophobicContact CZ-CG2 4.28Å; A482-V486 WeakPolarHBondContact O-CG2 3.36Å; A482-V486 PolarHBondContact O-N 3.47Å; A483-V486 PolarHBondContact O-N 2.98Å; E484-V486 PolarHBondContact O-N 3.45Å; V486-A489 PolarHBondContact O-N 3.45Å; V486-K490 HydrophobicContact CG1-CD 4.39Å; V486-K490 WeakPolarHBondContact O-CG 3.32Å; V486-K490 PolarHBondContact O-N 3.43Å; V486-L511 HydrophobicContact CG1-CD1 4.39Å; V486-I515 HydrophobicContact CG1-CD1 4.49Å; V486-L598 HydrophobicContact CB-CD2 3.74Å; V486-L598 HydrophobicContact CG1-CD2 3.9Å; V486-L598 HydrophobicContact CG2-CD2 3.81Å
487	K	88.3	Confident	85.2	Confident	99 Å²	99	41 Å²	41	43%	0.43	21%	0.21	S	C	.	.	H	α-helix	trans	-61.6	-46.9	175	-178.2	-175.5	169.7	-167.7	0	111.7	A483 E484 C485 A489 K490 E491	A483-K487 WeakPolarHBondContact O-CB 3.32Å; A483-K487 PolarHBondContact O-N 3.43Å; E484-K487 WeakPolarHBondContact O-CB 3.45Å; E484-K487 PolarHBondContact O-N 2.98Å; C485-K487 VanDerWaalsContact C-N 3.31Å; K487-A489 VanDerWaalsContact C-N 3.34Å; K487-A489 PolarHBondContact O-N 3.14Å; K487-K490 WeakPolarHBondContact O-CB 3.07Å; K487-K490 PolarHBondContact O-N 3.5Å; K487-K490 VanDerWaalsContact O-N 3.15Å; K487-E491 WeakPolarHBondContact CE-OE1 3.44Å; K487-E491 WeakPolarHBondContact O-CG 3.21Å; K487-E491 PolarHBondContact O-N 3.33Å
488	V	89.7	Confident	85.5	Confident	11 Å²	11	46.5 Å²	46.5	7%	0.067	24%	0.235	C	C	.	.	H	α-helix	trans	-59.1	-45.3	176.6	172.2	0	0	0	0	111.1	L418 H422 E484 C485 K490 E491 H492	L418-V488 HydrophobicContact CD1-CG2 4.46Å; H422-V488 WeakPolarHBondContact CE1-CG2 3.24Å; E484-V488 VanDerWaalsContact O-CG2 3.29Å; E484-V488 WeakPolarHBondContact O-CG2 3.45Å; E484-V488 PolarHBondContact O-N 3.31Å; C485-V488 PolarHBondContact O-N 3.5Å; V488-K490 VanDerWaalsContact C-N 3.33Å; V488-K490 PolarHBondContact O-N 3.17Å; V488-E491 PolarHBondContact O-N 2.94Å; V488-H492 PolarHBondContact O-CD2 3.49Å; V488-H492 PolarHBondContact O-N 2.91Å; V488-H492 VanDerWaalsContact O-N 3.09Å
489	A	89.4	Confident	85.2	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-39.8	176.6	0	0	0	0	0	112.3	F468 C485 V486 K487 C493 L507	F468-A489 HydrophobicContact CE2-CB 4.15Å; F468-A489 HydrophobicContact CZ-CB 4.48Å; C485-A489 PolarHBondContact O-N 3.24Å; C485-A489 VanDerWaalsContact O-N 3.08Å; V486-A489 PolarHBondContact O-N 3.45Å; K487-A489 VanDerWaalsContact C-N 3.34Å; K487-A489 PolarHBondContact O-N 3.14Å; A489-C493 VanDerWaalsContact O-CB 3.26Å; A489-C493 WeakPolarHBondContact O-CB 3.4Å; A489-C493 PolarHBondContact O-N 3.42Å; A489-L507 HydrophobicContact CB-CD2 4.28Å
490	K	87.7	Confident	84.9	Confident	41 Å²	41	49.5 Å²	49.5	18%	0.178	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-42.9	174.6	-74.1	173.1	-179.2	-178.8	0	112.3	V486 K487 V488 C493 K494	V486-K490 HydrophobicContact CG1-CD 4.39Å; V486-K490 WeakPolarHBondContact O-CG 3.32Å; V486-K490 PolarHBondContact O-N 3.43Å; K487-K490 WeakPolarHBondContact O-CB 3.07Å; K487-K490 PolarHBondContact O-N 3.5Å; K487-K490 VanDerWaalsContact O-N 3.15Å; V488-K490 VanDerWaalsContact C-N 3.33Å; V488-K490 PolarHBondContact O-N 3.17Å; K490-C493 PolarHBondContact O-N 2.89Å; K490-K494 WeakPolarHBondContact O-CG 3.48Å; K490-K494 PolarHBondContact O-N 3.5Å
491	E	88.9	Confident	84.8	Confident	103 Å²	103	48.2 Å²	48.2	48%	0.481	25%	0.252	S	S	.	.	H	α-helix	trans	-63.2	-46.5	-179.6	-74.6	175.2	-174.6	0	0	111.4	K487 V488 C493 K494 Q495	K487-E491 WeakPolarHBondContact CE-OE1 3.44Å; K487-E491 WeakPolarHBondContact O-CG 3.21Å; K487-E491 PolarHBondContact O-N 3.33Å; V488-E491 PolarHBondContact O-N 2.94Å; E491-C493 VanDerWaalsContact C-N 3.33Å; E491-C493 PolarHBondContact O-N 3.29Å; E491-K494 WeakPolarHBondContact O-CB 3.4Å; E491-K494 PolarHBondContact O-N 3.5Å; E491-Q495 PolarHBondContact O-N 2.92Å
492	H	86.1	Confident	84.8	Confident	33 Å²	33	50 Å²	50	15%	0.153	26%	0.26	C	S	.	.	H	α-helix	trans	-66.7	-34.1	174.1	-75.1	-68.2	0	0	0	113	F429 V488 K494 Q495	F429-H492 HydrophobicContact CB-CB 4.29Å; F429-H492 HydrophobicContact CD1-CB 4.35Å; F429-H492 HydrophobicContact CD2-CB 3.26Å; F429-H492 HydrophobicContact CE2-CB 3.56Å; F429-H492 HydrophobicContact CG-CB 3.73Å; F429-H492 HydrophobicContact CZ-CB 4.23Å; V488-H492 PolarHBondContact O-CD2 3.49Å; V488-H492 PolarHBondContact O-N 2.91Å; V488-H492 VanDerWaalsContact O-N 3.09Å; H492-K494 VanDerWaalsContact C-N 3.3Å; H492-K494 PolarHBondContact O-N 3.4Å; H492-Q495 PolarHBondContact ND1-OE1 3.44Å; H492-Q495 WeakPolarHBondContact O-CB 3.44Å; H492-Q495 PolarHBondContact O-N 2.61Å
493	C	87	Confident	84.8	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.4	-34.2	175.6	-166	0	0	0	0	112.2	F429 A489 K490 E491 Q495 L496 L507	F429-C493 HydrophobicContact CE1-CB 3.93Å; F429-C493 HydrophobicContact CZ-CB 3.96Å; A489-C493 VanDerWaalsContact O-CB 3.26Å; A489-C493 WeakPolarHBondContact O-CB 3.4Å; A489-C493 PolarHBondContact O-N 3.42Å; K490-C493 PolarHBondContact O-N 2.89Å; E491-C493 VanDerWaalsContact C-N 3.33Å; E491-C493 PolarHBondContact O-N 3.29Å; C493-Q495 VanDerWaalsContact C-N 3.29Å; C493-Q495 PolarHBondContact O-N 3.09Å; C493-L496 WeakPolarHBondContact O-CB 3.25Å; C493-L496 PolarHBondContact O-N 3.26Å; C493-L507 HydrophobicContact CB-CD2 3.89Å
494	K	85.8	Confident	84.7	Confident	140 Å²	140	51.2 Å²	51.2	61%	0.609	27%	0.267	S	S	*	.	H	α-helix	trans	-65.2	-30.5	173.4	-74.4	178.5	179.1	-177.3	0	113	K490 E491 H492 L496 S497	K490-K494 WeakPolarHBondContact O-CG 3.48Å; K490-K494 PolarHBondContact O-N 3.5Å; E491-K494 WeakPolarHBondContact O-CB 3.4Å; E491-K494 PolarHBondContact O-N 3.5Å; H492-K494 VanDerWaalsContact C-N 3.3Å; H492-K494 PolarHBondContact O-N 3.4Å; K494-L496 PolarHBondContact O-N 3.49Å; K494-S497 WeakPolarHBondContact O-CB 3.25Å; K494-S497 PolarHBondContact O-N 3.11Å; K494-S497 PolarHBondContact O-OG 3.47Å
495	Q	82.9	Confident	84.7	Confident	95 Å²	95	54.3 Å²	54.3	44%	0.444	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-29.8	175.6	-64.8	172.5	-21.2	0	0	111.8	E491 H492 C493 S497 E498	E491-Q495 PolarHBondContact O-N 2.92Å; H492-Q495 PolarHBondContact ND1-OE1 3.44Å; H492-Q495 WeakPolarHBondContact O-CB 3.44Å; H492-Q495 PolarHBondContact O-N 2.61Å; C493-Q495 VanDerWaalsContact C-N 3.29Å; C493-Q495 PolarHBondContact O-N 3.09Å; Q495-S497 PolarHBondContact O-N 2.86Å; Q495-E498 WeakPolarHBondContact O-CB 3.41Å; Q495-E498 PolarHBondContact O-N 3.26Å
496	L	80.7	Confident	84.6	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-66.6	-26	173.6	-66.2	163.9	0	0	0	112.8	F429 L432 C493 K494 E498 I499 L501 L503	F429-L496 HydrophobicContact CD1-CD1 3.48Å; F429-L496 VanDerWaalsContact CD1-CD1 3.48Å; F429-L496 HydrophobicContact CD1-CD2 4.43Å; F429-L496 HydrophobicContact CD1-CG 3.9Å; F429-L496 HydrophobicContact CE1-CD1 3.51Å; F429-L496 HydrophobicContact CE1-CG 4.35Å; L432-L496 HydrophobicContact CB-CD2 4.29Å; L432-L496 HydrophobicContact CD2-CD1 3.66Å; L432-L496 HydrophobicContact CD2-CD2 3.65Å; L432-L496 HydrophobicContact CD2-CG 4.32Å; L432-L496 HydrophobicContact CG-CD2 3.87Å; C493-L496 WeakPolarHBondContact O-CB 3.25Å; C493-L496 PolarHBondContact O-N 3.26Å; K494-L496 PolarHBondContact O-N 3.49Å; L496-E498 PolarHBondContact O-N 3.03Å; L496-I499 PolarHBondContact O-N 3.04Å; L496-L501 CarbonylContact C-O 3.31Å; L496-L501 VanDerWaalsContact C-O 3.31Å; L496-L501 WeakPolarHBondContact CB-O 3.37Å; L496-L501 PolarHBondContact O-N 3.21Å; L496-L503 HydrophobicContact CD1-CD1 4.06Å
497	S	80.9	Confident	84.6	Confident	50 Å²	50	54.7 Å²	54.7	35%	0.35	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-64.7	-22.5	177.6	-49.4	0	0	0	0	112	K494 Q495 I499 G500	K494-S497 WeakPolarHBondContact O-CB 3.25Å; K494-S497 PolarHBondContact O-N 3.11Å; K494-S497 PolarHBondContact O-OG 3.47Å; Q495-S497 PolarHBondContact O-N 2.86Å; S497-I499 PolarHBondContact O-N 2.93Å; S497-G500 PolarHBondContact O-N 3.24Å
498	E	76.6	Confident	84.6	Confident	169 Å²	169	52.6 Å²	52.6	79%	0.79	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-65.2	-25.8	173.6	-62	-178.7	178.4	0	0	112.7	Q495 L496 G500	Q495-E498 WeakPolarHBondContact O-CB 3.41Å; Q495-E498 PolarHBondContact O-N 3.26Å; L496-E498 PolarHBondContact O-N 3.03Å; E498-G500 VanDerWaalsContact C-N 3.3Å
499	I	74.1	Confident	84.5	Confident	59 Å²	59	56.2 Å²	56.2	30%	0.303	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-88.4	-0.9	173.9	-59.5	173.3	0	0	0	111.3	L433 A436 L496 S497	L433-I499 HydrophobicContact CB-CD1 4.36Å; L433-I499 HydrophobicContact CD1-CD1 3.14Å; L433-I499 HydrophobicContact CD1-CG1 4.13Å; L433-I499 HydrophobicContact CG-CD1 3.48Å; L433-I499 VanDerWaalsContact CG-CD1 3.48Å; A436-I499 HydrophobicContact CB-CD1 4.35Å; A436-I499 HydrophobicContact CB-CG2 4.16Å; L496-I499 PolarHBondContact O-N 3.04Å; S497-I499 PolarHBondContact O-N 2.93Å
500	G	78.4	Confident	84.5	Confident	70 Å²	70	58.6 Å²	58.6	72%	0.722	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	13.5	-175.3	0	0	0	0	0	114.1	S497 E498	S497-G500 PolarHBondContact O-N 3.24Å; E498-G500 VanDerWaalsContact C-N 3.3Å
501	L	81.7	Confident	84.6	Confident	20 Å²	20	56.7 Å²	56.7	11%	0.105	30%	0.304	C	S	.	.			trans	-105.3	96.7	173.3	-170.8	73.8	0	0	0	110.3	F453 V454 L496 L503	F453-L501 HydrophobicContact CE1-CD1 4.45Å; F453-L501 HydrophobicContact CE1-CD2 4.18Å; V454-L501 HydrophobicContact CG2-CD1 4.47Å; L496-L501 CarbonylContact C-O 3.31Å; L496-L501 VanDerWaalsContact C-O 3.31Å; L496-L501 WeakPolarHBondContact CB-O 3.37Å; L496-L501 PolarHBondContact O-N 3.21Å; L501-L503 HydrophobicContact CD1-CD2 4.34Å; L501-L503 HydrophobicContact CD2-CD1 3.86Å; L501-L503 HydrophobicContact CD2-CD2 4.42Å; L501-L503 HydrophobicContact CD2-CG 4.05Å; L501-L503 HydrophobicContact CG-CD1 4.35Å; L501-L503 HydrophobicContact CG-CD2 4.17Å; L501-L503 HydrophobicContact CG-CG 3.96Å; L501-L503 PolarHBondContact O-N 3.5Å
502	D	85.9	Confident	84.6	Confident	87 Å²	87	53.3 Å²	53.3	47%	0.465	29%	0.29	S	S	.	.			trans	-87.2	107.2	172.7	-174.7	15.7	0	0	0	111.4	T504 F505	D502-T504 WeakPolarHBondContact OD1-CB 3.48Å; D502-T504 PolarHBondContact OD1-N 3.18Å; D502-T504 PolarHBondContact OD1-OG1 3.11Å; D502-F505 WeakPolarHBondContact O-CE1 3.45Å
503	L	85.7	Confident	84.7	Confident	6 Å²	6	59.7 Å²	59.7	3%	0.031	32%	0.317	C	S	.	.			trans	-105.9	7.5	173.5	-60.6	-179.9	0	0	0	112.8	L432 M461 L496 L501 F505 T506 L507	L432-L503 HydrophobicContact CD2-CD1 3.89Å; M461-L503 HydrophobicContact CE-CB 3.82Å; M461-L503 HydrophobicContact CE-CD1 3.61Å; M461-L503 HydrophobicContact CE-CG 4.38Å; L496-L503 HydrophobicContact CD1-CD1 4.06Å; L501-L503 HydrophobicContact CD1-CD2 4.34Å; L501-L503 HydrophobicContact CD2-CD1 3.86Å; L501-L503 HydrophobicContact CD2-CD2 4.42Å; L501-L503 HydrophobicContact CD2-CG 4.05Å; L501-L503 HydrophobicContact CG-CD1 4.35Å; L501-L503 HydrophobicContact CG-CD2 4.17Å; L501-L503 HydrophobicContact CG-CG 3.96Å; L501-L503 PolarHBondContact O-N 3.5Å; L503-F505 VanDerWaalsContact C-N 3.31Å; L503-F505 PolarHBondContact O-N 2.96Å; L503-T506 WeakPolarHBondContact O-CB 3.37Å; L503-T506 PolarHBondContact O-N 3.49Å; L503-L507 PolarHBondContact O-N 3.36Å
504	T	85.2	Confident	84.7	Confident	25 Å²	25	61.7 Å²	61.7	15%	0.153	33%	0.328	C	S	.	.	H	α-helix	trans	-59.1	-44.7	-174.4	-51	0	0	0	0	110.9	D502 T506 L507 Q508	D502-T504 WeakPolarHBondContact OD1-CB 3.48Å; D502-T504 PolarHBondContact OD1-N 3.18Å; D502-T504 PolarHBondContact OD1-OG1 3.11Å; T504-T506 VanDerWaalsContact C-N 3.29Å; T504-T506 PolarHBondContact O-N 2.88Å; T504-L507 PolarHBondContact O-N 2.9Å; T504-Q508 WeakPolarHBondContact O-CB 3.41Å; T504-Q508 WeakPolarHBondContact O-CG 3.44Å; T504-Q508 PolarHBondContact O-N 3.06Å
505	F	87	Confident	84.9	Confident	127 Å²	127	55 Å²	55	56%	0.557	30%	0.299	S	S	*	.	H	α-helix	trans	-63.3	-34.8	177.7	79.3	-86.3	0	0	0	112.5	D502 L503 S509	D502-F505 WeakPolarHBondContact O-CE1 3.45Å; L503-F505 VanDerWaalsContact C-N 3.31Å; L503-F505 PolarHBondContact O-N 2.96Å; F505-S509 VanDerWaalsContact O-CB 3.24Å; F505-S509 WeakPolarHBondContact O-CB 3.28Å; F505-S509 PolarHBondContact O-N 3.42Å
506	T	87.1	Confident	85.2	Confident	8 Å²	8	54.8 Å²	54.8	5%	0.049	30%	0.296	C	S	.	.	H	α-helix	trans	-71.4	-44.6	179.3	-65.4	0	0	0	0	110.2	R458 M461 L503 T504 Q508 S509 L510	R458-T506 HydrophobicContact CG-CG2 4.12Å; M461-T506 HydrophobicContact CB-CG2 4.32Å; M461-T506 HydrophobicContact CG-CG2 3.98Å; L503-T506 WeakPolarHBondContact O-CB 3.37Å; L503-T506 PolarHBondContact O-N 3.49Å; T504-T506 VanDerWaalsContact C-N 3.29Å; T504-T506 PolarHBondContact O-N 2.88Å; T506-Q508 VanDerWaalsContact C-N 3.33Å; T506-Q508 PolarHBondContact O-N 2.98Å; T506-S509 PolarHBondContact O-N 3.31Å; T506-L510 HydrophobicContact CG2-CD1 3.9Å; T506-L510 HydrophobicContact CG2-CG 4.45Å; T506-L510 WeakPolarHBondContact O-CB 3.45Å; T506-L510 VanDerWaalsContact O-CG 3.26Å; T506-L510 WeakPolarHBondContact O-CG 3.24Å; T506-L510 PolarHBondContact O-N 3.44Å
507	L	88.4	Confident	85.5	Confident	2 Å²	2	58 Å²	58	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-57.8	-47.5	174.1	178.5	63.7	0	0	0	110.7	M461 F464 V465 A489 C493 L503 T504 L510 L511	M461-L507 HydrophobicContact SD-CB 4.41Å; M461-L507 HydrophobicContact SD-CD1 4.09Å; F464-L507 HydrophobicContact CE1-CD1 4.24Å; V465-L507 HydrophobicContact CG2-CD1 3.73Å; A489-L507 HydrophobicContact CB-CD2 4.28Å; C493-L507 HydrophobicContact CB-CD2 3.89Å; L503-L507 PolarHBondContact O-N 3.36Å; T504-L507 PolarHBondContact O-N 2.9Å; L507-L510 PolarHBondContact O-N 3.08Å; L507-L511 HydrophobicContact CD1-CD1 3.69Å; L507-L511 HydrophobicContact CD1-CG 4.2Å; L507-L511 HydrophobicContact CG-CD1 3.88Å; L507-L511 WeakPolarHBondContact O-CB 3.42Å; L507-L511 VanDerWaalsContact O-CG 3.28Å; L507-L511 WeakPolarHBondContact O-CG 3.47Å; L507-L511 PolarHBondContact O-N 2.78Å
508	Q	87.1	Confident	85.8	Confident	54 Å²	54	56.7 Å²	56.7	25%	0.252	31%	0.312	S	S	.	.	H	α-helix	trans	-59.4	-53.1	177.2	-70.8	177.6	-3.8	0	0	111.4	T504 T506 L510 L511 V512 F600	T504-Q508 WeakPolarHBondContact O-CB 3.41Å; T504-Q508 WeakPolarHBondContact O-CG 3.44Å; T504-Q508 PolarHBondContact O-N 3.06Å; T506-Q508 VanDerWaalsContact C-N 3.33Å; T506-Q508 PolarHBondContact O-N 2.98Å; Q508-L510 VanDerWaalsContact C-N 3.29Å; Q508-L510 PolarHBondContact O-N 2.81Å; Q508-L511 PolarHBondContact O-N 2.81Å; Q508-L511 VanDerWaalsContact O-N 3.11Å; Q508-V512 WeakPolarHBondContact O-CG2 3.28Å; Q508-V512 PolarHBondContact O-N 3.3Å; Q508-F600 HydrophobicContact CB-CE1 4.38Å; Q508-F600 VanDerWaalsContact CD-CE1 3.47Å; Q508-F600 HydrophobicContact CG-CD1 3.82Å; Q508-F600 HydrophobicContact CG-CE1 3.41Å; Q508-F600 VanDerWaalsContact CG-CE1 3.41Å; Q508-F600 HydrophobicContact CG-CZ 3.78Å; Q508-F600 VanDerWaalsContact NE2-CE1 3.33Å
509	S	88.8	Confident	86.3	Confident	87 Å²	87	48.7 Å²	48.7	61%	0.608	27%	0.274	S	S	*	.	H	α-helix	trans	-56.4	-40.5	-178.9	176.8	0	0	0	0	113	F505 T506	F505-S509 VanDerWaalsContact O-CB 3.24Å; F505-S509 WeakPolarHBondContact O-CB 3.28Å; F505-S509 PolarHBondContact O-N 3.42Å; T506-S509 PolarHBondContact O-N 3.31Å
510	L	88.6	Confident	87.1	Confident	51 Å²	51	49.9 Å²	49.9	27%	0.267	28%	0.278	S	S	.	.	H	α-helix	trans	-71.9	-37.2	178.6	-67.8	170	0	0	0	112.1	M461 K462 V465 T506 L507 Q508	M461-L510 HydrophobicContact CG-CD1 4.14Å; K462-L510 HydrophobicContact CB-CD1 4.23Å; K462-L510 HydrophobicContact CG-CD2 4.3Å; V465-L510 HydrophobicContact CB-CB 4.19Å; V465-L510 HydrophobicContact CB-CD1 4.24Å; V465-L510 HydrophobicContact CG1-CB 3.84Å; V465-L510 HydrophobicContact CG2-CB 4.04Å; V465-L510 HydrophobicContact CG2-CD1 3.91Å; T506-L510 HydrophobicContact CG2-CD1 3.9Å; T506-L510 HydrophobicContact CG2-CG 4.45Å; T506-L510 WeakPolarHBondContact O-CB 3.45Å; T506-L510 VanDerWaalsContact O-CG 3.26Å; T506-L510 WeakPolarHBondContact O-CG 3.24Å; T506-L510 PolarHBondContact O-N 3.44Å; L507-L510 PolarHBondContact O-N 3.08Å; Q508-L510 VanDerWaalsContact C-N 3.29Å; Q508-L510 PolarHBondContact O-N 2.81Å
511	L	89.3	Confident	87.5	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-78.7	-17.3	179.9	-69.7	173.7	0	0	0	114.1	V465 F468 F473 V486 L507 Q508 K513 D514 I515	V465-L511 HydrophobicContact CG1-CD2 3.8Å; V465-L511 HydrophobicContact CG1-CG 4.28Å; F468-L511 HydrophobicContact CD1-CD2 3.82Å; F468-L511 HydrophobicContact CE1-CD2 3.84Å; F473-L511 HydrophobicContact CE2-CD2 4.11Å; V486-L511 HydrophobicContact CG1-CD1 4.39Å; L507-L511 HydrophobicContact CD1-CD1 3.69Å; L507-L511 HydrophobicContact CD1-CG 4.2Å; L507-L511 HydrophobicContact CG-CD1 3.88Å; L507-L511 WeakPolarHBondContact O-CB 3.42Å; L507-L511 VanDerWaalsContact O-CG 3.28Å; L507-L511 WeakPolarHBondContact O-CG 3.47Å; L507-L511 PolarHBondContact O-N 2.78Å; Q508-L511 PolarHBondContact O-N 2.81Å; Q508-L511 VanDerWaalsContact O-N 3.11Å; L511-K513 VanDerWaalsContact C-N 3.27Å; L511-K513 PolarHBondContact O-N 3.34Å; L511-D514 PolarHBondContact O-N 2.98Å; L511-D514 VanDerWaalsContact O-N 3.16Å; L511-I515 HydrophobicContact CB-CD1 3.82Å; L511-I515 HydrophobicContact CB-CG1 4.34Å; L511-I515 WeakPolarHBondContact O-CB 3.28Å; L511-I515 WeakPolarHBondContact O-CG1 3.34Å; L511-I515 PolarHBondContact O-N 3.43Å
512	V	89.3	Confident	87.8	Confident	32 Å²	32	52 Å²	52	19%	0.194	27%	0.274	C	S	.	.	H	α-helix	trans	-53.1	-45	-176.9	173.2	0	0	0	0	111.8	Q508 D514 K516 E602 L603	Q508-V512 WeakPolarHBondContact O-CG2 3.28Å; Q508-V512 PolarHBondContact O-N 3.3Å; V512-D514 PolarHBondContact O-N 3.1Å; V512-K516 WeakPolarHBondContact O-CB 3.34Å; V512-K516 PolarHBondContact O-N 3.44Å; V512-E602 HydrophobicContact CG1-CB 4.43Å; V512-E602 HydrophobicContact CG2-CB 4.44Å; V512-L603 HydrophobicContact CG1-CD2 4.04Å
513	K	88.8	Confident	87.9	Confident	167 Å²	167	48.7 Å²	48.7	73%	0.726	26%	0.256	S	S	*	.	H	α-helix	trans	-62.9	-45.4	-177.5	-175.1	-173.3	173.5	-168.2	0	111.2	L511 K516 S517	L511-K513 VanDerWaalsContact C-N 3.27Å; L511-K513 PolarHBondContact O-N 3.34Å; K513-K516 PolarHBondContact O-N 3.46Å; K513-S517 PolarHBondContact O-N 2.96Å
514	D	87.6	Confident	88.1	Confident	41 Å²	41	52.4 Å²	52.4	22%	0.219	27%	0.273	C	S	.	.	H	α-helix	trans	-73.4	-41.6	-174.8	-55.4	-33.1	0	0	0	110.9	S469 F473 L511 V512 K516 S517 A518	S469-D514 VanDerWaalsContact CB-OD2 3.23Å; S469-D514 WeakPolarHBondContact CB-OD2 3.3Å; S469-D514 PolarHBondContact OG-OD2 2.94Å; F473-D514 HydrophobicContact CD2-CB 3.44Å; F473-D514 VanDerWaalsContact CD2-CB 3.44Å; F473-D514 HydrophobicContact CE2-CB 3.61Å; F473-D514 HydrophobicContact CG-CB 3.96Å; F473-D514 HydrophobicContact CZ-CB 4.25Å; L511-D514 PolarHBondContact O-N 2.98Å; L511-D514 VanDerWaalsContact O-N 3.16Å; V512-D514 PolarHBondContact O-N 3.1Å; D514-K516 PolarHBondContact O-N 2.94Å; D514-S517 WeakPolarHBondContact O-CB 3.23Å; D514-S517 PolarHBondContact O-N 3.42Å; D514-A518 WeakPolarHBondContact O-CB 3.42Å; D514-A518 PolarHBondContact O-N 3.15Å
515	I	88.1	Confident	88.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-41.3	174.9	-63.8	169.2	0	0	0	110.8	F473 V486 L511 S517 A518 L519 L598 F600 L603	F473-I515 HydrophobicContact CE1-CG1 4.23Å; F473-I515 HydrophobicContact CZ-CG1 3.71Å; V486-I515 HydrophobicContact CG1-CD1 4.49Å; L511-I515 HydrophobicContact CB-CD1 3.82Å; L511-I515 HydrophobicContact CB-CG1 4.34Å; L511-I515 WeakPolarHBondContact O-CB 3.28Å; L511-I515 WeakPolarHBondContact O-CG1 3.34Å; L511-I515 PolarHBondContact O-N 3.43Å; I515-S517 VanDerWaalsContact C-N 3.33Å; I515-S517 PolarHBondContact O-N 3.46Å; I515-A518 PolarHBondContact O-N 2.77Å; I515-L519 HydrophobicContact CG2-CD1 3.96Å; I515-L519 HydrophobicContact CG2-CG 4.2Å; I515-L519 WeakPolarHBondContact O-CB 3.43Å; I515-L519 VanDerWaalsContact O-CG 3.32Å; I515-L519 WeakPolarHBondContact O-CG 3.14Å; I515-L519 PolarHBondContact O-N 3.26Å; I515-L598 HydrophobicContact CD1-CD2 4.28Å; I515-L598 HydrophobicContact CG2-CB 4.08Å; I515-L598 HydrophobicContact CG2-CD1 4.31Å; I515-F600 HydrophobicContact CD1-CE2 3.69Å; I515-L603 HydrophobicContact CB-CD1 4.09Å; I515-L603 HydrophobicContact CG2-CD1 3.42Å; I515-L603 VanDerWaalsContact CG2-CD1 3.42Å
516	K	89.4	Confident	88.4	Confident	90 Å²	90	49.4 Å²	49.4	39%	0.391	26%	0.261	S	S	.	.	H	α-helix	trans	-58.8	-46.7	174.8	176.1	173.2	-177.2	178.1	0	111.1	V512 K513 D514 L519 Q520 L603 V606	V512-K516 WeakPolarHBondContact O-CB 3.34Å; V512-K516 PolarHBondContact O-N 3.44Å; K513-K516 PolarHBondContact O-N 3.46Å; D514-K516 PolarHBondContact O-N 2.94Å; K516-L519 PolarHBondContact O-N 2.83Å; K516-Q520 WeakPolarHBondContact O-CB 3.47Å; K516-Q520 WeakPolarHBondContact O-CG 3.34Å; K516-Q520 PolarHBondContact O-N 2.92Å; K516-L603 HydrophobicContact CB-CD2 4.09Å; K516-V606 HydrophobicContact CD-CG2 3.89Å; K516-V606 HydrophobicContact CG-CG1 4.02Å; K516-V606 HydrophobicContact CG-CG2 3.98Å
517	S	87.6	Confident	88.5	Confident	72 Å²	72	49.5 Å²	49.5	50%	0.503	26%	0.261	S	S	.	.	H	α-helix	trans	-60.9	-45	176.9	-171.5	0	0	0	0	111.6	K513 D514 I515 Q520 S521	K513-S517 PolarHBondContact O-N 2.96Å; D514-S517 WeakPolarHBondContact O-CB 3.23Å; D514-S517 PolarHBondContact O-N 3.42Å; I515-S517 VanDerWaalsContact C-N 3.33Å; I515-S517 PolarHBondContact O-N 3.46Å; S517-Q520 PolarHBondContact O-N 3.35Å; S517-S521 WeakPolarHBondContact O-CB 3.46Å; S517-S521 PolarHBondContact O-N 2.93Å
518	A	87.4	Confident	88.5	Confident	23 Å²	23	55.6 Å²	55.6	19%	0.19	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-44.6	178.8	0	0	0	0	0	112.6	F473 D514 I515 Q520 S521 Y522	F473-A518 HydrophobicContact CD1-CB 3.64Å; F473-A518 HydrophobicContact CE1-CB 3.85Å; D514-A518 WeakPolarHBondContact O-CB 3.42Å; D514-A518 PolarHBondContact O-N 3.15Å; I515-A518 PolarHBondContact O-N 2.77Å; A518-Q520 PolarHBondContact O-N 3.44Å; A518-S521 PolarHBondContact O-N 3.46Å; A518-Y522 WeakPolarHBondContact O-CB 3.36Å; A518-Y522 PolarHBondContact O-N 3.43Å
519	L	87.9	Confident	88.6	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-42.2	176.1	-72.4	174.2	0	0	0	111.6	L479 I515 K516 K523 F591 V606	L479-L519 HydrophobicContact CD1-CD2 4.18Å; L479-L519 HydrophobicContact CD2-CD2 4.08Å; I515-L519 HydrophobicContact CG2-CD1 3.96Å; I515-L519 HydrophobicContact CG2-CG 4.2Å; I515-L519 WeakPolarHBondContact O-CB 3.43Å; I515-L519 VanDerWaalsContact O-CG 3.32Å; I515-L519 WeakPolarHBondContact O-CG 3.14Å; I515-L519 PolarHBondContact O-N 3.26Å; K516-L519 PolarHBondContact O-N 2.83Å; L519-K523 VanDerWaalsContact O-CB 3.24Å; L519-K523 WeakPolarHBondContact O-CB 3.5Å; L519-K523 PolarHBondContact O-N 3.18Å; L519-F591 HydrophobicContact CD2-CE2 3.92Å; L519-F591 HydrophobicContact CD2-CZ 4.22Å; L519-V606 HydrophobicContact CB-CG1 4.5Å
520	Q	89.3	Confident	88.5	Confident	84 Å²	84	50.4 Å²	50.4	39%	0.393	26%	0.26	S	S	.	.	H	α-helix	trans	-66.1	-45.1	177	-74.1	179	-26.9	0	0	112	K516 S517 A518 Y522 K523 E524 V606	K516-Q520 WeakPolarHBondContact O-CB 3.47Å; K516-Q520 WeakPolarHBondContact O-CG 3.34Å; K516-Q520 PolarHBondContact O-N 2.92Å; S517-Q520 PolarHBondContact O-N 3.35Å; A518-Q520 PolarHBondContact O-N 3.44Å; Q520-Y522 PolarHBondContact O-N 3.24Å; Q520-K523 WeakPolarHBondContact O-CB 3.06Å; Q520-K523 PolarHBondContact O-N 2.82Å; Q520-E524 WeakPolarHBondContact O-CG 3.18Å; Q520-E524 PolarHBondContact O-N 3.13Å; Q520-V606 HydrophobicContact CG-CG1 4.45Å
521	S	87.9	Confident	88.5	Confident	68 Å²	68	53.6 Å²	53.6	48%	0.476	27%	0.272	S	S	.	.	H	α-helix	trans	-61.6	-44.6	176.8	179.7	0	0	0	0	111.5	S517 A518 K523 E524 I525	S517-S521 WeakPolarHBondContact O-CB 3.46Å; S517-S521 PolarHBondContact O-N 2.93Å; A518-S521 PolarHBondContact O-N 3.46Å; S521-K523 PolarHBondContact O-N 3.49Å; S521-E524 PolarHBondContact O-N 3.1Å; S521-I525 WeakPolarHBondContact O-CG1 3.39Å; S521-I525 PolarHBondContact O-N 3Å
522	Y	86.8	Confident	88.5	Confident	65 Å²	65	58.9 Å²	58.9	26%	0.255	30%	0.296	S	S	.	.	H	α-helix	trans	-68.1	-36.4	178.8	-160.7	-97.2	0	0	0	112.1	L479 A518 Q520 E524 I525 I526 F591	L479-Y522 HydrophobicContact CB-CD1 4.36Å; L479-Y522 HydrophobicContact CB-CD2 3.96Å; L479-Y522 HydrophobicContact CB-CE1 4.43Å; L479-Y522 HydrophobicContact CB-CE2 4.09Å; L479-Y522 HydrophobicContact CB-CG 4.09Å; L479-Y522 HydrophobicContact CD2-CD1 3.82Å; L479-Y522 HydrophobicContact CD2-CE1 4.2Å; L479-Y522 HydrophobicContact CD2-CG 4.1Å; A518-Y522 WeakPolarHBondContact O-CB 3.36Å; A518-Y522 PolarHBondContact O-N 3.43Å; Q520-Y522 PolarHBondContact O-N 3.24Å; Y522-E524 PolarHBondContact O-N 3.02Å; Y522-I525 PolarHBondContact O-N 3.43Å; Y522-I526 HydrophobicContact CD1-CD1 3.54Å; Y522-I526 HydrophobicContact CD1-CG1 3.98Å; Y522-I526 HydrophobicContact CE1-CD1 3.59Å; Y522-I526 HydrophobicContact CE1-CG1 3.93Å; Y522-I526 VanDerWaalsContact O-CG1 3.28Å; Y522-I526 WeakPolarHBondContact O-CG1 3.44Å; Y522-I526 PolarHBondContact O-N 3.03Å; Y522-F591 AromaticContact CD1-CD2 3.4Å; Y522-F591 HydrophobicContact CD1-CD2 3.4Å; Y522-F591 AromaticContact CD1-CE2 3.87Å; Y522-F591 HydrophobicContact CD1-CE2 3.87Å; Y522-F591 HydrophobicContact CD1-CG 4.37Å; Y522-F591 HydrophobicContact CE1-CB 4.4Å; Y522-F591 AromaticContact CE1-CD2 3.9Å; Y522-F591 HydrophobicContact CE1-CD2 3.9Å; Y522-F591 HydrophobicContact CG-CD2 4.48Å
523	K	89.7	Confident	88.3	Confident	19 Å²	19	59.8 Å²	59.8	8%	0.083	30%	0.296	C	S	.	.	H	α-helix	trans	-56.1	-48.9	170.5	179.9	-147.4	69.5	166.9	0	111.3	L519 Q520 S521 I525 I526 I527 F591 E613 I614	L519-K523 VanDerWaalsContact O-CB 3.24Å; L519-K523 WeakPolarHBondContact O-CB 3.5Å; L519-K523 PolarHBondContact O-N 3.18Å; Q520-K523 WeakPolarHBondContact O-CB 3.06Å; Q520-K523 PolarHBondContact O-N 2.82Å; S521-K523 PolarHBondContact O-N 3.49Å; K523-I525 PolarHBondContact O-N 3.01Å; K523-I526 PolarHBondContact O-N 3.21Å; K523-I527 HydrophobicContact CD-CD1 4.21Å; K523-I527 HydrophobicContact CG-CD1 3.96Å; K523-I527 WeakPolarHBondContact O-CG1 3.44Å; K523-I527 PolarHBondContact O-N 3.37Å; K523-F591 HydrophobicContact CB-CZ 4.44Å; K523-E613 HydrophobicContact CD-CB 4.41Å; K523-E613 WeakPolarHBondContact CD-OE2 3.32Å; K523-E613 WeakPolarHBondContact CE-OE2 3.49Å; K523-E613 IonicContact NZ-OE2 3.73Å; K523-E613 PolarHBondContact NZ-OE2 2.93Å; K523-I614 HydrophobicContact CB-CD1 4.36Å; K523-I614 HydrophobicContact CG-CD1 3.93Å; K523-I614 HydrophobicContact CG-CG1 3.86Å
524	E	89.8	Confident	88.2	Confident	84 Å²	84	53 Å²	53	39%	0.393	27%	0.268	S	S	.	.	H	α-helix	trans	-61.1	-43.2	177.3	-64.9	-56.2	152.4	0	0	111.8	Q520 S521 Y522 I526 I527 E528	Q520-E524 WeakPolarHBondContact O-CG 3.18Å; Q520-E524 PolarHBondContact O-N 3.13Å; S521-E524 PolarHBondContact O-N 3.1Å; Y522-E524 PolarHBondContact O-N 3.02Å; E524-I526 VanDerWaalsContact C-N 3.31Å; E524-I526 PolarHBondContact O-N 2.91Å; E524-I527 PolarHBondContact O-N 3.34Å; E524-I527 VanDerWaalsContact O-N 3.14Å; E524-E528 WeakPolarHBondContact O-CG 3.45Å; E524-E528 PolarHBondContact O-N 3.16Å
525	I	88.9	Confident	88	Confident	88 Å²	88	55.5 Å²	55.5	45%	0.451	29%	0.289	S	S	.	.	H	α-helix	trans	-58.9	-42.5	176	-66.5	165.8	0	0	0	111.3	S521 Y522 K523 A529	S521-I525 WeakPolarHBondContact O-CG1 3.39Å; S521-I525 PolarHBondContact O-N 3Å; Y522-I525 PolarHBondContact O-N 3.43Å; K523-I525 PolarHBondContact O-N 3.01Å; I525-A529 VanDerWaalsContact O-CB 3.22Å; I525-A529 WeakPolarHBondContact O-CB 3.43Å; I525-A529 PolarHBondContact O-N 2.9Å
526	I	88.1	Confident	87.9	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-44.5	176.2	-64.7	167.6	0	0	0	110.7	Y522 K523 E524 A529 T530 Q587 F591 I614	Y522-I526 HydrophobicContact CD1-CD1 3.54Å; Y522-I526 HydrophobicContact CD1-CG1 3.98Å; Y522-I526 HydrophobicContact CE1-CD1 3.59Å; Y522-I526 HydrophobicContact CE1-CG1 3.93Å; Y522-I526 VanDerWaalsContact O-CG1 3.28Å; Y522-I526 WeakPolarHBondContact O-CG1 3.44Å; Y522-I526 PolarHBondContact O-N 3.03Å; K523-I526 PolarHBondContact O-N 3.21Å; E524-I526 VanDerWaalsContact C-N 3.31Å; E524-I526 PolarHBondContact O-N 2.91Å; I526-A529 PolarHBondContact O-N 3.26Å; I526-T530 VanDerWaalsContact O-CB 3.27Å; I526-T530 WeakPolarHBondContact O-CB 3.49Å; I526-T530 PolarHBondContact O-N 2.84Å; I526-T530 PolarHBondContact O-OG1 2.99Å; I526-Q587 HydrophobicContact CD1-CG 4.41Å; I526-Q587 HydrophobicContact CG1-CG 3.91Å; I526-Q587 HydrophobicContact CG2-CG 4.04Å; I526-F591 HydrophobicContact CD1-CB 3.56Å; I526-F591 HydrophobicContact CD1-CD1 4.23Å; I526-F591 HydrophobicContact CD1-CD2 3.76Å; I526-F591 HydrophobicContact CD1-CE2 4.48Å; I526-F591 HydrophobicContact CD1-CG 3.57Å; I526-I614 HydrophobicContact CB-CD1 4.35Å; I526-I614 HydrophobicContact CD1-CD1 3.85Å; I526-I614 HydrophobicContact CG2-CD1 4.24Å; I526-I614 HydrophobicContact CG2-CG1 4.22Å; I526-I614 HydrophobicContact CG2-CG2 3.84Å
527	I	89.8	Confident	87.6	Confident	10 Å²	10	58.9 Å²	58.9	5%	0.051	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-47	-179.8	-73.3	171.5	0	0	0	110.4	K523 E524 T530 K531 E613 I614 V617	K523-I527 HydrophobicContact CD-CD1 4.21Å; K523-I527 HydrophobicContact CG-CD1 3.96Å; K523-I527 WeakPolarHBondContact O-CG1 3.44Å; K523-I527 PolarHBondContact O-N 3.37Å; E524-I527 PolarHBondContact O-N 3.34Å; E524-I527 VanDerWaalsContact O-N 3.14Å; I527-T530 PolarHBondContact O-N 3.16Å; I527-K531 HydrophobicContact CG2-CD 3.97Å; I527-K531 HydrophobicContact CG2-CG 4.47Å; I527-K531 WeakPolarHBondContact O-CB 3.27Å; I527-K531 VanDerWaalsContact O-CG 3.32Å; I527-K531 WeakPolarHBondContact O-CG 3.43Å; I527-K531 PolarHBondContact O-N 2.89Å; I527-E613 HydrophobicContact CD1-CB 4.3Å; I527-I614 HydrophobicContact CD1-CG1 4.45Å; I527-I614 HydrophobicContact CG1-CG1 4.06Å; I527-V617 HydrophobicContact CG1-CG2 4.3Å; I527-V617 HydrophobicContact CG2-CG2 4.05Å
528	E	88.9	Confident	87.2	Confident	131 Å²	131	60.8 Å²	60.8	61%	0.612	31%	0.308	S	S	*	.	H	α-helix	trans	-63.2	-46.2	177.5	-72	-177.9	170	0	0	111.8	E524 T530 K531 H532	E524-E528 WeakPolarHBondContact O-CG 3.45Å; E524-E528 PolarHBondContact O-N 3.16Å; E528-T530 VanDerWaalsContact C-N 3.27Å; E528-T530 PolarHBondContact O-N 3.23Å; E528-K531 PolarHBondContact O-N 3.25Å; E528-H532 WeakPolarHBondContact O-CB 3.19Å; E528-H532 PolarHBondContact O-N 3.5Å
529	A	87.9	Confident	87	Confident	28 Å²	28	60.6 Å²	60.6	23%	0.231	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-37.4	176.3	0	0	0	0	0	112.1	I525 I526 R533	I525-A529 VanDerWaalsContact O-CB 3.22Å; I525-A529 WeakPolarHBondContact O-CB 3.43Å; I525-A529 PolarHBondContact O-N 2.9Å; I526-A529 PolarHBondContact O-N 3.26Å; A529-R533 WeakPolarHBondContact O-CG 3.44Å; A529-R533 PolarHBondContact O-N 3.33Å; A529-R533 VanDerWaalsContact O-N 3.14Å
530	T	88	Confident	86.7	Confident	3 Å²	3	68.3 Å²	68.3	2%	0.018	33%	0.332	C	S	.	.	H	α-helix	trans	-68.8	-46	176.2	-57	0	0	0	0	110.7	I526 I527 E528 H532 R533 N534 F584 V617	I526-T530 VanDerWaalsContact O-CB 3.27Å; I526-T530 WeakPolarHBondContact O-CB 3.49Å; I526-T530 PolarHBondContact O-N 2.84Å; I526-T530 PolarHBondContact O-OG1 2.99Å; I527-T530 PolarHBondContact O-N 3.16Å; E528-T530 VanDerWaalsContact C-N 3.27Å; E528-T530 PolarHBondContact O-N 3.23Å; T530-H532 VanDerWaalsContact C-N 3.35Å; T530-H532 PolarHBondContact O-N 3.17Å; T530-R533 PolarHBondContact O-N 3.37Å; T530-N534 WeakPolarHBondContact O-CB 3.27Å; T530-N534 PolarHBondContact O-N 3.47Å; T530-N534 PolarHBondContact O-ND2 3.11Å; T530-N534 PolarHBondContact O-OD1 2.46Å; T530-F584 HydrophobicContact CG2-CD2 3.82Å; T530-F584 HydrophobicContact CG2-CE2 4.41Å; T530-V617 HydrophobicContact CG2-CG1 4.22Å
531	K	88.4	Confident	86.4	Confident	119 Å²	119	69.5 Å²	69.5	52%	0.517	34%	0.335	S	S	.	.	H	α-helix	trans	-60.3	-41.7	176.2	-75.4	173.1	178.9	172.7	0	112.5	I527 E528 N534 S535 V617	I527-K531 HydrophobicContact CG2-CD 3.97Å; I527-K531 HydrophobicContact CG2-CG 4.47Å; I527-K531 WeakPolarHBondContact O-CB 3.27Å; I527-K531 VanDerWaalsContact O-CG 3.32Å; I527-K531 WeakPolarHBondContact O-CG 3.43Å; I527-K531 PolarHBondContact O-N 2.89Å; E528-K531 PolarHBondContact O-N 3.25Å; K531-N534 WeakPolarHBondContact O-CB 3.45Å; K531-N534 PolarHBondContact O-N 2.71Å; K531-S535 PolarHBondContact O-N 3.07Å; K531-S535 VanDerWaalsContact O-N 3.1Å; K531-V617 HydrophobicContact CG-CG1 4.03Å
532	H	88.1	Confident	86	Confident	111 Å²	111	67.3 Å²	67.3	51%	0.514	32%	0.318	S	S	.	.	H	α-helix	trans	-60.4	-50.6	175.8	-174.5	-73.2	0	0	0	111	E528 T530 N534 S535 E536	E528-H532 WeakPolarHBondContact O-CB 3.19Å; E528-H532 PolarHBondContact O-N 3.5Å; T530-H532 VanDerWaalsContact C-N 3.35Å; T530-H532 PolarHBondContact O-N 3.17Å; H532-N534 VanDerWaalsContact C-N 3.3Å; H532-N534 PolarHBondContact O-N 3.2Å; H532-S535 WeakPolarHBondContact O-CB 3.43Å; H532-S535 PolarHBondContact O-N 3.22Å; H532-S535 VanDerWaalsContact O-N 3.08Å; H532-S535 PolarHBondContact O-OG 3.15Å; H532-E536 IonicContact CE1-OE1 2.68Å; H532-E536 PolarHBondContact CE1-OE1 3.45Å; H532-E536 IonicContact CE1-OE2 2.89Å; H532-E536 IonicContact ND1-OE2 3.33Å; H532-E536 PolarHBondContact O-N 3.41Å
533	R	86.4	Confident	85.8	Confident	52 Å²	52	67.1 Å²	67.1	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-59.5	-40.6	176.5	-74.9	-176.9	-140.9	128.5	3.5	112.6	A529 T530 S535 E536 E537 T580 Q587	A529-R533 WeakPolarHBondContact O-CG 3.44Å; A529-R533 PolarHBondContact O-N 3.33Å; A529-R533 VanDerWaalsContact O-N 3.14Å; T530-R533 PolarHBondContact O-N 3.37Å; R533-S535 PolarHBondContact O-N 3.35Å; R533-E536 PolarHBondContact O-N 3.11Å; R533-E536 VanDerWaalsContact O-N 3.16Å; R533-E537 PolarHBondContact O-N 3.37Å; R533-T580 HydrophobicContact CB-CG2 3.96Å; R533-T580 WeakPolarHBondContact O-CG2 3.43Å; R533-Q587 VanDerWaalsContact CZ-OE1 3.25Å
534	N	85.5	Confident	85.2	Confident	23 Å²	23	68.1 Å²	68.1	12%	0.123	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-28.5	177	-71.1	-2.5	0	0	0	112.6	T530 K531 H532 E536 H621	T530-N534 WeakPolarHBondContact O-CB 3.27Å; T530-N534 PolarHBondContact O-N 3.47Å; T530-N534 PolarHBondContact O-ND2 3.11Å; T530-N534 PolarHBondContact O-OD1 2.46Å; K531-N534 WeakPolarHBondContact O-CB 3.45Å; K531-N534 PolarHBondContact O-N 2.71Å; H532-N534 VanDerWaalsContact C-N 3.3Å; H532-N534 PolarHBondContact O-N 3.2Å; N534-E536 VanDerWaalsContact C-N 3.35Å; N534-H621 VanDerWaalsContact CG-CG 3.43Å; N534-H621 VanDerWaalsContact ND2-CB 3.34Å; N534-H621 WeakPolarHBondContact ND2-CB 3.28Å; N534-H621 VanDerWaalsContact ND2-CG 3.34Å; N534-H621 PolarHBondContact O-CE1 2.72Å; N534-H621 VanDerWaalsContact O-CE1 3.22Å; N534-H621 PolarHBondContact OD1-CD2 3.45Å
535	S	84.4	Confident	84.5	Confident	94 Å²	94	71.3 Å²	71.3	66%	0.657	34%	0.344	S	S	*	.	H	α-helix	trans	-74.9	-23.6	176.5	74.7	0	0	0	0	113.8	K531 H532 R533	K531-S535 PolarHBondContact O-N 3.07Å; K531-S535 VanDerWaalsContact O-N 3.1Å; H532-S535 WeakPolarHBondContact O-CB 3.43Å; H532-S535 PolarHBondContact O-N 3.22Å; H532-S535 VanDerWaalsContact O-N 3.08Å; H532-S535 PolarHBondContact O-OG 3.15Å; R533-S535 PolarHBondContact O-N 3.35Å
536	E	85	Confident	84.2	Confident	131 Å²	131	70.1 Å²	70.1	61%	0.612	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	3.4	178.1	-62.2	179.5	155.1	0	0	112.5	H532 R533 N534	H532-E536 IonicContact CE1-OE1 2.68Å; H532-E536 PolarHBondContact CE1-OE1 3.45Å; H532-E536 IonicContact CE1-OE2 2.89Å; H532-E536 IonicContact ND1-OE2 3.33Å; H532-E536 PolarHBondContact O-N 3.41Å; R533-E536 PolarHBondContact O-N 3.11Å; R533-E536 VanDerWaalsContact O-N 3.16Å; N534-E536 VanDerWaalsContact C-N 3.35Å
537	E	83.4	Confident	83.6	Confident	31 Å²	31	73.7 Å²	73.7	15%	0.145	36%	0.364	C	S	.	.			trans	-72.9	131.7	-175.2	-177.2	56.3	-92.6	0	0	112	R533 W539 S578 T580	R533-E537 PolarHBondContact O-N 3.37Å; E537-W539 HydrophobicContact CG-CD2 3.87Å; E537-W539 HydrophobicContact CG-CE3 4.45Å; E537-W539 HydrophobicContact CG-CG 4.07Å; E537-W539 HydrophobicContact CG-CZ2 4.23Å; E537-W539 WeakPolarHBondContact OE1-CA 3.25Å; E537-W539 PolarHBondContact OE1-N 3.05Å; E537-S578 WeakPolarHBondContact OE2-CB 3.43Å; E537-S578 PolarHBondContact OE2-OG 2.81Å; E537-S578 VanDerWaalsContact OE2-OG 3.12Å; E537-T580 HydrophobicContact CB-CG2 4.05Å; E537-T580 HydrophobicContact CG-CG2 4.27Å; E537-T580 WeakPolarHBondContact OE2-CB 3.41Å; E537-T580 WeakPolarHBondContact OE2-CG2 3.39Å; E537-T580 PolarHBondContact OE2-OG1 3.4Å
538	M	80.1	Confident	83	Confident	111 Å²	111	80.6 Å²	80.6	55%	0.547	40%	0.396	S	S	.	.			trans	-117	0	-178.2	-62.8	-62.1	-66.3	0	0	112.8	R540	M538-R540 HydrophobicContact CB-CG 4.25Å
539	W	82.6	Confident	82.4	Confident	20 Å²	20	76 Å²	76	8%	0.076	38%	0.381	C	S	.	.			trans	53.1	55.9	-179.4	-65.9	107.7	0	0	0	113	E537 H621 V622 S625 F637 I638 N641	E537-W539 HydrophobicContact CG-CD2 3.87Å; E537-W539 HydrophobicContact CG-CE3 4.45Å; E537-W539 HydrophobicContact CG-CG 4.07Å; E537-W539 HydrophobicContact CG-CZ2 4.23Å; E537-W539 WeakPolarHBondContact OE1-CA 3.25Å; E537-W539 PolarHBondContact OE1-N 3.05Å; W539-H621 AromaticContact CZ2-NE2 3.77Å; W539-V622 HydrophobicContact CH2-CG2 4.05Å; W539-S625 PolarHBondContact NE1-OG 2.96Å; W539-S625 VanDerWaalsContact NE1-OG 3.13Å; W539-F637 VanDerWaalsContact C-CE1 3.43Å; W539-F637 HydrophobicContact CB-CD1 4.19Å; W539-F637 HydrophobicContact CE3-CD1 4.49Å; W539-F637 HydrophobicContact CE3-CE1 4.47Å; W539-F637 VanDerWaalsContact O-CD1 3.23Å; W539-F637 WeakPolarHBondContact O-CD1 3.24Å; W539-F637 WeakPolarHBondContact O-CE1 3.33Å; W539-I638 HydrophobicContact CB-CG1 4.16Å; W539-I638 HydrophobicContact CD2-CD1 4.25Å; W539-I638 HydrophobicContact CD2-CG1 3.56Å; W539-I638 HydrophobicContact CE3-CB 4.46Å; W539-I638 HydrophobicContact CE3-CG1 3.81Å; W539-I638 HydrophobicContact CE3-CG2 4.49Å; W539-I638 HydrophobicContact CG-CD1 4.07Å; W539-I638 HydrophobicContact CG-CG1 3.72Å; W539-I638 HydrophobicContact CH2-CG2 4.24Å; W539-I638 HydrophobicContact CZ2-CG2 4.32Å; W539-I638 HydrophobicContact CZ3-CG1 4.44Å; W539-I638 HydrophobicContact CZ3-CG2 4.32Å; W539-N641 HydrophobicContact CZ3-CB 3.84Å
540	R	81.8	Confident	82	Confident	163 Å²	163	75.2 Å²	75.2	62%	0.615	37%	0.373	S	S	*	.			trans	-118.5	152.7	179.1	-61.3	179.6	-175.6	176.6	-0.5	111.3	M538	M538-R540 HydrophobicContact CB-CG 4.25Å
541	K	82.6	Confident	81.6	Confident	108 Å²	108	78.4 Å²	78.4	47%	0.47	39%	0.392	S	S	.	.			trans	-59.9	136.6	170.2	-61.5	-175.5	179.6	-163.8	0	109.6	W574 N576 F637	K541-W574 HydrophobicContact CB-CE3 3.89Å; K541-W574 HydrophobicContact CB-CZ3 4.15Å; K541-N576 WeakPolarHBondContact CD-OD1 3.32Å; K541-N576 VanDerWaalsContact CE-OD1 3.25Å; K541-N576 WeakPolarHBondContact CE-OD1 3.45Å; K541-N576 PolarHBondContact NZ-OD1 3.38Å; K541-F637 HydrophobicContact CG-CD2 4.36Å; K541-F637 HydrophobicContact CG-CE2 3.68Å; K541-F637 HydrophobicContact CG-CZ 4.14Å
542	M	80.6	Confident	81.3	Confident	22 Å²	22	78.9 Å²	78.9	11%	0.108	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	134.8	178	177.3	178.6	65.1	0	0	110.1	L544 L553 W574 V575 L577 Y579 V582	M542-L544 HydrophobicContact CE-CD1 4.25Å; M542-L544 HydrophobicContact CE-CD2 3.77Å; M542-L544 HydrophobicContact CE-CG 4.07Å; M542-L544 HydrophobicContact CG-CD2 4.2Å; M542-L544 HydrophobicContact SD-CD2 3.83Å; M542-L553 HydrophobicContact CE-CD2 3.7Å; M542-W574 WeakPolarHBondContact O-CA 3.49Å; M542-V575 HydrophobicContact CB-CB 4.3Å; M542-V575 HydrophobicContact CE-CB 3.68Å; M542-V575 HydrophobicContact CE-CG1 4.05Å; M542-V575 HydrophobicContact CE-CG2 3.54Å; M542-V575 PolarHBondContact N-O 3.23Å; M542-V575 VanDerWaalsContact N-O 3.1Å; M542-V575 PolarHBondContact O-N 2.82Å; M542-L577 PolarHBondContact N-O 2.72Å; M542-Y579 HydrophobicContact SD-CD2 3.9Å; M542-V582 HydrophobicContact CE-CG1 4.35Å; M542-V582 HydrophobicContact CE-CG2 4.3Å
543	N	80.8	Confident	81	Confident	61 Å²	61	74 Å²	74	33%	0.326	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121.5	169.9	-174	-7.7	0	0	0	109.1	M545 W574	N543-M545 VanDerWaalsContact C-N 3.3Å; N543-M545 PolarHBondContact OD1-N 2.91Å; N543-W574 HydrophobicContact CB-CD2 4.07Å; N543-W574 HydrophobicContact CB-CE3 3.84Å; N543-W574 HydrophobicContact CB-CH2 3.88Å; N543-W574 HydrophobicContact CB-CZ2 4.08Å; N543-W574 HydrophobicContact CB-CZ3 3.76Å; N543-W574 WeakPolarHBondContact ND2-CZ2 3.34Å
544	L	77.2	Confident	80.6	Confident	40 Å²	40	74.1 Å²	74.1	21%	0.209	37%	0.374	C	S	.	.			trans	-88	2.8	-179.4	-66.5	172.4	0	0	0	113.5	M542 T546 A549 L550 L553 C573 V575	M542-L544 HydrophobicContact CE-CD1 4.25Å; M542-L544 HydrophobicContact CE-CD2 3.77Å; M542-L544 HydrophobicContact CE-CG 4.07Å; M542-L544 HydrophobicContact CG-CD2 4.2Å; M542-L544 HydrophobicContact SD-CD2 3.83Å; L544-T546 PolarHBondContact O-N 3.37Å; L544-A549 HydrophobicContact CB-CB 4.03Å; L544-L550 HydrophobicContact CD1-CB 3.9Å; L544-L550 HydrophobicContact CD1-CD1 4.24Å; L544-L550 HydrophobicContact CD1-CG 4.36Å; L544-L553 HydrophobicContact CD1-CB 4.25Å; L544-L553 HydrophobicContact CD1-CD2 3.74Å; L544-C573 PolarHBondContact N-O 2.95Å; L544-V575 HydrophobicContact CD1-CG2 3.83Å; L544-V575 HydrophobicContact CG-CG2 4.35Å
545	M	76.4	Confident	80.4	Confident	152 Å²	152	79.1 Å²	79.1	75%	0.749	40%	0.397	S	S	*	.	S	Bend	trans	64.7	-34.6	-179.1	-54.4	-64	-166	0	0	115.1	N543	N543-M545 VanDerWaalsContact C-N 3.3Å; N543-M545 PolarHBondContact OD1-N 2.91Å
546	T	81.3	Confident	80.2	Confident	62 Å²	62	77.8 Å²	77.8	38%	0.38	38%	0.38	S	S	.	.	S	Bend	trans	-127.5	145.1	179.3	65.1	0	0	0	0	112.7	L544 E548 A549 L550	L544-T546 PolarHBondContact O-N 3.37Å; T546-E548 PolarHBondContact O-N 3.34Å; T546-A549 PolarHBondContact O-N 2.9Å; T546-A549 VanDerWaalsContact OG1-CB 3.28Å; T546-A549 WeakPolarHBondContact OG1-CB 3.43Å; T546-A549 PolarHBondContact OG1-N 3.46Å; T546-L550 PolarHBondContact O-N 2.91Å
547	P	76.1	Confident	79.9	Confident	75 Å²	75	71.6 Å²	71.6	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-69.9	-24.6	177.5	27.8	-33.6	0	0	0	111.9	L550 T551 C573	P547-L550 PolarHBondContact O-N 3.2Å; P547-T551 PolarHBondContact O-N 3.26Å; P547-T551 PolarHBondContact O-OG1 3.44Å; P547-C573 VanDerWaalsContact CD-SG 3.58Å
548	E	77.8	Confident	79.7	Confident	155 Å²	155	73 Å²	73	72%	0.724	36%	0.364	S	S	*	.	H	α-helix	trans	-64.3	-41.9	172.3	-65.7	171.1	-178	0	0	111.7	T546 L550 T551 K552	T546-E548 PolarHBondContact O-N 3.34Å; E548-L550 VanDerWaalsContact C-N 3.31Å; E548-L550 PolarHBondContact O-N 3.15Å; E548-T551 PolarHBondContact O-N 2.85Å; E548-K552 PolarHBondContact O-N 2.96Å
549	A	76.7	Confident	79.5	Confident	36 Å²	36	71.5 Å²	71.5	30%	0.298	36%	0.364	S	S	.	.	H	α-helix	trans	-66.5	-34.3	176.3	0	0	0	0	0	112.1	L544 T546 L553	L544-A549 HydrophobicContact CB-CB 4.03Å; T546-A549 PolarHBondContact O-N 2.9Å; T546-A549 VanDerWaalsContact OG1-CB 3.28Å; T546-A549 WeakPolarHBondContact OG1-CB 3.43Å; T546-A549 PolarHBondContact OG1-N 3.46Å; A549-L553 WeakPolarHBondContact O-CB 3.37Å; A549-L553 PolarHBondContact O-N 2.85Å
550	L	77.9	Confident	78.9	Confident	10 Å²	10	71.4 Å²	71.4	5%	0.052	37%	0.366	C	S	.	.	H	α-helix	trans	-66.9	-39.8	172.7	-173.5	123.6	0	0	0	111.9	L544 T546 P547 E548 L553 K554 V575	L544-L550 HydrophobicContact CD1-CB 3.9Å; L544-L550 HydrophobicContact CD1-CD1 4.24Å; L544-L550 HydrophobicContact CD1-CG 4.36Å; T546-L550 PolarHBondContact O-N 2.91Å; P547-L550 PolarHBondContact O-N 3.2Å; E548-L550 VanDerWaalsContact C-N 3.31Å; E548-L550 PolarHBondContact O-N 3.15Å; L550-L553 PolarHBondContact O-N 3.45Å; L550-K554 HydrophobicContact CD2-CD 4.08Å; L550-K554 VanDerWaalsContact CD2-CE 3.47Å; L550-K554 WeakPolarHBondContact O-CG 3.45Å; L550-K554 PolarHBondContact O-N 3.36Å; L550-V575 HydrophobicContact CD1-CG2 3.89Å
551	T	80.5	Confident	78.3	Confident	71 Å²	71	65.1 Å²	65.1	44%	0.436	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-45.5	175.6	-52.8	0	0	0	0	111	P547 E548 L553 K554 E555	P547-T551 PolarHBondContact O-N 3.26Å; P547-T551 PolarHBondContact O-OG1 3.44Å; E548-T551 PolarHBondContact O-N 2.85Å; T551-L553 PolarHBondContact O-N 3.32Å; T551-K554 WeakPolarHBondContact O-CB 3.47Å; T551-K554 PolarHBondContact O-N 2.91Å; T551-K554 VanDerWaalsContact O-N 3.17Å; T551-E555 WeakPolarHBondContact O-CG 3.17Å; T551-E555 PolarHBondContact O-N 2.92Å
552	K	82.3	Confident	78	Confident	128 Å²	128	60 Å²	60	56%	0.557	33%	0.33	S	S	*	.	H	α-helix	trans	-61.1	-41.8	174.9	-170.6	178.6	179.4	-178.8	0	112.4	E548 K554 E555 E556	E548-K552 PolarHBondContact O-N 2.96Å; K552-K554 VanDerWaalsContact C-N 3.34Å; K552-K554 PolarHBondContact O-N 3.46Å; K552-E555 PolarHBondContact O-N 3.34Å; K552-E556 VanDerWaalsContact CE-OE1 3.3Å; K552-E556 WeakPolarHBondContact CE-OE1 3.37Å; K552-E556 WeakPolarHBondContact O-CB 3.37Å; K552-E556 WeakPolarHBondContact O-CG 3.43Å; K552-E556 PolarHBondContact O-N 3Å
553	L	80.7	Confident	77.3	Confident	8 Å²	8	63.6 Å²	63.6	4%	0.042	36%	0.357	C	S	.	.	H	α-helix	trans	-63.6	-40.2	175.4	-179.5	65.6	0	0	0	111.8	M542 L544 A549 L550 T551 E556 M557 F565 V575 V582	M542-L553 HydrophobicContact CE-CD2 3.7Å; L544-L553 HydrophobicContact CD1-CB 4.25Å; L544-L553 HydrophobicContact CD1-CD2 3.74Å; A549-L553 WeakPolarHBondContact O-CB 3.37Å; A549-L553 PolarHBondContact O-N 2.85Å; L550-L553 PolarHBondContact O-N 3.45Å; T551-L553 PolarHBondContact O-N 3.32Å; L553-E556 PolarHBondContact O-N 3.14Å; L553-M557 HydrophobicContact CD1-CE 4.12Å; L553-M557 HydrophobicContact CD1-CG 4.24Å; L553-M557 HydrophobicContact CG-CG 4.41Å; L553-M557 WeakPolarHBondContact O-CB 3.2Å; L553-M557 VanDerWaalsContact O-CG 3.27Å; L553-M557 WeakPolarHBondContact O-CG 3.41Å; L553-M557 PolarHBondContact O-N 2.85Å; L553-F565 HydrophobicContact CD2-CE1 4.12Å; L553-F565 HydrophobicContact CD2-CZ 3.9Å; L553-F565 HydrophobicContact CG-CE1 4.06Å; L553-F565 HydrophobicContact CG-CZ 4.13Å; L553-V575 HydrophobicContact CD2-CG2 4.11Å; L553-V582 HydrophobicContact CD1-CG1 3.97Å; L553-V582 HydrophobicContact CD2-CG1 4.31Å
554	K	79.8	Confident	76.7	Confident	55 Å²	55	62.3 Å²	62.3	24%	0.239	35%	0.353	C	S	.	.	H	α-helix	trans	-61.7	-45	175	-76.4	174.5	175.6	-179	0	111.1	L550 T551 K552 M557 C558 F565 N566 T569	L550-K554 HydrophobicContact CD2-CD 4.08Å; L550-K554 VanDerWaalsContact CD2-CE 3.47Å; L550-K554 WeakPolarHBondContact O-CG 3.45Å; L550-K554 PolarHBondContact O-N 3.36Å; T551-K554 WeakPolarHBondContact O-CB 3.47Å; T551-K554 PolarHBondContact O-N 2.91Å; T551-K554 VanDerWaalsContact O-N 3.17Å; K552-K554 VanDerWaalsContact C-N 3.34Å; K552-K554 PolarHBondContact O-N 3.46Å; K554-M557 PolarHBondContact O-N 3.3Å; K554-C558 VanDerWaalsContact O-CB 3.27Å; K554-C558 WeakPolarHBondContact O-CB 3.12Å; K554-C558 PolarHBondContact O-N 3.28Å; K554-C558 PolarHBondContact O-SG 2.92Å; K554-F565 HydrophobicContact CG-CD1 4.21Å; K554-F565 HydrophobicContact CG-CE1 4.39Å; K554-N566 WeakPolarHBondContact CD-OD1 3.5Å; K554-T569 VanDerWaalsContact CE-CG2 3.41Å; K554-T569 VanDerWaalsContact CE-OG1 3.24Å; K554-T569 WeakPolarHBondContact CE-OG1 3.23Å; K554-T569 HydrophobicContact CG-CG2 4.37Å; K554-T569 PolarHBondContact NZ-OG1 3.27Å
555	E	80.9	Confident	76.5	Confident	128 Å²	128	60.4 Å²	60.4	60%	0.598	34%	0.343	S	S	*	.	H	α-helix	trans	-60.7	-46.8	175.9	-72	174	-179.9	0	0	111.8	T551 K552 M557 C558 S559	T551-E555 WeakPolarHBondContact O-CG 3.17Å; T551-E555 PolarHBondContact O-N 2.92Å; K552-E555 PolarHBondContact O-N 3.34Å; E555-M557 PolarHBondContact O-N 2.89Å; E555-C558 PolarHBondContact O-N 2.84Å; E555-S559 PolarHBondContact O-N 3.22Å; E555-S559 PolarHBondContact O-OG 3.07Å
556	E	79.4	Confident	76.3	Confident	67 Å²	67	57.2 Å²	57.2	31%	0.313	33%	0.329	S	S	.	.	H	α-helix	trans	-62.8	-41.8	177.8	-72.8	172.8	-174.7	0	0	112.4	K552 L553 S559 C560 K586	K552-E556 VanDerWaalsContact CE-OE1 3.3Å; K552-E556 WeakPolarHBondContact CE-OE1 3.37Å; K552-E556 WeakPolarHBondContact O-CB 3.37Å; K552-E556 WeakPolarHBondContact O-CG 3.43Å; K552-E556 PolarHBondContact O-N 3Å; L553-E556 PolarHBondContact O-N 3.14Å; E556-S559 WeakPolarHBondContact CA-OG 3.34Å; E556-S559 PolarHBondContact O-N 3.11Å; E556-S559 PolarHBondContact O-OG 2.87Å; E556-C560 PolarHBondContact O-N 3.29Å; E556-C560 VanDerWaalsContact O-N 3.16Å; E556-C560 PolarHBondContact O-SG 3.26Å; E556-K586 WeakPolarHBondContact OE2-CE 3.42Å; E556-K586 IonicContact OE2-NZ 3.53Å; E556-K586 PolarHBondContact OE2-NZ 3.34Å
557	M	79.8	Confident	75.9	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-68.4	-38.6	176.5	-72.7	-63.9	-175	0	0	111.7	L553 K554 E555 C560 G561 M562 F565 V582 T585 K586	L553-M557 HydrophobicContact CD1-CE 4.12Å; L553-M557 HydrophobicContact CD1-CG 4.24Å; L553-M557 HydrophobicContact CG-CG 4.41Å; L553-M557 WeakPolarHBondContact O-CB 3.2Å; L553-M557 VanDerWaalsContact O-CG 3.27Å; L553-M557 WeakPolarHBondContact O-CG 3.41Å; L553-M557 PolarHBondContact O-N 2.85Å; K554-M557 PolarHBondContact O-N 3.3Å; E555-M557 PolarHBondContact O-N 2.89Å; M557-C560 WeakPolarHBondContact O-CB 3.18Å; M557-C560 PolarHBondContact O-N 3.28Å; M557-G561 PolarHBondContact O-N 3.2Å; M557-M562 HydrophobicContact CB-CB 4.32Å; M557-M562 VanDerWaalsContact O-CB 3.26Å; M557-M562 WeakPolarHBondContact O-CB 3.44Å; M557-M562 PolarHBondContact O-N 3.4Å; M557-F565 HydrophobicContact CB-CB 4.11Å; M557-F565 HydrophobicContact CB-CD1 3.86Å; M557-F565 HydrophobicContact CB-CD2 4.16Å; M557-F565 HydrophobicContact CB-CE1 4.34Å; M557-F565 HydrophobicContact CB-CG 3.77Å; M557-F565 HydrophobicContact CE-CE2 4.18Å; M557-F565 HydrophobicContact CE-CZ 4.47Å; M557-F565 HydrophobicContact CG-CD1 3.95Å; M557-F565 HydrophobicContact CG-CD2 3.9Å; M557-F565 HydrophobicContact CG-CE1 3.94Å; M557-F565 HydrophobicContact CG-CE2 3.89Å; M557-F565 HydrophobicContact CG-CG 3.94Å; M557-F565 HydrophobicContact CG-CZ 3.91Å; M557-F565 HydrophobicContact SD-CD2 4.45Å; M557-F565 HydrophobicContact SD-CE2 4.39Å; M557-V582 HydrophobicContact CE-CB 4.24Å; M557-V582 HydrophobicContact CE-CG1 3.53Å; M557-T585 HydrophobicContact CE-CG2 4.42Å; M557-T585 HydrophobicContact SD-CG2 4.14Å; M557-K586 HydrophobicContact CE-CD 4.4Å; M557-K586 HydrophobicContact CE-CG 3.85Å; M557-K586 HydrophobicContact SD-CG 4.49Å
558	C	77.9	Confident	75.6	Confident	62 Å²	62	59 Å²	59	42%	0.419	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-40.3	172.5	-77.9	0	0	0	0	112	K554 E555 C560 G561	K554-C558 VanDerWaalsContact O-CB 3.27Å; K554-C558 WeakPolarHBondContact O-CB 3.12Å; K554-C558 PolarHBondContact O-N 3.28Å; K554-C558 PolarHBondContact O-SG 2.92Å; E555-C558 PolarHBondContact O-N 2.84Å; C558-C560 PolarHBondContact O-N 3.36Å; C558-G561 WeakPolarHBondContact O-CA 3.02Å; C558-G561 PolarHBondContact O-N 3.33Å
559	S	76.3	Confident	75.4	Confident	78 Å²	78	52.8 Å²	52.8	55%	0.545	30%	0.298	S	S	.	.	H	α-helix	trans	-63.4	-30.1	175.4	58.7	0	0	0	0	112.8	E555 E556 G561	E555-S559 PolarHBondContact O-N 3.22Å; E555-S559 PolarHBondContact O-OG 3.07Å; E556-S559 WeakPolarHBondContact CA-OG 3.34Å; E556-S559 PolarHBondContact O-N 3.11Å; E556-S559 PolarHBondContact O-OG 2.87Å; S559-G561 PolarHBondContact O-N 3.16Å
560	C	71.3	Confident	74.9	Confident	18 Å²	18	52.1 Å²	52.1	12%	0.122	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	0.4	172.2	-61.9	0	0	0	0	113.5	E556 M557 C558 M562 M589 V652	E556-C560 PolarHBondContact O-N 3.29Å; E556-C560 VanDerWaalsContact O-N 3.16Å; E556-C560 PolarHBondContact O-SG 3.26Å; M557-C560 WeakPolarHBondContact O-CB 3.18Å; M557-C560 PolarHBondContact O-N 3.28Å; C558-C560 PolarHBondContact O-N 3.36Å; C560-M562 HydrophobicContact CB-CG 4.5Å; C560-M589 HydrophobicContact CB-CB 4.14Å; C560-M589 HydrophobicContact CB-CE 4.31Å; C560-M589 HydrophobicContact CB-CG 4Å; C560-M589 WeakPolarHBondContact O-CE 3.36Å; C560-V652 WeakPolarHBondContact O-CG1 3.22Å
561	G	69.3	Low	74.1	Confident	31 Å²	31	58.6 Å²	58.6	32%	0.32	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	5.9	-179.6	0	0	0	0	0	115.4	M557 C558 S559 S563	M557-G561 PolarHBondContact O-N 3.2Å; C558-G561 WeakPolarHBondContact O-CA 3.02Å; C558-G561 PolarHBondContact O-N 3.33Å; S559-G561 PolarHBondContact O-N 3.16Å; G561-S563 VanDerWaalsContact C-N 3.34Å; G561-S563 PolarHBondContact O-N 2.72Å
562	M	75.2	Confident	73.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.343	C	S	.	.			trans	-85.9	68.6	-177.8	-55.8	-73.6	-79.3	0	0	111.6	M557 C560 S564 F565 T585 F644 T648 V649 V652	M557-M562 HydrophobicContact CB-CB 4.32Å; M557-M562 VanDerWaalsContact O-CB 3.26Å; M557-M562 WeakPolarHBondContact O-CB 3.44Å; M557-M562 PolarHBondContact O-N 3.4Å; C560-M562 HydrophobicContact CB-CG 4.5Å; M562-S564 VanDerWaalsContact C-N 3.28Å; M562-S564 PolarHBondContact O-N 3.08Å; M562-F565 HydrophobicContact CB-CB 4.33Å; M562-F565 WeakPolarHBondContact O-CB 3.36Å; M562-F565 PolarHBondContact O-N 3.16Å; M562-T585 HydrophobicContact CE-CG2 4.06Å; M562-F644 HydrophobicContact CE-CE1 4.06Å; M562-F644 HydrophobicContact CE-CE2 3.61Å; M562-F644 HydrophobicContact CE-CZ 3.29Å; M562-T648 HydrophobicContact CE-CG2 3.36Å; M562-T648 HydrophobicContact SD-CG2 3.87Å; M562-V649 HydrophobicContact CE-CB 4.13Å; M562-V649 HydrophobicContact CE-CG2 3.43Å; M562-V649 VanDerWaalsContact CE-CG2 3.43Å; M562-V652 HydrophobicContact SD-CB 3.73Å; M562-V652 HydrophobicContact SD-CG1 3.89Å; M562-V652 HydrophobicContact SD-CG2 3.67Å
563	S	66.2	Low	72.7	Confident	98 Å²	98	56.3 Å²	56.3	69%	0.685	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-24.1	-176.4	50.6	0	0	0	0	115.1	G561	G561-S563 VanDerWaalsContact C-N 3.34Å; G561-S563 PolarHBondContact O-N 2.72Å
564	S	67.6	Low	72.5	Confident	34 Å²	34	61.5 Å²	61.5	24%	0.238	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	3.2	177.5	56	0	0	0	0	114.3	M562 N566 Q567 T648	M562-S564 VanDerWaalsContact C-N 3.28Å; M562-S564 PolarHBondContact O-N 3.08Å; S564-N566 PolarHBondContact O-N 2.97Å; S564-N566 VanDerWaalsContact O-N 3.11Å; S564-Q567 WeakPolarHBondContact O-CB 3.45Å; S564-Q567 PolarHBondContact O-N 2.68Å; S564-T648 WeakPolarHBondContact OG-CG2 3.4Å
565	F	73.9	Confident	72.5	Confident	1 Å²	1	58.9 Å²	58.9	0%	0.004	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-57.7	-28.6	-178.7	-173.8	-103	0	0	0	113.3	L553 K554 M557 M562 Q567 Y568 T569 V575 L577 F644	L553-F565 HydrophobicContact CD2-CE1 4.12Å; L553-F565 HydrophobicContact CD2-CZ 3.9Å; L553-F565 HydrophobicContact CG-CE1 4.06Å; L553-F565 HydrophobicContact CG-CZ 4.13Å; K554-F565 HydrophobicContact CG-CD1 4.21Å; K554-F565 HydrophobicContact CG-CE1 4.39Å; M557-F565 HydrophobicContact CB-CB 4.11Å; M557-F565 HydrophobicContact CB-CD1 3.86Å; M557-F565 HydrophobicContact CB-CD2 4.16Å; M557-F565 HydrophobicContact CB-CE1 4.34Å; M557-F565 HydrophobicContact CB-CG 3.77Å; M557-F565 HydrophobicContact CE-CE2 4.18Å; M557-F565 HydrophobicContact CE-CZ 4.47Å; M557-F565 HydrophobicContact CG-CD1 3.95Å; M557-F565 HydrophobicContact CG-CD2 3.9Å; M557-F565 HydrophobicContact CG-CE1 3.94Å; M557-F565 HydrophobicContact CG-CE2 3.89Å; M557-F565 HydrophobicContact CG-CG 3.94Å; M557-F565 HydrophobicContact CG-CZ 3.91Å; M557-F565 HydrophobicContact SD-CD2 4.45Å; M557-F565 HydrophobicContact SD-CE2 4.39Å; M562-F565 HydrophobicContact CB-CB 4.33Å; M562-F565 WeakPolarHBondContact O-CB 3.36Å; M562-F565 PolarHBondContact O-N 3.16Å; F565-Q567 PolarHBondContact O-N 3.49Å; F565-Q567 VanDerWaalsContact O-N 3.11Å; F565-Y568 PolarHBondContact O-N 3.4Å; F565-T569 HydrophobicContact CD1-CG2 4.24Å; F565-T569 HydrophobicContact CE1-CG2 3.95Å; F565-V575 HydrophobicContact CZ-CG1 4.23Å; F565-L577 HydrophobicContact CD2-CD1 4.34Å; F565-L577 HydrophobicContact CE2-CD1 3.71Å; F565-F644 AromaticContact CD2-CE2 3.7Å; F565-F644 HydrophobicContact CD2-CE2 3.7Å; F565-F644 AromaticContact CD2-CZ 3.63Å; F565-F644 HydrophobicContact CD2-CZ 3.63Å; F565-F644 HydrophobicContact CE2-CE2 4.31Å; F565-F644 AromaticContact CE2-CZ 3.95Å; F565-F644 HydrophobicContact CE2-CZ 3.95Å
566	N	70.7	Confident	72.5	Confident	85 Å²	85	54.1 Å²	54.1	46%	0.455	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-58.1	-24.4	176.9	-69.1	-30.1	0	0	0	113.9	K554 S564 Y568 T569	K554-N566 WeakPolarHBondContact CD-OD1 3.5Å; S564-N566 PolarHBondContact O-N 2.97Å; S564-N566 VanDerWaalsContact O-N 3.11Å; N566-Y568 PolarHBondContact O-N 3.23Å; N566-T569 PolarHBondContact O-OG1 3.13Å
567	Q	74.8	Confident	72.6	Confident	149 Å²	149	51 Å²	51	70%	0.696	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-72.9	-16.1	178.3	-61.7	174.1	-0.9	0	0	112.9	S564 F565	S564-Q567 WeakPolarHBondContact O-CB 3.45Å; S564-Q567 PolarHBondContact O-N 2.68Å; F565-Q567 PolarHBondContact O-N 3.49Å; F565-Q567 VanDerWaalsContact O-N 3.11Å
568	Y	69.3	Low	72.8	Confident	26 Å²	26	51 Å²	51	10%	0.102	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-106.5	7.2	-177.2	-62.3	-87.9	0	0	0	112.8	F565 N566 N576 L577 Q640 F644	F565-Y568 PolarHBondContact O-N 3.4Å; N566-Y568 PolarHBondContact O-N 3.23Å; Y568-N576 WeakPolarHBondContact O-CB 3.46Å; Y568-N576 PolarHBondContact O-N 3.04Å; Y568-L577 HydrophobicContact CD1-CD2 3.8Å; Y568-L577 HydrophobicContact CD1-CG 4.34Å; Y568-L577 HydrophobicContact CE1-CD2 4.48Å; Y568-L577 HydrophobicContact CG-CD1 4.24Å; Y568-L577 HydrophobicContact CG-CD2 4.25Å; Y568-L577 HydrophobicContact CG-CG 4.37Å; Y568-Q640 HydrophobicContact CD1-CG 4.24Å; Y568-Q640 HydrophobicContact CE1-CG 4.17Å; Y568-F644 HydrophobicContact CD1-CB 4.36Å; Y568-F644 HydrophobicContact CD1-CD2 4.41Å; Y568-F644 AromaticContact CD2-CD2 3.66Å; Y568-F644 HydrophobicContact CD2-CD2 3.66Å; Y568-F644 HydrophobicContact CD2-CE2 4.17Å; Y568-F644 HydrophobicContact CE1-CB 3.99Å; Y568-F644 HydrophobicContact CE1-CD2 4.39Å; Y568-F644 AromaticContact CE2-CD2 3.65Å; Y568-F644 HydrophobicContact CE2-CD2 3.65Å; Y568-F644 HydrophobicContact CE2-CE2 4.42Å; Y568-F644 HydrophobicContact CG-CD2 4.05Å
569	T	72.6	Confident	73.1	Confident	24 Å²	24	54.8 Å²	54.8	15%	0.147	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-96.6	134.4	173.9	61.9	0	0	0	0	110.8	K554 F565 N566	K554-T569 VanDerWaalsContact CE-CG2 3.41Å; K554-T569 VanDerWaalsContact CE-OG1 3.24Å; K554-T569 WeakPolarHBondContact CE-OG1 3.23Å; K554-T569 HydrophobicContact CG-CG2 4.37Å; K554-T569 PolarHBondContact NZ-OG1 3.27Å; F565-T569 HydrophobicContact CD1-CG2 4.24Å; F565-T569 HydrophobicContact CE1-CG2 3.95Å; N566-T569 PolarHBondContact O-OG1 3.13Å
570	G	67.3	Low	73.6	Confident	22 Å²	22	51.6 Å²	51.6	23%	0.227	28%	0.277	C	S	.	.			trans	-92	-171.4	173.8	0	0	0	0	0	112.2	W574	G570-W574 PolarHBondContact N-O 3.42Å
571	D	60.8	Low	74.2	Confident	146 Å²	146	51.1 Å²	51.1	78%	0.781	27%	0.274	S	S	*	.	S	Bend	trans	-66.8	145.2	178.5	-61.6	-37.1	0	0	0	112	C573 W574	D571-C573 PolarHBondContact O-N 3.48Å; D571-W574 PolarHBondContact O-N 3.37Å
572	D	63.5	Low	75	Confident	133 Å²	133	50 Å²	50	71%	0.711	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	-91.1	-179.3	-56.5	-31.9	0	0	0	115.9
573	C	69.8	Low	75.5	Confident	17 Å²	17	50.7 Å²	50.7	12%	0.115	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.2	4.4	-167.5	-57.2	0	0	0	0	113.4	L544 P547 D571	L544-C573 PolarHBondContact N-O 2.95Å; P547-C573 VanDerWaalsContact CD-SG 3.58Å; D571-C573 PolarHBondContact O-N 3.48Å
574	W	75.9	Confident	76.6	Confident	117 Å²	117	46.2 Å²	46.2	44%	0.443	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	138	-172.5	-69.8	92.1	0	0	0	112.6	K541 M542 N543 G570 D571	K541-W574 HydrophobicContact CB-CE3 3.89Å; K541-W574 HydrophobicContact CB-CZ3 4.15Å; M542-W574 WeakPolarHBondContact O-CA 3.49Å; N543-W574 HydrophobicContact CB-CD2 4.07Å; N543-W574 HydrophobicContact CB-CE3 3.84Å; N543-W574 HydrophobicContact CB-CH2 3.88Å; N543-W574 HydrophobicContact CB-CZ2 4.08Å; N543-W574 HydrophobicContact CB-CZ3 3.76Å; N543-W574 WeakPolarHBondContact ND2-CZ2 3.34Å; G570-W574 PolarHBondContact N-O 3.42Å; D571-W574 PolarHBondContact O-N 3.37Å
575	V	79.9	Confident	77.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.3	171.6	-175.9	0	0	0	0	108.2	M542 L544 L550 L553 F565 L577	M542-V575 HydrophobicContact CB-CB 4.3Å; M542-V575 HydrophobicContact CE-CB 3.68Å; M542-V575 HydrophobicContact CE-CG1 4.05Å; M542-V575 HydrophobicContact CE-CG2 3.54Å; M542-V575 PolarHBondContact N-O 3.23Å; M542-V575 VanDerWaalsContact N-O 3.1Å; M542-V575 PolarHBondContact O-N 2.82Å; L544-V575 HydrophobicContact CD1-CG2 3.83Å; L544-V575 HydrophobicContact CG-CG2 4.35Å; L550-V575 HydrophobicContact CD1-CG2 3.89Å; L553-V575 HydrophobicContact CD2-CG2 4.11Å; F565-V575 HydrophobicContact CZ-CG1 4.23Å; V575-L577 HydrophobicContact CG1-CB 3.94Å; V575-L577 HydrophobicContact CG1-CD1 4.39Å; V575-L577 HydrophobicContact CG1-CG 4.29Å; V575-L577 PolarHBondContact O-N 3.06Å
576	N	80.4	Confident	78.2	Confident	29 Å²	29	47.9 Å²	47.9	16%	0.155	24%	0.238	C	C	.	.	S	Bend	trans	-79	33.5	178.6	-64.3	-49	0	0	0	111.8	K541 Y568 F637	K541-N576 WeakPolarHBondContact CD-OD1 3.32Å; K541-N576 VanDerWaalsContact CE-OD1 3.25Å; K541-N576 WeakPolarHBondContact CE-OD1 3.45Å; K541-N576 PolarHBondContact NZ-OD1 3.38Å; Y568-N576 WeakPolarHBondContact O-CB 3.46Å; Y568-N576 PolarHBondContact O-N 3.04Å; N576-F637 WeakPolarHBondContact O-CE2 3.27Å
577	L	82.6	Confident	79	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-132.6	154.9	175.8	-62.5	171.1	0	0	0	109.1	M542 F565 Y568 V575 V582 N641 F644	M542-L577 PolarHBondContact N-O 2.72Å; F565-L577 HydrophobicContact CD2-CD1 4.34Å; F565-L577 HydrophobicContact CE2-CD1 3.71Å; Y568-L577 HydrophobicContact CD1-CD2 3.8Å; Y568-L577 HydrophobicContact CD1-CG 4.34Å; Y568-L577 HydrophobicContact CE1-CD2 4.48Å; Y568-L577 HydrophobicContact CG-CD1 4.24Å; Y568-L577 HydrophobicContact CG-CD2 4.25Å; Y568-L577 HydrophobicContact CG-CG 4.37Å; V575-L577 HydrophobicContact CG1-CB 3.94Å; V575-L577 HydrophobicContact CG1-CD1 4.39Å; V575-L577 HydrophobicContact CG1-CG 4.29Å; V575-L577 PolarHBondContact O-N 3.06Å; L577-V582 HydrophobicContact CB-CG2 4.04Å; L577-V582 HydrophobicContact CD1-CG2 4.31Å; L577-N641 VanDerWaalsContact CA-OD1 3.31Å; L577-N641 WeakPolarHBondContact CA-OD1 3.2Å; L577-N641 WeakPolarHBondContact CD2-OD1 3.22Å; L577-F644 HydrophobicContact CD1-CD1 3.72Å; L577-F644 HydrophobicContact CD1-CD2 3.91Å; L577-F644 HydrophobicContact CD1-CE1 3.82Å; L577-F644 HydrophobicContact CD1-CE2 4.01Å; L577-F644 HydrophobicContact CD1-CG 3.76Å; L577-F644 HydrophobicContact CD1-CZ 3.95Å; L577-F644 HydrophobicContact CD2-CB 3.63Å; L577-F644 HydrophobicContact CD2-CD1 4.11Å; L577-F644 HydrophobicContact CD2-CD2 4.46Å; L577-F644 HydrophobicContact CD2-CG 3.8Å; L577-F644 HydrophobicContact CG-CG 4.46Å
578	S	84.4	Confident	79.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.189	C	C	.	.			trans	-72.3	150.2	174	78.8	0	0	0	0	111	E537 T580 L581 V582 N641	E537-S578 WeakPolarHBondContact OE2-CB 3.43Å; E537-S578 PolarHBondContact OE2-OG 2.81Å; E537-S578 VanDerWaalsContact OE2-OG 3.12Å; S578-T580 VanDerWaalsContact C-N 3.26Å; S578-T580 PolarHBondContact O-N 3.37Å; S578-T580 PolarHBondContact OG-OG1 3.31Å; S578-T580 VanDerWaalsContact OG-OG1 3.11Å; S578-L581 PolarHBondContact O-N 2.92Å; S578-L581 PolarHBondContact OG-N 3.04Å; S578-V582 WeakPolarHBondContact O-CG2 3.35Å; S578-V582 PolarHBondContact O-N 3.47Å; S578-N641 PolarHBondContact N-OD1 2.91Å
579	Y	84.3	Confident	80.5	Confident	142 Å²	142	36.9 Å²	36.9	56%	0.557	19%	0.185	S	C	*	.	H	α-helix	trans	-59.9	-39	176.5	169.9	-103.5	0	0	0	111.6	M542 L581 V582 A583	M542-Y579 HydrophobicContact SD-CD2 3.9Å; Y579-L581 PolarHBondContact O-N 3.12Å; Y579-V582 PolarHBondContact O-N 3.41Å; Y579-A583 WeakPolarHBondContact O-CB 3.48Å; Y579-A583 PolarHBondContact O-N 3.11Å
580	T	85.8	Confident	81.2	Confident	11 Å²	11	37.8 Å²	37.8	7%	0.067	20%	0.195	C	C	.	.	H	α-helix	trans	-64.2	-39.6	-177.6	63.1	0	0	0	0	112.2	R533 E537 S578 A583 F584	R533-T580 HydrophobicContact CB-CG2 3.96Å; R533-T580 WeakPolarHBondContact O-CG2 3.43Å; E537-T580 HydrophobicContact CB-CG2 4.05Å; E537-T580 HydrophobicContact CG-CG2 4.27Å; E537-T580 WeakPolarHBondContact OE2-CB 3.41Å; E537-T580 WeakPolarHBondContact OE2-CG2 3.39Å; E537-T580 PolarHBondContact OE2-OG1 3.4Å; S578-T580 VanDerWaalsContact C-N 3.26Å; S578-T580 PolarHBondContact O-N 3.37Å; S578-T580 PolarHBondContact OG-OG1 3.31Å; S578-T580 VanDerWaalsContact OG-OG1 3.11Å; T580-A583 PolarHBondContact O-N 2.47Å; T580-F584 WeakPolarHBondContact O-CB 3.27Å; T580-F584 PolarHBondContact O-N 3.04Å
581	L	84.8	Confident	82.3	Confident	9 Å²	9	36.8 Å²	36.8	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-71.8	-37.7	-179.3	-172.5	61.1	0	0	0	112.1	S578 Y579 F584 T585 N641 F644 L645	S578-L581 PolarHBondContact O-N 2.92Å; S578-L581 PolarHBondContact OG-N 3.04Å; Y579-L581 PolarHBondContact O-N 3.12Å; L581-F584 HydrophobicContact CD1-CD1 4.38Å; L581-T585 WeakPolarHBondContact O-CB 3.5Å; L581-T585 PolarHBondContact O-N 3.22Å; L581-T585 PolarHBondContact O-OG1 2.87Å; L581-N641 HydrophobicContact CD2-CB 3.74Å; L581-N641 WeakPolarHBondContact CD2-O 3.06Å; L581-F644 HydrophobicContact CD2-CB 4.27Å; L581-F644 HydrophobicContact CD2-CD1 3.69Å; L581-F644 HydrophobicContact CD2-CG 4.46Å; L581-F644 HydrophobicContact CG-CD1 4Å; L581-F644 HydrophobicContact CG-CE1 4.5Å; L581-L645 HydrophobicContact CD1-CB 4.12Å; L581-L645 HydrophobicContact CD1-CD1 4Å; L581-L645 HydrophobicContact CD1-CD2 4.49Å; L581-L645 HydrophobicContact CD1-CG 4.42Å
582	V	85.3	Confident	83.6	Confident	6 Å²	6	29.8 Å²	29.8	4%	0.036	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-46.9	173.2	169.9	0	0	0	0	110.5	M542 L553 M557 L577 S578 Y579 T585 K586	M542-V582 HydrophobicContact CE-CG1 4.35Å; M542-V582 HydrophobicContact CE-CG2 4.3Å; L553-V582 HydrophobicContact CD1-CG1 3.97Å; L553-V582 HydrophobicContact CD2-CG1 4.31Å; M557-V582 HydrophobicContact CE-CB 4.24Å; M557-V582 HydrophobicContact CE-CG1 3.53Å; L577-V582 HydrophobicContact CB-CG2 4.04Å; L577-V582 HydrophobicContact CD1-CG2 4.31Å; S578-V582 WeakPolarHBondContact O-CG2 3.35Å; S578-V582 PolarHBondContact O-N 3.47Å; Y579-V582 PolarHBondContact O-N 3.41Å; V582-T585 PolarHBondContact O-N 3.37Å; V582-K586 WeakPolarHBondContact O-CG 3.32Å; V582-K586 PolarHBondContact O-N 3.35Å; V582-K586 VanDerWaalsContact O-N 3.12Å
583	A	86.6	Confident	84.8	Confident	16 Å²	16	26.6 Å²	26.6	13%	0.132	13%	0.127	C	C	.	.	H	α-helix	trans	-64.1	-41.6	177.4	0	0	0	0	0	112.2	Y579 T580 K586 Q587	Y579-A583 WeakPolarHBondContact O-CB 3.48Å; Y579-A583 PolarHBondContact O-N 3.11Å; T580-A583 PolarHBondContact O-N 2.47Å; A583-K586 PolarHBondContact O-N 3.37Å; A583-Q587 WeakPolarHBondContact O-CB 3.26Å; A583-Q587 PolarHBondContact O-N 3.29Å
584	F	89.4	Confident	85.6	Confident	4 Å²	4	27 Å²	27	2%	0.018	13%	0.127	C	C	.	.	H	α-helix	trans	-59.5	-49	173.7	171.5	-98.3	0	0	0	111.4	T530 T580 L581 K586 Q587 M588 I614 A618 L645	T530-F584 HydrophobicContact CG2-CD2 3.82Å; T530-F584 HydrophobicContact CG2-CE2 4.41Å; T580-F584 WeakPolarHBondContact O-CB 3.27Å; T580-F584 PolarHBondContact O-N 3.04Å; L581-F584 HydrophobicContact CD1-CD1 4.38Å; F584-K586 VanDerWaalsContact C-N 3.33Å; F584-K586 PolarHBondContact O-N 3.46Å; F584-Q587 PolarHBondContact O-N 3.13Å; F584-M588 HydrophobicContact CE1-CB 4.38Å; F584-M588 HydrophobicContact CE1-CG 4.39Å; F584-M588 HydrophobicContact CZ-CB 4.3Å; F584-M588 HydrophobicContact CZ-CG 4.19Å; F584-M588 WeakPolarHBondContact O-CB 3.49Å; F584-M588 PolarHBondContact O-N 3.43Å; F584-I614 HydrophobicContact CE2-CG2 3.56Å; F584-I614 HydrophobicContact CZ-CG2 4.02Å; F584-A618 HydrophobicContact CD1-CB 4.04Å; F584-A618 HydrophobicContact CD2-CB 4Å; F584-A618 HydrophobicContact CE1-CB 3.67Å; F584-A618 HydrophobicContact CE2-CB 3.61Å; F584-A618 HydrophobicContact CG-CB 4.2Å; F584-A618 HydrophobicContact CZ-CB 3.45Å; F584-A618 VanDerWaalsContact CZ-CB 3.45Å; F584-L645 HydrophobicContact CD1-CD1 4.31Å; F584-L645 HydrophobicContact CE1-CD1 3.86Å
585	T	86.6	Confident	86.1	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-57.1	-46.9	-179.9	-58.7	0	0	0	0	111.1	M557 M562 L581 V582 M588 M589 V649	M557-T585 HydrophobicContact CE-CG2 4.42Å; M557-T585 HydrophobicContact SD-CG2 4.14Å; M562-T585 HydrophobicContact CE-CG2 4.06Å; L581-T585 WeakPolarHBondContact O-CB 3.5Å; L581-T585 PolarHBondContact O-N 3.22Å; L581-T585 PolarHBondContact O-OG1 2.87Å; V582-T585 PolarHBondContact O-N 3.37Å; T585-M588 PolarHBondContact O-N 3.16Å; T585-M589 HydrophobicContact CG2-CG 4.49Å; T585-M589 WeakPolarHBondContact O-CB 3.38Å; T585-M589 VanDerWaalsContact O-CG 3.25Å; T585-M589 WeakPolarHBondContact O-CG 3.38Å; T585-M589 PolarHBondContact O-N 3.1Å; T585-V649 HydrophobicContact CG2-CG1 4.24Å; T585-V649 HydrophobicContact CG2-CG2 3.93Å; T585-V649 WeakPolarHBondContact OG1-CG2 3.32Å
586	K	87.5	Confident	86.4	Confident	69 Å²	69	23.2 Å²	23.2	30%	0.3	12%	0.116	S	C	.	.	H	α-helix	trans	-60.9	-47.7	177	-72.8	179.8	167.5	-167.7	0	112.4	E556 M557 V582 A583 F584 M588 M589 A590	E556-K586 WeakPolarHBondContact OE2-CE 3.42Å; E556-K586 IonicContact OE2-NZ 3.53Å; E556-K586 PolarHBondContact OE2-NZ 3.34Å; M557-K586 HydrophobicContact CE-CD 4.4Å; M557-K586 HydrophobicContact CE-CG 3.85Å; M557-K586 HydrophobicContact SD-CG 4.49Å; V582-K586 WeakPolarHBondContact O-CG 3.32Å; V582-K586 PolarHBondContact O-N 3.35Å; V582-K586 VanDerWaalsContact O-N 3.12Å; A583-K586 PolarHBondContact O-N 3.37Å; F584-K586 VanDerWaalsContact C-N 3.33Å; F584-K586 PolarHBondContact O-N 3.46Å; K586-M588 VanDerWaalsContact C-N 3.34Å; K586-M588 PolarHBondContact O-N 3.36Å; K586-M589 PolarHBondContact O-N 3.08Å; K586-A590 WeakPolarHBondContact O-CB 3.34Å; K586-A590 PolarHBondContact O-N 3.41Å
587	Q	87.7	Confident	86.7	Confident	30 Å²	30	26 Å²	26	14%	0.14	13%	0.126	C	C	.	.	H	α-helix	trans	-67.5	-36.9	-177.7	-169.4	170.1	13.7	0	0	112.2	I526 R533 A583 F584 F591	I526-Q587 HydrophobicContact CD1-CG 4.41Å; I526-Q587 HydrophobicContact CG1-CG 3.91Å; I526-Q587 HydrophobicContact CG2-CG 4.04Å; R533-Q587 VanDerWaalsContact CZ-OE1 3.25Å; A583-Q587 WeakPolarHBondContact O-CB 3.26Å; A583-Q587 PolarHBondContact O-N 3.29Å; F584-Q587 PolarHBondContact O-N 3.13Å; Q587-F591 WeakPolarHBondContact O-CB 3.39Å; Q587-F591 PolarHBondContact O-N 3.14Å
588	M	87.9	Confident	86.8	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.6	-49.9	175.6	-174.7	39	-106.8	0	0	110.4	F584 T585 K586 A590 F591 L592 L611 I614 V653	F584-M588 HydrophobicContact CE1-CB 4.38Å; F584-M588 HydrophobicContact CE1-CG 4.39Å; F584-M588 HydrophobicContact CZ-CB 4.3Å; F584-M588 HydrophobicContact CZ-CG 4.19Å; F584-M588 WeakPolarHBondContact O-CB 3.49Å; F584-M588 PolarHBondContact O-N 3.43Å; T585-M588 PolarHBondContact O-N 3.16Å; K586-M588 VanDerWaalsContact C-N 3.34Å; K586-M588 PolarHBondContact O-N 3.36Å; M588-A590 PolarHBondContact O-N 3.27Å; M588-F591 WeakPolarHBondContact O-CB 3.48Å; M588-F591 PolarHBondContact O-N 2.88Å; M588-L592 HydrophobicContact CE-CB 3.82Å; M588-L592 PolarHBondContact O-N 3.46Å; M588-L611 HydrophobicContact CE-CD2 3.06Å; M588-L611 HydrophobicContact CE-CG 4.4Å; M588-L611 HydrophobicContact SD-CD2 4.01Å; M588-I614 HydrophobicContact SD-CB 4.33Å; M588-I614 HydrophobicContact SD-CG2 3.76Å; M588-V653 HydrophobicContact CE-CG1 4.17Å; M588-V653 HydrophobicContact CE-CG2 4.38Å; M588-V653 HydrophobicContact CG-CG2 4.35Å
589	M	88.2	Confident	86.8	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.2	-41.2	177.8	-68.9	-58.4	-52.4	0	0	112.6	C560 T585 K586 F591 L592 E593 V652 V653 R656	C560-M589 HydrophobicContact CB-CB 4.14Å; C560-M589 HydrophobicContact CB-CE 4.31Å; C560-M589 HydrophobicContact CB-CG 4Å; C560-M589 WeakPolarHBondContact O-CE 3.36Å; T585-M589 HydrophobicContact CG2-CG 4.49Å; T585-M589 WeakPolarHBondContact O-CB 3.38Å; T585-M589 VanDerWaalsContact O-CG 3.25Å; T585-M589 WeakPolarHBondContact O-CG 3.38Å; T585-M589 PolarHBondContact O-N 3.1Å; K586-M589 PolarHBondContact O-N 3.08Å; M589-F591 VanDerWaalsContact C-N 3.35Å; M589-F591 PolarHBondContact O-N 2.9Å; M589-L592 HydrophobicContact CE-CD2 4.2Å; M589-L592 PolarHBondContact O-N 2.87Å; M589-L592 HydrophobicContact SD-CD2 4.37Å; M589-E593 WeakPolarHBondContact O-CG 3.39Å; M589-E593 PolarHBondContact O-N 2.87Å; M589-V652 HydrophobicContact CE-CG1 4.27Å; M589-V652 HydrophobicContact SD-CG1 4.32Å; M589-V653 HydrophobicContact SD-CG2 3.71Å; M589-R656 HydrophobicContact CE-CG 4.34Å
590	A	87.8	Confident	86.6	Confident	43 Å²	43	21.7 Å²	21.7	36%	0.355	11%	0.11	S	C	.	.	H	α-helix	trans	-60.4	-43.5	174.1	0	0	0	0	0	111.9	K586 M588 L592 E593 E594	K586-A590 WeakPolarHBondContact O-CB 3.34Å; K586-A590 PolarHBondContact O-N 3.41Å; M588-A590 PolarHBondContact O-N 3.27Å; A590-L592 PolarHBondContact O-N 3.37Å; A590-E593 PolarHBondContact O-N 3.37Å; A590-E594 WeakPolarHBondContact O-CG 3.48Å; A590-E594 PolarHBondContact O-N 3.01Å
591	F	89.6	Confident	86.4	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.8	-41	175.4	179.6	-114.9	0	0	0	112.7	L479 L519 Y522 K523 I526 Q587 M588 M589 G595 L607 L611 I614	L479-F591 HydrophobicContact CD2-CD2 3.68Å; L479-F591 HydrophobicContact CD2-CE2 3.9Å; L519-F591 HydrophobicContact CD2-CE2 3.92Å; L519-F591 HydrophobicContact CD2-CZ 4.22Å; Y522-F591 AromaticContact CD1-CD2 3.4Å; Y522-F591 HydrophobicContact CD1-CD2 3.4Å; Y522-F591 AromaticContact CD1-CE2 3.87Å; Y522-F591 HydrophobicContact CD1-CE2 3.87Å; Y522-F591 HydrophobicContact CD1-CG 4.37Å; Y522-F591 HydrophobicContact CE1-CB 4.4Å; Y522-F591 AromaticContact CE1-CD2 3.9Å; Y522-F591 HydrophobicContact CE1-CD2 3.9Å; Y522-F591 HydrophobicContact CG-CD2 4.48Å; K523-F591 HydrophobicContact CB-CZ 4.44Å; I526-F591 HydrophobicContact CD1-CB 3.56Å; I526-F591 HydrophobicContact CD1-CD1 4.23Å; I526-F591 HydrophobicContact CD1-CD2 3.76Å; I526-F591 HydrophobicContact CD1-CE2 4.48Å; I526-F591 HydrophobicContact CD1-CG 3.57Å; Q587-F591 WeakPolarHBondContact O-CB 3.39Å; Q587-F591 PolarHBondContact O-N 3.14Å; M588-F591 WeakPolarHBondContact O-CB 3.48Å; M588-F591 PolarHBondContact O-N 2.88Å; M589-F591 VanDerWaalsContact C-N 3.35Å; M589-F591 PolarHBondContact O-N 2.9Å; F591-G595 WeakPolarHBondContact O-CA 3.48Å; F591-G595 PolarHBondContact O-N 3.03Å; F591-L607 HydrophobicContact CE1-CD1 4.29Å; F591-L607 HydrophobicContact CZ-CD1 4.44Å; F591-L611 HydrophobicContact CD1-CD2 3.7Å; F591-L611 HydrophobicContact CE1-CD2 3.88Å; F591-L611 HydrophobicContact CE1-CG 4.37Å; F591-I614 HydrophobicContact CD1-CD1 3.59Å; F591-I614 HydrophobicContact CE1-CD1 3.61Å; F591-I614 HydrophobicContact CG-CD1 4.3Å; F591-I614 HydrophobicContact CZ-CD1 4.32Å
592	L	88.4	Confident	86.3	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.3	-47.5	176.5	179	63.3	0	0	0	111.1	M588 M589 A590 G595 L596 L611 V653 R656 F657	M588-L592 HydrophobicContact CE-CB 3.82Å; M588-L592 PolarHBondContact O-N 3.46Å; M589-L592 HydrophobicContact CE-CD2 4.2Å; M589-L592 PolarHBondContact O-N 2.87Å; M589-L592 HydrophobicContact SD-CD2 4.37Å; A590-L592 PolarHBondContact O-N 3.37Å; L592-G595 PolarHBondContact O-N 3.42Å; L592-L596 HydrophobicContact CD1-CD1 4.06Å; L592-L596 HydrophobicContact CD1-CG 4.12Å; L592-L596 HydrophobicContact CG-CD1 4.01Å; L592-L596 HydrophobicContact CG-CG 4.44Å; L592-L596 WeakPolarHBondContact O-CB 3.19Å; L592-L596 WeakPolarHBondContact O-CG 3.43Å; L592-L596 PolarHBondContact O-N 2.95Å; L592-L611 HydrophobicContact CB-CD2 4.35Å; L592-L611 HydrophobicContact CD1-CD1 3.83Å; L592-L611 HydrophobicContact CD1-CD2 4.07Å; L592-V653 HydrophobicContact CD2-CB 4.48Å; L592-V653 HydrophobicContact CD2-CG1 4.16Å; L592-R656 HydrophobicContact CD2-CB 3.7Å; L592-F657 HydrophobicContact CD1-CB 4.19Å; L592-F657 HydrophobicContact CD1-CD2 4.05Å
593	E	87.6	Confident	86.2	Confident	65 Å²	65	30.6 Å²	30.6	30%	0.304	16%	0.158	S	C	.	.	H	α-helix	trans	-64.2	-46.4	-178.8	-71.3	-174.6	165.8	0	0	112.2	M589 A590 L596 K597 R656	M589-E593 WeakPolarHBondContact O-CG 3.39Å; M589-E593 PolarHBondContact O-N 2.87Å; A590-E593 PolarHBondContact O-N 3.37Å; E593-L596 PolarHBondContact O-N 3.17Å; E593-K597 WeakPolarHBondContact O-CG 3.35Å; E593-K597 PolarHBondContact O-N 2.91Å; E593-K597 VanDerWaalsContact O-N 3.09Å; E593-R656 IonicContact OE1-CZ 2.69Å; E593-R656 IonicContact OE1-NH1 3.21Å; E593-R656 PolarHBondContact OE1-NH1 3.43Å
594	E	87.2	Confident	86.2	Confident	26 Å²	26	31.4 Å²	31.4	12%	0.121	16%	0.159	C	C	.	.	H	α-helix	trans	-69.1	-36.7	177.7	-59.2	-57	167.9	0	0	112	L479 S480 A483 A590 L596 K597 L598	L479-E594 HydrophobicContact CD2-CB 3.92Å; L479-E594 HydrophobicContact CG-CB 3.96Å; S480-E594 WeakPolarHBondContact CB-OE1 3.3Å; S480-E594 PolarHBondContact OG-OE1 3.11Å; A483-E594 VanDerWaalsContact CB-OE2 3.32Å; A483-E594 WeakPolarHBondContact CB-OE2 3.37Å; A590-E594 WeakPolarHBondContact O-CG 3.48Å; A590-E594 PolarHBondContact O-N 3.01Å; E594-L596 VanDerWaalsContact C-N 3.33Å; E594-L596 PolarHBondContact O-N 3.48Å; E594-K597 PolarHBondContact O-N 3.43Å; E594-K597 IonicContact OE1-NZ 3.48Å; E594-K597 PolarHBondContact OE1-NZ 3.48Å; E594-K597 VanDerWaalsContact OE1-NZ 3.15Å; E594-K597 WeakPolarHBondContact OE2-CD 3.22Å; E594-K597 WeakPolarHBondContact OE2-CE 3.21Å; E594-K597 IonicContact OE2-NZ 2.82Å; E594-K597 PolarHBondContact OE2-NZ 2.93Å; E594-L598 PolarHBondContact O-N 3.32Å
595	G	86.3	Confident	85.9	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-36.7	173	0	0	0	0	0	112.9	F591 L592 L598 Y599	F591-G595 WeakPolarHBondContact O-CA 3.48Å; F591-G595 PolarHBondContact O-N 3.03Å; L592-G595 PolarHBondContact O-N 3.42Å; G595-L598 CarbonylContact O-C 3.54Å; G595-L598 PolarHBondContact O-N 2.94Å; G595-Y599 PolarHBondContact O-N 2.6Å; G595-Y599 VanDerWaalsContact O-N 3.15Å
596	L	86.6	Confident	85.9	Confident	36 Å²	36	36.2 Å²	36.2	19%	0.188	18%	0.183	C	C	.	.	H	α-helix	trans	-69.7	-37.4	175.2	-74.6	174.4	0	0	0	112.4	L592 E593 E594 L598 Y599 L607 V661	L592-L596 HydrophobicContact CD1-CD1 4.06Å; L592-L596 HydrophobicContact CD1-CG 4.12Å; L592-L596 HydrophobicContact CG-CD1 4.01Å; L592-L596 HydrophobicContact CG-CG 4.44Å; L592-L596 WeakPolarHBondContact O-CB 3.19Å; L592-L596 WeakPolarHBondContact O-CG 3.43Å; L592-L596 PolarHBondContact O-N 2.95Å; E593-L596 PolarHBondContact O-N 3.17Å; E594-L596 VanDerWaalsContact C-N 3.33Å; E594-L596 PolarHBondContact O-N 3.48Å; L596-L598 PolarHBondContact O-N 2.87Å; L596-Y599 WeakPolarHBondContact O-CB 3.21Å; L596-Y599 PolarHBondContact O-N 2.82Å; L596-Y599 VanDerWaalsContact O-N 3.12Å; L596-L607 HydrophobicContact CD2-CD2 4.36Å; L596-V661 HydrophobicContact CD2-CG2 3.86Å
597	K	85.7	Confident	85.9	Confident	87 Å²	87	33 Å²	33	38%	0.378	17%	0.169	S	C	.	.	H	α-helix	trans	-61.1	-33.8	172.8	-68.3	-178.1	-163.2	166.8	0	112.3	A483 E484 E593 E594 Y599	A483-K597 HydrophobicContact CB-CB 4.13Å; A483-K597 HydrophobicContact CB-CD 4.14Å; E484-K597 IonicContact OE1-NZ 3.9Å; E484-K597 PolarHBondContact OE1-NZ 3.47Å; E484-K597 VanDerWaalsContact OE1-NZ 3.08Å; E593-K597 WeakPolarHBondContact O-CG 3.35Å; E593-K597 PolarHBondContact O-N 2.91Å; E593-K597 VanDerWaalsContact O-N 3.09Å; E594-K597 PolarHBondContact O-N 3.43Å; E594-K597 IonicContact OE1-NZ 3.48Å; E594-K597 PolarHBondContact OE1-NZ 3.48Å; E594-K597 VanDerWaalsContact OE1-NZ 3.15Å; E594-K597 WeakPolarHBondContact OE2-CD 3.22Å; E594-K597 WeakPolarHBondContact OE2-CE 3.21Å; E594-K597 IonicContact OE2-NZ 2.82Å; E594-K597 PolarHBondContact OE2-NZ 2.93Å; K597-Y599 VanDerWaalsContact C-N 3.34Å
598	L	84.9	Confident	85.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	0.2	178.2	-69.5	172.6	0	0	0	113.7	L479 A483 V486 I515 E594 G595 L596 F600 L603	L479-L598 HydrophobicContact CD1-CD1 3.6Å; L479-L598 HydrophobicContact CG-CD1 4.27Å; A483-L598 HydrophobicContact CB-CD1 4.21Å; A483-L598 HydrophobicContact CB-CD2 4.24Å; A483-L598 HydrophobicContact CB-CG 3.93Å; V486-L598 HydrophobicContact CB-CD2 3.74Å; V486-L598 HydrophobicContact CG1-CD2 3.9Å; V486-L598 HydrophobicContact CG2-CD2 3.81Å; I515-L598 HydrophobicContact CD1-CD2 4.28Å; I515-L598 HydrophobicContact CG2-CB 4.08Å; I515-L598 HydrophobicContact CG2-CD1 4.31Å; E594-L598 PolarHBondContact O-N 3.32Å; G595-L598 CarbonylContact O-C 3.54Å; G595-L598 PolarHBondContact O-N 2.94Å; L596-L598 PolarHBondContact O-N 2.87Å; L598-F600 VanDerWaalsContact O-CD2 3.3Å; L598-F600 WeakPolarHBondContact O-CD2 3.49Å; L598-F600 WeakPolarHBondContact O-CE2 3.34Å; L598-L603 WeakPolarHBondContact O-CD1 3.19Å
599	Y	84.7	Confident	85.7	Confident	46 Å²	46	36 Å²	36	18%	0.18	18%	0.184	C	C	.	.			trans	-66	135.9	-170.7	179	-102	0	0	0	113.9	G595 L596 K597 H604 L607 V661	G595-Y599 PolarHBondContact O-N 2.6Å; G595-Y599 VanDerWaalsContact O-N 3.15Å; L596-Y599 WeakPolarHBondContact O-CB 3.21Å; L596-Y599 PolarHBondContact O-N 2.82Å; L596-Y599 VanDerWaalsContact O-N 3.12Å; K597-Y599 VanDerWaalsContact C-N 3.34Å; Y599-H604 HydrophobicContact CE2-CB 3.93Å; Y599-H604 AromaticContact CE2-ND1 3.89Å; Y599-H604 PolarHBondContact OH-ND1 3.43Å; Y599-L607 HydrophobicContact CD2-CD2 4.28Å; Y599-V661 HydrophobicContact CD1-CG2 4.41Å; Y599-V661 HydrophobicContact CD2-CG2 3.99Å; Y599-V661 HydrophobicContact CE1-CB 4.46Å; Y599-V661 HydrophobicContact CE1-CG1 4.15Å; Y599-V661 HydrophobicContact CE1-CG2 4.2Å; Y599-V661 HydrophobicContact CE2-CG1 4.12Å; Y599-V661 HydrophobicContact CE2-CG2 3.76Å; Y599-V661 HydrophobicContact CG-CG2 4.33Å; Y599-V661 WeakPolarHBondContact OH-CG1 3.39Å
600	F	81.1	Confident	85.7	Confident	7 Å²	7	36.2 Å²	36.2	3%	0.031	19%	0.185	C	C	.	.			trans	-141.2	158	164.8	-50.9	-72	0	0	0	109.3	Q508 I515 L598 E602 L603 H604	Q508-F600 HydrophobicContact CB-CE1 4.38Å; Q508-F600 VanDerWaalsContact CD-CE1 3.47Å; Q508-F600 HydrophobicContact CG-CD1 3.82Å; Q508-F600 HydrophobicContact CG-CE1 3.41Å; Q508-F600 VanDerWaalsContact CG-CE1 3.41Å; Q508-F600 HydrophobicContact CG-CZ 3.78Å; Q508-F600 VanDerWaalsContact NE2-CE1 3.33Å; I515-F600 HydrophobicContact CD1-CE2 3.69Å; L598-F600 VanDerWaalsContact O-CD2 3.3Å; L598-F600 WeakPolarHBondContact O-CD2 3.49Å; L598-F600 WeakPolarHBondContact O-CE2 3.34Å; F600-E602 PolarHBondContact O-N 3.41Å; F600-E602 VanDerWaalsContact O-N 3.12Å; F600-L603 HydrophobicContact CD2-CD1 3.67Å; F600-L603 HydrophobicContact CD2-CG 4.39Å; F600-L603 HydrophobicContact CE2-CD1 4.37Å; F600-L603 PolarHBondContact O-N 3.11Å; F600-H604 PolarHBondContact O-N 3.03Å
601	P	81.4	Confident	85.7	Confident	89 Å²	89	34.2 Å²	34.2	58%	0.578	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-51.8	-37.2	-179.1	-28.2	36.6	0	0	0	114.4	L603 H604	P601-L603 VanDerWaalsContact C-N 3.3Å; P601-L603 PolarHBondContact O-N 2.85Å; P601-H604 WeakPolarHBondContact O-CB 3.35Å; P601-H604 PolarHBondContact O-N 2.96Å
602	E	82	Confident	85.6	Confident	122 Å²	122	39.2 Å²	39.2	57%	0.57	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-69.1	-26	179.7	-62.3	75.2	-166.3	0	0	113	V512 F600 H604	V512-E602 HydrophobicContact CG1-CB 4.43Å; V512-E602 HydrophobicContact CG2-CB 4.44Å; F600-E602 PolarHBondContact O-N 3.41Å; F600-E602 VanDerWaalsContact O-N 3.12Å; E602-H604 VanDerWaalsContact C-N 3.34Å
603	L	83.9	Confident	85.5	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-88.6	-3	178	-64.8	178.1	0	0	0	112.9	V512 I515 K516 L598 F600 P601 M605 V606 L607	V512-L603 HydrophobicContact CG1-CD2 4.04Å; I515-L603 HydrophobicContact CB-CD1 4.09Å; I515-L603 HydrophobicContact CG2-CD1 3.42Å; I515-L603 VanDerWaalsContact CG2-CD1 3.42Å; K516-L603 HydrophobicContact CB-CD2 4.09Å; L598-L603 WeakPolarHBondContact O-CD1 3.19Å; F600-L603 HydrophobicContact CD2-CD1 3.67Å; F600-L603 HydrophobicContact CD2-CG 4.39Å; F600-L603 HydrophobicContact CE2-CD1 4.37Å; F600-L603 PolarHBondContact O-N 3.11Å; P601-L603 VanDerWaalsContact C-N 3.3Å; P601-L603 PolarHBondContact O-N 2.85Å; L603-M605 PolarHBondContact O-N 2.91Å; L603-V606 PolarHBondContact O-N 3.44Å; L603-V606 VanDerWaalsContact O-N 3.15Å; L603-L607 PolarHBondContact O-N 3.4Å
604	H	85.1	Confident	85.5	Confident	33 Å²	33	39.7 Å²	39.7	15%	0.153	19%	0.19	C	C	.	.	H	α-helix	trans	-55	-50.8	-174.8	-178.5	77.4	0	0	0	113.2	Y599 F600 P601 E602 V606 L608 F657 V661	Y599-H604 HydrophobicContact CE2-CB 3.93Å; Y599-H604 AromaticContact CE2-ND1 3.89Å; Y599-H604 PolarHBondContact OH-ND1 3.43Å; F600-H604 PolarHBondContact O-N 3.03Å; P601-H604 WeakPolarHBondContact O-CB 3.35Å; P601-H604 PolarHBondContact O-N 2.96Å; E602-H604 VanDerWaalsContact C-N 3.34Å; H604-V606 VanDerWaalsContact C-N 3.35Å; H604-V606 PolarHBondContact O-N 3.38Å; H604-L608 VanDerWaalsContact O-CB 3.24Å; H604-L608 WeakPolarHBondContact O-CB 3.49Å; H604-L608 PolarHBondContact O-N 3.47Å; H604-F657 AromaticContact CE1-CE1 3.78Å; H604-F657 AromaticContact CE1-CZ 3.72Å; H604-F657 AromaticContact ND1-CZ 3.91Å; H604-V661 WeakPolarHBondContact ND1-CG1 3.45Å
605	M	84.9	Confident	85.6	Confident	90 Å²	90	38.7 Å²	38.7	44%	0.443	19%	0.185	S	C	.	.	H	α-helix	trans	-66.3	-38.3	179.5	-67.3	-59	-64.4	0	0	111.8	L603 L608 E609	L603-M605 PolarHBondContact O-N 2.91Å; M605-L608 PolarHBondContact O-N 2.82Å; M605-E609 VanDerWaalsContact O-CB 3.3Å; M605-E609 WeakPolarHBondContact O-CB 3.43Å; M605-E609 VanDerWaalsContact O-CG 3.3Å; M605-E609 WeakPolarHBondContact O-CG 3.14Å; M605-E609 PolarHBondContact O-N 3.34Å
606	V	86	Confident	85.6	Confident	14 Å²	14	41.5 Å²	41.5	9%	0.085	20%	0.2	C	C	.	.	H	α-helix	trans	-63.8	-47.3	179.8	178.6	0	0	0	0	110.9	K516 L519 Q520 L603 H604 S610	K516-V606 HydrophobicContact CD-CG2 3.89Å; K516-V606 HydrophobicContact CG-CG1 4.02Å; K516-V606 HydrophobicContact CG-CG2 3.98Å; L519-V606 HydrophobicContact CB-CG1 4.5Å; Q520-V606 HydrophobicContact CG-CG1 4.45Å; L603-V606 PolarHBondContact O-N 3.44Å; L603-V606 VanDerWaalsContact O-N 3.15Å; H604-V606 VanDerWaalsContact C-N 3.35Å; H604-V606 PolarHBondContact O-N 3.38Å; V606-S610 VanDerWaalsContact O-CB 3.25Å; V606-S610 WeakPolarHBondContact O-CB 3.48Å; V606-S610 PolarHBondContact O-N 3.43Å; V606-S610 PolarHBondContact O-OG 2.95Å
607	L	86.8	Confident	85.6	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-46.8	177.9	-175.9	62	0	0	0	110	F591 L596 Y599 L603 E609 S610 L611 F657	F591-L607 HydrophobicContact CE1-CD1 4.29Å; F591-L607 HydrophobicContact CZ-CD1 4.44Å; L596-L607 HydrophobicContact CD2-CD2 4.36Å; Y599-L607 HydrophobicContact CD2-CD2 4.28Å; L603-L607 PolarHBondContact O-N 3.4Å; L607-E609 PolarHBondContact O-N 3.37Å; L607-S610 PolarHBondContact O-N 3.34Å; L607-L611 HydrophobicContact CD1-CD1 4.29Å; L607-L611 HydrophobicContact CD1-CG 4.3Å; L607-L611 HydrophobicContact CG-CD1 3.95Å; L607-L611 HydrophobicContact CG-CG 4.4Å; L607-L611 WeakPolarHBondContact O-CG 3.46Å; L607-L611 PolarHBondContact O-N 2.76Å; L607-F657 HydrophobicContact CD2-CD2 4.39Å; L607-F657 HydrophobicContact CD2-CE2 3.91Å; L607-F657 HydrophobicContact CG-CE2 4.08Å
608	L	85.9	Confident	85.6	Confident	6 Å²	6	37 Å²	37	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-46.9	-179.9	-173.9	66	0	0	0	112.8	H604 M605 L611 R612 F657 A665 Q667 L668	H604-L608 VanDerWaalsContact O-CB 3.24Å; H604-L608 WeakPolarHBondContact O-CB 3.49Å; H604-L608 PolarHBondContact O-N 3.47Å; M605-L608 PolarHBondContact O-N 2.82Å; L608-L611 PolarHBondContact O-N 3.41Å; L608-R612 WeakPolarHBondContact O-CB 3.38Å; L608-R612 PolarHBondContact O-N 2.89Å; L608-F657 HydrophobicContact CB-CZ 4.27Å; L608-F657 HydrophobicContact CD1-CE1 4.16Å; L608-F657 HydrophobicContact CD1-CE2 4.5Å; L608-F657 HydrophobicContact CD1-CZ 3.97Å; L608-A665 HydrophobicContact CD1-CB 3.81Å; L608-Q667 HydrophobicContact CD2-CB 4.1Å; L608-Q667 HydrophobicContact CD2-CG 4.08Å; L608-Q667 HydrophobicContact CG-CB 4.34Å; L608-L668 HydrophobicContact CD1-CD1 3.97Å; L608-L668 HydrophobicContact CD1-CD2 4.49Å; L608-L668 HydrophobicContact CD1-CG 3.76Å
609	E	86.6	Confident	85.6	Confident	88 Å²	88	37.5 Å²	37.5	41%	0.411	18%	0.184	S	C	.	.	H	α-helix	trans	-64.2	-41.5	176.4	-74.2	175.2	174.3	0	0	111.5	M605 L607 L611 R612 E613	M605-E609 VanDerWaalsContact O-CB 3.3Å; M605-E609 WeakPolarHBondContact O-CB 3.43Å; M605-E609 VanDerWaalsContact O-CG 3.3Å; M605-E609 WeakPolarHBondContact O-CG 3.14Å; M605-E609 PolarHBondContact O-N 3.34Å; L607-E609 PolarHBondContact O-N 3.37Å; E609-L611 PolarHBondContact O-N 3.29Å; E609-R612 WeakPolarHBondContact O-CB 3.41Å; E609-R612 PolarHBondContact O-N 2.89Å; E609-E613 WeakPolarHBondContact O-CG 3.27Å; E609-E613 PolarHBondContact O-N 2.66Å
610	S	87.2	Confident	85.7	Confident	5 Å²	5	40.6 Å²	40.6	4%	0.035	20%	0.201	C	C	.	.	H	α-helix	trans	-62.5	-45	177.9	-59.6	0	0	0	0	111.8	V606 L607 E613 I614	V606-S610 VanDerWaalsContact O-CB 3.25Å; V606-S610 WeakPolarHBondContact O-CB 3.48Å; V606-S610 PolarHBondContact O-N 3.43Å; V606-S610 PolarHBondContact O-OG 2.95Å; L607-S610 PolarHBondContact O-N 3.34Å; S610-E613 PolarHBondContact O-N 3.34Å; S610-I614 WeakPolarHBondContact O-CD1 3.48Å; S610-I614 VanDerWaalsContact O-CG1 3.26Å; S610-I614 WeakPolarHBondContact O-CG1 3.26Å; S610-I614 PolarHBondContact O-N 3.12Å; S610-I614 VanDerWaalsContact O-N 3.1Å
611	L	87.8	Confident	85.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.3	-45	175.8	-64.1	167.8	0	0	0	111	M588 F591 L592 L607 L608 E609 E613 I614 I615 F657 L668	M588-L611 HydrophobicContact CE-CD2 3.06Å; M588-L611 HydrophobicContact CE-CG 4.4Å; M588-L611 HydrophobicContact SD-CD2 4.01Å; F591-L611 HydrophobicContact CD1-CD2 3.7Å; F591-L611 HydrophobicContact CE1-CD2 3.88Å; F591-L611 HydrophobicContact CE1-CG 4.37Å; L592-L611 HydrophobicContact CB-CD2 4.35Å; L592-L611 HydrophobicContact CD1-CD1 3.83Å; L592-L611 HydrophobicContact CD1-CD2 4.07Å; L607-L611 HydrophobicContact CD1-CD1 4.29Å; L607-L611 HydrophobicContact CD1-CG 4.3Å; L607-L611 HydrophobicContact CG-CD1 3.95Å; L607-L611 HydrophobicContact CG-CG 4.4Å; L607-L611 WeakPolarHBondContact O-CG 3.46Å; L607-L611 PolarHBondContact O-N 2.76Å; L608-L611 PolarHBondContact O-N 3.41Å; E609-L611 PolarHBondContact O-N 3.29Å; L611-E613 PolarHBondContact O-N 3.16Å; L611-I614 PolarHBondContact O-N 3.32Å; L611-I615 WeakPolarHBondContact O-CB 3.49Å; L611-I615 WeakPolarHBondContact O-CD1 3.4Å; L611-I615 VanDerWaalsContact O-CG1 3.25Å; L611-I615 WeakPolarHBondContact O-CG1 3.44Å; L611-I615 PolarHBondContact O-N 3.42Å; L611-F657 HydrophobicContact CD1-CD2 3.5Å; L611-F657 VanDerWaalsContact CD1-CD2 3.5Å; L611-F657 HydrophobicContact CD1-CE2 3.76Å; L611-L668 HydrophobicContact CB-CD2 4.45Å
612	R	87.1	Confident	86	Confident	106 Å²	106	37.8 Å²	37.8	40%	0.4	18%	0.18	S	C	.	.	H	α-helix	trans	-57.4	-47.5	177.1	161.6	162	-168.7	-103.6	0.6	112	L608 E609 I615 L616 L671	L608-R612 WeakPolarHBondContact O-CB 3.38Å; L608-R612 PolarHBondContact O-N 2.89Å; E609-R612 WeakPolarHBondContact O-CB 3.41Å; E609-R612 PolarHBondContact O-N 2.89Å; R612-I615 PolarHBondContact O-N 3.33Å; R612-L616 WeakPolarHBondContact O-CB 3.36Å; R612-L616 PolarHBondContact O-N 3.49Å; R612-L671 HydrophobicContact CB-CD1 3.67Å; R612-L671 HydrophobicContact CG-CD1 3.43Å; R612-L671 VanDerWaalsContact CG-CD1 3.43Å; R612-L671 HydrophobicContact CG-CD2 4.37Å; R612-L671 HydrophobicContact CG-CG 4.32Å
613	E	86.6	Confident	86	Confident	74 Å²	74	33 Å²	33	35%	0.346	16%	0.159	S	C	.	.	H	α-helix	trans	-66.6	-42.8	-178.9	-73.9	177.8	-166.9	0	0	112.3	K523 I527 E609 S610 L611 I615 L616 V617	K523-E613 HydrophobicContact CD-CB 4.41Å; K523-E613 WeakPolarHBondContact CD-OE2 3.32Å; K523-E613 WeakPolarHBondContact CE-OE2 3.49Å; K523-E613 IonicContact NZ-OE2 3.73Å; K523-E613 PolarHBondContact NZ-OE2 2.93Å; I527-E613 HydrophobicContact CD1-CB 4.3Å; E609-E613 WeakPolarHBondContact O-CG 3.27Å; E609-E613 PolarHBondContact O-N 2.66Å; S610-E613 PolarHBondContact O-N 3.34Å; L611-E613 PolarHBondContact O-N 3.16Å; E613-I615 VanDerWaalsContact C-N 3.33Å; E613-I615 PolarHBondContact O-N 2.88Å; E613-L616 PolarHBondContact O-N 2.85Å; E613-V617 WeakPolarHBondContact O-CG2 3.27Å; E613-V617 PolarHBondContact O-N 2.89Å
614	I	88.6	Confident	86	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-59.3	-46.5	175.4	-68.6	164.5	0	0	0	110.5	K523 I526 I527 F584 M588 F591 S610 L611 L616 V617 A618	K523-I614 HydrophobicContact CB-CD1 4.36Å; K523-I614 HydrophobicContact CG-CD1 3.93Å; K523-I614 HydrophobicContact CG-CG1 3.86Å; I526-I614 HydrophobicContact CB-CD1 4.35Å; I526-I614 HydrophobicContact CD1-CD1 3.85Å; I526-I614 HydrophobicContact CG2-CD1 4.24Å; I526-I614 HydrophobicContact CG2-CG1 4.22Å; I526-I614 HydrophobicContact CG2-CG2 3.84Å; I527-I614 HydrophobicContact CD1-CG1 4.45Å; I527-I614 HydrophobicContact CG1-CG1 4.06Å; F584-I614 HydrophobicContact CE2-CG2 3.56Å; F584-I614 HydrophobicContact CZ-CG2 4.02Å; M588-I614 HydrophobicContact SD-CB 4.33Å; M588-I614 HydrophobicContact SD-CG2 3.76Å; F591-I614 HydrophobicContact CD1-CD1 3.59Å; F591-I614 HydrophobicContact CE1-CD1 3.61Å; F591-I614 HydrophobicContact CG-CD1 4.3Å; F591-I614 HydrophobicContact CZ-CD1 4.32Å; S610-I614 WeakPolarHBondContact O-CD1 3.48Å; S610-I614 VanDerWaalsContact O-CG1 3.26Å; S610-I614 WeakPolarHBondContact O-CG1 3.26Å; S610-I614 PolarHBondContact O-N 3.12Å; S610-I614 VanDerWaalsContact O-N 3.1Å; L611-I614 PolarHBondContact O-N 3.32Å; I614-L616 PolarHBondContact O-N 2.98Å; I614-V617 PolarHBondContact O-N 3.33Å; I614-A618 PolarHBondContact O-N 3.46Å
615	I	87.5	Confident	85.9	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-43.9	177	-73	164.2	0	0	0	111.2	L611 R612 E613 V617 A618 V619 L650 V653 L668	L611-I615 WeakPolarHBondContact O-CB 3.49Å; L611-I615 WeakPolarHBondContact O-CD1 3.4Å; L611-I615 VanDerWaalsContact O-CG1 3.25Å; L611-I615 WeakPolarHBondContact O-CG1 3.44Å; L611-I615 PolarHBondContact O-N 3.42Å; R612-I615 PolarHBondContact O-N 3.33Å; E613-I615 VanDerWaalsContact C-N 3.33Å; E613-I615 PolarHBondContact O-N 2.88Å; I615-V617 VanDerWaalsContact C-N 3.27Å; I615-V617 PolarHBondContact O-N 2.63Å; I615-A618 PolarHBondContact O-N 3.07Å; I615-A618 VanDerWaalsContact O-N 3.14Å; I615-V619 HydrophobicContact CG2-CG2 4.08Å; I615-V619 WeakPolarHBondContact O-CG2 3.44Å; I615-V619 PolarHBondContact O-N 3.25Å; I615-L650 HydrophobicContact CB-CD2 4.34Å; I615-L650 HydrophobicContact CD1-CD2 3.82Å; I615-L650 HydrophobicContact CG1-CD2 3.95Å; I615-L650 HydrophobicContact CG2-CD2 3.45Å; I615-L650 VanDerWaalsContact CG2-CD2 3.45Å; I615-V653 HydrophobicContact CD1-CG1 4.26Å; I615-L668 HydrophobicContact CD1-CD2 3.85Å
616	L	87	Confident	85.8	Confident	61 Å²	61	36.7 Å²	36.7	32%	0.319	17%	0.171	S	C	.	.	H	α-helix	trans	-59.3	-39.5	-177.6	-169.2	73.5	0	0	0	111.6	R612 E613 I614 A618 V619 Q620 L671	R612-L616 WeakPolarHBondContact O-CB 3.36Å; R612-L616 PolarHBondContact O-N 3.49Å; E613-L616 PolarHBondContact O-N 2.85Å; I614-L616 PolarHBondContact O-N 2.98Å; L616-A618 PolarHBondContact O-N 3.23Å; L616-V619 PolarHBondContact O-N 2.94Å; L616-Q620 HydrophobicContact CG-CG 4.28Å; L616-Q620 VanDerWaalsContact O-CB 3.3Å; L616-Q620 WeakPolarHBondContact O-CB 3.47Å; L616-Q620 VanDerWaalsContact O-CG 3.23Å; L616-Q620 WeakPolarHBondContact O-CG 3.36Å; L616-Q620 PolarHBondContact O-N 3.1Å; L616-L671 HydrophobicContact CD1-CD2 4.22Å
617	V	86.9	Confident	85.6	Confident	22 Å²	22	44.5 Å²	44.5	13%	0.133	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-41.7	177.5	173	0	0	0	0	111.6	I527 T530 K531 E613 I614 I615 H621	I527-V617 HydrophobicContact CG1-CG2 4.3Å; I527-V617 HydrophobicContact CG2-CG2 4.05Å; T530-V617 HydrophobicContact CG2-CG1 4.22Å; K531-V617 HydrophobicContact CG-CG1 4.03Å; E613-V617 WeakPolarHBondContact O-CG2 3.27Å; E613-V617 PolarHBondContact O-N 2.89Å; I614-V617 PolarHBondContact O-N 3.33Å; I615-V617 VanDerWaalsContact C-N 3.27Å; I615-V617 PolarHBondContact O-N 2.63Å; V617-H621 WeakPolarHBondContact O-CB 3.48Å; V617-H621 PolarHBondContact O-N 2.68Å; V617-H621 VanDerWaalsContact O-N 3.15Å
618	A	85.6	Confident	85.3	Confident	6 Å²	6	47.7 Å²	47.7	5%	0.05	22%	0.221	C	C	.	.	H	α-helix	trans	-68.3	-43.6	177.1	0	0	0	0	0	112	F584 I614 I615 L616 H621 V622 L645	F584-A618 HydrophobicContact CD1-CB 4.04Å; F584-A618 HydrophobicContact CD2-CB 4Å; F584-A618 HydrophobicContact CE1-CB 3.67Å; F584-A618 HydrophobicContact CE2-CB 3.61Å; F584-A618 HydrophobicContact CG-CB 4.2Å; F584-A618 HydrophobicContact CZ-CB 3.45Å; F584-A618 VanDerWaalsContact CZ-CB 3.45Å; I614-A618 PolarHBondContact O-N 3.46Å; I615-A618 PolarHBondContact O-N 3.07Å; I615-A618 VanDerWaalsContact O-N 3.14Å; L616-A618 PolarHBondContact O-N 3.23Å; A618-H621 PolarHBondContact O-N 3.4Å; A618-V622 WeakPolarHBondContact O-CG2 3.44Å; A618-V622 PolarHBondContact O-N 3.43Å; A618-V622 VanDerWaalsContact O-N 3.11Å; A618-L645 HydrophobicContact CB-CD2 4.32Å
619	V	85.5	Confident	85.1	Confident	11 Å²	11	49.8 Å²	49.8	7%	0.067	23%	0.23	C	C	.	.	H	α-helix	trans	-63.4	-46.5	178	175.6	0	0	0	0	111.1	I615 L616 H621 V622 D623 L645 A675	I615-V619 HydrophobicContact CG2-CG2 4.08Å; I615-V619 WeakPolarHBondContact O-CG2 3.44Å; I615-V619 PolarHBondContact O-N 3.25Å; L616-V619 PolarHBondContact O-N 2.94Å; V619-H621 VanDerWaalsContact C-N 3.28Å; V619-H621 PolarHBondContact O-N 2.91Å; V619-V622 PolarHBondContact O-N 2.92Å; V619-D623 WeakPolarHBondContact O-CB 3.46Å; V619-D623 PolarHBondContact O-N 2.84Å; V619-L645 HydrophobicContact CG2-CD2 3.9Å; V619-A675 HydrophobicContact CG1-CB 3.96Å
620	Q	86	Confident	84.6	Confident	111 Å²	111	54.7 Å²	54.7	52%	0.519	25%	0.253	S	S	.	.	H	α-helix	trans	-60.5	-37.1	177.9	-76.2	176.4	-11.7	0	0	112.6	L616 Y624	L616-Q620 HydrophobicContact CG-CG 4.28Å; L616-Q620 VanDerWaalsContact O-CB 3.3Å; L616-Q620 WeakPolarHBondContact O-CB 3.47Å; L616-Q620 VanDerWaalsContact O-CG 3.23Å; L616-Q620 WeakPolarHBondContact O-CG 3.36Å; L616-Q620 PolarHBondContact O-N 3.1Å; Q620-Y624 VanDerWaalsContact O-CB 3.23Å; Q620-Y624 WeakPolarHBondContact O-CB 3.31Å; Q620-Y624 PolarHBondContact O-N 3.46Å
621	H	84.8	Confident	84.4	Confident	32 Å²	32	58.7 Å²	58.7	15%	0.148	27%	0.272	C	S	.	.	H	α-helix	trans	-66.3	-47.6	176.3	179.2	57.7	0	0	0	111.9	N534 W539 V617 A618 V619 D623 Y624 S625	N534-H621 VanDerWaalsContact CG-CG 3.43Å; N534-H621 VanDerWaalsContact ND2-CB 3.34Å; N534-H621 WeakPolarHBondContact ND2-CB 3.28Å; N534-H621 VanDerWaalsContact ND2-CG 3.34Å; N534-H621 PolarHBondContact O-CE1 2.72Å; N534-H621 VanDerWaalsContact O-CE1 3.22Å; N534-H621 PolarHBondContact OD1-CD2 3.45Å; W539-H621 AromaticContact CZ2-NE2 3.77Å; V617-H621 WeakPolarHBondContact O-CB 3.48Å; V617-H621 PolarHBondContact O-N 2.68Å; V617-H621 VanDerWaalsContact O-N 3.15Å; A618-H621 PolarHBondContact O-N 3.4Å; V619-H621 VanDerWaalsContact C-N 3.28Å; V619-H621 PolarHBondContact O-N 2.91Å; H621-D623 VanDerWaalsContact C-N 3.33Å; H621-D623 PolarHBondContact O-N 3.02Å; H621-Y624 PolarHBondContact O-N 3.05Å; H621-S625 WeakPolarHBondContact O-CB 3.33Å; H621-S625 PolarHBondContact O-N 3.4Å; H621-S625 PolarHBondContact O-OG 3.26Å
622	V	84.3	Confident	84	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.024	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-45.2	176.5	175.2	0	0	0	0	110.7	W539 A618 V619 S625 L626 I638 A642 L645	W539-V622 HydrophobicContact CH2-CG2 4.05Å; A618-V622 WeakPolarHBondContact O-CG2 3.44Å; A618-V622 PolarHBondContact O-N 3.43Å; A618-V622 VanDerWaalsContact O-N 3.11Å; V619-V622 PolarHBondContact O-N 2.92Å; V622-S625 PolarHBondContact O-N 3.29Å; V622-L626 HydrophobicContact CG1-CD1 4.08Å; V622-L626 WeakPolarHBondContact O-CB 3.23Å; V622-L626 WeakPolarHBondContact O-CG 3.46Å; V622-L626 PolarHBondContact O-N 3.24Å; V622-I638 HydrophobicContact CG1-CG2 4.21Å; V622-A642 HydrophobicContact CG1-CB 3.66Å; V622-L645 HydrophobicContact CG2-CD2 4.2Å
623	D	82.3	Confident	83.7	Confident	23 Å²	23	65 Å²	65	12%	0.123	32%	0.319	C	S	.	.	H	α-helix	trans	-63.8	-43.6	178.5	-76.6	-18.9	0	0	0	112.3	V619 H621 L626 R627	V619-D623 WeakPolarHBondContact O-CB 3.46Å; V619-D623 PolarHBondContact O-N 2.84Å; H621-D623 VanDerWaalsContact C-N 3.33Å; H621-D623 PolarHBondContact O-N 3.02Å; D623-L626 PolarHBondContact O-N 2.87Å; D623-R627 WeakPolarHBondContact O-CG 3.17Å; D623-R627 PolarHBondContact O-N 2.9Å; D623-R627 VanDerWaalsContact O-N 3.15Å
624	Y	84	Confident	83.3	Confident	159 Å²	159	65 Å²	65	62%	0.624	32%	0.318	S	S	*	.	H	α-helix	trans	-62.3	-45.6	176	178.1	-98.5	0	0	0	111.2	Q620 H621 L626 R627 C628	Q620-Y624 VanDerWaalsContact O-CB 3.23Å; Q620-Y624 WeakPolarHBondContact O-CB 3.31Å; Q620-Y624 PolarHBondContact O-N 3.46Å; H621-Y624 PolarHBondContact O-N 3.05Å; Y624-L626 VanDerWaalsContact C-N 3.35Å; Y624-L626 PolarHBondContact O-N 3.37Å; Y624-R627 PolarHBondContact O-N 2.8Å; Y624-C628 VanDerWaalsContact CZ-SG 3.52Å; Y624-C628 PolarHBondContact O-N 3.36Å; Y624-C628 PolarHBondContact O-SG 3.46Å; Y624-C628 VanDerWaalsContact O-SG 3.37Å
625	S	82.9	Confident	83	Confident	15 Å²	15	69.1 Å²	69.1	11%	0.105	34%	0.336	C	S	.	.	H	α-helix	trans	-63.2	-38.2	176.9	-67	0	0	0	0	112.6	W539 H621 V622 R627 C628 E629	W539-S625 PolarHBondContact NE1-OG 2.96Å; W539-S625 VanDerWaalsContact NE1-OG 3.13Å; H621-S625 WeakPolarHBondContact O-CB 3.33Å; H621-S625 PolarHBondContact O-N 3.4Å; H621-S625 PolarHBondContact O-OG 3.26Å; V622-S625 PolarHBondContact O-N 3.29Å; S625-R627 VanDerWaalsContact C-N 3.31Å; S625-R627 PolarHBondContact O-N 2.9Å; S625-C628 PolarHBondContact O-N 3.27Å; S625-E629 WeakPolarHBondContact O-CB 2.97Å; S625-E629 PolarHBondContact O-N 3.43Å
626	L	82.1	Confident	82.8	Confident	28 Å²	28	71.7 Å²	71.7	15%	0.147	36%	0.358	C	S	.	.	H	α-helix	trans	-63.8	-32.9	175	-78	169.9	0	0	0	113.6	V622 D623 Y624 K635 I638 L639	V622-L626 HydrophobicContact CG1-CD1 4.08Å; V622-L626 WeakPolarHBondContact O-CB 3.23Å; V622-L626 WeakPolarHBondContact O-CG 3.46Å; V622-L626 PolarHBondContact O-N 3.24Å; D623-L626 PolarHBondContact O-N 2.87Å; Y624-L626 VanDerWaalsContact C-N 3.35Å; Y624-L626 PolarHBondContact O-N 3.37Å; L626-K635 HydrophobicContact CD2-CG 4.38Å; L626-I638 HydrophobicContact CD1-CG2 4.38Å; L626-I638 HydrophobicContact CD2-CB 3.76Å; L626-I638 HydrophobicContact CD2-CG2 3.46Å; L626-I638 VanDerWaalsContact CD2-CG2 3.46Å; L626-I638 HydrophobicContact CG-CB 4.36Å; L626-I638 HydrophobicContact CG-CG2 3.51Å; L626-L639 HydrophobicContact CD1-CD2 4.28Å; L626-L639 HydrophobicContact CD2-CD2 3.86Å; L626-L639 HydrophobicContact CD2-CG 3.83Å
627	R	81.8	Confident	82.6	Confident	178 Å²	178	69.8 Å²	69.8	67%	0.672	35%	0.347	S	S	*	.	H	α-helix	trans	-78.3	-37.4	178.8	-70.6	175.9	-173.2	-161.4	1.9	112.5	D623 Y624 S625	D623-R627 WeakPolarHBondContact O-CG 3.17Å; D623-R627 PolarHBondContact O-N 2.9Å; D623-R627 VanDerWaalsContact O-N 3.15Å; Y624-R627 PolarHBondContact O-N 2.8Å; S625-R627 VanDerWaalsContact C-N 3.31Å; S625-R627 PolarHBondContact O-N 2.9Å
628	C	81.1	Confident	82.4	Confident	68 Å²	68	68.7 Å²	68.7	46%	0.459	34%	0.341	S	S	.	.	H	α-helix	trans	-83.9	-24.7	-176	-66.7	0	0	0	0	113.4	Y624 S625	Y624-C628 VanDerWaalsContact CZ-SG 3.52Å; Y624-C628 PolarHBondContact O-N 3.36Å; Y624-C628 PolarHBondContact O-SG 3.46Å; Y624-C628 VanDerWaalsContact O-SG 3.37Å; S625-C628 PolarHBondContact O-N 3.27Å
629	E	81.5	Confident	82.3	Confident	49 Å²	49	71.9 Å²	71.9	23%	0.229	36%	0.356	C	S	.	.			trans	-77.3	125.3	-175.6	-169.9	61.1	-99.1	0	0	112.5	S625 E631 K634 I638	S625-E629 WeakPolarHBondContact O-CB 2.97Å; S625-E629 PolarHBondContact O-N 3.43Å; E629-E631 PolarHBondContact OE1-N 3.35Å; E629-K634 HydrophobicContact CG-CB 3.73Å; E629-K634 WeakPolarHBondContact OE2-CD 3.2Å; E629-I638 HydrophobicContact CB-CD1 3.88Å; E629-I638 HydrophobicContact CG-CD1 3.91Å
630	Q	75.4	Confident	82.2	Confident	192 Å²	192	74.4 Å²	74.4	90%	0.897	37%	0.367	S	S	*	.			trans	-99.8	-20.8	-178.8	-62.6	-175.8	7.5	0	0	112.5
631	E	83.3	Confident	82.1	Confident	89 Å²	89	69.1 Å²	69.1	42%	0.416	34%	0.343	S	S	.	.			trans	-81.5	123	-177.8	-169.8	169.4	-163.1	0	0	111.6	E629 E633 K634 K635	E629-E631 PolarHBondContact OE1-N 3.35Å; E631-E633 VanDerWaalsContact C-N 3.34Å; E631-E633 PolarHBondContact O-N 2.83Å; E631-K634 HydrophobicContact CB-CB 4.3Å; E631-K634 HydrophobicContact CB-CD 4.38Å; E631-K634 HydrophobicContact CB-CG 4.44Å; E631-K634 HydrophobicContact CG-CG 4.47Å; E631-K634 PolarHBondContact O-N 3.46Å; E631-K634 VanDerWaalsContact OE2-CD 3.26Å; E631-K634 WeakPolarHBondContact OE2-CD 3.45Å; E631-K634 WeakPolarHBondContact OE2-CE 3.39Å; E631-K634 IonicContact OE2-NZ 3.66Å; E631-K634 PolarHBondContact OE2-NZ 3.31Å; E631-K635 WeakPolarHBondContact O-CB 3.45Å; E631-K635 PolarHBondContact O-N 2.83Å
632	A	80.1	Confident	82	Confident	81 Å²	81	67.7 Å²	67.7	67%	0.669	34%	0.336	S	S	*	.	H	α-helix	trans	-62.3	-37.6	-172.9	0	0	0	0	0	113.4	K635 A636	A632-K635 PolarHBondContact O-N 3.45Å; A632-A636 WeakPolarHBondContact O-CB 3.33Å; A632-A636 PolarHBondContact O-N 2.89Å
633	E	79.3	Confident	82	Confident	157 Å²	157	68.4 Å²	68.4	73%	0.734	34%	0.342	S	S	*	.	H	α-helix	trans	-68.6	-43.8	179.3	-64.5	-173.5	176	0	0	112	E631 A636 F637	E631-E633 VanDerWaalsContact C-N 3.34Å; E631-E633 PolarHBondContact O-N 2.83Å; E633-A636 PolarHBondContact O-N 3.42Å; E633-F637 PolarHBondContact O-N 3.33Å
634	K	80	Confident	82	Confident	73 Å²	73	67.3 Å²	67.3	32%	0.317	34%	0.336	S	S	.	.	H	α-helix	trans	-66.2	-40.5	174	-71.9	-176.3	-176.2	141.8	0	111.4	E629 E631 A636 F637 I638	E629-K634 HydrophobicContact CG-CB 3.73Å; E629-K634 WeakPolarHBondContact OE2-CD 3.2Å; E631-K634 HydrophobicContact CB-CB 4.3Å; E631-K634 HydrophobicContact CB-CD 4.38Å; E631-K634 HydrophobicContact CB-CG 4.44Å; E631-K634 HydrophobicContact CG-CG 4.47Å; E631-K634 PolarHBondContact O-N 3.46Å; E631-K634 VanDerWaalsContact OE2-CD 3.26Å; E631-K634 WeakPolarHBondContact OE2-CD 3.45Å; E631-K634 WeakPolarHBondContact OE2-CE 3.39Å; E631-K634 IonicContact OE2-NZ 3.66Å; E631-K634 PolarHBondContact OE2-NZ 3.31Å; K634-A636 VanDerWaalsContact C-N 3.32Å; K634-A636 PolarHBondContact O-N 3.36Å; K634-F637 CarbonylContact O-C 3.6Å; K634-F637 WeakPolarHBondContact O-CB 3.43Å; K634-F637 PolarHBondContact O-N 2.97Å; K634-F637 VanDerWaalsContact O-N 3.11Å; K634-I638 WeakPolarHBondContact O-CG1 3.3Å; K634-I638 PolarHBondContact O-N 2.88Å
635	K	82.2	Confident	82	Confident	88 Å²	88	59.8 Å²	59.8	38%	0.383	31%	0.306	S	S	.	.	H	α-helix	trans	-60.1	-41.3	175.2	-167.6	170.4	-175.7	170	0	111.9	L626 E631 A632 I638 L639	L626-K635 HydrophobicContact CD2-CG 4.38Å; E631-K635 WeakPolarHBondContact O-CB 3.45Å; E631-K635 PolarHBondContact O-N 2.83Å; A632-K635 PolarHBondContact O-N 3.45Å; K635-I638 PolarHBondContact O-N 3.14Å; K635-L639 WeakPolarHBondContact O-CB 3.36Å; K635-L639 VanDerWaalsContact O-CG 3.3Å; K635-L639 WeakPolarHBondContact O-CG 3.25Å; K635-L639 PolarHBondContact O-N 3.48Å
636	A	82.2	Confident	81.8	Confident	58 Å²	58	59.1 Å²	59.1	48%	0.479	30%	0.302	S	S	.	.	H	α-helix	trans	-63.4	-40.4	173.3	0	0	0	0	0	112.4	A632 E633 K634 L639 Q640	A632-A636 WeakPolarHBondContact O-CB 3.33Å; A632-A636 PolarHBondContact O-N 2.89Å; E633-A636 PolarHBondContact O-N 3.42Å; K634-A636 VanDerWaalsContact C-N 3.32Å; K634-A636 PolarHBondContact O-N 3.36Å; A636-L639 PolarHBondContact O-N 3.39Å; A636-Q640 PolarHBondContact O-N 2.96Å
637	F	83.5	Confident	81.7	Confident	21 Å²	21	61 Å²	61	9%	0.092	31%	0.312	C	S	.	.	H	α-helix	trans	-66.2	-41.4	175.2	-175.8	-108.6	0	0	0	112.7	W539 K541 N576 E633 K634 L639 Q640 N641	W539-F637 VanDerWaalsContact C-CE1 3.43Å; W539-F637 HydrophobicContact CB-CD1 4.19Å; W539-F637 HydrophobicContact CE3-CD1 4.49Å; W539-F637 HydrophobicContact CE3-CE1 4.47Å; W539-F637 VanDerWaalsContact O-CD1 3.23Å; W539-F637 WeakPolarHBondContact O-CD1 3.24Å; W539-F637 WeakPolarHBondContact O-CE1 3.33Å; K541-F637 HydrophobicContact CG-CD2 4.36Å; K541-F637 HydrophobicContact CG-CE2 3.68Å; K541-F637 HydrophobicContact CG-CZ 4.14Å; N576-F637 WeakPolarHBondContact O-CE2 3.27Å; E633-F637 PolarHBondContact O-N 3.33Å; K634-F637 CarbonylContact O-C 3.6Å; K634-F637 WeakPolarHBondContact O-CB 3.43Å; K634-F637 PolarHBondContact O-N 2.97Å; K634-F637 VanDerWaalsContact O-N 3.11Å; F637-L639 VanDerWaalsContact C-N 3.32Å; F637-L639 PolarHBondContact O-N 3.47Å; F637-Q640 WeakPolarHBondContact O-CB 3.39Å; F637-Q640 PolarHBondContact O-N 3.43Å; F637-N641 VanDerWaalsContact CE1-ND2 3.28Å; F637-N641 WeakPolarHBondContact CE1-ND2 3.26Å; F637-N641 WeakPolarHBondContact CZ-ND2 3.48Å; F637-N641 PolarHBondContact O-N 3.28Å; F637-N641 PolarHBondContact O-ND2 3.27Å
638	I	82.8	Confident	81.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-39.8	175.3	-59.8	161.9	0	0	0	110	W539 V622 L626 E629 K634 K635 Q640 N641 A642	W539-I638 HydrophobicContact CB-CG1 4.16Å; W539-I638 HydrophobicContact CD2-CD1 4.25Å; W539-I638 HydrophobicContact CD2-CG1 3.56Å; W539-I638 HydrophobicContact CE3-CB 4.46Å; W539-I638 HydrophobicContact CE3-CG1 3.81Å; W539-I638 HydrophobicContact CE3-CG2 4.49Å; W539-I638 HydrophobicContact CG-CD1 4.07Å; W539-I638 HydrophobicContact CG-CG1 3.72Å; W539-I638 HydrophobicContact CH2-CG2 4.24Å; W539-I638 HydrophobicContact CZ2-CG2 4.32Å; W539-I638 HydrophobicContact CZ3-CG1 4.44Å; W539-I638 HydrophobicContact CZ3-CG2 4.32Å; V622-I638 HydrophobicContact CG1-CG2 4.21Å; L626-I638 HydrophobicContact CD1-CG2 4.38Å; L626-I638 HydrophobicContact CD2-CB 3.76Å; L626-I638 HydrophobicContact CD2-CG2 3.46Å; L626-I638 VanDerWaalsContact CD2-CG2 3.46Å; L626-I638 HydrophobicContact CG-CB 4.36Å; L626-I638 HydrophobicContact CG-CG2 3.51Å; E629-I638 HydrophobicContact CB-CD1 3.88Å; E629-I638 HydrophobicContact CG-CD1 3.91Å; K634-I638 WeakPolarHBondContact O-CG1 3.3Å; K634-I638 PolarHBondContact O-N 2.88Å; K635-I638 PolarHBondContact O-N 3.14Å; I638-Q640 VanDerWaalsContact C-N 3.31Å; I638-Q640 PolarHBondContact O-N 3.19Å; I638-N641 PolarHBondContact O-N 2.84Å; I638-A642 WeakPolarHBondContact O-CB 3.15Å; I638-A642 PolarHBondContact O-N 2.96Å
639	L	83.1	Confident	81.8	Confident	72 Å²	72	49.7 Å²	49.7	38%	0.377	26%	0.26	S	S	.	.	H	α-helix	trans	-62.2	-36.1	174.7	-76.2	171	0	0	0	112.9	L626 K635 A636 F637 A642 S643 R679	L626-L639 HydrophobicContact CD1-CD2 4.28Å; L626-L639 HydrophobicContact CD2-CD2 3.86Å; L626-L639 HydrophobicContact CD2-CG 3.83Å; K635-L639 WeakPolarHBondContact O-CB 3.36Å; K635-L639 VanDerWaalsContact O-CG 3.3Å; K635-L639 WeakPolarHBondContact O-CG 3.25Å; K635-L639 PolarHBondContact O-N 3.48Å; A636-L639 PolarHBondContact O-N 3.39Å; F637-L639 VanDerWaalsContact C-N 3.32Å; F637-L639 PolarHBondContact O-N 3.47Å; L639-A642 PolarHBondContact O-N 2.92Å; L639-S643 PolarHBondContact O-N 2.93Å; L639-S643 PolarHBondContact O-OG 2.93Å; L639-S643 VanDerWaalsContact O-OG 3.08Å; L639-R679 PolarHBondContact O-NH2 3.23Å
640	Q	82.8	Confident	81.9	Confident	64 Å²	64	47.7 Å²	47.7	30%	0.299	25%	0.251	S	S	.	.	H	α-helix	trans	-65.1	-44.4	174.2	-173.9	176.2	13.6	0	0	111.4	Y568 A636 F637 I638 A642 S643 F644	Y568-Q640 HydrophobicContact CD1-CG 4.24Å; Y568-Q640 HydrophobicContact CE1-CG 4.17Å; A636-Q640 PolarHBondContact O-N 2.96Å; F637-Q640 WeakPolarHBondContact O-CB 3.39Å; F637-Q640 PolarHBondContact O-N 3.43Å; I638-Q640 VanDerWaalsContact C-N 3.31Å; I638-Q640 PolarHBondContact O-N 3.19Å; Q640-A642 VanDerWaalsContact C-N 3.35Å; Q640-S643 VanDerWaalsContact C-OG 3.32Å; Q640-S643 WeakPolarHBondContact CA-OG 3.44Å; Q640-S643 WeakPolarHBondContact O-CB 3.38Å; Q640-S643 PolarHBondContact O-N 3.29Å; Q640-S643 PolarHBondContact O-OG 3.21Å; Q640-F644 PolarHBondContact O-N 2.74Å; Q640-F644 VanDerWaalsContact O-N 3.13Å
641	N	84.1	Confident	82.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-38.9	174.3	-78.6	-83.6	0	0	0	111.7	W539 L577 S578 L581 F637 I638 S643 F644 L645	W539-N641 HydrophobicContact CZ3-CB 3.84Å; L577-N641 VanDerWaalsContact CA-OD1 3.31Å; L577-N641 WeakPolarHBondContact CA-OD1 3.2Å; L577-N641 WeakPolarHBondContact CD2-OD1 3.22Å; S578-N641 PolarHBondContact N-OD1 2.91Å; L581-N641 HydrophobicContact CD2-CB 3.74Å; L581-N641 WeakPolarHBondContact CD2-O 3.06Å; F637-N641 VanDerWaalsContact CE1-ND2 3.28Å; F637-N641 WeakPolarHBondContact CE1-ND2 3.26Å; F637-N641 WeakPolarHBondContact CZ-ND2 3.48Å; F637-N641 PolarHBondContact O-N 3.28Å; F637-N641 PolarHBondContact O-ND2 3.27Å; I638-N641 PolarHBondContact O-N 2.84Å; N641-S643 VanDerWaalsContact C-N 3.34Å; N641-S643 PolarHBondContact O-N 2.96Å; N641-F644 WeakPolarHBondContact O-CB 3.46Å; N641-F644 PolarHBondContact O-N 3.46Å; N641-F644 VanDerWaalsContact O-N 3.16Å; N641-L645 PolarHBondContact O-N 3.44Å
642	A	83.5	Confident	82.3	Confident	2 Å²	2	36.7 Å²	36.7	2%	0.017	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-39	173.3	0	0	0	0	0	112.2	V622 I638 L639 Q640 F644 L645 H646	V622-A642 HydrophobicContact CG1-CB 3.66Å; I638-A642 WeakPolarHBondContact O-CB 3.15Å; I638-A642 PolarHBondContact O-N 2.96Å; L639-A642 PolarHBondContact O-N 2.92Å; Q640-A642 VanDerWaalsContact C-N 3.35Å; A642-F644 VanDerWaalsContact C-N 3.32Å; A642-F644 PolarHBondContact O-N 2.94Å; A642-L645 PolarHBondContact O-N 2.93Å; A642-H646 PolarHBondContact O-CD2 3.41Å; A642-H646 PolarHBondContact O-N 3.28Å
643	S	83.3	Confident	82.5	Confident	20 Å²	20	32.9 Å²	32.9	14%	0.14	17%	0.172	C	C	.	.	H	α-helix	trans	-60.9	-44.8	172.4	7.5	0	0	0	0	111.6	L639 Q640 N641 L645 H646 D647 R679	L639-S643 PolarHBondContact O-N 2.93Å; L639-S643 PolarHBondContact O-OG 2.93Å; L639-S643 VanDerWaalsContact O-OG 3.08Å; Q640-S643 VanDerWaalsContact C-OG 3.32Å; Q640-S643 WeakPolarHBondContact CA-OG 3.44Å; Q640-S643 WeakPolarHBondContact O-CB 3.38Å; Q640-S643 PolarHBondContact O-N 3.29Å; Q640-S643 PolarHBondContact O-OG 3.21Å; N641-S643 VanDerWaalsContact C-N 3.34Å; N641-S643 PolarHBondContact O-N 2.96Å; S643-L645 VanDerWaalsContact C-N 3.3Å; S643-L645 PolarHBondContact O-N 3.41Å; S643-H646 PolarHBondContact O-N 3.06Å; S643-D647 WeakPolarHBondContact O-CA 3.46Å; S643-D647 VanDerWaalsContact O-CB 3.27Å; S643-D647 WeakPolarHBondContact O-CB 3.32Å; S643-D647 PolarHBondContact O-N 3.37Å; S643-R679 PolarHBondContact OG-NH2 2.9Å
644	F	83.1	Confident	82.7	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	I	π-helix	trans	-60.9	-45.4	-178	-179.7	-106.1	0	0	0	110.7	M562 F565 Y568 L577 L581 Q640 N641 A642 T648 V649	M562-F644 HydrophobicContact CE-CE1 4.06Å; M562-F644 HydrophobicContact CE-CE2 3.61Å; M562-F644 HydrophobicContact CE-CZ 3.29Å; F565-F644 AromaticContact CD2-CE2 3.7Å; F565-F644 HydrophobicContact CD2-CE2 3.7Å; F565-F644 AromaticContact CD2-CZ 3.63Å; F565-F644 HydrophobicContact CD2-CZ 3.63Å; F565-F644 HydrophobicContact CE2-CE2 4.31Å; F565-F644 AromaticContact CE2-CZ 3.95Å; F565-F644 HydrophobicContact CE2-CZ 3.95Å; Y568-F644 HydrophobicContact CD1-CB 4.36Å; Y568-F644 HydrophobicContact CD1-CD2 4.41Å; Y568-F644 AromaticContact CD2-CD2 3.66Å; Y568-F644 HydrophobicContact CD2-CD2 3.66Å; Y568-F644 HydrophobicContact CD2-CE2 4.17Å; Y568-F644 HydrophobicContact CE1-CB 3.99Å; Y568-F644 HydrophobicContact CE1-CD2 4.39Å; Y568-F644 AromaticContact CE2-CD2 3.65Å; Y568-F644 HydrophobicContact CE2-CD2 3.65Å; Y568-F644 HydrophobicContact CE2-CE2 4.42Å; Y568-F644 HydrophobicContact CG-CD2 4.05Å; L577-F644 HydrophobicContact CD1-CD1 3.72Å; L577-F644 HydrophobicContact CD1-CD2 3.91Å; L577-F644 HydrophobicContact CD1-CE1 3.82Å; L577-F644 HydrophobicContact CD1-CE2 4.01Å; L577-F644 HydrophobicContact CD1-CG 3.76Å; L577-F644 HydrophobicContact CD1-CZ 3.95Å; L577-F644 HydrophobicContact CD2-CB 3.63Å; L577-F644 HydrophobicContact CD2-CD1 4.11Å; L577-F644 HydrophobicContact CD2-CD2 4.46Å; L577-F644 HydrophobicContact CD2-CG 3.8Å; L577-F644 HydrophobicContact CG-CG 4.46Å; L581-F644 HydrophobicContact CD2-CB 4.27Å; L581-F644 HydrophobicContact CD2-CD1 3.69Å; L581-F644 HydrophobicContact CD2-CG 4.46Å; L581-F644 HydrophobicContact CG-CD1 4Å; L581-F644 HydrophobicContact CG-CE1 4.5Å; Q640-F644 PolarHBondContact O-N 2.74Å; Q640-F644 VanDerWaalsContact O-N 3.13Å; N641-F644 WeakPolarHBondContact O-CB 3.46Å; N641-F644 PolarHBondContact O-N 3.46Å; N641-F644 VanDerWaalsContact O-N 3.16Å; A642-F644 VanDerWaalsContact C-N 3.32Å; A642-F644 PolarHBondContact O-N 2.94Å; F644-T648 HydrophobicContact CD2-CG2 4.44Å; F644-T648 HydrophobicContact CE2-CG2 4.09Å; F644-T648 WeakPolarHBondContact O-CA 3.27Å; F644-T648 VanDerWaalsContact O-CB 3.27Å; F644-T648 WeakPolarHBondContact O-CB 3.44Å; F644-T648 PolarHBondContact O-N 3.05Å; F644-T648 VanDerWaalsContact O-N 3.1Å; F644-V649 HydrophobicContact CD1-CG2 3.9Å; F644-V649 HydrophobicContact CE1-CG2 3.59Å; F644-V649 HydrophobicContact CZ-CG2 4.08Å; F644-V649 PolarHBondContact O-N 2.8Å
645	L	84	Confident	82.9	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	I	π-helix	trans	-59.3	-52.9	175	-174.5	60.4	0	0	0	111.8	L581 F584 A618 V619 V622 N641 A642 S643 V649 L650	L581-L645 HydrophobicContact CD1-CB 4.12Å; L581-L645 HydrophobicContact CD1-CD1 4Å; L581-L645 HydrophobicContact CD1-CD2 4.49Å; L581-L645 HydrophobicContact CD1-CG 4.42Å; F584-L645 HydrophobicContact CD1-CD1 4.31Å; F584-L645 HydrophobicContact CE1-CD1 3.86Å; A618-L645 HydrophobicContact CB-CD2 4.32Å; V619-L645 HydrophobicContact CG2-CD2 3.9Å; V622-L645 HydrophobicContact CG2-CD2 4.2Å; N641-L645 PolarHBondContact O-N 3.44Å; A642-L645 PolarHBondContact O-N 2.93Å; S643-L645 VanDerWaalsContact C-N 3.3Å; S643-L645 PolarHBondContact O-N 3.41Å; L645-V649 HydrophobicContact CD1-CB 4.17Å; L645-V649 HydrophobicContact CD1-CG1 4.27Å; L645-V649 HydrophobicContact CD1-CG2 4.49Å; L645-V649 WeakPolarHBondContact O-CB 3.36Å; L645-V649 PolarHBondContact O-N 3.18Å; L645-L650 WeakPolarHBondContact O-CG 3.28Å; L645-L650 PolarHBondContact O-N 3.11Å
646	H	79.6	Confident	83	Confident	2 Å²	2	28 Å²	28	1%	0.009	15%	0.147	C	C	.	.	I	π-helix	trans	-80.3	-36.7	-171.3	-68.5	-53.5	0	0	0	115.7	A642 S643 L650 P651 A675	A642-H646 PolarHBondContact O-CD2 3.41Å; A642-H646 PolarHBondContact O-N 3.28Å; S643-H646 PolarHBondContact O-N 3.06Å; H646-L650 WeakPolarHBondContact ND1-CD1 3.07Å; H646-P651 WeakPolarHBondContact O-CD 3.48Å; H646-A675 WeakPolarHBondContact CE1-CB 3.35Å
647	D	79.8	Confident	83	Confident	66 Å²	66	25.2 Å²	25.2	35%	0.353	12%	0.124	S	C	.	.	I	π-helix	trans	-98.8	-16.8	-172.9	-60.4	-44.7	0	0	0	112.2	S643 R676 R679	S643-D647 WeakPolarHBondContact O-CA 3.46Å; S643-D647 VanDerWaalsContact O-CB 3.27Å; S643-D647 WeakPolarHBondContact O-CB 3.32Å; S643-D647 PolarHBondContact O-N 3.37Å; D647-R676 IonicContact OD1-CZ 3.07Å; D647-R676 IonicContact OD1-NE 2.72Å; D647-R676 IonicContact OD1-NH2 3.26Å; D647-R676 PolarHBondContact OD1-NH2 3.42Å; D647-R679 IonicContact OD2-CZ 3.58Å; D647-R679 IonicContact OD2-NH1 2.69Å; D647-R679 PolarHBondContact OD2-NH1 3.41Å
648	T	80.8	Confident	83.1	Confident	8 Å²	8	27.1 Å²	27.1	5%	0.049	13%	0.133	C	C	.	.	I	π-helix	trans	-118.5	-54.5	177.9	-43	0	0	0	0	113.2	M562 S564 F644 P651 V652	M562-T648 HydrophobicContact CE-CG2 3.36Å; M562-T648 HydrophobicContact SD-CG2 3.87Å; S564-T648 WeakPolarHBondContact OG-CG2 3.4Å; F644-T648 HydrophobicContact CD2-CG2 4.44Å; F644-T648 HydrophobicContact CE2-CG2 4.09Å; F644-T648 WeakPolarHBondContact O-CA 3.27Å; F644-T648 VanDerWaalsContact O-CB 3.27Å; F644-T648 WeakPolarHBondContact O-CB 3.44Å; F644-T648 PolarHBondContact O-N 3.05Å; F644-T648 VanDerWaalsContact O-N 3.1Å; T648-P651 WeakPolarHBondContact O-CD 3.42Å; T648-V652 WeakPolarHBondContact O-CB 3.47Å; T648-V652 WeakPolarHBondContact O-CG2 3.35Å; T648-V652 PolarHBondContact O-N 3.05Å
649	V	82.9	Confident	83	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	16%	0.158	C	C	.	.	I	π-helix	trans	-69.7	-53.8	-174.1	-178.7	0	0	0	0	111.7	M562 T585 F644 L645 V652 V653	M562-V649 HydrophobicContact CE-CB 4.13Å; M562-V649 HydrophobicContact CE-CG2 3.43Å; M562-V649 VanDerWaalsContact CE-CG2 3.43Å; T585-V649 HydrophobicContact CG2-CG1 4.24Å; T585-V649 HydrophobicContact CG2-CG2 3.93Å; T585-V649 WeakPolarHBondContact OG1-CG2 3.32Å; F644-V649 HydrophobicContact CD1-CG2 3.9Å; F644-V649 HydrophobicContact CE1-CG2 3.59Å; F644-V649 HydrophobicContact CZ-CG2 4.08Å; F644-V649 PolarHBondContact O-N 2.8Å; L645-V649 HydrophobicContact CD1-CB 4.17Å; L645-V649 HydrophobicContact CD1-CG1 4.27Å; L645-V649 HydrophobicContact CD1-CG2 4.49Å; L645-V649 WeakPolarHBondContact O-CB 3.36Å; L645-V649 PolarHBondContact O-N 3.18Å; V649-V652 PolarHBondContact O-N 3.28Å; V649-V653 HydrophobicContact CG1-CG2 4.28Å; V649-V653 WeakPolarHBondContact O-CG2 3.43Å; V649-V653 PolarHBondContact O-N 3.4Å
650	L	83.5	Confident	82.6	Confident	7 Å²	7	31.1 Å²	31.1	4%	0.037	16%	0.161	C	C	.	.	H	α-helix	trans	-59.4	-45.1	-178	-62.7	-178.6	0	0	0	113.3	I615 L645 H646 V652 V653 E654 R672	I615-L650 HydrophobicContact CB-CD2 4.34Å; I615-L650 HydrophobicContact CD1-CD2 3.82Å; I615-L650 HydrophobicContact CG1-CD2 3.95Å; I615-L650 HydrophobicContact CG2-CD2 3.45Å; I615-L650 VanDerWaalsContact CG2-CD2 3.45Å; L645-L650 WeakPolarHBondContact O-CG 3.28Å; L645-L650 PolarHBondContact O-N 3.11Å; H646-L650 WeakPolarHBondContact ND1-CD1 3.07Å; L650-V652 VanDerWaalsContact C-N 3.31Å; L650-V652 PolarHBondContact O-N 2.74Å; L650-V653 PolarHBondContact O-N 3.47Å; L650-E654 WeakPolarHBondContact O-CB 3.43Å; L650-E654 VanDerWaalsContact O-CG 3.3Å; L650-E654 WeakPolarHBondContact O-CG 3.38Å; L650-E654 PolarHBondContact O-N 3.41Å; L650-R672 HydrophobicContact CD1-CB 4.41Å
651	P	83.9	Confident	82.4	Confident	26 Å²	26	29.1 Å²	29.1	17%	0.169	15%	0.153	C	C	.	.	H	α-helix	trans	-65.8	-33.3	178.7	-23	36.7	0	0	0	112.9	H646 T648 K655	H646-P651 WeakPolarHBondContact O-CD 3.48Å; T648-P651 WeakPolarHBondContact O-CD 3.42Å; P651-K655 VanDerWaalsContact O-CB 3.26Å; P651-K655 WeakPolarHBondContact O-CB 3.38Å; P651-K655 PolarHBondContact O-N 2.9Å
652	V	84.4	Confident	81.7	Confident	25 Å²	25	32.3 Å²	32.3	15%	0.152	19%	0.186	C	C	.	.	H	α-helix	trans	-70.6	-41.5	176.4	170.6	0	0	0	0	110.8	C560 M562 M589 T648 V649 L650 K655 R656	C560-V652 WeakPolarHBondContact O-CG1 3.22Å; M562-V652 HydrophobicContact SD-CB 3.73Å; M562-V652 HydrophobicContact SD-CG1 3.89Å; M562-V652 HydrophobicContact SD-CG2 3.67Å; M589-V652 HydrophobicContact CE-CG1 4.27Å; M589-V652 HydrophobicContact SD-CG1 4.32Å; T648-V652 WeakPolarHBondContact O-CB 3.47Å; T648-V652 WeakPolarHBondContact O-CG2 3.35Å; T648-V652 PolarHBondContact O-N 3.05Å; V649-V652 PolarHBondContact O-N 3.28Å; L650-V652 VanDerWaalsContact C-N 3.31Å; L650-V652 PolarHBondContact O-N 2.74Å; V652-K655 PolarHBondContact O-N 3.3Å; V652-R656 WeakPolarHBondContact O-CB 3.36Å; V652-R656 PolarHBondContact O-N 3.03Å
653	V	84.4	Confident	81.2	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-45.8	173.9	170.8	0	0	0	0	111.2	M588 M589 L592 I615 V649 L650 R656 F657	M588-V653 HydrophobicContact CE-CG1 4.17Å; M588-V653 HydrophobicContact CE-CG2 4.38Å; M588-V653 HydrophobicContact CG-CG2 4.35Å; M589-V653 HydrophobicContact SD-CG2 3.71Å; L592-V653 HydrophobicContact CD2-CB 4.48Å; L592-V653 HydrophobicContact CD2-CG1 4.16Å; I615-V653 HydrophobicContact CD1-CG1 4.26Å; V649-V653 HydrophobicContact CG1-CG2 4.28Å; V649-V653 WeakPolarHBondContact O-CG2 3.43Å; V649-V653 PolarHBondContact O-N 3.4Å; L650-V653 PolarHBondContact O-N 3.47Å; V653-R656 PolarHBondContact O-N 3.15Å; V653-F657 VanDerWaalsContact O-CB 3.28Å; V653-F657 WeakPolarHBondContact O-CB 3.45Å; V653-F657 PolarHBondContact O-N 3Å
654	E	83.3	Confident	80.4	Confident	13 Å²	13	41.3 Å²	41.3	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-55.6	-54.4	174	-76.6	170.7	177.3	0	0	110.6	L650 R656 F657 E658 L668 Q669 R672	L650-E654 WeakPolarHBondContact O-CB 3.43Å; L650-E654 VanDerWaalsContact O-CG 3.3Å; L650-E654 WeakPolarHBondContact O-CG 3.38Å; L650-E654 PolarHBondContact O-N 3.41Å; E654-R656 PolarHBondContact O-N 2.95Å; E654-F657 PolarHBondContact O-N 3.43Å; E654-E658 WeakPolarHBondContact O-CB 3.43Å; E654-E658 VanDerWaalsContact O-CG 3.28Å; E654-E658 WeakPolarHBondContact O-CG 3.31Å; E654-E658 PolarHBondContact O-N 3.41Å; E654-L668 HydrophobicContact CG-CB 3.87Å; E654-Q669 WeakPolarHBondContact OE1-CA 3.3Å; E654-Q669 PolarHBondContact OE1-N 3.3Å; E654-R672 VanDerWaalsContact OE1-CB 3.28Å; E654-R672 WeakPolarHBondContact OE1-CB 3.37Å; E654-R672 VanDerWaalsContact OE1-CD 3.27Å; E654-R672 WeakPolarHBondContact OE1-CD 3.44Å; E654-R672 WeakPolarHBondContact OE2-CD 3.44Å; E654-R672 IonicContact OE2-CZ 3.57Å; E654-R672 IonicContact OE2-NH1 3.9Å; E654-R672 PolarHBondContact OE2-NH1 3.35Å
655	K	84.4	Confident	79.8	Confident	128 Å²	128	41.4 Å²	41.4	56%	0.557	23%	0.231	S	C	*	.	H	α-helix	trans	-61.4	-44.7	-177.5	-168.9	-173.5	-176.3	-152.3	0	112	P651 V652 E658 E659	P651-K655 VanDerWaalsContact O-CB 3.26Å; P651-K655 WeakPolarHBondContact O-CB 3.38Å; P651-K655 PolarHBondContact O-N 2.9Å; V652-K655 PolarHBondContact O-N 3.3Å; K655-E658 PolarHBondContact O-N 2.99Å; K655-E659 WeakPolarHBondContact CE-OE1 3.49Å; K655-E659 HydrophobicContact CG-CG 4.5Å; K655-E659 IonicContact NZ-OE1 2.6Å; K655-E659 PolarHBondContact NZ-OE1 3.3Å; K655-E659 WeakPolarHBondContact O-CB 3.4Å; K655-E659 VanDerWaalsContact O-CG 3.3Å; K655-E659 WeakPolarHBondContact O-CG 3.4Å; K655-E659 PolarHBondContact O-N 3.34Å
656	R	82.9	Confident	79.1	Confident	73 Å²	73	48.4 Å²	48.4	28%	0.275	26%	0.262	S	S	.	.	H	α-helix	trans	-67.2	-36.3	178.6	-91.9	-67.8	-172.7	90.3	3.9	112.7	M589 L592 E593 V652 V653 E654 E659 G660	M589-R656 HydrophobicContact CE-CG 4.34Å; L592-R656 HydrophobicContact CD2-CB 3.7Å; E593-R656 IonicContact OE1-CZ 2.69Å; E593-R656 IonicContact OE1-NH1 3.21Å; E593-R656 PolarHBondContact OE1-NH1 3.43Å; V652-R656 WeakPolarHBondContact O-CB 3.36Å; V652-R656 PolarHBondContact O-N 3.03Å; V653-R656 PolarHBondContact O-N 3.15Å; E654-R656 PolarHBondContact O-N 2.95Å; R656-E659 IonicContact NE-OE2 3.85Å; R656-G660 PolarHBondContact O-N 3Å
657	F	83.4	Confident	78.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.4	-43.7	172.8	-176.4	-86.8	0	0	0	111.2	L592 H604 L607 L608 L611 V653 E654 G660 V661 A665 L668	L592-F657 HydrophobicContact CD1-CB 4.19Å; L592-F657 HydrophobicContact CD1-CD2 4.05Å; H604-F657 AromaticContact CE1-CE1 3.78Å; H604-F657 AromaticContact CE1-CZ 3.72Å; H604-F657 AromaticContact ND1-CZ 3.91Å; L607-F657 HydrophobicContact CD2-CD2 4.39Å; L607-F657 HydrophobicContact CD2-CE2 3.91Å; L607-F657 HydrophobicContact CG-CE2 4.08Å; L608-F657 HydrophobicContact CB-CZ 4.27Å; L608-F657 HydrophobicContact CD1-CE1 4.16Å; L608-F657 HydrophobicContact CD1-CE2 4.5Å; L608-F657 HydrophobicContact CD1-CZ 3.97Å; L611-F657 HydrophobicContact CD1-CD2 3.5Å; L611-F657 VanDerWaalsContact CD1-CD2 3.5Å; L611-F657 HydrophobicContact CD1-CE2 3.76Å; V653-F657 VanDerWaalsContact O-CB 3.28Å; V653-F657 WeakPolarHBondContact O-CB 3.45Å; V653-F657 PolarHBondContact O-N 3Å; E654-F657 PolarHBondContact O-N 3.43Å; F657-G660 PolarHBondContact O-N 3.06Å; F657-V661 HydrophobicContact CD1-CB 4.47Å; F657-V661 HydrophobicContact CD1-CG2 4.26Å; F657-V661 HydrophobicContact CD2-CG2 4.29Å; F657-V661 HydrophobicContact CE1-CB 4.25Å; F657-V661 HydrophobicContact CE1-CG1 4.38Å; F657-V661 HydrophobicContact CE1-CG2 4.02Å; F657-V661 HydrophobicContact CE2-CG2 4.04Å; F657-V661 HydrophobicContact CG-CG2 4.41Å; F657-V661 HydrophobicContact CZ-CG2 3.92Å; F657-V661 VanDerWaalsContact O-CB 3.28Å; F657-V661 WeakPolarHBondContact O-CB 3.35Å; F657-V661 WeakPolarHBondContact O-CG2 3.47Å; F657-V661 PolarHBondContact O-N 3.01Å; F657-A665 HydrophobicContact CD1-CB 3.63Å; F657-A665 HydrophobicContact CE1-CB 3.76Å; F657-L668 HydrophobicContact CG-CD1 4.46Å
658	E	84.2	Confident	78.1	Confident	62 Å²	62	48.5 Å²	48.5	29%	0.29	26%	0.26	S	S	.	.	H	α-helix	trans	-63.9	-41.8	177	-71.6	-176.5	175.5	0	0	112.5	E654 K655 G662 P664 Q669	E654-E658 WeakPolarHBondContact O-CB 3.43Å; E654-E658 VanDerWaalsContact O-CG 3.28Å; E654-E658 WeakPolarHBondContact O-CG 3.31Å; E654-E658 PolarHBondContact O-N 3.41Å; K655-E658 PolarHBondContact O-N 2.99Å; E658-G662 VanDerWaalsContact O-CA 3.27Å; E658-G662 WeakPolarHBondContact O-CA 3.46Å; E658-G662 PolarHBondContact O-N 3.3Å; E658-P664 WeakPolarHBondContact OE1-CA 3.4Å; E658-Q669 PolarHBondContact OE1-NE2 2.87Å
659	E	82.6	Confident	77.6	Confident	113 Å²	113	51 Å²	51	53%	0.528	27%	0.271	S	S	.	.	H	α-helix	trans	-62.8	-40.5	174	-75.3	171.8	-178	0	0	111.8	K655 R656	K655-E659 WeakPolarHBondContact CE-OE1 3.49Å; K655-E659 HydrophobicContact CG-CG 4.5Å; K655-E659 IonicContact NZ-OE1 2.6Å; K655-E659 PolarHBondContact NZ-OE1 3.3Å; K655-E659 WeakPolarHBondContact O-CB 3.4Å; K655-E659 VanDerWaalsContact O-CG 3.3Å; K655-E659 WeakPolarHBondContact O-CG 3.4Å; K655-E659 PolarHBondContact O-N 3.34Å; R656-E659 IonicContact NE-OE2 3.85Å
660	G	74.4	Confident	77	Confident	43 Å²	43	55.1 Å²	55.1	44%	0.443	29%	0.293	S	S	.	.	H	α-helix	trans	-77.9	-30.4	-178.3	0	0	0	0	0	114.8	R656 F657	R656-G660 PolarHBondContact O-N 3Å; F657-G660 PolarHBondContact O-N 3.06Å
661	V	77.9	Confident	76.2	Confident	21 Å²	21	55.7 Å²	55.7	13%	0.127	30%	0.296	C	S	.	.	H	α-helix	trans	-104.9	-23	-174.3	174.1	0	0	0	0	112.8	L596 Y599 H604 F657 K663	L596-V661 HydrophobicContact CD2-CG2 3.86Å; Y599-V661 HydrophobicContact CD1-CG2 4.41Å; Y599-V661 HydrophobicContact CD2-CG2 3.99Å; Y599-V661 HydrophobicContact CE1-CB 4.46Å; Y599-V661 HydrophobicContact CE1-CG1 4.15Å; Y599-V661 HydrophobicContact CE1-CG2 4.2Å; Y599-V661 HydrophobicContact CE2-CG1 4.12Å; Y599-V661 HydrophobicContact CE2-CG2 3.76Å; Y599-V661 HydrophobicContact CG-CG2 4.33Å; Y599-V661 WeakPolarHBondContact OH-CG1 3.39Å; H604-V661 WeakPolarHBondContact ND1-CG1 3.45Å; F657-V661 HydrophobicContact CD1-CB 4.47Å; F657-V661 HydrophobicContact CD1-CG2 4.26Å; F657-V661 HydrophobicContact CD2-CG2 4.29Å; F657-V661 HydrophobicContact CE1-CB 4.25Å; F657-V661 HydrophobicContact CE1-CG1 4.38Å; F657-V661 HydrophobicContact CE1-CG2 4.02Å; F657-V661 HydrophobicContact CE2-CG2 4.04Å; F657-V661 HydrophobicContact CG-CG2 4.41Å; F657-V661 HydrophobicContact CZ-CG2 3.92Å; F657-V661 VanDerWaalsContact O-CB 3.28Å; F657-V661 WeakPolarHBondContact O-CB 3.35Å; F657-V661 WeakPolarHBondContact O-CG2 3.47Å; F657-V661 PolarHBondContact O-N 3.01Å; V661-K663 HydrophobicContact CG1-CB 4.2Å; V661-K663 PolarHBondContact O-N 3.11Å
662	G	70.3	Confident	75.3	Confident	67 Å²	67	57.5 Å²	57.5	69%	0.691	30%	0.3	S	S	*	.	S	Bend	trans	71.5	10.9	-176	0	0	0	0	0	114.6	E658	E658-G662 VanDerWaalsContact O-CA 3.27Å; E658-G662 WeakPolarHBondContact O-CA 3.46Å; E658-G662 PolarHBondContact O-N 3.3Å
663	K	72.1	Confident	74.4	Confident	132 Å²	132	62.4 Å²	62.4	57%	0.574	32%	0.319	S	S	*	.	S	Bend	trans	-130.4	141.5	176.7	-67.3	-178.3	-179.5	175	0	111.3	V661	V661-K663 HydrophobicContact CG1-CB 4.2Å; V661-K663 PolarHBondContact O-N 3.11Å
664	P	66.4	Low	73.2	Confident	80 Å²	80	65.2 Å²	65.2	52%	0.519	34%	0.339	S	S	.	.			trans	-67.7	131.3	177.6	27.2	-33.3	0	0	0	112	E658 K666	E658-P664 WeakPolarHBondContact OE1-CA 3.4Å; P664-K666 PolarHBondContact O-N 2.69Å; P664-K666 VanDerWaalsContact O-N 3.14Å
665	A	70.8	Confident	72	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.008	34%	0.338	C	S	.	.			trans	-85.6	79.2	178.9	0	0	0	0	0	111.2	L608 F657 Q667 L668 Q669	L608-A665 HydrophobicContact CD1-CB 3.81Å; F657-A665 HydrophobicContact CD1-CB 3.63Å; F657-A665 HydrophobicContact CE1-CB 3.76Å; A665-Q667 PolarHBondContact O-N 2.99Å; A665-Q667 VanDerWaalsContact O-N 3.14Å; A665-L668 HydrophobicContact CB-CB 3.98Å; A665-L668 HydrophobicContact CB-CD1 3.75Å; A665-L668 HydrophobicContact CB-CG 3.97Å; A665-L668 PolarHBondContact O-N 3.48Å; A665-Q669 WeakPolarHBondContact O-CG 3.43Å; A665-Q669 PolarHBondContact O-N 3.48Å
666	K	68.3	Low	70.6	Confident	147 Å²	147	63.5 Å²	63.5	64%	0.639	33%	0.329	S	S	*	.	H	α-helix	trans	-51.7	-39.2	-179.2	-68.1	-174.9	179.5	-179.8	0	113.2	P664 L668 Q669 D670	P664-K666 PolarHBondContact O-N 2.69Å; P664-K666 VanDerWaalsContact O-N 3.14Å; K666-L668 PolarHBondContact O-N 3.34Å; K666-Q669 PolarHBondContact O-N 3.28Å; K666-D670 WeakPolarHBondContact O-CB 3.3Å; K666-D670 PolarHBondContact O-N 3.43Å
667	Q	69.3	Low	68.9	Low	65 Å²	65	64.3 Å²	64.3	30%	0.304	34%	0.342	S	S	.	.	H	α-helix	trans	-66.7	-34.1	179.1	-64.9	-177.8	-13.1	0	0	113.7	L608 A665 L671	L608-Q667 HydrophobicContact CD2-CB 4.1Å; L608-Q667 HydrophobicContact CD2-CG 4.08Å; L608-Q667 HydrophobicContact CG-CB 4.34Å; A665-Q667 PolarHBondContact O-N 2.99Å; A665-Q667 VanDerWaalsContact O-N 3.14Å; Q667-L671 WeakPolarHBondContact O-CG 3.43Å; Q667-L671 PolarHBondContact O-N 2.98Å; Q667-L671 VanDerWaalsContact O-N 3.1Å
668	L	70.4	Confident	67.1	Low	5 Å²	5	67.9 Å²	67.9	3%	0.026	36%	0.361	C	S	.	.	H	α-helix	trans	-73.3	-40.6	174.4	-65.6	177.6	0	0	0	110.5	L608 L611 I615 E654 F657 A665 K666 D670 L671 R672	L608-L668 HydrophobicContact CD1-CD1 3.97Å; L608-L668 HydrophobicContact CD1-CD2 4.49Å; L608-L668 HydrophobicContact CD1-CG 3.76Å; L611-L668 HydrophobicContact CB-CD2 4.45Å; I615-L668 HydrophobicContact CD1-CD2 3.85Å; E654-L668 HydrophobicContact CG-CB 3.87Å; F657-L668 HydrophobicContact CG-CD1 4.46Å; A665-L668 HydrophobicContact CB-CB 3.98Å; A665-L668 HydrophobicContact CB-CD1 3.75Å; A665-L668 HydrophobicContact CB-CG 3.97Å; A665-L668 PolarHBondContact O-N 3.48Å; K666-L668 PolarHBondContact O-N 3.34Å; L668-D670 VanDerWaalsContact C-N 3.29Å; L668-D670 PolarHBondContact O-N 3.38Å; L668-L671 HydrophobicContact CD2-CD1 4.12Å; L668-L671 WeakPolarHBondContact O-CB 3.38Å; L668-L671 PolarHBondContact O-N 3.44Å; L668-R672 PolarHBondContact O-N 2.9Å
669	Q	69.8	Low	65.2	Low	60 Å²	60	69 Å²	69	28%	0.28	36%	0.362	S	S	.	.	H	α-helix	trans	-61.4	-37.6	174.3	-64.5	177.7	3	0	0	112	E654 E658 A665 K666 R672 K673	E654-Q669 WeakPolarHBondContact OE1-CA 3.3Å; E654-Q669 PolarHBondContact OE1-N 3.3Å; E658-Q669 PolarHBondContact OE1-NE2 2.87Å; A665-Q669 WeakPolarHBondContact O-CG 3.43Å; A665-Q669 PolarHBondContact O-N 3.48Å; K666-Q669 PolarHBondContact O-N 3.28Å; Q669-R672 PolarHBondContact O-N 3.35Å; Q669-K673 VanDerWaalsContact O-CG 3.29Å; Q669-K673 WeakPolarHBondContact O-CG 3.39Å; Q669-K673 PolarHBondContact O-N 3.42Å
670	D	70.8	Confident	63.3	Low	89 Å²	89	69 Å²	69	48%	0.476	37%	0.369	S	S	.	.	H	α-helix	trans	-70.2	-39.5	176.2	-69.2	-23.9	0	0	0	111.8	K666 L668 R672 K673 S674	K666-D670 WeakPolarHBondContact O-CB 3.3Å; K666-D670 PolarHBondContact O-N 3.43Å; L668-D670 VanDerWaalsContact C-N 3.29Å; L668-D670 PolarHBondContact O-N 3.38Å; D670-R672 VanDerWaalsContact C-N 3.35Å; D670-R672 PolarHBondContact O-N 2.96Å; D670-K673 PolarHBondContact O-N 3.02Å; D670-S674 WeakPolarHBondContact O-CB 3.5Å; D670-S674 PolarHBondContact O-N 3.05Å; D670-S674 PolarHBondContact O-OG 3.45Å
671	L	65.5	Low	61.7	Low	19 Å²	19	71.4 Å²	71.4	10%	0.099	37%	0.372	C	S	.	.	H	α-helix	trans	-61	-42.5	171.5	-75.6	166.5	0	0	0	112.1	R612 L616 Q667 L668 K673 S674 A675	R612-L671 HydrophobicContact CB-CD1 3.67Å; R612-L671 HydrophobicContact CG-CD1 3.43Å; R612-L671 VanDerWaalsContact CG-CD1 3.43Å; R612-L671 HydrophobicContact CG-CD2 4.37Å; R612-L671 HydrophobicContact CG-CG 4.32Å; L616-L671 HydrophobicContact CD1-CD2 4.22Å; Q667-L671 WeakPolarHBondContact O-CG 3.43Å; Q667-L671 PolarHBondContact O-N 2.98Å; Q667-L671 VanDerWaalsContact O-N 3.1Å; L668-L671 HydrophobicContact CD2-CD1 4.12Å; L668-L671 WeakPolarHBondContact O-CB 3.38Å; L668-L671 PolarHBondContact O-N 3.44Å; L671-K673 VanDerWaalsContact C-N 3.34Å; L671-S674 WeakPolarHBondContact CA-OG 3.31Å; L671-S674 PolarHBondContact O-N 3.36Å; L671-S674 PolarHBondContact O-OG 3.42Å; L671-A675 VanDerWaalsContact O-CB 3.25Å; L671-A675 WeakPolarHBondContact O-CB 3.45Å; L671-A675 PolarHBondContact O-N 3.44Å
672	R	65.6	Low	59.9	Low	64 Å²	64	75.2 Å²	75.2	24%	0.242	40%	0.397	C	S	.	.	H	α-helix	trans	-63.3	-41.2	176.4	179.1	-179.9	173.4	-169.5	-1	111.4	L650 E654 L668 Q669 D670 R676	L650-R672 HydrophobicContact CD1-CB 4.41Å; E654-R672 VanDerWaalsContact OE1-CB 3.28Å; E654-R672 WeakPolarHBondContact OE1-CB 3.37Å; E654-R672 VanDerWaalsContact OE1-CD 3.27Å; E654-R672 WeakPolarHBondContact OE1-CD 3.44Å; E654-R672 WeakPolarHBondContact OE2-CD 3.44Å; E654-R672 IonicContact OE2-CZ 3.57Å; E654-R672 IonicContact OE2-NH1 3.9Å; E654-R672 PolarHBondContact OE2-NH1 3.35Å; L668-R672 PolarHBondContact O-N 2.9Å; Q669-R672 PolarHBondContact O-N 3.35Å; D670-R672 VanDerWaalsContact C-N 3.35Å; D670-R672 PolarHBondContact O-N 2.96Å; R672-R676 WeakPolarHBondContact O-CB 3.45Å; R672-R676 WeakPolarHBondContact O-CG 3.4Å; R672-R676 PolarHBondContact O-N 3.48Å; R672-R676 VanDerWaalsContact O-N 3.09Å
673	K	65.3	Low	58.2	Low	128 Å²	128	79 Å²	79	56%	0.557	40%	0.402	S	S	*	.	H	α-helix	trans	-66.2	-47.7	175.6	-73.5	170.7	-172.4	169.2	0	111.4	Q669 D670 L671 A675 R676 T677	Q669-K673 VanDerWaalsContact O-CG 3.29Å; Q669-K673 WeakPolarHBondContact O-CG 3.39Å; Q669-K673 PolarHBondContact O-N 3.42Å; D670-K673 PolarHBondContact O-N 3.02Å; L671-K673 VanDerWaalsContact C-N 3.34Å; K673-A675 VanDerWaalsContact C-N 3.35Å; K673-A675 PolarHBondContact O-N 2.95Å; K673-R676 PolarHBondContact O-N 3.34Å; K673-T677 PolarHBondContact O-N 3.33Å; K673-T677 PolarHBondContact O-OG1 2.74Å
674	S	60.4	Low	56.4	Low	60 Å²	60	76.7 Å²	76.7	42%	0.42	40%	0.402	S	S	.	.	H	α-helix	trans	-63.5	-40.1	-179.6	62.3	0	0	0	0	112.4	D670 L671 T677 I678	D670-S674 WeakPolarHBondContact O-CB 3.5Å; D670-S674 PolarHBondContact O-N 3.05Å; D670-S674 PolarHBondContact O-OG 3.45Å; L671-S674 WeakPolarHBondContact CA-OG 3.31Å; L671-S674 PolarHBondContact O-N 3.36Å; L671-S674 PolarHBondContact O-OG 3.42Å; S674-T677 PolarHBondContact O-N 2.71Å; S674-I678 PolarHBondContact O-N 3.34Å
675	A	56.6	Low	55.1	Low	4 Å²	4	78 Å²	78	3%	0.033	41%	0.409	C	S	.	.	H	α-helix	trans	-74.2	-29.7	179.8	0	0	0	0	0	112.8	V619 H646 L671 K673 T677 I678 R679	V619-A675 HydrophobicContact CG1-CB 3.96Å; H646-A675 WeakPolarHBondContact CE1-CB 3.35Å; L671-A675 VanDerWaalsContact O-CB 3.25Å; L671-A675 WeakPolarHBondContact O-CB 3.45Å; L671-A675 PolarHBondContact O-N 3.44Å; K673-A675 VanDerWaalsContact C-N 3.35Å; K673-A675 PolarHBondContact O-N 2.95Å; A675-T677 VanDerWaalsContact C-N 3.33Å; A675-T677 PolarHBondContact O-N 3.12Å; A675-I678 PolarHBondContact O-N 3.01Å; A675-R679 PolarHBondContact O-N 2.99Å
676	R	55.9	Low	53.2	Low	101 Å²	101	86.2 Å²	86.2	38%	0.381	45%	0.449	S	S	.	.	H	α-helix	trans	-63.5	-36.1	168.9	-83.6	179.2	170.5	-166.2	-7.1	112.7	D647 R672 K673 I678 R679	D647-R676 IonicContact OD1-CZ 3.07Å; D647-R676 IonicContact OD1-NE 2.72Å; D647-R676 IonicContact OD1-NH2 3.26Å; D647-R676 PolarHBondContact OD1-NH2 3.42Å; R672-R676 WeakPolarHBondContact O-CB 3.45Å; R672-R676 WeakPolarHBondContact O-CG 3.4Å; R672-R676 PolarHBondContact O-N 3.48Å; R672-R676 VanDerWaalsContact O-N 3.09Å; K673-R676 PolarHBondContact O-N 3.34Å; R676-I678 VanDerWaalsContact C-N 3.33Å; R676-I678 PolarHBondContact O-N 3.03Å; R676-R679 VanDerWaalsContact O-CB 3.32Å; R676-R679 WeakPolarHBondContact O-CB 3.44Å; R676-R679 PolarHBondContact O-N 3.41Å
677	T	46.8	Very low	51.4	Low	90 Å²	90	84.1 Å²	84.1	55%	0.552	45%	0.453	S	S	*	.	H	α-helix	trans	-65.8	-35.9	178.8	-39.5	0	0	0	0	112.3	K673 S674 A675 R679 V680 N681	K673-T677 PolarHBondContact O-N 3.33Å; K673-T677 PolarHBondContact O-OG1 2.74Å; S674-T677 PolarHBondContact O-N 2.71Å; A675-T677 VanDerWaalsContact C-N 3.33Å; A675-T677 PolarHBondContact O-N 3.12Å; T677-R679 VanDerWaalsContact C-N 3.25Å; T677-R679 PolarHBondContact O-N 3.46Å; T677-V680 PolarHBondContact O-N 3.26Å; T677-N681 PolarHBondContact O-N 3.3Å
678	I	46	Very low	49.5	Very low	75 Å²	75	90 Å²	90	39%	0.385	48%	0.481	S	S	.	.	H	α-helix	trans	-66	-31.3	177.3	-62.6	168.4	0	0	0	111.2	S674 A675 R676 V680	S674-I678 PolarHBondContact O-N 3.34Å; A675-I678 PolarHBondContact O-N 3.01Å; R676-I678 VanDerWaalsContact C-N 3.33Å; R676-I678 PolarHBondContact O-N 3.03Å; I678-V680 VanDerWaalsContact C-N 3.29Å; I678-V680 PolarHBondContact O-N 3.28Å
679	R	44.7	Very low	47.5	Very low	85 Å²	85	100 Å²	100	32%	0.321	54%	0.541	S	S	.	.	H	α-helix	trans	-69.3	-22.4	176.8	-146.7	176.8	-177	-153.1	-8.6	114.1	L639 S643 D647 A675 R676 T677	L639-R679 PolarHBondContact O-NH2 3.23Å; S643-R679 PolarHBondContact OG-NH2 2.9Å; D647-R679 IonicContact OD2-CZ 3.58Å; D647-R679 IonicContact OD2-NH1 2.69Å; D647-R679 PolarHBondContact OD2-NH1 3.41Å; A675-R679 PolarHBondContact O-N 2.99Å; R676-R679 VanDerWaalsContact O-CB 3.32Å; R676-R679 WeakPolarHBondContact O-CB 3.44Å; R676-R679 PolarHBondContact O-N 3.41Å; T677-R679 VanDerWaalsContact C-N 3.25Å; T677-R679 PolarHBondContact O-N 3.46Å
680	V	42.4	Very low	46.4	Very low	112 Å²	112	102 Å²	102	68%	0.679	56%	0.555	S	S	*	*	H	α-helix	trans	-95	-22.9	-175.4	177.9	0	0	0	0	112.5	T677 I678 P682	T677-V680 PolarHBondContact O-N 3.26Å; I678-V680 VanDerWaalsContact C-N 3.29Å; I678-V680 PolarHBondContact O-N 3.28Å; V680-P682 VanDerWaalsContact C-CD 3.44Å; V680-P682 WeakPolarHBondContact O-CD 3.43Å
681	N	39.8	Very low	45.1	Very low	95 Å²	95	102.7 Å²	102.7	51%	0.508	56%	0.559	S	S	.	*			trans	-111.1	84.7	180	-97.2	1.3	0	0	0	112.3	T677 D683	T677-N681 PolarHBondContact O-N 3.3Å; N681-D683 PolarHBondContact O-N 3.31Å
682	P	40.1	Very low	44	Very low	100 Å²	100	107.3 Å²	107.3	65%	0.649	58%	0.584	S	S	*	*	S	Bend	trans	-71.1	-13.1	166.3	27.5	-30.8	0	0	0	113.7	V680	V680-P682 VanDerWaalsContact C-CD 3.44Å; V680-P682 WeakPolarHBondContact O-CD 3.43Å
683	D	36.2	Very low	42.7	Very low	148 Å²	148	109.9 Å²	109.9	79%	0.791	60%	0.604	S	S	*	*	S	Bend	trans	-107.3	-2.7	-171.7	-71.9	-32.9	0	0	0	115.9	N681 T685	N681-D683 PolarHBondContact O-N 3.31Å; D683-T685 VanDerWaalsContact C-N 3.3Å; D683-T685 PolarHBondContact O-N 3.28Å; D683-T685 VanDerWaalsContact O-N 3.11Å
684	S	34.3	Very low	41.3	Very low	82 Å²	82	108.8 Å²	108.8	57%	0.573	61%	0.607	S	S	*	*			trans	-90.8	63.5	178.2	64.4	0	0	0	0	111.9
685	T	37.5	Very low	40	Very low	109 Å²	109	112 Å²	112	67%	0.669	62%	0.62	S	S	*	*			trans	-116.3	83.9	158.4	31.1	0	0	0	0	109.2	D683	D683-T685 VanDerWaalsContact C-N 3.3Å; D683-T685 PolarHBondContact O-N 3.28Å; D683-T685 VanDerWaalsContact O-N 3.11Å
686	M	32.5	Very low	38.9	Very low	172 Å²	172	119.7 Å²	119.7	85%	0.847	66%	0.662	S	S	*	*			trans	-135	122.3	149.1	-93.9	-79.3	177.5	0	0	107.1
687	S	29	Very low	37.5	Very low	104 Å²	104	121.2 Å²	121.2	73%	0.727	68%	0.683	S	S	*	*			trans	79.2	129.9	160.1	-39.3	0	0	0	0	114.6
688	Q	29.1	Very low	36.8	Very low	188 Å²	188	123.8 Å²	123.8	88%	0.879	69%	0.694	S	S	*	*			cis	-150.2	151.8	19	-68	178	-33.9	0	0	110.2
689	V	29.7	Very low	35.9	Very low	215 Å²	215	128.2 Å²	128.2	100%	1.303	72%	0.722	S	S	*	*			trans	-64	0	171.5	173	0	0	0	0	111.6

Retrieved 689 of 689 residues in 2884.3 ms (Link to these results)

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