A0A087XHQ8_POEFO Loading...

Phosphatidylinositol glycan anchor biosynthesis, class Q

AlphaFold DB , UniProt , Accession A0A087XHQ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 548 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	29.8	Very low	34.1	Very low	202 Å²	202	98 Å²	98	100%	0.995	57%	0.574	S	S	*	*				0	-46	0	-89.7	-165.4	171.7	0	0	112.6	S4 Q5	M1-S4 VanDerWaalsContact C-OG 3.32Å; M1-S4 WeakPolarHBondContact CA-OG 3.17Å; M1-S4 PolarHBondContact O-OG 3.03Å; M1-Q5 WeakPolarHBondContact O-CB 3.44Å; M1-Q5 PolarHBondContact O-N 3.38Å
2	L	31.7	Very low	34	Very low	130 Å²	130	94.6 Å²	94.6	68%	0.681	56%	0.555	S	S	*	*	H	α-helix	trans	-66.6	-42.4	176.1	-99.2	119.6	0	0	0	114.3	S4 Q5 M6	L2-S4 VanDerWaalsContact C-N 3.34Å; L2-S4 PolarHBondContact O-N 3.1Å; L2-Q5 PolarHBondContact O-N 3.49Å; L2-Q5 VanDerWaalsContact O-N 3.08Å; L2-M6 WeakPolarHBondContact O-CG 3.48Å; L2-M6 PolarHBondContact O-N 3.35Å
3	S	32.4	Very low	33.6	Very low	61 Å²	61	97.8 Å²	97.8	43%	0.427	57%	0.569	S	S	.	*	H	α-helix	trans	-61.1	-42.4	178.7	70.9	0	0	0	0	112.3	Q5 M6 Q7	S3-Q5 VanDerWaalsContact C-N 3.27Å; S3-Q5 PolarHBondContact O-N 2.89Å; S3-M6 PolarHBondContact O-N 3.3Å; S3-Q7 WeakPolarHBondContact O-CB 3.48Å; S3-Q7 PolarHBondContact O-N 2.9Å
4	S	34.6	Very low	33.7	Very low	67 Å²	67	94.3 Å²	94.3	47%	0.469	55%	0.546	S	S	.	.	H	α-helix	trans	-63.9	-30.7	175	44.5	0	0	0	0	113	M1 L2 A8	M1-S4 VanDerWaalsContact C-OG 3.32Å; M1-S4 WeakPolarHBondContact CA-OG 3.17Å; M1-S4 PolarHBondContact O-OG 3.03Å; L2-S4 VanDerWaalsContact C-N 3.34Å; L2-S4 PolarHBondContact O-N 3.1Å; S4-A8 WeakPolarHBondContact O-CB 3.43Å; S4-A8 PolarHBondContact O-N 3.45Å
5	Q	36.1	Very low	33.3	Very low	128 Å²	128	93.8 Å²	93.8	60%	0.598	55%	0.55	S	S	*	*	H	α-helix	trans	-79.2	-37.2	177.9	-147.9	172.7	6.4	0	0	111.5	M1 L2 S3 A8 Q9	M1-Q5 WeakPolarHBondContact O-CB 3.44Å; M1-Q5 PolarHBondContact O-N 3.38Å; L2-Q5 PolarHBondContact O-N 3.49Å; L2-Q5 VanDerWaalsContact O-N 3.08Å; S3-Q5 VanDerWaalsContact C-N 3.27Å; S3-Q5 PolarHBondContact O-N 2.89Å; Q5-A8 PolarHBondContact O-N 3.49Å; Q5-Q9 PolarHBondContact O-N 2.78Å
6	M	33.9	Very low	33	Very low	36 Å²	36	93.4 Å²	93.4	18%	0.177	55%	0.549	C	S	.	.	H	α-helix	trans	-71.8	-35.8	173.9	-63.8	-145	82.2	0	0	112.4	L2 S3 A8 Q9 S10 L14 L485	L2-M6 WeakPolarHBondContact O-CG 3.48Å; L2-M6 PolarHBondContact O-N 3.35Å; S3-M6 PolarHBondContact O-N 3.3Å; M6-A8 VanDerWaalsContact C-N 3.31Å; M6-Q9 PolarHBondContact O-N 3.21Å; M6-S10 WeakPolarHBondContact O-CB 3.25Å; M6-S10 PolarHBondContact O-N 2.82Å; M6-S10 PolarHBondContact O-OG 3.31Å; M6-L14 HydrophobicContact CB-CD1 4.35Å; M6-L485 HydrophobicContact CE-CB 4.21Å; M6-L485 HydrophobicContact CE-CD1 3.85Å; M6-L485 HydrophobicContact CE-CD2 4.34Å; M6-L485 HydrophobicContact CE-CG 4.37Å
7	Q	36.9	Very low	32.8	Very low	70 Å²	70	95.6 Å²	95.6	33%	0.327	56%	0.557	S	S	.	*	H	α-helix	trans	-64.7	-35.9	173.1	-172.5	166.8	15	0	0	111.6	S3 Q9 G11 D13	S3-Q7 WeakPolarHBondContact O-CB 3.48Å; S3-Q7 PolarHBondContact O-N 2.9Å; Q7-Q9 VanDerWaalsContact C-N 3.34Å; Q7-G11 PolarHBondContact O-N 3.22Å; Q7-D13 PolarHBondContact NE2-OD1 3.33Å
8	A	37.7	Very low	32.6	Very low	86 Å²	86	93.2 Å²	93.2	71%	0.711	56%	0.556	S	S	*	*	H	α-helix	trans	-69.3	-28.6	172.5	0	0	0	0	0	113.4	S4 Q5 M6	S4-A8 WeakPolarHBondContact O-CB 3.43Å; S4-A8 PolarHBondContact O-N 3.45Å; Q5-A8 PolarHBondContact O-N 3.49Å; M6-A8 VanDerWaalsContact C-N 3.31Å
9	Q	34.8	Very low	32.2	Very low	167 Å²	167	92.5 Å²	92.5	78%	0.78	56%	0.556	S	S	*	*	H	α-helix	trans	-86	-30.7	176.1	-78.5	-174.7	-13.6	0	0	113.9	Q5 M6 Q7	Q5-Q9 PolarHBondContact O-N 2.78Å; M6-Q9 PolarHBondContact O-N 3.21Å; Q7-Q9 VanDerWaalsContact C-N 3.34Å
10	S	36.2	Very low	32.5	Very low	59 Å²	59	98.8 Å²	98.8	41%	0.413	57%	0.57	S	S	.	*	H	α-helix	trans	-93.1	-25.5	-176.8	76.5	0	0	0	0	113.6	M6 V12	M6-S10 WeakPolarHBondContact O-CB 3.25Å; M6-S10 PolarHBondContact O-N 2.82Å; M6-S10 PolarHBondContact O-OG 3.31Å; S10-V12 PolarHBondContact O-N 3.4Å; S10-V12 PolarHBondContact OG-N 3.02Å; S10-V12 PolarHBondContact OG-O 2.82Å
11	G	30.7	Very low	32.2	Very low	72 Å²	72	98.2 Å²	98.2	74%	0.742	57%	0.572	S	S	*	*			trans	70	12	-176.1	0	0	0	0	0	114.8	Q7	Q7-G11 PolarHBondContact O-N 3.22Å
12	V	32.9	Very low	32.2	Very low	57 Å²	57	94.5 Å²	94.5	35%	0.345	56%	0.555	S	S	.	*	S	Bend	trans	-124.7	141.5	-176.9	-174.8	0	0	0	0	109.8	S10 L14	S10-V12 PolarHBondContact O-N 3.4Å; S10-V12 PolarHBondContact OG-N 3.02Å; S10-V12 PolarHBondContact OG-O 2.82Å; V12-L14 PolarHBondContact O-N 2.96Å
13	D	29.8	Very low	32.2	Very low	137 Å²	137	92.1 Å²	92.1	73%	0.733	55%	0.547	S	S	*	.			trans	-69	113.6	176.3	-150.2	5.8	0	0	0	109.7	Q7	Q7-D13 PolarHBondContact NE2-OD1 3.33Å
14	L	33.8	Very low	32	Very low	48 Å²	48	98.9 Å²	98.9	25%	0.251	57%	0.569	S	S	.	*			trans	-107.3	114.9	-171.4	-71.9	165.4	0	0	0	109.6	M6 V12	M6-L14 HydrophobicContact CB-CD1 4.35Å; V12-L14 PolarHBondContact O-N 2.96Å
15	S	27.8	Very low	31.8	Very low	87 Å²	87	104 Å²	104	61%	0.608	59%	0.591	S	S	*	*			trans	-83.1	114.8	169.6	49.2	0	0	0	0	110	L17	S15-L17 PolarHBondContact O-N 3.22Å
16	V	29.6	Very low	32	Very low	88 Å²	88	101.7 Å²	101.7	53%	0.533	60%	0.602	S	S	.	*			trans	-79.7	101.5	176.4	179.2	0	0	0	0	108.3	G18	V16-G18 VanDerWaalsContact C-N 3.29Å; V16-G18 PolarHBondContact O-N 3.36Å; V16-G18 VanDerWaalsContact O-N 3.1Å
17	L	28.3	Very low	32	Very low	131 Å²	131	107.8 Å²	107.8	69%	0.686	63%	0.63	S	S	*	*			trans	-85	78.7	170.9	-147.4	92.2	0	0	0	109.6	S15	S15-L17 PolarHBondContact O-N 3.22Å
18	G	29.5	Very low	32.1	Very low	51 Å²	51	113.6 Å²	113.6	53%	0.526	66%	0.657	S	S	.	*			trans	88.7	135.1	167.1	0	0	0	0	0	115.9	V16	V16-G18 VanDerWaalsContact C-N 3.29Å; V16-G18 PolarHBondContact O-N 3.36Å; V16-G18 VanDerWaalsContact O-N 3.1Å
19	S	25.8	Very low	32	Very low	81 Å²	81	111.1 Å²	111.1	57%	0.566	64%	0.64	S	S	*	*			trans	-119.6	150.5	153.1	53.2	0	0	0	0	106.4
20	W	38.6	Very low	32.2	Very low	218 Å²	218	108.5 Å²	108.5	83%	0.826	63%	0.629	S	S	*	*				174.6	152.3	125.2	-103	57.2	0	0	0	114.1
21	S	26.3	Very low	32.3	Very low	87 Å²	87	109.9 Å²	109.9	61%	0.608	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-68.5	148.4	173.3	48	0	0	0	0	113
22	L	29.4	Very low	32.5	Very low	123 Å²	123	109.2 Å²	109.2	64%	0.644	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-72.4	147.1	171.9	-118.1	94.2	0	0	0	112.1	M30	L22-M30 HydrophobicContact CD1-CE 4Å; L22-M30 HydrophobicContact CD2-CE 4.42Å
23	P	30.7	Very low	32.7	Very low	81 Å²	81	112.3 Å²	112.3	53%	0.526	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-82	158.3	175.9	34.6	-29.6	0	0	0	111
24	K	28.1	Very low	33.2	Very low	202 Å²	202	108.1 Å²	108.1	88%	0.878	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-63.8	153.2	173.9	-75.7	-176.5	172.1	-173.5	0	111.9	G26	K24-G26 PolarHBondContact O-N 3.33Å
25	D	31.8	Very low	33.4	Very low	175 Å²	175	113.5 Å²	113.5	94%	0.936	62%	0.616	S	S	*	*	S	Bend	trans	-47.9	128.9	-171.7	-72.6	-46.2	0	0	0	114.8
26	G	39.4	Very low	33.8	Very low	79 Å²	79	114 Å²	114	81%	0.814	61%	0.612	S	S	*	*	S	Bend	trans	131.5	-1.5	168.7	0	0	0	0	0	117	K24	K24-G26 PolarHBondContact O-N 3.33Å
27	Q	33.4	Very low	34	Very low	165 Å²	165	111.6 Å²	111.6	77%	0.771	60%	0.596	S	S	*	*			trans	-116	129.6	176.5	-86.5	-176.5	-23.3	0	0	113.3	G29	Q27-G29 PolarHBondContact O-N 3.22Å
28	E	38.8	Very low	34.4	Very low	191 Å²	191	107.9 Å²	107.9	89%	0.893	58%	0.581	S	S	*	*			trans	-63.2	50.8	175.1	-61.9	178.7	149.8	0	0	113.5
29	G	37.4	Very low	34.5	Very low	35 Å²	35	110.4 Å²	110.4	36%	0.361	59%	0.587	S	S	.	*	H	α-helix	trans	-90.2	-23.9	-166.2	0	0	0	0	0	116.6	Q27 F33	Q27-G29 PolarHBondContact O-N 3.22Å; G29-F33 WeakPolarHBondContact O-CB 3.4Å; G29-F33 PolarHBondContact O-N 3.11Å
30	M	37	Very low	34.8	Very low	111 Å²	111	111.9 Å²	111.9	55%	0.547	59%	0.587	S	S	.	*	H	α-helix	trans	-71.9	-36.4	-174.7	-168	73.5	73.5	0	0	112.2	L22 L34	L22-M30 HydrophobicContact CD1-CE 4Å; L22-M30 HydrophobicContact CD2-CE 4.42Å; M30-L34 WeakPolarHBondContact O-CG 3.49Å; M30-L34 PolarHBondContact O-N 2.79Å
31	E	39.4	Very low	34.6	Very low	89 Å²	89	104.3 Å²	104.3	42%	0.416	56%	0.56	S	S	.	*	H	α-helix	trans	-86.4	-31.5	-174.6	-65.8	-168.9	173.1	0	0	113.6	F33 R35	E31-F33 VanDerWaalsContact C-N 3.28Å; E31-R35 VanDerWaalsContact O-CB 3.25Å; E31-R35 WeakPolarHBondContact O-CB 3.46Å; E31-R35 PolarHBondContact O-N 3.06Å; E31-R35 VanDerWaalsContact O-N 3.08Å
32	S	34.9	Very low	34.9	Very low	58 Å²	58	105.6 Å²	105.6	41%	0.406	57%	0.566	S	S	.	*	H	α-helix	trans	-67.1	-36	170	80.1	0	0	0	0	110.4	R35 D36	S32-R35 WeakPolarHBondContact O-CB 3.37Å; S32-R35 PolarHBondContact O-N 3.08Å; S32-D36 WeakPolarHBondContact O-CB 3.2Å; S32-D36 VanDerWaalsContact O-CG 3.31Å; S32-D36 PolarHBondContact O-N 3.3Å
33	F	37	Very low	35.3	Very low	121 Å²	121	103.8 Å²	103.8	53%	0.531	56%	0.555	S	S	.	*	H	α-helix	trans	-68.9	-44.7	176.6	177.7	-106.3	0	0	0	113.1	G29 E31 R35 D36 L37	G29-F33 WeakPolarHBondContact O-CB 3.4Å; G29-F33 PolarHBondContact O-N 3.11Å; E31-F33 VanDerWaalsContact C-N 3.28Å; F33-R35 PolarHBondContact O-N 3.42Å; F33-D36 PolarHBondContact O-N 3.03Å; F33-L37 HydrophobicContact CD1-CD1 3.8Å; F33-L37 HydrophobicContact CD2-CD1 3.94Å; F33-L37 HydrophobicContact CE1-CD1 3.26Å; F33-L37 HydrophobicContact CE2-CD1 3.43Å; F33-L37 VanDerWaalsContact CE2-CD1 3.43Å; F33-L37 HydrophobicContact CG-CD1 4.13Å; F33-L37 HydrophobicContact CZ-CD1 3.07Å; F33-L37 WeakPolarHBondContact O-CB 3.31Å; F33-L37 PolarHBondContact O-N 2.77Å
34	L	39.8	Very low	35.4	Very low	50 Å²	50	107.2 Å²	107.2	26%	0.262	56%	0.564	S	S	.	*	H	α-helix	trans	-64.6	-29.8	172.4	-74.4	172.2	0	0	0	112.1	M30 S38 I68	M30-L34 WeakPolarHBondContact O-CG 3.49Å; M30-L34 PolarHBondContact O-N 2.79Å; L34-S38 WeakPolarHBondContact O-CB 3.47Å; L34-S38 PolarHBondContact O-N 2.95Å; L34-S38 PolarHBondContact O-OG 3.29Å; L34-I68 HydrophobicContact CD1-CG2 4.46Å
35	R	37.8	Very low	35.6	Very low	160 Å²	160	106 Å²	106	60%	0.604	55%	0.553	S	S	*	*	H	α-helix	trans	-69.9	-44.6	173.2	-158.9	-179.6	-55.5	-177.7	3.2	111.3	E31 S32 F33 S38 T39	E31-R35 VanDerWaalsContact O-CB 3.25Å; E31-R35 WeakPolarHBondContact O-CB 3.46Å; E31-R35 PolarHBondContact O-N 3.06Å; E31-R35 VanDerWaalsContact O-N 3.08Å; S32-R35 WeakPolarHBondContact O-CB 3.37Å; S32-R35 PolarHBondContact O-N 3.08Å; F33-R35 PolarHBondContact O-N 3.42Å; R35-S38 WeakPolarHBondContact CA-OG 3.44Å; R35-S38 PolarHBondContact O-N 3.08Å; R35-S38 PolarHBondContact O-OG 2.8Å; R35-T39 WeakPolarHBondContact O-CG2 3.43Å; R35-T39 PolarHBondContact O-N 2.87Å; R35-T39 VanDerWaalsContact O-N 3.11Å
36	D	35.8	Very low	35.9	Very low	97 Å²	97	101.1 Å²	101.1	52%	0.519	52%	0.522	S	S	.	.	H	α-helix	trans	-72.9	-29.1	176.2	-70.3	-20.2	0	0	0	113.1	S32 F33 T39 I40	S32-D36 WeakPolarHBondContact O-CB 3.2Å; S32-D36 VanDerWaalsContact O-CG 3.31Å; S32-D36 PolarHBondContact O-N 3.3Å; F33-D36 PolarHBondContact O-N 3.03Å; D36-T39 WeakPolarHBondContact CA-OG1 3.49Å; D36-T39 PolarHBondContact O-OG1 3.29Å; D36-I40 WeakPolarHBondContact O-CD1 3.44Å; D36-I40 WeakPolarHBondContact O-CG1 3.35Å; D36-I40 PolarHBondContact O-N 3.33Å
37	L	35.4	Very low	35.8	Very low	38 Å²	38	100.5 Å²	100.5	20%	0.199	50%	0.5	C	S	.	.	H	α-helix	trans	-73.6	-32.1	168.9	-110.7	125.7	0	0	0	111.7	F33 T39 I40 F41 W46	F33-L37 HydrophobicContact CD1-CD1 3.8Å; F33-L37 HydrophobicContact CD2-CD1 3.94Å; F33-L37 HydrophobicContact CE1-CD1 3.26Å; F33-L37 HydrophobicContact CE2-CD1 3.43Å; F33-L37 VanDerWaalsContact CE2-CD1 3.43Å; F33-L37 HydrophobicContact CG-CD1 4.13Å; F33-L37 HydrophobicContact CZ-CD1 3.07Å; F33-L37 WeakPolarHBondContact O-CB 3.31Å; F33-L37 PolarHBondContact O-N 2.77Å; L37-T39 VanDerWaalsContact C-N 3.3Å; L37-I40 PolarHBondContact O-N 2.84Å; L37-F41 HydrophobicContact CD2-CD2 3.89Å; L37-F41 HydrophobicContact CD2-CE2 4.47Å; L37-F41 WeakPolarHBondContact O-CA 3.35Å; L37-F41 WeakPolarHBondContact O-CB 3.31Å; L37-F41 PolarHBondContact O-N 3.24Å; L37-W46 HydrophobicContact CB-CH2 4.08Å; L37-W46 HydrophobicContact CD2-CH2 3.48Å; L37-W46 VanDerWaalsContact CD2-CH2 3.48Å; L37-W46 HydrophobicContact CD2-CZ3 3.81Å; L37-W46 HydrophobicContact CG-CH2 4.39Å
38	S	35.6	Very low	36	Very low	53 Å²	53	95.8 Å²	95.8	37%	0.371	48%	0.478	S	S	.	.	H	α-helix	trans	-73.5	-20.4	175	76.5	0	0	0	0	113.5	L34 R35	L34-S38 WeakPolarHBondContact O-CB 3.47Å; L34-S38 PolarHBondContact O-N 2.95Å; L34-S38 PolarHBondContact O-OG 3.29Å; R35-S38 WeakPolarHBondContact CA-OG 3.44Å; R35-S38 PolarHBondContact O-N 3.08Å; R35-S38 PolarHBondContact O-OG 2.8Å
39	T	33.1	Very low	35.9	Very low	105 Å²	105	91 Å²	91	64%	0.644	46%	0.457	S	S	*	.	H	α-helix	trans	-81.5	-24.2	171.6	54.3	0	0	0	0	112.4	R35 D36 L37	R35-T39 WeakPolarHBondContact O-CG2 3.43Å; R35-T39 PolarHBondContact O-N 2.87Å; R35-T39 VanDerWaalsContact O-N 3.11Å; D36-T39 WeakPolarHBondContact CA-OG1 3.49Å; D36-T39 PolarHBondContact O-OG1 3.29Å; L37-T39 VanDerWaalsContact C-N 3.3Å
40	I	31.7	Very low	35.8	Very low	112 Å²	112	95.3 Å²	95.3	57%	0.574	46%	0.463	S	S	*	.	H	α-helix	trans	-96.4	-35.6	178	-60	169.2	0	0	0	112.1	D36 L37	D36-I40 WeakPolarHBondContact O-CD1 3.44Å; D36-I40 WeakPolarHBondContact O-CG1 3.35Å; D36-I40 PolarHBondContact O-N 3.33Å; L37-I40 PolarHBondContact O-N 2.84Å
41	F	33.2	Very low	35.8	Very low	58 Å²	58	97 Å²	97	25%	0.254	46%	0.463	S	S	.	.	S	Bend	trans	-128.4	98.7	179.1	-63.1	-79.8	0	0	0	110.4	L37 Q43 L146	L37-F41 HydrophobicContact CD2-CD2 3.89Å; L37-F41 HydrophobicContact CD2-CE2 4.47Å; L37-F41 WeakPolarHBondContact O-CA 3.35Å; L37-F41 WeakPolarHBondContact O-CB 3.31Å; L37-F41 PolarHBondContact O-N 3.24Å; F41-Q43 PolarHBondContact O-N 3.12Å; F41-L146 HydrophobicContact CE1-CD2 4.2Å
42	P	32.6	Very low	35.6	Very low	115 Å²	115	97.7 Å²	97.7	75%	0.747	47%	0.466	S	S	*	.			trans	-80.5	29.5	-167.1	31.8	-36.1	0	0	0	114.9
43	Q	37.9	Very low	35.3	Very low	85 Å²	85	102.7 Å²	102.7	40%	0.397	48%	0.481	S	S	.	.			trans	-84.4	146.9	-171.7	-62.4	-169.1	4.4	0	0	114	F41 L143	F41-Q43 PolarHBondContact O-N 3.12Å; Q43-L143 VanDerWaalsContact NE2-CD2 3.33Å
44	E	32.4	Very low	35.3	Very low	153 Å²	153	101 Å²	101	72%	0.715	50%	0.497	S	S	*	.	S	Bend	trans	-84.2	-14.6	-172	-65.1	-177.4	169	0	0	115.1
45	R	33.4	Very low	34.9	Very low	176 Å²	176	105.2 Å²	105.2	66%	0.664	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.5	126.1	-170.7	-61.8	-172.6	-174.3	-163.1	-0.3	112.6	V62 L63	R45-V62 HydrophobicContact CB-CG1 4.09Å; R45-L63 CarbonylContact C-O 3.57Å; R45-L63 VanDerWaalsContact CA-O 3.31Å; R45-L63 WeakPolarHBondContact CA-O 3.27Å
46	W	38.9	Very low	34.5	Very low	72 Å²	72	105 Å²	105	27%	0.273	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	148.5	-177.5	-64.5	82.9	0	0	0	110.6	L37 V62 L63	L37-W46 HydrophobicContact CB-CH2 4.08Å; L37-W46 HydrophobicContact CD2-CH2 3.48Å; L37-W46 VanDerWaalsContact CD2-CH2 3.48Å; L37-W46 HydrophobicContact CD2-CZ3 3.81Å; L37-W46 HydrophobicContact CG-CH2 4.39Å; W46-V62 CarbonylContact O-C 3.11Å; W46-V62 WeakPolarHBondContact O-CA 3.47Å; W46-L63 HydrophobicContact CB-CB 4.23Å; W46-L63 PolarHBondContact N-O 2.91Å; W46-L63 PolarHBondContact O-N 2.69Å
47	L	36.5	Very low	34.3	Very low	67 Å²	67	102.4 Å²	102.4	35%	0.351	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.4	174.2	-120.9	83.6	0	0	0	110.7	I49 C60 V62 V133	L47-I49 HydrophobicContact CD2-CD1 4.35Å; L47-I49 HydrophobicContact CD2-CG1 4.28Å; L47-C60 WeakPolarHBondContact CD2-SG 3.39Å; L47-V62 HydrophobicContact CD1-CG2 3.86Å; L47-V133 HydrophobicContact CD1-CB 4.32Å; L47-V133 HydrophobicContact CD1-CG1 4.2Å; L47-V133 HydrophobicContact CD1-CG2 3.18Å; L47-V133 HydrophobicContact CD2-CG2 4.13Å; L47-V133 HydrophobicContact CG-CG2 4.29Å
48	Q	37.7	Very low	34.4	Very low	65 Å²	65	105.9 Å²	105.9	30%	0.304	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	117	167.9	-167.9	171.3	33.3	0	0	108.9	R50 C60 E61 L63	Q48-R50 VanDerWaalsContact CD-NE 3.35Å; Q48-R50 HydrophobicContact CG-CG 4.17Å; Q48-R50 VanDerWaalsContact NE2-NH2 3.17Å; Q48-C60 CarbonylContact O-C 3.53Å; Q48-C60 WeakPolarHBondContact O-CA 3.46Å; Q48-E61 PolarHBondContact N-O 3.32Å; Q48-E61 PolarHBondContact O-N 2.76Å; Q48-L63 HydrophobicContact CB-CD1 3.96Å
49	I	36.8	Very low	34.3	Very low	90 Å²	90	105.5 Å²	105.5	46%	0.462	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	117.8	174.8	-55.7	175.7	0	0	0	107.4	L47 F58 S59	L47-I49 HydrophobicContact CD2-CD1 4.35Å; L47-I49 HydrophobicContact CD2-CG1 4.28Å; I49-F58 HydrophobicContact CG2-CB 3.85Å; I49-F58 HydrophobicContact CG2-CD1 4.17Å; I49-F58 HydrophobicContact CG2-CG 4.29Å; I49-S59 CarbonylContact C-O 3.44Å; I49-S59 WeakPolarHBondContact CA-O 3.19Å
50	R	34.9	Very low	34.4	Very low	127 Å²	127	102.2 Å²	102.2	48%	0.479	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	147.9	174.9	-59.2	-176.8	-173	-150.5	-0.7	109.7	Q48 F58 S59	Q48-R50 VanDerWaalsContact CD-NE 3.35Å; Q48-R50 HydrophobicContact CG-CG 4.17Å; Q48-R50 VanDerWaalsContact NE2-NH2 3.17Å; R50-F58 CarbonylContact O-C 3.58Å; R50-S59 WeakPolarHBondContact CB-OG 3.37Å; R50-S59 PolarHBondContact N-O 2.84Å; R50-S59 PolarHBondContact O-N 2.83Å; R50-S59 PolarHBondContact O-OG 2.87Å
51	R	37.3	Very low	34.6	Very low	146 Å²	146	101.4 Å²	101.4	55%	0.551	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	121.3	169.5	-175.9	177.4	177.3	171.9	-0.5	107.9	F58	R51-F58 HydrophobicContact CB-CD1 4.16Å; R51-F58 HydrophobicContact CB-CE1 4.3Å; R51-F58 HydrophobicContact CG-CD1 4.49Å; R51-F58 HydrophobicContact CG-CE1 4.42Å
52	Q	33.9	Very low	34.7	Very low	103 Å²	103	101 Å²	101	48%	0.481	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-80.2	124	170.5	-77.6	-175.1	-9.9	0	0	109.1	G54 K55	Q52-G54 PolarHBondContact O-N 3.38Å; Q52-K55 PolarHBondContact O-N 3.28Å
53	F	29.4	Very low	35	Very low	163 Å²	163	97 Å²	97	72%	0.715	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	132.5	173.6	-97.1	-89.1	0	0	0	110.2
54	G	36.8	Very low	34.9	Very low	85 Å²	85	94.7 Å²	94.7	88%	0.876	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	-4.6	179.5	0	0	0	0	0	116.8	Q52	Q52-G54 PolarHBondContact O-N 3.38Å
55	K	31.2	Very low	35.2	Very low	140 Å²	140	96.2 Å²	96.2	61%	0.609	48%	0.479	S	S	*	.	S	Bend	trans	-122.8	147.3	172.6	-67.4	-179.4	-177.2	171.7	0	111	Q52 G57	Q52-K55 PolarHBondContact O-N 3.28Å; K55-G57 PolarHBondContact O-N 2.75Å
56	T	31	Very low	35.4	Very low	154 Å²	154	93.7 Å²	93.7	95%	0.945	48%	0.479	S	S	*	.	S	Bend	trans	-76.8	0.7	177.7	46	0	0	0	0	113.8
57	G	29.7	Very low	35.5	Very low	44 Å²	44	94.7 Å²	94.7	45%	0.454	49%	0.486	S	S	.	.	S	Bend	trans	-106.1	145.6	-177.7	0	0	0	0	0	113.6	K55	K55-G57 PolarHBondContact O-N 2.75Å
58	F	38.4	Very low	35.7	Very low	111 Å²	111	93.7 Å²	93.7	49%	0.487	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	135.1	168.4	-61.2	-84.7	0	0	0	109.7	I49 R50 R51 I98	I49-F58 HydrophobicContact CG2-CB 3.85Å; I49-F58 HydrophobicContact CG2-CD1 4.17Å; I49-F58 HydrophobicContact CG2-CG 4.29Å; R50-F58 CarbonylContact O-C 3.58Å; R51-F58 HydrophobicContact CB-CD1 4.16Å; R51-F58 HydrophobicContact CB-CE1 4.3Å; R51-F58 HydrophobicContact CG-CD1 4.49Å; R51-F58 HydrophobicContact CG-CE1 4.42Å; F58-I98 HydrophobicContact CD1-CD1 4.16Å; F58-I98 HydrophobicContact CE1-CD1 3.49Å; F58-I98 VanDerWaalsContact CE1-CD1 3.49Å; F58-I98 HydrophobicContact CZ-CD1 4.19Å
59	S	32.8	Very low	35.6	Very low	44 Å²	44	94.8 Å²	94.8	31%	0.308	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	122.4	168	57.8	0	0	0	0	109	I49 R50	I49-S59 CarbonylContact C-O 3.44Å; I49-S59 WeakPolarHBondContact CA-O 3.19Å; R50-S59 WeakPolarHBondContact CB-OG 3.37Å; R50-S59 PolarHBondContact N-O 2.84Å; R50-S59 PolarHBondContact O-N 2.83Å; R50-S59 PolarHBondContact O-OG 2.87Å
60	C	35.5	Very low	35.5	Very low	36 Å²	36	99.8 Å²	99.8	24%	0.243	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.5	176.1	174.3	0	0	0	0	108	L47 Q48	L47-C60 WeakPolarHBondContact CD2-SG 3.39Å; Q48-C60 CarbonylContact O-C 3.53Å; Q48-C60 WeakPolarHBondContact O-CA 3.46Å
61	E	35.8	Very low	35.8	Very low	96 Å²	96	99.2 Å²	99.2	45%	0.449	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	131.5	177.2	-163.5	173.6	-169.5	0	0	109.8	Q48	Q48-E61 PolarHBondContact N-O 3.32Å; Q48-E61 PolarHBondContact O-N 2.76Å
62	V	36.1	Very low	35.8	Very low	49 Å²	49	95.8 Å²	95.8	30%	0.297	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	107.2	179.7	-174.3	0	0	0	0	109.2	R45 W46 L47	R45-V62 HydrophobicContact CB-CG1 4.09Å; W46-V62 CarbonylContact O-C 3.11Å; W46-V62 WeakPolarHBondContact O-CA 3.47Å; L47-V62 HydrophobicContact CD1-CG2 3.86Å
63	L	38.3	Very low	35.9	Very low	30 Å²	30	95.1 Å²	95.1	16%	0.157	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	127.3	-179.5	-68.5	165.3	0	0	0	110.9	R45 W46 Q48 I68	R45-L63 CarbonylContact C-O 3.57Å; R45-L63 VanDerWaalsContact CA-O 3.31Å; R45-L63 WeakPolarHBondContact CA-O 3.27Å; W46-L63 HydrophobicContact CB-CB 4.23Å; W46-L63 PolarHBondContact N-O 2.91Å; W46-L63 PolarHBondContact O-N 2.69Å; Q48-L63 HydrophobicContact CB-CD1 3.96Å; L63-I68 HydrophobicContact CB-CD1 4.48Å; L63-I68 HydrophobicContact CB-CG1 4.42Å
64	S	36.1	Very low	36.3	Very low	37 Å²	37	89.3 Å²	89.3	26%	0.259	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	154.5	168.8	65.3	0	0	0	0	111.6	D66 Q67 I68	S64-D66 PolarHBondContact O-N 3.26Å; S64-D66 VanDerWaalsContact O-N 3.08Å; S64-Q67 PolarHBondContact O-N 2.77Å; S64-Q67 WeakPolarHBondContact OG-CG 3.31Å; S64-I68 PolarHBondContact O-N 3.11Å
65	R	38.2	Very low	36.2	Very low	186 Å²	186	92.3 Å²	92.3	70%	0.702	49%	0.486	S	S	*	.	H	α-helix	trans	-52.5	-33.6	-178.8	-159.4	170	91.6	165	6	113.8	C69	R65-C69 PolarHBondContact O-N 3.38Å
66	D	38.8	Very low	36.3	Very low	122 Å²	122	93.3 Å²	93.3	65%	0.652	49%	0.49	S	S	*	.	H	α-helix	trans	-75.8	-25.2	179.7	-64.7	-22.9	0	0	0	113.6	S64 R70	S64-D66 PolarHBondContact O-N 3.26Å; S64-D66 VanDerWaalsContact O-N 3.08Å; D66-R70 WeakPolarHBondContact O-CB 3.48Å; D66-R70 WeakPolarHBondContact O-CG 3.33Å; D66-R70 PolarHBondContact O-N 2.86Å
67	Q	40.4	Very low	36.4	Very low	93 Å²	93	89.8 Å²	89.8	44%	0.435	48%	0.476	S	S	.	.	H	α-helix	trans	-79.5	-31.1	174.8	-70.3	175.8	3	0	0	111.9	S64	S64-Q67 PolarHBondContact O-N 2.77Å; S64-Q67 WeakPolarHBondContact OG-CG 3.31Å
68	I	41.1	Very low	36.5	Very low	47 Å²	47	95.7 Å²	95.7	24%	0.241	49%	0.492	C	S	.	.	H	α-helix	trans	-65.2	-45.5	174.2	-62	168.7	0	0	0	109.7	L34 L63 S64	L34-I68 HydrophobicContact CD1-CG2 4.46Å; L63-I68 HydrophobicContact CB-CD1 4.48Å; L63-I68 HydrophobicContact CB-CG1 4.42Å; S64-I68 PolarHBondContact O-N 3.11Å
69	C	35.6	Very low	36.2	Very low	87 Å²	87	99.8 Å²	99.8	59%	0.588	51%	0.51	S	S	*	.	H	α-helix	trans	-75.1	-23.3	178.7	-64.7	0	0	0	0	114.5	R65	R65-C69 PolarHBondContact O-N 3.38Å
70	R	35.3	Very low	36.2	Very low	195 Å²	195	107 Å²	107	74%	0.736	54%	0.535	S	S	*	.	H	α-helix	trans	-73.8	-32.2	179.6	-94.1	-178.7	173.5	173.9	-0.1	113.5	D66 D72 S73	D66-R70 WeakPolarHBondContact O-CB 3.48Å; D66-R70 WeakPolarHBondContact O-CG 3.33Å; D66-R70 PolarHBondContact O-N 2.86Å; R70-D72 PolarHBondContact O-N 2.96Å; R70-S73 PolarHBondContact O-N 3.19Å; R70-S73 PolarHBondContact O-OG 3.47Å
71	K	39.8	Very low	35.9	Very low	115 Å²	115	114.3 Å²	114.3	50%	0.5	56%	0.563	S	S	.	*	H	α-helix	trans	-63.2	-28.4	178.1	-80.7	-174.9	174.1	178.4	0	113.1	S73 G74 E75	K71-S73 PolarHBondContact O-N 2.78Å; K71-G74 PolarHBondContact O-N 3.19Å; K71-E75 PolarHBondContact O-N 2.72Å
72	D	37.7	Very low	35.5	Very low	75 Å²	75	115.3 Å²	115.3	40%	0.401	58%	0.581	S	S	.	*	H	α-helix	trans	-66.1	-19.3	177.8	-161.6	10.4	0	0	0	113.5	R70 K76	R70-D72 PolarHBondContact O-N 2.96Å; D72-K76 IonicContact OD1-NZ 3.37Å; D72-K76 PolarHBondContact OD1-NZ 3.1Å
73	S	36.3	Very low	35.7	Very low	89 Å²	89	121.9 Å²	121.9	62%	0.622	61%	0.608	S	S	*	*	H	α-helix	trans	-101	-16.9	177.8	56.4	0	0	0	0	114.7	R70 K71	R70-S73 PolarHBondContact O-N 3.19Å; R70-S73 PolarHBondContact O-OG 3.47Å; K71-S73 PolarHBondContact O-N 2.78Å
74	G	36.5	Very low	35.5	Very low	41 Å²	41	129.6 Å²	129.6	42%	0.423	64%	0.643	S	S	.	*	H	α-helix	trans	-89.1	-42.5	-179.1	0	0	0	0	0	113.7	K71 K76 A77	K71-G74 PolarHBondContact O-N 3.19Å; G74-K76 PolarHBondContact O-N 2.92Å; G74-A77 PolarHBondContact O-N 3.43Å
75	E	36.3	Very low	35.1	Very low	148 Å²	148	134.9 Å²	134.9	69%	0.692	67%	0.669	S	S	*	*	H	α-helix	trans	-79.5	-19.2	-173.7	-80.2	-178.4	160.7	0	0	114.1	K71 A77	K71-E75 PolarHBondContact O-N 2.72Å; E75-A77 VanDerWaalsContact C-N 3.27Å; E75-A77 PolarHBondContact O-N 3.34Å
76	K	32.7	Very low	34.6	Very low	161 Å²	161	132.9 Å²	132.9	70%	0.7	67%	0.672	S	S	*	*	H	α-helix	trans	-74.9	-14.5	173	-80.5	172.7	-178.2	140.6	0	113.5	D72 G74	D72-K76 IonicContact OD1-NZ 3.37Å; D72-K76 PolarHBondContact OD1-NZ 3.1Å; G74-K76 PolarHBondContact O-N 2.92Å
77	A	32.9	Very low	34.1	Very low	80 Å²	80	130.5 Å²	130.5	66%	0.661	68%	0.676	S	S	*	*	H	α-helix	trans	-94.4	-25	-177.9	0	0	0	0	0	114.1	G74 E75	G74-A77 PolarHBondContact O-N 3.43Å; E75-A77 VanDerWaalsContact C-N 3.27Å; E75-A77 PolarHBondContact O-N 3.34Å
78	E	32.6	Very low	33.6	Very low	167 Å²	167	134.1 Å²	134.1	78%	0.78	70%	0.698	S	S	*	*	H	α-helix	trans	-100	-17.6	-177	-82.8	-176.6	152.7	0	0	114.8	K80	E78-K80 PolarHBondContact O-N 3.19Å; E78-K80 VanDerWaalsContact O-N 3.1Å
79	K	31.6	Very low	32.8	Very low	197 Å²	197	136.3 Å²	136.3	86%	0.857	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	24	-178.1	-125.5	176.9	-173.9	178.1	0	115.5
80	K	31.8	Very low	32.7	Very low	195 Å²	195	141.5 Å²	141.5	85%	0.848	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.2	11.2	176.1	-123.6	-178.7	-174	-179.9	0	114.8	E78	E78-K80 PolarHBondContact O-N 3.19Å; E78-K80 VanDerWaalsContact O-N 3.1Å
81	K	30.3	Very low	32.3	Very low	191 Å²	191	140.6 Å²	140.6	83%	0.83	74%	0.744	S	S	*	*	S	Bend	trans	-142.8	70.6	174.5	-82.3	-172.4	173	-179	0	111.3
82	S	28.1	Very low	31.9	Very low	116 Å²	116	143.5 Å²	143.5	81%	0.811	76%	0.759	S	S	*	*			trans	170.1	80.9	153.7	33.3	0	0	0	0	108.6
83	E	39.5	Very low	31.8	Very low	187 Å²	187	145.4 Å²	145.4	87%	0.874	77%	0.769	S	S	*	*			trans	-86.9	156.4	143	-77.6	-179.3	160.8	0	0	107
84	E	33.3	Very low	31.9	Very low	192 Å²	192	147 Å²	147	90%	0.897	77%	0.766	S	S	*	*			trans	89.5	94.4	177.4	-53.3	176.9	173.9	0	0	114.8
85	D	27.6	Very low	32	Very low	148 Å²	148	152.4 Å²	152.4	79%	0.791	78%	0.781	S	S	*	*				175.2	150	96.2	-141	-1.8	0	0	0	111.9
86	D	28.1	Very low	32.4	Very low	145 Å²	145	151.6 Å²	151.6	78%	0.775	78%	0.775	S	S	*	*			trans	62.1	108.2	160.3	-74.6	-24.7	0	0	0	123.3
87	G	28.6	Very low	33	Very low	71 Å²	71	147.2 Å²	147.2	73%	0.732	76%	0.761	S	S	*	*				64.2	112.4	103.7	0	0	0	0	0	121.6
88	D	29	Very low	33.8	Very low	169 Å²	169	146.2 Å²	146.2	90%	0.904	74%	0.744	S	S	*	*			trans	50.1	106	148	-69.5	-16.2	0	0	0	120.7
89	A	26.1	Very low	34.8	Very low	94 Å²	94	140.8 Å²	140.8	78%	0.777	72%	0.718	S	S	*	*				176.9	104.2	115.9	0	0	0	0	0	109.5	Q91	A89-Q91 PolarHBondContact O-N 3.37Å
90	E	31.8	Very low	35.8	Very low	196 Å²	196	134.5 Å²	134.5	92%	0.916	70%	0.697	S	S	*	*			trans	-65.3	100.5	166.3	-70.4	176.7	163.1	0	0	109.2
91	Q	27.2	Very low	37.1	Very low	176 Å²	176	127.1 Å²	127.1	82%	0.822	67%	0.665	S	S	*	*			trans	-103.3	102.1	152.4	-94.3	173.4	-3.4	0	0	106.6	A89 D93	A89-Q91 PolarHBondContact O-N 3.37Å; Q91-D93 VanDerWaalsContact C-N 3.32Å; Q91-D93 PolarHBondContact O-N 3.08Å
92	E	32.7	Very low	38.7	Very low	175 Å²	175	122.5 Å²	122.5	82%	0.818	64%	0.643	S	S	*	*			trans	-59.7	97.4	166.9	-70.4	-178.4	151.3	0	0	108	E94	E92-E94 VanDerWaalsContact C-N 3.26Å; E92-E94 PolarHBondContact O-N 3.22Å
93	D	34.5	Very low	40.4	Very low	116 Å²	116	120 Å²	120	62%	0.62	62%	0.618	S	S	*	*			trans	-64.6	89.4	166.5	-84	-33.9	0	0	0	107.6	Q91 E95	Q91-D93 VanDerWaalsContact C-N 3.32Å; Q91-D93 PolarHBondContact O-N 3.08Å; D93-E95 VanDerWaalsContact C-N 3.35Å; D93-E95 PolarHBondContact O-N 3.33Å
94	E	38.5	Very low	41.4	Very low	121 Å²	121	112.7 Å²	112.7	57%	0.565	58%	0.584	S	S	*	*			trans	-59.2	97.6	171	-77.4	-171	163.4	0	0	109.2	E92 K96	E92-E94 VanDerWaalsContact C-N 3.26Å; E92-E94 PolarHBondContact O-N 3.22Å; E94-K96 PolarHBondContact O-N 2.72Å
95	E	39.9	Very low	42.8	Very low	156 Å²	156	106.9 Å²	106.9	73%	0.729	55%	0.554	S	S	*	*			trans	-59.8	106.2	174.5	-77.3	-169.3	149.3	0	0	110.4	D93 V97	D93-E95 VanDerWaalsContact C-N 3.35Å; D93-E95 PolarHBondContact O-N 3.33Å; E95-V97 PolarHBondContact O-N 2.88Å; E95-V97 VanDerWaalsContact O-N 3.11Å
96	K	43.3	Very low	44.7	Very low	131 Å²	131	103.5 Å²	103.5	57%	0.57	53%	0.533	S	S	*	.			trans	-79.8	94.7	177.6	-71.1	-177.5	-179	-178.1	0	110.7	E94	E94-K96 PolarHBondContact O-N 2.72Å
97	V	46.8	Very low	46.5	Very low	68 Å²	68	96.9 Å²	96.9	41%	0.412	50%	0.497	S	S	.	.			trans	-61.8	134.5	167.7	-180	0	0	0	0	109.6	E95 F99 A492 L493	E95-V97 PolarHBondContact O-N 2.88Å; E95-V97 VanDerWaalsContact O-N 3.11Å; V97-F99 HydrophobicContact CG1-CD2 4.34Å; V97-F99 HydrophobicContact CG1-CE1 4.39Å; V97-F99 HydrophobicContact CG1-CE2 3.82Å; V97-F99 HydrophobicContact CG1-CZ 3.84Å; V97-A492 HydrophobicContact CB-CB 3.86Å; V97-A492 HydrophobicContact CG1-CB 4.09Å; V97-A492 CarbonylContact O-C 3.57Å; V97-A492 WeakPolarHBondContact O-CA 3.46Å; V97-A492 VanDerWaalsContact O-CB 3.31Å; V97-A492 WeakPolarHBondContact O-CB 3.47Å; V97-L493 PolarHBondContact O-N 3.46Å
98	I	49.6	Very low	48.1	Very low	59 Å²	59	94.7 Å²	94.7	30%	0.303	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119.9	178.6	-53.6	176.1	0	0	0	109	F58 V100 L493 L495	F58-I98 HydrophobicContact CD1-CD1 4.16Å; F58-I98 HydrophobicContact CE1-CD1 3.49Å; F58-I98 VanDerWaalsContact CE1-CD1 3.49Å; F58-I98 HydrophobicContact CZ-CD1 4.19Å; I98-V100 HydrophobicContact CG2-CG2 4.32Å; I98-L493 CarbonylContact C-O 3.53Å; I98-L493 WeakPolarHBondContact CA-O 3.38Å; I98-L493 HydrophobicContact CD1-CD2 4.43Å; I98-L493 HydrophobicContact CG1-CB 4.25Å; I98-L493 HydrophobicContact CG1-CD2 4.33Å; I98-L493 HydrophobicContact CG2-CB 4.4Å; I98-L493 HydrophobicContact CG2-CD2 4.24Å; I98-L495 HydrophobicContact CG2-CD1 3.66Å; I98-L495 HydrophobicContact CG2-CG 4.09Å
99	F	52.8	Low	49.9	Very low	53 Å²	53	87.6 Å²	87.6	23%	0.232	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.2	173.4	-69.6	-71.1	0	0	0	110.1	V97 A492 L493 H494 L495	V97-F99 HydrophobicContact CG1-CD2 4.34Å; V97-F99 HydrophobicContact CG1-CE1 4.39Å; V97-F99 HydrophobicContact CG1-CE2 3.82Å; V97-F99 HydrophobicContact CG1-CZ 3.84Å; F99-A492 HydrophobicContact CD2-CB 3.45Å; F99-A492 VanDerWaalsContact CD2-CB 3.45Å; F99-A492 HydrophobicContact CE2-CB 3.32Å; F99-L493 PolarHBondContact N-O 2.83Å; F99-H494 AromaticContact CD2-CE1 3.5Å; F99-H494 AromaticContact CD2-NE2 3.47Å; F99-H494 WeakPolarHBondContact CD2-NE2 3.45Å; F99-H494 AromaticContact CG-CE1 3.86Å; F99-H494 CarbonylContact O-C 3.54Å; F99-H494 WeakPolarHBondContact O-CA 3.48Å; F99-L495 PolarHBondContact O-N 3.43Å
100	V	53.5	Low	51.8	Low	66 Å²	66	83.5 Å²	83.5	40%	0.4	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	109.2	174.2	-176.1	0	0	0	0	109.5	I98 F482 L495 M497	I98-V100 HydrophobicContact CG2-CG2 4.32Å; V100-F482 HydrophobicContact CG1-CD1 4.28Å; V100-F482 HydrophobicContact CG1-CE1 3.86Å; V100-L495 CarbonylContact C-O 3.57Å; V100-L495 WeakPolarHBondContact CA-O 3.33Å; V100-L495 HydrophobicContact CG2-CB 4.42Å; V100-L495 HydrophobicContact CG2-CD1 4.42Å; V100-M497 HydrophobicContact CG1-CB 4.14Å
101	H	58.8	Low	53.5	Low	40 Å²	40	77.1 Å²	77.1	19%	0.185	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	129.7	173.5	-62.6	-89	0	0	0	108.6	H494 L495 L496 M497	H101-H494 AromaticContact CD2-ND1 3.79Å; H101-H494 AromaticContact CE1-ND1 3.89Å; H101-H494 AromaticContact NE2-CE1 3.78Å; H101-H494 AromaticContact NE2-CG 3.98Å; H101-H494 AromaticContact NE2-ND1 2.96Å; H101-H494 PolarHBondContact NE2-ND1 3.5Å; H101-L495 PolarHBondContact N-O 2.95Å; H101-L496 HydrophobicContact CB-CD1 4.04Å; H101-M497 WeakPolarHBondContact O-CB 3.39Å; H101-M497 PolarHBondContact O-N 3.19Å
102	Y	62.8	Low	55.3	Low	93 Å²	93	71.1 Å²	71.1	37%	0.365	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	152.2	176	65.5	-89.3	0	0	0	111.1	Q104 V107 M497	Y102-Q104 HydrophobicContact CD2-CB 4.37Å; Y102-Q104 HydrophobicContact CE2-CB 3.94Å; Y102-Q104 HydrophobicContact CE2-CG 4.27Å; Y102-Q104 PolarHBondContact O-N 2.84Å; Y102-V107 HydrophobicContact CD2-CB 4.34Å; Y102-V107 HydrophobicContact CD2-CG2 3.68Å; Y102-V107 HydrophobicContact CG-CG2 4.3Å; Y102-M497 HydrophobicContact CG-CE 4.25Å
103	E	63.5	Low	56.9	Low	63 Å²	63	63.3 Å²	63.3	29%	0.294	30%	0.303	S	S	.	.			trans	-86.1	100.2	174.3	-167.6	177.6	150.4	0	0	109.4	R105 K106 V107	E103-R105 VanDerWaalsContact C-N 3.28Å; E103-R105 PolarHBondContact O-N 3.39Å; E103-K106 HydrophobicContact CB-CB 4.36Å; E103-K106 HydrophobicContact CB-CD 4.22Å; E103-K106 HydrophobicContact CB-CG 4.35Å; E103-K106 HydrophobicContact CG-CD 4.27Å; E103-K106 HydrophobicContact CG-CG 4.2Å; E103-K106 PolarHBondContact O-N 2.81Å; E103-K106 WeakPolarHBondContact OE1-CE 3.41Å; E103-K106 IonicContact OE1-NZ 3.83Å; E103-K106 VanDerWaalsContact OE2-CD 3.25Å; E103-K106 WeakPolarHBondContact OE2-CD 3.34Å; E103-K106 WeakPolarHBondContact OE2-CE 3.42Å; E103-K106 IonicContact OE2-NZ 2.62Å; E103-K106 PolarHBondContact OE2-NZ 3.45Å; E103-V107 WeakPolarHBondContact O-CG2 3.35Å; E103-V107 PolarHBondContact O-N 2.77Å
104	Q	60.5	Low	58.1	Low	35 Å²	35	62.8 Å²	62.8	16%	0.164	31%	0.305	C	S	.	.	H	α-helix	trans	-50	-44.6	-172.4	-174.7	166.7	-9.1	0	0	113.2	Y102 K106 V107 M108 D147	Y102-Q104 HydrophobicContact CD2-CB 4.37Å; Y102-Q104 HydrophobicContact CE2-CB 3.94Å; Y102-Q104 HydrophobicContact CE2-CG 4.27Å; Y102-Q104 PolarHBondContact O-N 2.84Å; Q104-K106 PolarHBondContact O-N 3.34Å; Q104-V107 PolarHBondContact O-N 2.94Å; Q104-M108 HydrophobicContact CG-CG 4.21Å; Q104-M108 WeakPolarHBondContact O-CB 3.4Å; Q104-M108 WeakPolarHBondContact O-CG 3.48Å; Q104-M108 PolarHBondContact O-N 2.76Å; Q104-D147 PolarHBondContact NE2-OD1 2.79Å; Q104-D147 VanDerWaalsContact NE2-OD1 3.13Å; Q104-D147 PolarHBondContact NE2-OD2 2.73Å
105	R	64.3	Low	58.7	Low	69 Å²	69	61.6 Å²	61.6	26%	0.26	31%	0.306	S	S	.	.	H	α-helix	trans	-56.4	-44.9	176.5	-175	177.6	-175.5	-123.5	-4.6	113	E103 L109 S161 E162	E103-R105 VanDerWaalsContact C-N 3.28Å; E103-R105 PolarHBondContact O-N 3.39Å; R105-L109 HydrophobicContact CG-CD1 3.84Å; R105-L109 WeakPolarHBondContact O-CB 3.33Å; R105-L109 VanDerWaalsContact O-CG 3.25Å; R105-L109 WeakPolarHBondContact O-CG 3.16Å; R105-L109 PolarHBondContact O-N 3.23Å; R105-L109 VanDerWaalsContact O-N 3.09Å; R105-S161 PolarHBondContact NH2-O 2.93Å; R105-S161 VanDerWaalsContact NH2-O 3.16Å; R105-S161 PolarHBondContact NH2-OG 3.25Å; R105-E162 IonicContact CZ-OE1 3.25Å; R105-E162 IonicContact NH1-OE1 2.63Å; R105-E162 PolarHBondContact NH1-OE1 3.03Å; R105-E162 IonicContact NH2-OE1 2.95Å; R105-E162 PolarHBondContact NH2-OE1 3.2Å
106	K	66.9	Low	59	Low	78 Å²	78	59.4 Å²	59.4	34%	0.339	30%	0.296	S	S	.	.	H	α-helix	trans	-67.8	-38	-178.6	-71.9	-178.3	-179.7	156.1	0	111.5	E103 Q104 S110 Y474 I499	E103-K106 HydrophobicContact CB-CB 4.36Å; E103-K106 HydrophobicContact CB-CD 4.22Å; E103-K106 HydrophobicContact CB-CG 4.35Å; E103-K106 HydrophobicContact CG-CD 4.27Å; E103-K106 HydrophobicContact CG-CG 4.2Å; E103-K106 PolarHBondContact O-N 2.81Å; E103-K106 WeakPolarHBondContact OE1-CE 3.41Å; E103-K106 IonicContact OE1-NZ 3.83Å; E103-K106 VanDerWaalsContact OE2-CD 3.25Å; E103-K106 WeakPolarHBondContact OE2-CD 3.34Å; E103-K106 WeakPolarHBondContact OE2-CE 3.42Å; E103-K106 IonicContact OE2-NZ 2.62Å; E103-K106 PolarHBondContact OE2-NZ 3.45Å; Q104-K106 PolarHBondContact O-N 3.34Å; K106-S110 WeakPolarHBondContact O-CB 3.21Å; K106-S110 PolarHBondContact O-N 3.06Å; K106-Y474 HydrophobicContact CB-CD2 4.37Å; K106-Y474 HydrophobicContact CB-CG 4.33Å; K106-Y474 HydrophobicContact CG-CD1 4.31Å; K106-Y474 HydrophobicContact CG-CD2 4.3Å; K106-Y474 HydrophobicContact CG-CG 4.05Å; K106-I499 HydrophobicContact CB-CD1 3.87Å; K106-I499 VanDerWaalsContact O-CD1 3.29Å; K106-I499 WeakPolarHBondContact O-CD1 3.48Å
107	V	65.4	Low	58.7	Low	6 Å²	6	57.3 Å²	57.3	4%	0.036	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-47.1	179.4	-177.3	0	0	0	0	111	Y102 E103 Q104 L109 S110 F134 V137 M497 I499	Y102-V107 HydrophobicContact CD2-CB 4.34Å; Y102-V107 HydrophobicContact CD2-CG2 3.68Å; Y102-V107 HydrophobicContact CG-CG2 4.3Å; E103-V107 WeakPolarHBondContact O-CG2 3.35Å; E103-V107 PolarHBondContact O-N 2.77Å; Q104-V107 PolarHBondContact O-N 2.94Å; V107-L109 VanDerWaalsContact C-N 3.29Å; V107-L109 PolarHBondContact O-N 3.21Å; V107-S110 PolarHBondContact O-N 3.01Å; V107-S110 PolarHBondContact O-OG 3.06Å; V107-F134 HydrophobicContact CG1-CD1 4.17Å; V107-F134 HydrophobicContact CG1-CE1 4.17Å; V107-V137 HydrophobicContact CG1-CG1 4.35Å; V107-M497 HydrophobicContact CB-CE 4.31Å; V107-M497 HydrophobicContact CG1-CE 4.21Å; V107-M497 HydrophobicContact CG2-CE 3.13Å; V107-I499 HydrophobicContact CG2-CD1 4.49Å
108	M	62.3	Low	58.1	Low	25 Å²	25	62.3 Å²	62.3	12%	0.123	32%	0.322	C	S	.	.	H	α-helix	trans	-65.6	-31.8	-179.8	-66.5	-59.3	-69.4	0	0	112.7	Q104 V137 L143 F144	Q104-M108 HydrophobicContact CG-CG 4.21Å; Q104-M108 WeakPolarHBondContact O-CB 3.4Å; Q104-M108 WeakPolarHBondContact O-CG 3.48Å; Q104-M108 PolarHBondContact O-N 2.76Å; M108-V137 HydrophobicContact SD-CG1 3.87Å; M108-L143 HydrophobicContact CE-CB 3.74Å; M108-L143 HydrophobicContact SD-CB 4.48Å; M108-L143 HydrophobicContact SD-CD1 4.49Å; M108-F144 HydrophobicContact CE-CB 4.41Å
109	L	66.3	Low	57.3	Low	20 Å²	20	69.5 Å²	69.5	11%	0.105	35%	0.354	C	S	.	.	H	α-helix	trans	-89.8	-10.6	177.1	-64.5	176.6	0	0	0	113.7	R105 V107 H158 Y474	R105-L109 HydrophobicContact CG-CD1 3.84Å; R105-L109 WeakPolarHBondContact O-CB 3.33Å; R105-L109 VanDerWaalsContact O-CG 3.25Å; R105-L109 WeakPolarHBondContact O-CG 3.16Å; R105-L109 PolarHBondContact O-N 3.23Å; R105-L109 VanDerWaalsContact O-N 3.09Å; V107-L109 VanDerWaalsContact C-N 3.29Å; V107-L109 PolarHBondContact O-N 3.21Å; L109-H158 VanDerWaalsContact CD2-O 3.24Å; L109-H158 WeakPolarHBondContact CD2-O 3.2Å; L109-Y474 HydrophobicContact CB-CD2 4.2Å; L109-Y474 HydrophobicContact CB-CE2 3.85Å; L109-Y474 HydrophobicContact CD1-CE2 3.98Å
110	S	66.8	Low	56.1	Low	7 Å²	7	71.8 Å²	71.8	5%	0.049	38%	0.377	C	S	.	.			trans	-75.6	135.5	179.1	68.7	0	0	0	0	111.1	K106 V107 A138 Y474	K106-S110 WeakPolarHBondContact O-CB 3.21Å; K106-S110 PolarHBondContact O-N 3.06Å; V107-S110 PolarHBondContact O-N 3.01Å; V107-S110 PolarHBondContact O-OG 3.06Å; S110-A138 WeakPolarHBondContact O-CB 3.41Å; S110-Y474 VanDerWaalsContact CA-O 3.28Å; S110-Y474 WeakPolarHBondContact CA-O 3.03Å; S110-Y474 WeakPolarHBondContact CB-O 3.48Å
111	Q	68.1	Low	55	Low	63 Å²	63	72.3 Å²	72.3	29%	0.294	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.3	167.7	-64.1	-152.8	12.4	0	0	108.7	H113 H236 R475 A477	Q111-H113 PolarHBondContact O-ND1 2.83Å; Q111-H236 VanDerWaalsContact CD-CG 3.4Å; Q111-H236 PolarHBondContact NE2-ND1 3.2Å; Q111-H236 PolarHBondContact OE1-CD2 3.42Å; Q111-H236 PolarHBondContact OE1-ND1 3Å; Q111-H236 PolarHBondContact OE1-NE2 3.28Å; Q111-R475 PolarHBondContact N-O 3Å; Q111-A477 WeakPolarHBondContact O-CB 3.1Å; Q111-A477 PolarHBondContact O-N 2.87Å
112	L	64.8	Low	53.7	Low	50 Å²	50	78.8 Å²	78.8	26%	0.262	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	117.3	177.1	-121.4	101.7	0	0	0	109.8	R131 F134 A477	L112-R131 HydrophobicContact CD2-CG 3.76Å; L112-F134 HydrophobicContact CD1-CB 4.24Å; L112-A477 WeakPolarHBondContact CA-O 3.48Å; L112-A477 HydrophobicContact CD1-CB 4.26Å
113	H	66.7	Low	52.2	Low	11 Å²	11	77.3 Å²	77.3	5%	0.051	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-75.7	143.6	177.8	-70.3	68.9	0	0	0	110.7	Q111 V115 R131 A477 L502 Y511	Q111-H113 PolarHBondContact O-ND1 2.83Å; H113-V115 PolarHBondContact O-N 3.12Å; H113-R131 PolarHBondContact O-NH2 3.23Å; H113-A477 PolarHBondContact N-O 3.43Å; H113-L502 HydrophobicContact CB-CD1 3.95Å; H113-L502 HydrophobicContact CB-CD2 4.32Å; H113-L502 HydrophobicContact CB-CG 4.49Å; H113-L502 VanDerWaalsContact ND1-CD1 3.35Å; H113-L502 WeakPolarHBondContact ND1-CD1 3.18Å; H113-Y511 PolarHBondContact CD2-OH 3.18Å; H113-Y511 AromaticContact NE2-CE2 3.77Å; H113-Y511 AromaticContact NE2-CZ 3.61Å; H113-Y511 PolarHBondContact NE2-OH 2.86Å
114	P	58.2	Low	50.7	Low	104 Å²	104	80 Å²	80	68%	0.675	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-57.2	138	173.5	24.5	-31.7	0	0	0	109.5	E116 R131	P114-E116 PolarHBondContact O-N 3.38Å; P114-R131 VanDerWaalsContact C-NH2 3.34Å; P114-R131 VanDerWaalsContact CA-NH2 3.27Å
115	V	52.7	Low	49.5	Very low	96 Å²	96	86.6 Å²	86.6	58%	0.582	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-70.2	119.5	171.6	165.3	0	0	0	0	104.4	H113 A117	H113-V115 PolarHBondContact O-N 3.12Å; V115-A117 PolarHBondContact O-N 3.21Å
116	E	45.8	Very low	48.2	Very low	110 Å²	110	89.2 Å²	89.2	51%	0.514	53%	0.527	S	S	.	.			trans	-60.9	94.9	168.3	-74.3	175.5	179.3	0	0	106.4	P114 Q118 T510	P114-E116 PolarHBondContact O-N 3.38Å; E116-Q118 VanDerWaalsContact C-N 3.28Å; E116-Q118 PolarHBondContact O-N 3.2Å; E116-T510 PolarHBondContact OE1-OG1 3.18Å; E116-T510 VanDerWaalsContact OE1-OG1 3.05Å
117	A	35.5	Very low	47	Very low	87 Å²	87	92.1 Å²	92.1	72%	0.719	54%	0.541	S	S	*	.			trans	-59.8	103.8	159.3	0	0	0	0	0	104.7	V115 E119	V115-A117 PolarHBondContact O-N 3.21Å; A117-E119 PolarHBondContact O-N 3.3Å
118	Q	34.8	Very low	46.1	Very low	173 Å²	173	95.2 Å²	95.2	81%	0.808	56%	0.563	S	S	*	*			trans	-45.2	128.2	159.7	-100.8	173.8	-21.3	0	0	106.5	E116 S120	E116-Q118 VanDerWaalsContact C-N 3.28Å; E116-Q118 PolarHBondContact O-N 3.2Å; Q118-S120 PolarHBondContact O-N 3.45Å
119	E	33	Very low	45.5	Very low	210 Å²	210	98.3 Å²	98.3	98%	0.981	58%	0.577	S	S	*	*	S	Bend	trans	-58.2	81.7	171.7	-68.5	177.5	155.2	0	0	109.3	A117	A117-E119 PolarHBondContact O-N 3.3Å
120	S	28.2	Very low	44.7	Very low	102 Å²	102	100.4 Å²	100.4	71%	0.713	59%	0.588	S	S	*	*			trans	-117.7	114.6	158.3	54.5	0	0	0	0	105.1	Q118	Q118-S120 PolarHBondContact O-N 3.45Å
121	G	30.1	Very low	44	Very low	76 Å²	76	103 Å²	103	78%	0.784	60%	0.597	S	S	*	*			trans	-55.2	154.6	-168.7	0	0	0	0	0	114.8
122	D	32	Very low	43.2	Very low	177 Å²	177	105.4 Å²	105.4	95%	0.947	61%	0.608	S	S	*	*	S	Bend	trans	64.8	119.6	163.5	-145.8	11.9	0	0	0	117.3
123	G	31.5	Very low	42.7	Very low	61 Å²	61	105 Å²	105	63%	0.629	61%	0.608	S	S	*	*			trans	109.3	81.4	178.7	0	0	0	0	0	113.6	E125	G123-E125 PolarHBondContact O-N 2.84Å
124	S	31.7	Very low	42.2	Very low	120 Å²	120	106 Å²	106	84%	0.839	61%	0.612	S	S	*	*			trans	-61.5	98.5	162.9	56.2	0	0	0	0	109.2
125	E	33.8	Very low	42.1	Very low	174 Å²	174	102.2 Å²	102.2	81%	0.813	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-56	134.3	166.3	-76.9	-165	159.9	0	0	108.9	G123 H127	G123-E125 PolarHBondContact O-N 2.84Å; E125-H127 PolarHBondContact O-N 2.99Å
126	P	37	Very low	42.3	Very low	123 Å²	123	102.3 Å²	102.3	80%	0.799	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-60	126.4	-179.5	23.5	-31.2	0	0	0	109.3	S128	P126-S128 PolarHBondContact O-N 2.62Å
127	H	43.1	Very low	42.8	Very low	140 Å²	140	99 Å²	99	65%	0.648	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-50.6	117.1	172.9	-73.8	-75	0	0	0	109.2	E125 E129	E125-H127 PolarHBondContact O-N 2.99Å; H127-E129 PolarHBondContact O-N 2.7Å
128	S	46.9	Very low	43.8	Very low	70 Å²	70	96.3 Å²	96.3	49%	0.49	56%	0.558	S	S	.	*			trans	-45.1	124.5	175.8	173.6	0	0	0	0	110.8	P126 L130 R131 Q132	P126-S128 PolarHBondContact O-N 2.62Å; S128-L130 PolarHBondContact O-N 2.82Å; S128-R131 WeakPolarHBondContact O-CA 3.1Å; S128-R131 WeakPolarHBondContact O-CB 3.33Å; S128-R131 PolarHBondContact O-N 3.31Å; S128-Q132 PolarHBondContact O-N 3.28Å
129	E	49.2	Very low	44.9	Very low	90 Å²	90	98.5 Å²	98.5	42%	0.421	56%	0.559	S	S	.	*	H	α-helix	trans	-54.8	-37.9	179.7	-63.2	-177.7	169.5	0	0	111.5	H127 R131 Q132 V133	H127-E129 PolarHBondContact O-N 2.7Å; E129-R131 PolarHBondContact O-N 2.97Å; E129-Q132 WeakPolarHBondContact O-CB 3.42Å; E129-Q132 PolarHBondContact O-N 2.74Å; E129-V133 VanDerWaalsContact O-CG2 3.27Å; E129-V133 WeakPolarHBondContact O-CG2 3.46Å; E129-V133 PolarHBondContact O-N 2.61Å
130	L	49.7	Very low	46	Very low	65 Å²	65	89.6 Å²	89.6	34%	0.34	52%	0.52	S	S	.	.	H	α-helix	trans	-57.2	-37.3	176.6	-154.6	130.9	0	0	0	111.7	S128 V133 F134	S128-L130 PolarHBondContact O-N 2.82Å; L130-V133 PolarHBondContact O-N 2.84Å; L130-F134 HydrophobicContact CD2-CD2 3.94Å; L130-F134 HydrophobicContact CD2-CE2 3.49Å; L130-F134 VanDerWaalsContact CD2-CE2 3.49Å; L130-F134 HydrophobicContact CG-CE2 4.19Å; L130-F134 WeakPolarHBondContact O-CD2 2.98Å; L130-F134 PolarHBondContact O-N 2.98Å
131	R	50.6	Low	47.2	Very low	61 Å²	61	92.2 Å²	92.2	23%	0.23	52%	0.521	C	S	.	.	H	α-helix	trans	-69.3	-38.1	175.3	-178.6	175.8	-166.4	156.3	11.1	112.7	L112 H113 P114 S128 E129 V133 G135	L112-R131 HydrophobicContact CD2-CG 3.76Å; H113-R131 PolarHBondContact O-NH2 3.23Å; P114-R131 VanDerWaalsContact C-NH2 3.34Å; P114-R131 VanDerWaalsContact CA-NH2 3.27Å; S128-R131 WeakPolarHBondContact O-CA 3.1Å; S128-R131 WeakPolarHBondContact O-CB 3.33Å; S128-R131 PolarHBondContact O-N 3.31Å; E129-R131 PolarHBondContact O-N 2.97Å; R131-V133 VanDerWaalsContact C-N 3.32Å; R131-G135 PolarHBondContact O-N 3.18Å
132	Q	53	Low	48.3	Very low	114 Å²	114	93.1 Å²	93.1	53%	0.533	51%	0.513	S	S	.	.	H	α-helix	trans	-64.9	-41.6	175.6	-64.8	-175.1	4.9	0	0	110.5	S128 E129 G135 T136	S128-Q132 PolarHBondContact O-N 3.28Å; E129-Q132 WeakPolarHBondContact O-CB 3.42Å; E129-Q132 PolarHBondContact O-N 2.74Å; Q132-G135 CarbonylContact O-C 3.59Å; Q132-G135 PolarHBondContact O-N 2.83Å; Q132-T136 PolarHBondContact O-N 3.13Å; Q132-T136 PolarHBondContact O-OG1 2.77Å; Q132-T136 VanDerWaalsContact O-OG1 3.06Å
133	V	53.5	Low	49.2	Very low	42 Å²	42	86.3 Å²	86.3	26%	0.255	48%	0.476	S	S	.	.	H	α-helix	trans	-60.5	-49.1	176.6	177.3	0	0	0	0	111.1	L47 E129 L130 R131 G135 T136 V137	L47-V133 HydrophobicContact CD1-CB 4.32Å; L47-V133 HydrophobicContact CD1-CG1 4.2Å; L47-V133 HydrophobicContact CD1-CG2 3.18Å; L47-V133 HydrophobicContact CD2-CG2 4.13Å; L47-V133 HydrophobicContact CG-CG2 4.29Å; E129-V133 VanDerWaalsContact O-CG2 3.27Å; E129-V133 WeakPolarHBondContact O-CG2 3.46Å; E129-V133 PolarHBondContact O-N 2.61Å; L130-V133 PolarHBondContact O-N 2.84Å; R131-V133 VanDerWaalsContact C-N 3.32Å; V133-G135 VanDerWaalsContact C-N 3.29Å; V133-G135 PolarHBondContact O-N 3.44Å; V133-T136 PolarHBondContact O-N 3.48Å; V133-T136 VanDerWaalsContact O-N 3.12Å; V133-V137 HydrophobicContact CG1-CG2 4.33Å; V133-V137 WeakPolarHBondContact O-CG2 3.11Å; V133-V137 PolarHBondContact O-N 2.98Å
134	F	56.6	Low	50.2	Low	31 Å²	31	84.9 Å²	84.9	14%	0.136	45%	0.453	C	S	.	.	H	α-helix	trans	-58.3	-42.8	174.3	-83.5	-65.1	0	0	0	112.4	V107 L112 L130 T136 V137 A138 V480 M497	V107-F134 HydrophobicContact CG1-CD1 4.17Å; V107-F134 HydrophobicContact CG1-CE1 4.17Å; L112-F134 HydrophobicContact CD1-CB 4.24Å; L130-F134 HydrophobicContact CD2-CD2 3.94Å; L130-F134 HydrophobicContact CD2-CE2 3.49Å; L130-F134 VanDerWaalsContact CD2-CE2 3.49Å; L130-F134 HydrophobicContact CG-CE2 4.19Å; L130-F134 WeakPolarHBondContact O-CD2 2.98Å; L130-F134 PolarHBondContact O-N 2.98Å; F134-T136 VanDerWaalsContact C-N 3.31Å; F134-T136 PolarHBondContact O-N 3.45Å; F134-V137 PolarHBondContact O-N 3.27Å; F134-A138 VanDerWaalsContact O-CB 3.27Å; F134-A138 WeakPolarHBondContact O-CB 3.35Å; F134-A138 PolarHBondContact O-N 3.34Å; F134-V480 HydrophobicContact CD2-CG2 4.48Å; F134-V480 HydrophobicContact CE1-CG2 4.32Å; F134-V480 HydrophobicContact CE2-CG2 4.15Å; F134-V480 HydrophobicContact CZ-CG2 4.09Å; F134-M497 HydrophobicContact CE1-CE 3.53Å; F134-M497 HydrophobicContact CE1-SD 3.61Å; F134-M497 HydrophobicContact CZ-CE 3.94Å; F134-M497 HydrophobicContact CZ-SD 3.35Å; F134-M497 WeakPolarHBondContact CZ-SD 3.41Å
135	G	55.5	Low	51.1	Low	25 Å²	25	83.9 Å²	83.9	26%	0.258	44%	0.441	S	S	.	.	H	α-helix	trans	-60.8	-38.9	175.2	0	0	0	0	0	113.1	R131 Q132 V133 R139	R131-G135 PolarHBondContact O-N 3.18Å; Q132-G135 CarbonylContact O-C 3.59Å; Q132-G135 PolarHBondContact O-N 2.83Å; V133-G135 VanDerWaalsContact C-N 3.29Å; V133-G135 PolarHBondContact O-N 3.44Å; G135-R139 WeakPolarHBondContact O-CB 3.49Å; G135-R139 WeakPolarHBondContact O-CD 3.27Å; G135-R139 WeakPolarHBondContact O-CG 3.05Å; G135-R139 PolarHBondContact O-N 3.17Å
136	T	56.4	Low	52	Low	98 Å²	98	80.8 Å²	80.8	60%	0.601	43%	0.43	S	S	*	.	H	α-helix	trans	-72.1	-45.3	178.3	-61.5	0	0	0	0	111.8	Q132 V133 F134 R139 S140	Q132-T136 PolarHBondContact O-N 3.13Å; Q132-T136 PolarHBondContact O-OG1 2.77Å; Q132-T136 VanDerWaalsContact O-OG1 3.06Å; V133-T136 PolarHBondContact O-N 3.48Å; V133-T136 VanDerWaalsContact O-N 3.12Å; F134-T136 VanDerWaalsContact C-N 3.31Å; F134-T136 PolarHBondContact O-N 3.45Å; T136-R139 PolarHBondContact O-N 3.1Å; T136-S140 PolarHBondContact O-N 3.24Å; T136-S140 VanDerWaalsContact O-N 3.12Å
137	V	56.1	Low	52.6	Low	40 Å²	40	77.5 Å²	77.5	24%	0.242	41%	0.405	C	S	.	.	H	α-helix	trans	-61.5	-49.6	178.4	172.4	0	0	0	0	110.5	V107 M108 V133 F134 R139 S140 L143	V107-V137 HydrophobicContact CG1-CG1 4.35Å; M108-V137 HydrophobicContact SD-CG1 3.87Å; V133-V137 HydrophobicContact CG1-CG2 4.33Å; V133-V137 WeakPolarHBondContact O-CG2 3.11Å; V133-V137 PolarHBondContact O-N 2.98Å; F134-V137 PolarHBondContact O-N 3.27Å; V137-R139 PolarHBondContact O-N 3.34Å; V137-R139 VanDerWaalsContact O-N 3.17Å; V137-S140 PolarHBondContact O-N 3.09Å; V137-S140 VanDerWaalsContact O-N 3.09Å; V137-S140 PolarHBondContact O-OG 3.12Å; V137-L143 HydrophobicContact CG1-CD1 4.26Å
138	A	56.8	Low	53	Low	30 Å²	30	79.4 Å²	79.4	25%	0.248	41%	0.407	C	S	.	.	H	α-helix	trans	-62.5	-23.5	179.2	0	0	0	0	0	113.7	S110 F134	S110-A138 WeakPolarHBondContact O-CB 3.41Å; F134-A138 VanDerWaalsContact O-CB 3.27Å; F134-A138 WeakPolarHBondContact O-CB 3.35Å; F134-A138 PolarHBondContact O-N 3.34Å
139	R	57.9	Low	53.1	Low	220 Å²	220	80.4 Å²	80.4	83%	0.83	40%	0.4	S	S	*	.	H	α-helix	trans	-95.6	-5.4	178.1	-69.3	176.7	-176.3	-173.3	2.2	113.7	G135 T136 V137 Q141	G135-R139 WeakPolarHBondContact O-CB 3.49Å; G135-R139 WeakPolarHBondContact O-CD 3.27Å; G135-R139 WeakPolarHBondContact O-CG 3.05Å; G135-R139 PolarHBondContact O-N 3.17Å; T136-R139 PolarHBondContact O-N 3.1Å; V137-R139 PolarHBondContact O-N 3.34Å; V137-R139 VanDerWaalsContact O-N 3.17Å; R139-Q141 PolarHBondContact O-N 3.23Å; R139-Q141 VanDerWaalsContact O-N 3.1Å
140	S	56.2	Low	53	Low	23 Å²	23	78.3 Å²	78.3	16%	0.161	39%	0.392	C	S	.	.			trans	-79.9	96.2	-174.3	69.1	0	0	0	0	112.1	T136 V137 P142 L143	T136-S140 PolarHBondContact O-N 3.24Å; T136-S140 VanDerWaalsContact O-N 3.12Å; V137-S140 PolarHBondContact O-N 3.09Å; V137-S140 VanDerWaalsContact O-N 3.09Å; V137-S140 PolarHBondContact O-OG 3.12Å; S140-P142 VanDerWaalsContact C-N 3.34Å; S140-L143 PolarHBondContact O-N 3.35Å; S140-L143 WeakPolarHBondContact OG-CB 3.2Å; S140-L143 WeakPolarHBondContact OG-CD1 3.3Å; S140-L143 VanDerWaalsContact OG-CG 3.3Å; S140-L143 WeakPolarHBondContact OG-CG 3.41Å
141	Q	54.4	Low	53.1	Low	156 Å²	156	80.7 Å²	80.7	73%	0.729	41%	0.406	S	S	*	.	H	α-helix	trans	-57.2	-35.7	176	-165.1	175.4	-8.6	0	0	114.3	R139 L143 F144 V145	R139-Q141 PolarHBondContact O-N 3.23Å; R139-Q141 VanDerWaalsContact O-N 3.1Å; Q141-L143 PolarHBondContact O-N 3.26Å; Q141-F144 WeakPolarHBondContact O-CB 3.48Å; Q141-F144 PolarHBondContact O-N 3.36Å; Q141-V145 PolarHBondContact O-N 2.63Å
142	P	52.5	Low	53.2	Low	96 Å²	96	79.2 Å²	79.2	62%	0.623	41%	0.409	S	S	*	.	H	α-helix	trans	-64.4	-35.3	178.1	-24.1	35.3	0	0	0	114.5	S140 F144 V145 L146	S140-P142 VanDerWaalsContact C-N 3.34Å; P142-F144 PolarHBondContact O-N 2.82Å; P142-V145 PolarHBondContact O-N 3.46Å; P142-L146 PolarHBondContact O-N 3.34Å
143	L	51.7	Low	53.1	Low	34 Å²	34	80.4 Å²	80.4	18%	0.178	43%	0.427	C	S	.	.	H	α-helix	trans	-64.2	-30.5	176.5	-74.3	-174.3	0	0	0	111.8	Q43 M108 V137 S140 Q141	Q43-L143 VanDerWaalsContact NE2-CD2 3.33Å; M108-L143 HydrophobicContact CE-CB 3.74Å; M108-L143 HydrophobicContact SD-CB 4.48Å; M108-L143 HydrophobicContact SD-CD1 4.49Å; V137-L143 HydrophobicContact CG1-CD1 4.26Å; S140-L143 PolarHBondContact O-N 3.35Å; S140-L143 WeakPolarHBondContact OG-CB 3.2Å; S140-L143 WeakPolarHBondContact OG-CD1 3.3Å; S140-L143 VanDerWaalsContact OG-CG 3.3Å; S140-L143 WeakPolarHBondContact OG-CG 3.41Å; Q141-L143 PolarHBondContact O-N 3.26Å
144	F	52.5	Low	53	Low	31 Å²	31	83 Å²	83	14%	0.136	44%	0.439	C	S	.	.	H	α-helix	trans	-72.5	-37.9	179.1	-167.9	-92.9	0	0	0	112.6	M108 Q141 P142 Y149 H158	M108-F144 HydrophobicContact CE-CB 4.41Å; Q141-F144 WeakPolarHBondContact O-CB 3.48Å; Q141-F144 PolarHBondContact O-N 3.36Å; P142-F144 PolarHBondContact O-N 2.82Å; F144-Y149 HydrophobicContact CE2-CD2 4.38Å; F144-H158 HydrophobicContact CE1-CB 4.31Å; F144-H158 HydrophobicContact CE2-CB 4.23Å; F144-H158 HydrophobicContact CZ-CB 4.02Å
145	V	49.9	Very low	52.9	Low	98 Å²	98	92.4 Å²	92.4	59%	0.594	47%	0.473	S	S	*	.	H	α-helix	trans	-74.5	-30.5	-178.5	177.4	0	0	0	0	111.9	Q141 P142 D147	Q141-V145 PolarHBondContact O-N 2.63Å; P142-V145 PolarHBondContact O-N 3.46Å; V145-D147 VanDerWaalsContact C-N 3.3Å; V145-D147 PolarHBondContact O-N 3.39Å
146	L	53.1	Low	52.7	Low	109 Å²	109	92.1 Å²	92.1	57%	0.571	47%	0.467	S	S	*	.	H	α-helix	trans	-67.6	-30.7	-179.4	-141.7	86.8	0	0	0	113	F41 P142 R148	F41-L146 HydrophobicContact CE1-CD2 4.2Å; P142-L146 PolarHBondContact O-N 3.34Å; L146-R148 VanDerWaalsContact C-N 3.28Å; L146-R148 PolarHBondContact O-N 3.43Å
147	D	49.4	Very low	52.5	Low	54 Å²	54	90.2 Å²	90.2	29%	0.289	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	5.9	-170.2	-112.4	22.5	0	0	0	114.6	Q104 V145 Y149	Q104-D147 PolarHBondContact NE2-OD1 2.79Å; Q104-D147 VanDerWaalsContact NE2-OD1 3.13Å; Q104-D147 PolarHBondContact NE2-OD2 2.73Å; V145-D147 VanDerWaalsContact C-N 3.3Å; V145-D147 PolarHBondContact O-N 3.39Å; D147-Y149 HydrophobicContact CB-CD2 3.59Å; D147-Y149 HydrophobicContact CB-CE2 3.28Å; D147-Y149 PolarHBondContact O-N 2.93Å; D147-Y149 WeakPolarHBondContact OD2-CE2 3.31Å; D147-Y149 VanDerWaalsContact OD2-CZ 3.28Å; D147-Y149 PolarHBondContact OD2-OH 3.25Å
148	R	50.6	Low	52.1	Low	181 Å²	181	92.7 Å²	92.7	68%	0.683	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	27.8	177.9	-62.2	-172.3	-177.9	-163.5	6.2	115.7	L146 D150 D151	L146-R148 VanDerWaalsContact C-N 3.28Å; L146-R148 PolarHBondContact O-N 3.43Å; R148-D150 PolarHBondContact O-N 2.98Å; R148-D151 VanDerWaalsContact CD-OD2 3.31Å; R148-D151 WeakPolarHBondContact CD-OD2 3.04Å; R148-D151 IonicContact NH1-OD2 2.82Å; R148-D151 PolarHBondContact O-N 3.36Å
149	Y	49.7	Very low	51.8	Low	90 Å²	90	95.2 Å²	95.2	35%	0.353	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.2	170.8	-65.8	-68.2	0	0	0	112.8	F144 D147	F144-Y149 HydrophobicContact CE2-CD2 4.38Å; D147-Y149 HydrophobicContact CB-CD2 3.59Å; D147-Y149 HydrophobicContact CB-CE2 3.28Å; D147-Y149 PolarHBondContact O-N 2.93Å; D147-Y149 WeakPolarHBondContact OD2-CE2 3.31Å; D147-Y149 VanDerWaalsContact OD2-CZ 3.28Å; D147-Y149 PolarHBondContact OD2-OH 3.25Å
150	D	47.5	Very low	51.5	Low	47 Å²	47	85.4 Å²	85.4	25%	0.251	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	14.4	-174	-74.4	-38.8	0	0	0	115.3	R148 G152 S156	R148-D150 PolarHBondContact O-N 2.98Å; D150-G152 PolarHBondContact O-N 2.94Å; D150-S156 PolarHBondContact OD1-N 3.09Å; D150-S156 VanDerWaalsContact OD1-N 3.15Å; D150-S156 PolarHBondContact OD1-OG 3.22Å
151	D	50.6	Low	51.3	Low	115 Å²	115	85.9 Å²	85.9	62%	0.615	43%	0.434	S	S	*	.			trans	-68	20	-179.1	-87.8	3.6	0	0	0	114.5	R148	R148-D151 VanDerWaalsContact CD-OD2 3.31Å; R148-D151 WeakPolarHBondContact CD-OD2 3.04Å; R148-D151 IonicContact NH1-OD2 2.82Å; R148-D151 PolarHBondContact O-N 3.36Å
152	G	53.7	Low	51.3	Low	30 Å²	30	83.9 Å²	83.9	31%	0.309	43%	0.425	S	S	.	.	S	Bend	trans	-94.6	162.7	173.5	0	0	0	0	0	113.5	D150 L154	D150-G152 PolarHBondContact O-N 2.94Å; G152-L154 PolarHBondContact O-N 3.05Å; G152-L154 VanDerWaalsContact O-N 3.08Å
153	P	50.2	Low	51.4	Low	139 Å²	139	81 Å²	81	90%	0.903	41%	0.413	S	S	*	.	S	Bend	trans	-64.1	-13	177	26.7	-34.9	0	0	0	113.9
154	L	52.4	Low	51.6	Low	97 Å²	97	89 Å²	89	51%	0.508	44%	0.44	S	S	.	.	S	Bend	trans	-118.9	122.4	174.8	-73.7	159	0	0	0	108.2	G152 S156 I168	G152-L154 PolarHBondContact O-N 3.05Å; G152-L154 VanDerWaalsContact O-N 3.08Å; L154-S156 PolarHBondContact O-N 2.94Å; L154-I168 HydrophobicContact CD1-CG1 4.13Å
155	R	54.1	Low	51.9	Low	228 Å²	228	95.3 Å²	95.3	86%	0.86	47%	0.471	S	S	*	.			trans	-65.9	112.1	174.3	-74	-176.2	169.6	179.5	-3.6	109.2
156	S	51.6	Low	52.5	Low	18 Å²	18	93 Å²	93	13%	0.126	46%	0.462	C	S	.	.			trans	-81.4	131.7	179.7	73.7	0	0	0	0	109.1	D150 L154	D150-S156 PolarHBondContact OD1-N 3.09Å; D150-S156 VanDerWaalsContact OD1-N 3.15Å; D150-S156 PolarHBondContact OD1-OG 3.22Å; L154-S156 PolarHBondContact O-N 2.94Å
157	T	51.5	Low	52.9	Low	59 Å²	59	88.5 Å²	88.5	36%	0.362	44%	0.439	S	S	.	.			trans	-72.3	154.7	171.1	56.2	0	0	0	0	109.4	W159 Q160	T157-W159 PolarHBondContact O-N 3.47Å; T157-Q160 WeakPolarHBondContact O-CB 3.25Å; T157-Q160 PolarHBondContact O-N 3.01Å; T157-Q160 VanDerWaalsContact OG1-CD 3.31Å; T157-Q160 PolarHBondContact OG1-OE1 3.23Å
158	H	47	Very low	53.7	Low	92 Å²	92	89.9 Å²	89.9	43%	0.426	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-16.2	-175.5	69.9	-79.8	0	0	0	116.8	L109 F144	L109-H158 VanDerWaalsContact CD2-O 3.24Å; L109-H158 WeakPolarHBondContact CD2-O 3.2Å; F144-H158 HydrophobicContact CE1-CB 4.31Å; F144-H158 HydrophobicContact CE2-CB 4.23Å; F144-H158 HydrophobicContact CZ-CB 4.02Å
159	W	50.2	Low	54.5	Low	83 Å²	83	85.2 Å²	85.2	31%	0.314	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-8.2	176.6	-53.9	107.5	0	0	0	115.6	T157 H236	T157-W159 PolarHBondContact O-N 3.47Å; W159-H236 AromaticContact CH2-ND1 3.8Å
160	Q	53	Low	55.4	Low	13 Å²	13	84.3 Å²	84.3	6%	0.061	44%	0.441	C	S	.	.			trans	-100.2	2	-165.2	-74.2	170.2	-27.3	0	0	115.3	T157 E162 V170 E171	T157-Q160 WeakPolarHBondContact O-CB 3.25Å; T157-Q160 PolarHBondContact O-N 3.01Å; T157-Q160 VanDerWaalsContact OG1-CD 3.31Å; T157-Q160 PolarHBondContact OG1-OE1 3.23Å; Q160-E162 VanDerWaalsContact C-N 3.29Å; Q160-E162 PolarHBondContact O-N 3.34Å; Q160-V170 HydrophobicContact CG-CB 4.35Å; Q160-V170 HydrophobicContact CG-CG1 3.93Å; Q160-E171 PolarHBondContact NE2-OE2 3.37Å
161	S	51.8	Low	56.6	Low	33 Å²	33	84 Å²	84	23%	0.231	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	14.6	-163.6	67	0	0	0	0	117.7	R105 G163	R105-S161 PolarHBondContact NH2-O 2.93Å; R105-S161 VanDerWaalsContact NH2-O 3.16Å; R105-S161 PolarHBondContact NH2-OG 3.25Å; S161-G163 VanDerWaalsContact C-N 3.3Å; S161-G163 PolarHBondContact O-N 3.06Å
162	E	53.6	Low	57.8	Low	115 Å²	115	83.5 Å²	83.5	54%	0.537	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-2.7	-179.4	-64.9	-104.6	103.2	0	0	113.5	R105 Q160 Q472	R105-E162 IonicContact CZ-OE1 3.25Å; R105-E162 IonicContact NH1-OE1 2.63Å; R105-E162 PolarHBondContact NH1-OE1 3.03Å; R105-E162 IonicContact NH2-OE1 2.95Å; R105-E162 PolarHBondContact NH2-OE1 3.2Å; Q160-E162 VanDerWaalsContact C-N 3.29Å; Q160-E162 PolarHBondContact O-N 3.34Å; E162-Q472 PolarHBondContact OE2-NE2 3.37Å
163	G	55.9	Low	58.7	Low	35 Å²	35	87.8 Å²	87.8	36%	0.361	45%	0.45	S	S	.	.			trans	154.1	156.4	174.3	0	0	0	0	0	113.6	S161 E165 A166 S167	S161-G163 VanDerWaalsContact C-N 3.3Å; S161-G163 PolarHBondContact O-N 3.06Å; G163-E165 PolarHBondContact O-N 3.44Å; G163-A166 PolarHBondContact O-N 2.68Å; G163-S167 WeakPolarHBondContact O-CB 3.47Å; G163-S167 PolarHBondContact O-N 3.19Å
164	R	56.1	Low	59.9	Low	201 Å²	201	85.7 Å²	85.7	76%	0.758	43%	0.427	S	S	*	.	H	α-helix	trans	-59.9	-43	-178.4	-72.8	-179.2	175.7	170.3	-1.5	112.6	S167 I168	R164-S167 PolarHBondContact O-N 3.19Å; R164-I168 VanDerWaalsContact O-CG1 3.31Å; R164-I168 WeakPolarHBondContact O-CG1 3.09Å; R164-I168 PolarHBondContact O-N 2.82Å; R164-I168 VanDerWaalsContact O-N 3.11Å
165	E	58.5	Low	61.2	Low	165 Å²	165	87.1 Å²	87.1	77%	0.771	43%	0.431	S	S	*	.	H	α-helix	trans	-68.8	-43.9	-178.3	-61.6	-171.7	173.7	0	0	112.2	G163 S167 I168 V169	G163-E165 PolarHBondContact O-N 3.44Å; E165-S167 VanDerWaalsContact C-N 3.31Å; E165-S167 PolarHBondContact O-N 2.96Å; E165-I168 PolarHBondContact O-N 3.39Å; E165-V169 WeakPolarHBondContact O-CG2 3.19Å; E165-V169 PolarHBondContact O-N 3Å; E165-V169 VanDerWaalsContact O-N 3.09Å
166	A	60.9	Low	62.2	Low	49 Å²	49	79 Å²	79	41%	0.405	41%	0.413	S	S	.	.	H	α-helix	trans	-62.4	-38.8	174.7	0	0	0	0	0	111.6	G163 I168 V169 V170	G163-A166 PolarHBondContact O-N 2.68Å; A166-I168 PolarHBondContact O-N 2.7Å; A166-V169 PolarHBondContact O-N 3.24Å; A166-V170 WeakPolarHBondContact O-CB 3.25Å; A166-V170 WeakPolarHBondContact O-CG2 3.34Å; A166-V170 PolarHBondContact O-N 3.14Å
167	S	61.6	Low	63.5	Low	15 Å²	15	81.1 Å²	81.1	11%	0.105	43%	0.427	C	S	.	.	H	α-helix	trans	-64.7	-39.1	177.3	-168.1	0	0	0	0	112.6	G163 R164 E165 E171	G163-S167 WeakPolarHBondContact O-CB 3.47Å; G163-S167 PolarHBondContact O-N 3.19Å; R164-S167 PolarHBondContact O-N 3.19Å; E165-S167 VanDerWaalsContact C-N 3.31Å; E165-S167 PolarHBondContact O-N 2.96Å; S167-E171 PolarHBondContact O-N 3.27Å
168	I	67.5	Low	64.7	Low	82 Å²	82	82.6 Å²	82.6	42%	0.421	44%	0.436	S	S	.	.	H	α-helix	trans	-64.9	-46.9	175.8	-66.8	162.8	0	0	0	110.3	L154 R164 E165 A166 V170 E171 L172	L154-I168 HydrophobicContact CD1-CG1 4.13Å; R164-I168 VanDerWaalsContact O-CG1 3.31Å; R164-I168 WeakPolarHBondContact O-CG1 3.09Å; R164-I168 PolarHBondContact O-N 2.82Å; R164-I168 VanDerWaalsContact O-N 3.11Å; E165-I168 PolarHBondContact O-N 3.39Å; A166-I168 PolarHBondContact O-N 2.7Å; I168-V170 VanDerWaalsContact C-N 3.33Å; I168-V170 PolarHBondContact O-N 3.04Å; I168-E171 PolarHBondContact O-N 3.22Å; I168-L172 HydrophobicContact CG2-CD1 4Å; I168-L172 HydrophobicContact CG2-CG 4.48Å; I168-L172 WeakPolarHBondContact O-CG 3.45Å; I168-L172 PolarHBondContact O-N 3.09Å
169	V	67.8	Low	66.2	Low	83 Å²	83	81.9 Å²	81.9	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-61.2	-42.4	178.7	174.2	0	0	0	0	111.2	E165 A166 L172 L173	E165-V169 WeakPolarHBondContact O-CG2 3.19Å; E165-V169 PolarHBondContact O-N 3Å; E165-V169 VanDerWaalsContact O-N 3.09Å; A166-V169 PolarHBondContact O-N 3.24Å; V169-L172 PolarHBondContact O-N 3.31Å; V169-L173 HydrophobicContact CG1-CD1 4.1Å; V169-L173 WeakPolarHBondContact O-CB 3.29Å; V169-L173 PolarHBondContact O-N 2.83Å
170	V	68.5	Low	67.5	Low	72 Å²	72	83 Å²	83	44%	0.436	45%	0.452	S	S	.	.	H	α-helix	trans	-66	-40.1	178.4	174.3	0	0	0	0	111.6	Q160 A166 I168 L173 K174	Q160-V170 HydrophobicContact CG-CB 4.35Å; Q160-V170 HydrophobicContact CG-CG1 3.93Å; A166-V170 WeakPolarHBondContact O-CB 3.25Å; A166-V170 WeakPolarHBondContact O-CG2 3.34Å; A166-V170 PolarHBondContact O-N 3.14Å; I168-V170 VanDerWaalsContact C-N 3.33Å; I168-V170 PolarHBondContact O-N 3.04Å; V170-L173 PolarHBondContact O-N 3.46Å; V170-K174 WeakPolarHBondContact O-CB 3.31Å; V170-K174 PolarHBondContact O-N 2.78Å
171	E	71.6	Confident	68.5	Low	39 Å²	39	84.4 Å²	84.4	18%	0.182	47%	0.469	C	S	.	.	H	α-helix	trans	-69.4	-37.6	178.3	-161.9	61.2	-151.9	0	0	111.8	Q160 S167 I168 K174 Q175	Q160-E171 PolarHBondContact NE2-OE2 3.37Å; S167-E171 PolarHBondContact O-N 3.27Å; I168-E171 PolarHBondContact O-N 3.22Å; E171-K174 WeakPolarHBondContact O-CB 3.42Å; E171-K174 PolarHBondContact O-N 3.44Å; E171-K174 IonicContact OE1-NZ 2.77Å; E171-K174 PolarHBondContact OE1-NZ 3.16Å; E171-K174 IonicContact OE2-NZ 3.86Å; E171-K174 PolarHBondContact OE2-NZ 3.05Å; E171-Q175 WeakPolarHBondContact O-CG 3.44Å; E171-Q175 PolarHBondContact O-N 3.15Å
172	L	75.8	Confident	69.8	Low	105 Å²	105	88.3 Å²	88.3	55%	0.55	49%	0.487	S	S	.	.	H	α-helix	trans	-62.7	-43.5	171.2	-71.6	172.2	0	0	0	111.7	I168 V169 K174 Q175 A176	I168-L172 HydrophobicContact CG2-CD1 4Å; I168-L172 HydrophobicContact CG2-CG 4.48Å; I168-L172 WeakPolarHBondContact O-CG 3.45Å; I168-L172 PolarHBondContact O-N 3.09Å; V169-L172 PolarHBondContact O-N 3.31Å; L172-K174 VanDerWaalsContact C-N 3.3Å; L172-K174 PolarHBondContact O-N 3.19Å; L172-Q175 PolarHBondContact O-N 2.94Å; L172-A176 WeakPolarHBondContact O-CB 3.22Å; L172-A176 PolarHBondContact O-N 2.71Å
173	L	72.8	Confident	71	Confident	120 Å²	120	87.9 Å²	87.9	63%	0.628	49%	0.488	S	S	*	.	H	α-helix	trans	-61.4	-40.7	175.1	-120.1	114.3	0	0	0	111.5	V169 V170 A176 S177	V169-L173 HydrophobicContact CG1-CD1 4.1Å; V169-L173 WeakPolarHBondContact O-CB 3.29Å; V169-L173 PolarHBondContact O-N 2.83Å; V170-L173 PolarHBondContact O-N 3.46Å; L173-A176 PolarHBondContact O-N 2.69Å; L173-S177 VanDerWaalsContact O-CB 3.23Å; L173-S177 WeakPolarHBondContact O-CB 3.48Å; L173-S177 PolarHBondContact O-N 3.15Å
174	K	76.2	Confident	72	Confident	95 Å²	95	90 Å²	90	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-64	-46.6	177.1	179.3	-179.7	160	-147.2	0	111.1	V170 E171 L172 A176 S177	V170-K174 WeakPolarHBondContact O-CB 3.31Å; V170-K174 PolarHBondContact O-N 2.78Å; E171-K174 WeakPolarHBondContact O-CB 3.42Å; E171-K174 PolarHBondContact O-N 3.44Å; E171-K174 IonicContact OE1-NZ 2.77Å; E171-K174 PolarHBondContact OE1-NZ 3.16Å; E171-K174 IonicContact OE2-NZ 3.86Å; E171-K174 PolarHBondContact OE2-NZ 3.05Å; L172-K174 VanDerWaalsContact C-N 3.3Å; L172-K174 PolarHBondContact O-N 3.19Å; K174-A176 VanDerWaalsContact C-N 3.31Å; K174-A176 PolarHBondContact O-N 3.27Å; K174-S177 PolarHBondContact O-N 2.91Å; K174-S177 PolarHBondContact O-OG 2.8Å
175	Q	79.2	Confident	73.2	Confident	127 Å²	127	82.2 Å²	82.2	59%	0.593	47%	0.473	S	S	*	.	H	α-helix	trans	-61.3	-38.9	175.3	-73	-180	0.7	0	0	112.3	E171 L172 P179	E171-Q175 WeakPolarHBondContact O-CG 3.44Å; E171-Q175 PolarHBondContact O-N 3.15Å; L172-Q175 PolarHBondContact O-N 2.94Å; Q175-P179 WeakPolarHBondContact O-CD 3.46Å
176	A	76.3	Confident	74.2	Confident	59 Å²	59	83.6 Å²	83.6	49%	0.488	47%	0.471	S	S	.	.	H	α-helix	trans	-73.5	-29.4	175.6	0	0	0	0	0	113.3	L172 L173 K174 V178 P179 L180	L172-A176 WeakPolarHBondContact O-CB 3.22Å; L172-A176 PolarHBondContact O-N 2.71Å; L173-A176 PolarHBondContact O-N 2.69Å; K174-A176 VanDerWaalsContact C-N 3.31Å; K174-A176 PolarHBondContact O-N 3.27Å; A176-V178 PolarHBondContact O-N 2.92Å; A176-P179 VanDerWaalsContact O-CD 3.28Å; A176-P179 WeakPolarHBondContact O-CD 3.3Å; A176-P179 WeakPolarHBondContact O-CG 3.21Å; A176-L180 VanDerWaalsContact O-CB 3.29Å; A176-L180 WeakPolarHBondContact O-CB 3.5Å; A176-L180 PolarHBondContact O-N 3.19Å
177	S	77.1	Confident	75.1	Confident	61 Å²	61	87.4 Å²	87.4	43%	0.427	48%	0.482	S	S	.	.	H	α-helix	trans	-68.6	-31	-176.1	72	0	0	0	0	113.6	L173 K174 G181	L173-S177 VanDerWaalsContact O-CB 3.23Å; L173-S177 WeakPolarHBondContact O-CB 3.48Å; L173-S177 PolarHBondContact O-N 3.15Å; K174-S177 PolarHBondContact O-N 2.91Å; K174-S177 PolarHBondContact O-OG 2.8Å; S177-G181 WeakPolarHBondContact O-CA 3.46Å; S177-G181 PolarHBondContact O-N 2.8Å
178	V	77	Confident	76	Confident	91 Å²	91	88 Å²	88	55%	0.552	48%	0.484	S	S	*	.	H	α-helix	trans	-66.3	-54.6	-179.7	178.6	0	0	0	0	112.3	A176 L180 G181 L182	A176-V178 PolarHBondContact O-N 2.92Å; V178-L180 VanDerWaalsContact C-N 3.34Å; V178-L180 PolarHBondContact O-N 3.41Å; V178-G181 PolarHBondContact O-N 3.41Å; V178-L182 HydrophobicContact CG1-CD1 4.34Å; V178-L182 PolarHBondContact O-N 3.26Å
179	P	79.1	Confident	76.7	Confident	77 Å²	77	87.3 Å²	87.3	50%	0.5	49%	0.486	S	S	.	.	H	α-helix	trans	-66.5	-36.2	176.7	25.7	-33.5	0	0	0	112.1	Q175 A176 L182 L183	Q175-P179 WeakPolarHBondContact O-CD 3.46Å; A176-P179 VanDerWaalsContact O-CD 3.28Å; A176-P179 WeakPolarHBondContact O-CD 3.3Å; A176-P179 WeakPolarHBondContact O-CG 3.21Å; P179-L182 PolarHBondContact O-N 3Å; P179-L183 PolarHBondContact O-N 3.24Å
180	L	76.8	Confident	77.4	Confident	107 Å²	107	87.3 Å²	87.3	56%	0.56	49%	0.486	S	S	*	.	H	α-helix	trans	-63.7	-43.2	176.1	-163.3	81.8	0	0	0	111.2	A176 V178 L183 L184	A176-L180 VanDerWaalsContact O-CB 3.29Å; A176-L180 WeakPolarHBondContact O-CB 3.5Å; A176-L180 PolarHBondContact O-N 3.19Å; V178-L180 VanDerWaalsContact C-N 3.34Å; V178-L180 PolarHBondContact O-N 3.41Å; L180-L183 PolarHBondContact O-N 3.14Å; L180-L184 HydrophobicContact CD2-CD1 4.26Å; L180-L184 HydrophobicContact CG-CD1 3.86Å; L180-L184 WeakPolarHBondContact O-CB 3.24Å; L180-L184 WeakPolarHBondContact O-CD1 3.33Å; L180-L184 PolarHBondContact O-N 2.95Å
181	G	74.6	Confident	78	Confident	42 Å²	42	88.7 Å²	88.7	43%	0.433	48%	0.483	S	S	.	.	H	α-helix	trans	-64	-39	176.3	0	0	0	0	0	112.8	S177 V178 G185	S177-G181 WeakPolarHBondContact O-CA 3.46Å; S177-G181 PolarHBondContact O-N 2.8Å; V178-G181 PolarHBondContact O-N 3.41Å; G181-G185 PolarHBondContact O-N 2.93Å
182	L	78.4	Confident	78.4	Confident	115 Å²	115	88.6 Å²	88.6	60%	0.602	49%	0.485	S	S	*	.	H	α-helix	trans	-64.1	-43.2	173.4	-79.6	161	0	0	0	112.2	V178 P179 G185 R186	V178-L182 HydrophobicContact CG1-CD1 4.34Å; V178-L182 PolarHBondContact O-N 3.26Å; P179-L182 PolarHBondContact O-N 3Å; L182-G185 PolarHBondContact O-N 3.47Å; L182-R186 WeakPolarHBondContact O-CG 3.35Å; L182-R186 PolarHBondContact O-N 3.39Å
183	L	79.8	Confident	78.6	Confident	106 Å²	106	92.6 Å²	92.6	56%	0.555	49%	0.493	S	S	*	.	H	α-helix	trans	-63.5	-51.2	176.2	-173.2	103.5	0	0	0	110.9	P179 L180 G185 R186 M187	P179-L183 PolarHBondContact O-N 3.24Å; L180-L183 PolarHBondContact O-N 3.14Å; L183-G185 VanDerWaalsContact C-N 3.29Å; L183-G185 PolarHBondContact O-N 3.43Å; L183-R186 PolarHBondContact O-N 2.96Å; L183-R186 VanDerWaalsContact O-N 3.16Å; L183-M187 WeakPolarHBondContact O-CG 3.28Å; L183-M187 PolarHBondContact O-N 3.02Å
184	L	77.3	Confident	78.8	Confident	80 Å²	80	90.6 Å²	90.6	42%	0.419	48%	0.482	S	S	.	.	H	α-helix	trans	-58.3	-41.9	176.4	-98.5	115.5	0	0	0	111.4	L180 R186 M187 L188	L180-L184 HydrophobicContact CD2-CD1 4.26Å; L180-L184 HydrophobicContact CG-CD1 3.86Å; L180-L184 WeakPolarHBondContact O-CB 3.24Å; L180-L184 WeakPolarHBondContact O-CD1 3.33Å; L180-L184 PolarHBondContact O-N 2.95Å; L184-R186 VanDerWaalsContact C-N 3.35Å; L184-R186 PolarHBondContact O-N 2.99Å; L184-M187 PolarHBondContact O-N 3.18Å; L184-L188 WeakPolarHBondContact O-CB 3.47Å; L184-L188 PolarHBondContact O-N 3.42Å
185	G	80.4	Confident	78.6	Confident	37 Å²	37	89 Å²	89	38%	0.381	48%	0.483	S	S	.	.	H	α-helix	trans	-60.2	-41.4	176.2	0	0	0	0	0	112.9	G181 L182 L183 L188 S189	G181-G185 PolarHBondContact O-N 2.93Å; L182-G185 PolarHBondContact O-N 3.47Å; L183-G185 VanDerWaalsContact C-N 3.29Å; L183-G185 PolarHBondContact O-N 3.43Å; G185-L188 PolarHBondContact O-N 2.87Å; G185-S189 PolarHBondContact O-N 3.18Å
186	R	80.3	Confident	78.1	Confident	193 Å²	193	87 Å²	87	73%	0.728	48%	0.482	S	S	*	.	H	α-helix	trans	-67	-40.7	173.9	-74.5	-176.2	176.3	-178.6	0	112.6	L182 L183 L184 L188 S189 V190	L182-R186 WeakPolarHBondContact O-CG 3.35Å; L182-R186 PolarHBondContact O-N 3.39Å; L183-R186 PolarHBondContact O-N 2.96Å; L183-R186 VanDerWaalsContact O-N 3.16Å; L184-R186 VanDerWaalsContact C-N 3.35Å; L184-R186 PolarHBondContact O-N 2.99Å; R186-L188 VanDerWaalsContact C-N 3.3Å; R186-L188 PolarHBondContact O-N 2.84Å; R186-S189 PolarHBondContact O-N 3.08Å; R186-S189 PolarHBondContact O-OG 3.25Å; R186-V190 WeakPolarHBondContact O-CG2 3.49Å; R186-V190 PolarHBondContact O-N 3.49Å; R186-V190 VanDerWaalsContact O-N 3.13Å
187	M	78.9	Confident	78	Confident	130 Å²	130	86 Å²	86	64%	0.64	47%	0.474	S	S	*	.	H	α-helix	trans	-64.4	-39.7	175	-65.8	-163.8	86.4	0	0	111.2	L183 L184 V190 W191	L183-M187 WeakPolarHBondContact O-CG 3.28Å; L183-M187 PolarHBondContact O-N 3.02Å; L184-M187 PolarHBondContact O-N 3.18Å; M187-V190 PolarHBondContact O-N 3.43Å; M187-W191 VanDerWaalsContact O-CB 3.32Å; M187-W191 WeakPolarHBondContact O-CB 3.39Å; M187-W191 PolarHBondContact O-N 3.12Å
188	L	81.5	Confident	77.4	Confident	28 Å²	28	93.4 Å²	93.4	15%	0.147	49%	0.493	C	S	.	.	H	α-helix	trans	-65.6	-40.7	177.5	-135.9	93.3	0	0	0	111.9	L184 G185 R186 W191 T192 L225 Q226	L184-L188 WeakPolarHBondContact O-CB 3.47Å; L184-L188 PolarHBondContact O-N 3.42Å; G185-L188 PolarHBondContact O-N 2.87Å; R186-L188 VanDerWaalsContact C-N 3.3Å; R186-L188 PolarHBondContact O-N 2.84Å; L188-W191 PolarHBondContact O-N 2.86Å; L188-T192 WeakPolarHBondContact O-CB 3.24Å; L188-T192 WeakPolarHBondContact O-CG2 3.38Å; L188-T192 PolarHBondContact O-N 2.74Å; L188-T192 PolarHBondContact O-OG1 3.44Å; L188-L225 HydrophobicContact CD1-CB 3.5Å; L188-L225 HydrophobicContact CD1-CD1 3.77Å; L188-L225 HydrophobicContact CD1-CG 4.19Å; L188-L225 HydrophobicContact CD2-CB 3.78Å; L188-L225 HydrophobicContact CG-CB 4.28Å; L188-Q226 HydrophobicContact CD2-CB 4.27Å; L188-Q226 HydrophobicContact CD2-CG 3.45Å; L188-Q226 VanDerWaalsContact CD2-CG 3.45Å
189	S	81.6	Confident	77	Confident	66 Å²	66	95.6 Å²	95.6	46%	0.462	50%	0.5	S	S	.	.	H	α-helix	trans	-65.2	-44.3	178.7	70	0	0	0	0	111.4	G185 R186 W191 T192 W193	G185-S189 PolarHBondContact O-N 3.18Å; R186-S189 PolarHBondContact O-N 3.08Å; R186-S189 PolarHBondContact O-OG 3.25Å; S189-W191 VanDerWaalsContact C-N 3.34Å; S189-W191 PolarHBondContact O-N 2.94Å; S189-T192 WeakPolarHBondContact CA-OG1 3.39Å; S189-T192 PolarHBondContact O-N 3.46Å; S189-T192 PolarHBondContact O-OG1 3.23Å; S189-W193 WeakPolarHBondContact O-CB 3.31Å; S189-W193 PolarHBondContact O-N 2.85Å
190	V	82.3	Confident	76.4	Confident	83 Å²	83	95.7 Å²	95.7	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-59.7	-45.1	173.2	173.6	0	0	0	0	111	R186 M187 W193 I194	R186-V190 WeakPolarHBondContact O-CG2 3.49Å; R186-V190 PolarHBondContact O-N 3.49Å; R186-V190 VanDerWaalsContact O-N 3.13Å; M187-V190 PolarHBondContact O-N 3.43Å; V190-W193 WeakPolarHBondContact O-CB 3.39Å; V190-W193 PolarHBondContact O-N 3.12Å; V190-I194 HydrophobicContact CG1-CD1 4.13Å; V190-I194 WeakPolarHBondContact O-CG1 3.33Å; V190-I194 PolarHBondContact O-N 3.45Å
191	W	81.5	Confident	76	Confident	101 Å²	101	93.4 Å²	93.4	38%	0.383	49%	0.489	S	S	.	.	H	α-helix	trans	-60.7	-46.7	177.5	177.6	-98.1	0	0	0	112.4	M187 L188 S189 W193 I194 C195 L218 T222	M187-W191 VanDerWaalsContact O-CB 3.32Å; M187-W191 WeakPolarHBondContact O-CB 3.39Å; M187-W191 PolarHBondContact O-N 3.12Å; L188-W191 PolarHBondContact O-N 2.86Å; S189-W191 VanDerWaalsContact C-N 3.34Å; S189-W191 PolarHBondContact O-N 2.94Å; W191-W193 VanDerWaalsContact C-N 3.3Å; W191-W193 PolarHBondContact O-N 3.09Å; W191-I194 WeakPolarHBondContact O-CB 3.38Å; W191-I194 PolarHBondContact O-N 3.42Å; W191-I194 VanDerWaalsContact O-N 3.16Å; W191-C195 PolarHBondContact NE1-SG 3.34Å; W191-C195 VanDerWaalsContact NE1-SG 3.37Å; W191-C195 PolarHBondContact O-N 3.39Å; W191-C195 PolarHBondContact O-SG 2.85Å; W191-L218 HydrophobicContact CH2-CD2 4.18Å; W191-L218 HydrophobicContact CZ2-CD1 4.04Å; W191-L218 HydrophobicContact CZ2-CD2 3.55Å; W191-L218 HydrophobicContact CZ2-CG 3.95Å; W191-T222 VanDerWaalsContact CD1-CG2 3.4Å
192	T	79.1	Confident	76.3	Confident	37 Å²	37	95.7 Å²	95.7	23%	0.227	49%	0.494	C	S	.	.	H	α-helix	trans	-66	-34.6	179.2	60.1	0	0	0	0	112.1	L188 S189 C195 S196	L188-T192 WeakPolarHBondContact O-CB 3.24Å; L188-T192 WeakPolarHBondContact O-CG2 3.38Å; L188-T192 PolarHBondContact O-N 2.74Å; L188-T192 PolarHBondContact O-OG1 3.44Å; S189-T192 WeakPolarHBondContact CA-OG1 3.39Å; S189-T192 PolarHBondContact O-N 3.46Å; S189-T192 PolarHBondContact O-OG1 3.23Å; T192-C195 PolarHBondContact O-N 3.43Å; T192-S196 VanDerWaalsContact O-CB 3.27Å; T192-S196 WeakPolarHBondContact O-CB 3.41Å; T192-S196 PolarHBondContact O-N 3.42Å; T192-S196 PolarHBondContact O-OG 3.27Å
193	W	80.1	Confident	76.2	Confident	190 Å²	190	98.1 Å²	98.1	72%	0.72	50%	0.5	S	S	*	.	H	α-helix	trans	-60.7	-46.1	171.9	179.9	77.5	0	0	0	111.2	S189 V190 W191 S196 A197	S189-W193 WeakPolarHBondContact O-CB 3.31Å; S189-W193 PolarHBondContact O-N 2.85Å; V190-W193 WeakPolarHBondContact O-CB 3.39Å; V190-W193 PolarHBondContact O-N 3.12Å; W191-W193 VanDerWaalsContact C-N 3.3Å; W191-W193 PolarHBondContact O-N 3.09Å; W193-S196 WeakPolarHBondContact CA-OG 3.49Å; W193-S196 PolarHBondContact O-N 3.02Å; W193-S196 PolarHBondContact O-OG 3.35Å; W193-A197 PolarHBondContact O-N 2.83Å; W193-A197 VanDerWaalsContact O-N 3.16Å
194	I	78.4	Confident	76.2	Confident	77 Å²	77	96.9 Å²	96.9	40%	0.395	50%	0.499	S	S	.	.	H	α-helix	trans	-60.8	-48.7	174.9	-64.8	165.5	0	0	0	111	V190 W191 S196 A197 L200	V190-I194 HydrophobicContact CG1-CD1 4.13Å; V190-I194 WeakPolarHBondContact O-CG1 3.33Å; V190-I194 PolarHBondContact O-N 3.45Å; W191-I194 WeakPolarHBondContact O-CB 3.38Å; W191-I194 PolarHBondContact O-N 3.42Å; W191-I194 VanDerWaalsContact O-N 3.16Å; I194-S196 VanDerWaalsContact C-N 3.25Å; I194-S196 PolarHBondContact O-N 3.36Å; I194-A197 WeakPolarHBondContact O-CB 3.43Å; I194-A197 PolarHBondContact O-N 3.17Å; I194-L200 WeakPolarHBondContact O-CD1 3.11Å
195	C	70.4	Confident	76.2	Confident	62 Å²	62	96.8 Å²	96.8	42%	0.419	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-31.7	178.9	-69.1	0	0	0	0	113	W191 T192 A197	W191-C195 PolarHBondContact NE1-SG 3.34Å; W191-C195 VanDerWaalsContact NE1-SG 3.37Å; W191-C195 PolarHBondContact O-N 3.39Å; W191-C195 PolarHBondContact O-SG 2.85Å; T192-C195 PolarHBondContact O-N 3.43Å; C195-A197 VanDerWaalsContact C-N 3.28Å
196	S	68.6	Low	76.1	Confident	84 Å²	84	103.3 Å²	103.3	59%	0.587	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-2.7	176.5	74.2	0	0	0	0	113.9	T192 W193 I194 R198	T192-S196 VanDerWaalsContact O-CB 3.27Å; T192-S196 WeakPolarHBondContact O-CB 3.41Å; T192-S196 PolarHBondContact O-N 3.42Å; T192-S196 PolarHBondContact O-OG 3.27Å; W193-S196 WeakPolarHBondContact CA-OG 3.49Å; W193-S196 PolarHBondContact O-N 3.02Å; W193-S196 PolarHBondContact O-OG 3.35Å; I194-S196 VanDerWaalsContact C-N 3.25Å; I194-S196 PolarHBondContact O-N 3.36Å; S196-R198 PolarHBondContact O-N 3.38Å
197	A	75.1	Confident	76	Confident	39 Å²	39	99.9 Å²	99.9	32%	0.322	50%	0.502	S	S	.	.			trans	-59.1	133.6	-178.9	0	0	0	0	0	110.8	W193 I194 C195 I199 L200	W193-A197 PolarHBondContact O-N 2.83Å; W193-A197 VanDerWaalsContact O-N 3.16Å; I194-A197 WeakPolarHBondContact O-CB 3.43Å; I194-A197 PolarHBondContact O-N 3.17Å; C195-A197 VanDerWaalsContact C-N 3.28Å; A197-I199 PolarHBondContact O-N 3.43Å; A197-L200 PolarHBondContact O-N 3.39Å
198	R	64.5	Low	76	Confident	217 Å²	217	98.3 Å²	98.3	82%	0.819	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-27.1	-176.5	-72.9	-173.9	178.2	-177.3	0.1	113.7	S196 L200 S201 V202	S196-R198 PolarHBondContact O-N 3.38Å; R198-L200 VanDerWaalsContact C-N 3.3Å; R198-L200 PolarHBondContact O-N 3.3Å; R198-S201 WeakPolarHBondContact CA-OG 3.48Å; R198-S201 PolarHBondContact O-N 3.09Å; R198-S201 PolarHBondContact O-OG 3.11Å; R198-V202 WeakPolarHBondContact O-CG2 3.37Å
199	I	68.8	Low	75.7	Confident	137 Å²	137	99.7 Å²	99.7	70%	0.703	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-34	179.4	-62	168.3	0	0	0	111.5	A197	A197-I199 PolarHBondContact O-N 3.43Å
200	L	66.1	Low	75.6	Confident	79 Å²	79	100 Å²	100	41%	0.414	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-15.4	179.6	-64.2	175.7	0	0	0	113	I194 A197 R198 L205	I194-L200 WeakPolarHBondContact O-CD1 3.11Å; A197-L200 PolarHBondContact O-N 3.39Å; R198-L200 VanDerWaalsContact C-N 3.3Å; R198-L200 PolarHBondContact O-N 3.3Å; L200-L205 HydrophobicContact CD2-CD1 4.46Å
201	S	69.1	Low	75.5	Confident	59 Å²	59	101.1 Å²	101.1	41%	0.413	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-0.5	-178.8	67.1	0	0	0	0	114.3	R198 R206	R198-S201 WeakPolarHBondContact CA-OG 3.48Å; R198-S201 PolarHBondContact O-N 3.09Å; R198-S201 PolarHBondContact O-OG 3.11Å; S201-R206 WeakPolarHBondContact O-CD 3.32Å
202	V	80.1	Confident	75.6	Confident	90 Å²	90	99 Å²	99	55%	0.545	50%	0.503	S	S	.	.	S	Bend	trans	-91.8	152.3	176.9	-178.5	0	0	0	0	110.9	R198 L205 R206	R198-V202 WeakPolarHBondContact O-CG2 3.37Å; V202-L205 PolarHBondContact O-N 3.3Å; V202-L205 VanDerWaalsContact O-N 3.13Å; V202-R206 PolarHBondContact O-N 2.88Å
203	F	76.4	Confident	75.9	Confident	166 Å²	166	97.6 Å²	97.6	73%	0.728	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	136.9	172.5	179.7	-92.2	0	0	0	110.4	F207	F203-F207 HydrophobicContact CD2-CB 4.31Å; F203-F207 HydrophobicContact CE2-CB 4.3Å
204	P	79	Confident	76.3	Confident	80 Å²	80	89.2 Å²	89.2	52%	0.519	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93.6	-6.7	10.6	35.5	-35.5	0	0	0	115.4	R206 F207 L208	P204-R206 VanDerWaalsContact C-N 3.33Å; P204-R206 PolarHBondContact O-N 3.11Å; P204-F207 WeakPolarHBondContact O-CB 3.45Å; P204-F207 PolarHBondContact O-N 3.15Å; P204-L208 PolarHBondContact O-N 3.38Å
205	L	77.8	Confident	76.6	Confident	78 Å²	78	87.4 Å²	87.4	41%	0.408	46%	0.459	S	S	.	.	H	α-helix	trans	-60.6	-39.4	-172.6	-71.8	166.8	0	0	0	112.9	L200 V202 F207 L208 S209	L200-L205 HydrophobicContact CD2-CD1 4.46Å; V202-L205 PolarHBondContact O-N 3.3Å; V202-L205 VanDerWaalsContact O-N 3.13Å; L205-F207 VanDerWaalsContact C-N 3.32Å; L205-F207 PolarHBondContact O-N 3.03Å; L205-L208 PolarHBondContact O-N 3.5Å; L205-S209 VanDerWaalsContact O-CB 3.26Å; L205-S209 WeakPolarHBondContact O-CB 3.4Å; L205-S209 PolarHBondContact O-N 2.99Å
206	R	78.8	Confident	77.4	Confident	174 Å²	174	86.6 Å²	86.6	66%	0.657	45%	0.452	S	S	*	.	H	α-helix	trans	-62.7	-38	175.7	-172.1	174	179.7	179.3	0.7	112.9	S201 V202 P204 S210	S201-R206 WeakPolarHBondContact O-CD 3.32Å; V202-R206 PolarHBondContact O-N 2.88Å; P204-R206 VanDerWaalsContact C-N 3.33Å; P204-R206 PolarHBondContact O-N 3.11Å; R206-S210 WeakPolarHBondContact O-CB 3.4Å; R206-S210 PolarHBondContact O-N 3.36Å; R206-S210 VanDerWaalsContact O-N 3.12Å
207	F	78.3	Confident	78.3	Confident	121 Å²	121	82.6 Å²	82.6	53%	0.531	42%	0.424	S	S	.	.	H	α-helix	trans	-67.3	-46.1	176.4	176.9	-98.3	0	0	0	110.5	F203 P204 L205 S210 K211	F203-F207 HydrophobicContact CD2-CB 4.31Å; F203-F207 HydrophobicContact CE2-CB 4.3Å; P204-F207 WeakPolarHBondContact O-CB 3.45Å; P204-F207 PolarHBondContact O-N 3.15Å; L205-F207 VanDerWaalsContact C-N 3.32Å; L205-F207 PolarHBondContact O-N 3.03Å; F207-S210 PolarHBondContact O-N 3.29Å; F207-S210 PolarHBondContact O-OG 3.42Å; F207-K211 HydrophobicContact CE1-CG 4.39Å; F207-K211 HydrophobicContact CZ-CG 4.34Å; F207-K211 WeakPolarHBondContact O-CG 3.49Å; F207-K211 PolarHBondContact O-N 2.94Å
208	L	77.8	Confident	78.9	Confident	96 Å²	96	83.1 Å²	83.1	50%	0.503	42%	0.421	S	S	.	.	H	α-helix	trans	-62.3	-48.1	179.3	-163	65.3	0	0	0	111.3	P204 L205 S210 K211 L212	P204-L208 PolarHBondContact O-N 3.38Å; L205-L208 PolarHBondContact O-N 3.5Å; L208-S210 VanDerWaalsContact C-N 3.27Å; L208-S210 PolarHBondContact O-N 3.47Å; L208-K211 WeakPolarHBondContact O-CA 3.35Å; L208-K211 PolarHBondContact O-N 3.36Å; L208-L212 HydrophobicContact CD1-CD1 3.73Å; L208-L212 HydrophobicContact CG-CD1 3.69Å; L208-L212 VanDerWaalsContact O-CD1 3.29Å; L208-L212 WeakPolarHBondContact O-CD1 3.31Å; L208-L212 PolarHBondContact O-N 2.86Å
209	S	77	Confident	79.8	Confident	58 Å²	58	75.9 Å²	75.9	41%	0.406	40%	0.404	S	S	.	.	H	α-helix	trans	-58.1	-36.9	176.8	177.6	0	0	0	0	112.8	L205 K211 C215	L205-S209 VanDerWaalsContact O-CB 3.26Å; L205-S209 WeakPolarHBondContact O-CB 3.4Å; L205-S209 PolarHBondContact O-N 2.99Å; S209-K211 PolarHBondContact O-N 2.89Å; S209-C215 VanDerWaalsContact O-CB 3.25Å; S209-C215 WeakPolarHBondContact O-CB 3.24Å
210	S	77.7	Confident	80.5	Confident	72 Å²	72	70.4 Å²	70.4	50%	0.503	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.4	175.5	76.3	0	0	0	0	114.7	R206 F207 L208	R206-S210 WeakPolarHBondContact O-CB 3.4Å; R206-S210 PolarHBondContact O-N 3.36Å; R206-S210 VanDerWaalsContact O-N 3.12Å; F207-S210 PolarHBondContact O-N 3.29Å; F207-S210 PolarHBondContact O-OG 3.42Å; L208-S210 VanDerWaalsContact C-N 3.27Å; L208-S210 PolarHBondContact O-N 3.47Å
211	K	80	Confident	81.4	Confident	107 Å²	107	68 Å²	68	47%	0.465	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-31.7	-176.7	-66.3	-60.1	-178	-169.2	0	113.4	F207 L208 S209 S213	F207-K211 HydrophobicContact CE1-CG 4.39Å; F207-K211 HydrophobicContact CZ-CG 4.34Å; F207-K211 WeakPolarHBondContact O-CG 3.49Å; F207-K211 PolarHBondContact O-N 2.94Å; L208-K211 WeakPolarHBondContact O-CA 3.35Å; L208-K211 PolarHBondContact O-N 3.36Å; S209-K211 PolarHBondContact O-N 2.89Å; K211-S213 PolarHBondContact O-N 3.02Å
212	L	84.4	Confident	82.1	Confident	55 Å²	55	66.3 Å²	66.3	29%	0.288	35%	0.347	S	S	.	.			trans	-72	126.4	176.6	-91.2	70.3	0	0	0	110	L208 T214 C215 V216 D357	L208-L212 HydrophobicContact CD1-CD1 3.73Å; L208-L212 HydrophobicContact CG-CD1 3.69Å; L208-L212 VanDerWaalsContact O-CD1 3.29Å; L208-L212 WeakPolarHBondContact O-CD1 3.31Å; L208-L212 PolarHBondContact O-N 2.86Å; L212-T214 PolarHBondContact O-N 2.9Å; L212-C215 HydrophobicContact CB-CB 4.23Å; L212-C215 PolarHBondContact O-N 3.26Å; L212-V216 WeakPolarHBondContact O-CG2 3.43Å; L212-V216 PolarHBondContact O-N 2.94Å; L212-D357 WeakPolarHBondContact CB-OD2 3.41Å
213	S	85.6	Confident	82.3	Confident	8 Å²	8	67.8 Å²	67.8	6%	0.056	35%	0.348	C	S	.	.	H	α-helix	trans	-65.1	-32.1	177.5	63.2	0	0	0	0	111.7	K211 V216 Q217 S353 D357	K211-S213 PolarHBondContact O-N 3.02Å; S213-V216 PolarHBondContact O-N 2.84Å; S213-Q217 WeakPolarHBondContact O-CB 3.21Å; S213-Q217 PolarHBondContact O-N 3.32Å; S213-S353 PolarHBondContact OG-O 3.37Å; S213-D357 WeakPolarHBondContact CB-OD1 3.41Å; S213-D357 PolarHBondContact N-OD1 3.3Å; S213-D357 PolarHBondContact N-OD2 3.23Å; S213-D357 PolarHBondContact OG-OD1 2.84Å; S213-D357 PolarHBondContact OG-OD2 2.67Å
214	T	88.3	Confident	82.6	Confident	14 Å²	14	60.7 Å²	60.7	9%	0.086	32%	0.317	C	S	.	.	H	α-helix	trans	-59	-46.6	173.2	46.1	0	0	0	0	112.9	L212 V216 Q217 L218 L354 D357	L212-T214 PolarHBondContact O-N 2.9Å; T214-V216 PolarHBondContact O-N 3.11Å; T214-Q217 PolarHBondContact O-N 3.25Å; T214-L218 WeakPolarHBondContact O-CB 3.31Å; T214-L218 PolarHBondContact O-N 3.33Å; T214-L354 HydrophobicContact CG2-CB 3.65Å; T214-L354 HydrophobicContact CG2-CD1 3.9Å; T214-L354 HydrophobicContact CG2-CG 4.4Å; T214-L354 VanDerWaalsContact CG2-N 3.27Å; T214-D357 WeakPolarHBondContact CB-OD2 3.1Å; T214-D357 VanDerWaalsContact CG2-OD2 3.25Å; T214-D357 WeakPolarHBondContact CG2-OD2 3.27Å; T214-D357 PolarHBondContact N-OD2 3.45Å; T214-D357 PolarHBondContact OG1-OD2 2.92Å
215	C	85.5	Confident	82.7	Confident	40 Å²	40	59.3 Å²	59.3	27%	0.27	30%	0.304	S	S	.	.	H	α-helix	trans	-64.2	-41	178.6	-66.9	0	0	0	0	111.6	S209 L212 L218 S219	S209-C215 VanDerWaalsContact O-CB 3.25Å; S209-C215 WeakPolarHBondContact O-CB 3.24Å; L212-C215 HydrophobicContact CB-CB 4.23Å; L212-C215 PolarHBondContact O-N 3.26Å; C215-L218 PolarHBondContact O-N 2.85Å; C215-S219 PolarHBondContact O-N 2.72Å; C215-S219 PolarHBondContact O-OG 3.41Å
216	V	85.7	Confident	82.9	Confident	44 Å²	44	60.2 Å²	60.2	27%	0.267	31%	0.306	S	S	.	.	H	α-helix	trans	-66	-44.8	177	176.4	0	0	0	0	111.5	L212 S213 T214 L218 S219 Y220 Y516	L212-V216 WeakPolarHBondContact O-CG2 3.43Å; L212-V216 PolarHBondContact O-N 2.94Å; S213-V216 PolarHBondContact O-N 2.84Å; T214-V216 PolarHBondContact O-N 3.11Å; V216-L218 VanDerWaalsContact C-N 3.3Å; V216-L218 PolarHBondContact O-N 3.12Å; V216-S219 PolarHBondContact O-N 2.72Å; V216-S219 PolarHBondContact O-OG 2.89Å; V216-Y220 VanDerWaalsContact O-CB 3.31Å; V216-Y220 WeakPolarHBondContact O-CB 3.37Å; V216-Y220 PolarHBondContact O-N 3.07Å; V216-Y516 HydrophobicContact CG1-CD2 3.58Å; V216-Y516 HydrophobicContact CG1-CE2 3.56Å; V216-Y516 HydrophobicContact CG1-CG 4.13Å
217	Q	88.8	Confident	82.8	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.1	-35.9	177.5	-179.3	59.5	10.9	0	0	111.5	S213 T214 Y220 R221 T349 S353 N459 Y516	S213-Q217 WeakPolarHBondContact O-CB 3.21Å; S213-Q217 PolarHBondContact O-N 3.32Å; T214-Q217 PolarHBondContact O-N 3.25Å; Q217-Y220 PolarHBondContact O-N 2.92Å; Q217-R221 WeakPolarHBondContact O-CB 3.33Å; Q217-R221 WeakPolarHBondContact O-CG 3.38Å; Q217-R221 PolarHBondContact O-N 3.43Å; Q217-T349 VanDerWaalsContact NE2-CB 3.27Å; Q217-T349 PolarHBondContact NE2-OG1 3.12Å; Q217-S353 WeakPolarHBondContact CB-OG 3.49Å; Q217-N459 PolarHBondContact NE2-ND2 3.47Å; Q217-N459 PolarHBondContact NE2-OD1 2.97Å; Q217-N459 PolarHBondContact OE1-ND2 3.19Å; Q217-N459 VanDerWaalsContact OE1-ND2 3.13Å; Q217-Y516 VanDerWaalsContact OE1-CE1 3.3Å; Q217-Y516 PolarHBondContact OE1-OH 3.22Å
218	L	86.5	Confident	82.8	Confident	50 Å²	50	52.3 Å²	52.3	26%	0.262	29%	0.285	S	S	.	.	H	α-helix	trans	-65.6	-47.5	175.7	-171.4	54.8	0	0	0	111.4	W191 T214 C215 V216 Y220 R221 T222 F350	W191-L218 HydrophobicContact CH2-CD2 4.18Å; W191-L218 HydrophobicContact CZ2-CD1 4.04Å; W191-L218 HydrophobicContact CZ2-CD2 3.55Å; W191-L218 HydrophobicContact CZ2-CG 3.95Å; T214-L218 WeakPolarHBondContact O-CB 3.31Å; T214-L218 PolarHBondContact O-N 3.33Å; C215-L218 PolarHBondContact O-N 2.85Å; V216-L218 VanDerWaalsContact C-N 3.3Å; V216-L218 PolarHBondContact O-N 3.12Å; L218-Y220 VanDerWaalsContact C-N 3.32Å; L218-Y220 PolarHBondContact O-N 3.39Å; L218-R221 PolarHBondContact O-N 2.9Å; L218-T222 VanDerWaalsContact O-CG2 3.29Å; L218-T222 WeakPolarHBondContact O-CG2 3.31Å; L218-T222 PolarHBondContact O-N 3Å; L218-T222 PolarHBondContact O-OG1 2.88Å; L218-F350 HydrophobicContact CB-CE2 4.18Å; L218-F350 HydrophobicContact CD1-CE2 4.21Å; L218-F350 HydrophobicContact CD2-CE2 4.41Å
219	S	84.4	Confident	82.3	Confident	66 Å²	66	50.9 Å²	50.9	46%	0.462	29%	0.294	S	S	.	.	H	α-helix	trans	-60.9	-43.3	176.2	64.5	0	0	0	0	111.4	C215 V216 R221 T222 E223	C215-S219 PolarHBondContact O-N 2.72Å; C215-S219 PolarHBondContact O-OG 3.41Å; V216-S219 PolarHBondContact O-N 2.72Å; V216-S219 PolarHBondContact O-OG 2.89Å; S219-R221 PolarHBondContact O-N 3.44Å; S219-T222 WeakPolarHBondContact CA-OG1 3.49Å; S219-T222 PolarHBondContact O-N 3.45Å; S219-T222 PolarHBondContact O-OG1 2.63Å; S219-E223 PolarHBondContact O-N 2.91Å
220	Y	84.3	Confident	82.1	Confident	21 Å²	21	50.3 Å²	50.3	8%	0.082	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-44	177.7	-178.9	-110.9	0	0	0	112.9	V216 Q217 L218 E223 R224 N459 P514 Y516	V216-Y220 VanDerWaalsContact O-CB 3.31Å; V216-Y220 WeakPolarHBondContact O-CB 3.37Å; V216-Y220 PolarHBondContact O-N 3.07Å; Q217-Y220 PolarHBondContact O-N 2.92Å; L218-Y220 VanDerWaalsContact C-N 3.32Å; L218-Y220 PolarHBondContact O-N 3.39Å; Y220-E223 PolarHBondContact O-N 3.47Å; Y220-R224 PolarHBondContact O-N 2.93Å; Y220-R224 VanDerWaalsContact O-N 3.11Å; Y220-R224 PolarHBondContact OH-NE 3.33Å; Y220-R224 VanDerWaalsContact OH-NE 3.09Å; Y220-R224 PolarHBondContact OH-NH2 2.89Å; Y220-N459 HydrophobicContact CE1-CB 4.03Å; Y220-P514 PolarHBondContact OH-O 3Å; Y220-Y516 AromaticContact CD1-CD1 3.95Å; Y220-Y516 HydrophobicContact CD1-CD1 3.95Å; Y220-Y516 HydrophobicContact CD1-CE1 4.05Å; Y220-Y516 AromaticContact CD2-CD1 3.67Å; Y220-Y516 HydrophobicContact CD2-CD1 3.67Å; Y220-Y516 HydrophobicContact CD2-CG 4.47Å; Y220-Y516 HydrophobicContact CE1-CD1 4.32Å; Y220-Y516 HydrophobicContact CE2-CD1 4.06Å; Y220-Y516 AromaticContact CG-CD1 3.58Å; Y220-Y516 HydrophobicContact CG-CD1 3.58Å; Y220-Y516 HydrophobicContact CG-CE1 4.03Å
221	R	84.9	Confident	81.5	Confident	30 Å²	30	52.5 Å²	52.5	11%	0.113	31%	0.305	C	S	.	.	H	α-helix	trans	-67.9	-37.2	176.4	-78.5	-177.1	169.1	-171.2	-4	112.9	Q217 L218 S219 E223 R224 L225 D252 L346 G347 T349	Q217-R221 WeakPolarHBondContact O-CB 3.33Å; Q217-R221 WeakPolarHBondContact O-CG 3.38Å; Q217-R221 PolarHBondContact O-N 3.43Å; L218-R221 PolarHBondContact O-N 2.9Å; S219-R221 PolarHBondContact O-N 3.44Å; R221-E223 VanDerWaalsContact C-N 3.3Å; R221-E223 PolarHBondContact O-N 2.97Å; R221-R224 PolarHBondContact O-N 2.67Å; R221-L225 WeakPolarHBondContact O-CG 3.29Å; R221-L225 PolarHBondContact O-N 2.79Å; R221-D252 IonicContact CZ-OD2 3.41Å; R221-D252 IonicContact NE-OD2 3.52Å; R221-D252 VanDerWaalsContact NH2-CG 3.25Å; R221-D252 IonicContact NH2-OD1 3.49Å; R221-D252 PolarHBondContact NH2-OD1 3.09Å; R221-D252 IonicContact NH2-OD2 2.64Å; R221-D252 PolarHBondContact NH2-OD2 3.11Å; R221-L346 VanDerWaalsContact CZ-O 3.32Å; R221-L346 VanDerWaalsContact NH1-C 3.33Å; R221-L346 PolarHBondContact NH1-O 3.46Å; R221-L346 PolarHBondContact NH2-O 2.96Å; R221-G347 VanDerWaalsContact NH2-CA 3.35Å; R221-T349 PolarHBondContact NE-OG1 2.83Å; R221-T349 PolarHBondContact NH2-OG1 3.49Å
222	T	83.9	Confident	80.7	Confident	23 Å²	23	56.1 Å²	56.1	14%	0.141	32%	0.323	C	S	.	.	H	α-helix	trans	-61.9	-40.9	176	56.6	0	0	0	0	111.6	W191 L218 S219 L225 Q226	W191-T222 VanDerWaalsContact CD1-CG2 3.4Å; L218-T222 VanDerWaalsContact O-CG2 3.29Å; L218-T222 WeakPolarHBondContact O-CG2 3.31Å; L218-T222 PolarHBondContact O-N 3Å; L218-T222 PolarHBondContact O-OG1 2.88Å; S219-T222 WeakPolarHBondContact CA-OG1 3.49Å; S219-T222 PolarHBondContact O-N 3.45Å; S219-T222 PolarHBondContact O-OG1 2.63Å; T222-L225 PolarHBondContact O-N 3.36Å; T222-Q226 WeakPolarHBondContact O-CG 3.36Å; T222-Q226 PolarHBondContact O-N 3.3Å
223	E	83.8	Confident	79.7	Confident	120 Å²	120	55.1 Å²	55.1	56%	0.561	32%	0.323	S	S	*	.	H	α-helix	trans	-62.3	-45.9	175	-171.8	-179.4	175.7	0	0	111.3	S219 Y220 R221 L225 Q226 T227	S219-E223 PolarHBondContact O-N 2.91Å; Y220-E223 PolarHBondContact O-N 3.47Å; R221-E223 VanDerWaalsContact C-N 3.3Å; R221-E223 PolarHBondContact O-N 2.97Å; E223-L225 PolarHBondContact O-N 3.44Å; E223-Q226 WeakPolarHBondContact O-CB 3.44Å; E223-Q226 PolarHBondContact O-N 2.87Å; E223-Q226 VanDerWaalsContact O-N 3.15Å; E223-T227 WeakPolarHBondContact O-CG2 3.2Å; E223-T227 PolarHBondContact O-N 3.35Å
224	R	82.6	Confident	78.4	Confident	18 Å²	18	62.6 Å²	62.6	7%	0.068	36%	0.363	C	S	.	.	H	α-helix	trans	-59.1	-44.5	175.4	-77.5	-176.2	169.4	-149.5	-6.4	112.9	Y220 R221 Q226 T227 L228 V245 N459 T513	Y220-R224 PolarHBondContact O-N 2.93Å; Y220-R224 VanDerWaalsContact O-N 3.11Å; Y220-R224 PolarHBondContact OH-NE 3.33Å; Y220-R224 VanDerWaalsContact OH-NE 3.09Å; Y220-R224 PolarHBondContact OH-NH2 2.89Å; R221-R224 PolarHBondContact O-N 2.67Å; R224-Q226 VanDerWaalsContact C-N 3.29Å; R224-Q226 PolarHBondContact O-N 3.48Å; R224-T227 PolarHBondContact O-N 3.33Å; R224-T227 PolarHBondContact O-OG1 2.93Å; R224-L228 PolarHBondContact O-N 3.34Å; R224-L228 VanDerWaalsContact O-N 3.13Å; R224-V245 HydrophobicContact CB-CG1 4.04Å; R224-V245 HydrophobicContact CG-CG1 4.43Å; R224-N459 VanDerWaalsContact CZ-O 3.32Å; R224-N459 PolarHBondContact NH1-O 2.86Å; R224-N459 PolarHBondContact NH2-O 3.34Å; R224-T513 PolarHBondContact NH2-OG1 3.03Å
225	L	81.9	Confident	77.6	Confident	50 Å²	50	64.1 Å²	64.1	26%	0.262	38%	0.377	S	S	.	.	H	α-helix	trans	-65.8	-33.1	178	-72.5	164	0	0	0	111.8	L188 R221 T222 E223 L228 G229	L188-L225 HydrophobicContact CD1-CB 3.5Å; L188-L225 HydrophobicContact CD1-CD1 3.77Å; L188-L225 HydrophobicContact CD1-CG 4.19Å; L188-L225 HydrophobicContact CD2-CB 3.78Å; L188-L225 HydrophobicContact CG-CB 4.28Å; R221-L225 WeakPolarHBondContact O-CG 3.29Å; R221-L225 PolarHBondContact O-N 2.79Å; T222-L225 PolarHBondContact O-N 3.36Å; E223-L225 PolarHBondContact O-N 3.44Å; L225-L228 PolarHBondContact O-N 2.91Å; L225-G229 PolarHBondContact O-N 2.66Å; L225-G229 VanDerWaalsContact O-N 3.16Å
226	Q	80.9	Confident	77	Confident	97 Å²	97	63.7 Å²	63.7	45%	0.453	37%	0.371	S	S	.	.	H	α-helix	trans	-64.1	-42.7	170.9	-71.8	174.4	-3.4	0	0	111.8	L188 T222 E223 R224 L228 G229 A230	L188-Q226 HydrophobicContact CD2-CB 4.27Å; L188-Q226 HydrophobicContact CD2-CG 3.45Å; L188-Q226 VanDerWaalsContact CD2-CG 3.45Å; T222-Q226 WeakPolarHBondContact O-CG 3.36Å; T222-Q226 PolarHBondContact O-N 3.3Å; E223-Q226 WeakPolarHBondContact O-CB 3.44Å; E223-Q226 PolarHBondContact O-N 2.87Å; E223-Q226 VanDerWaalsContact O-N 3.15Å; R224-Q226 VanDerWaalsContact C-N 3.29Å; R224-Q226 PolarHBondContact O-N 3.48Å; Q226-L228 PolarHBondContact O-N 3.4Å; Q226-G229 PolarHBondContact O-N 3.39Å; Q226-G229 VanDerWaalsContact O-N 3.1Å; Q226-A230 PolarHBondContact O-N 3.36Å
227	T	76.6	Confident	76.6	Confident	68 Å²	68	65 Å²	65	42%	0.417	38%	0.375	S	S	.	.	H	α-helix	trans	-63.6	-29.4	177.4	65.1	0	0	0	0	113.1	E223 R224 A230	E223-T227 WeakPolarHBondContact O-CG2 3.2Å; E223-T227 PolarHBondContact O-N 3.35Å; R224-T227 PolarHBondContact O-N 3.33Å; R224-T227 PolarHBondContact O-OG1 2.93Å; T227-A230 WeakPolarHBondContact O-CB 3.35Å
228	L	77.5	Confident	76.1	Confident	61 Å²	61	68.5 Å²	68.5	32%	0.319	39%	0.393	S	S	.	.	H	α-helix	trans	-72.9	-35.3	174	-173.1	67.1	0	0	0	112	R224 L225 Q226 A230 K242 L246	R224-L228 PolarHBondContact O-N 3.34Å; R224-L228 VanDerWaalsContact O-N 3.13Å; L225-L228 PolarHBondContact O-N 2.91Å; Q226-L228 PolarHBondContact O-N 3.4Å; L228-A230 PolarHBondContact O-N 3.49Å; L228-K242 HydrophobicContact CD1-CB 4.31Å; L228-L246 HydrophobicContact CD1-CB 4.2Å; L228-L246 HydrophobicContact CD2-CD1 3.93Å
229	G	68.3	Low	75.9	Confident	67 Å²	67	69.7 Å²	69.7	69%	0.691	40%	0.397	S	S	*	.	H	α-helix	trans	-74.3	-8.1	177.1	0	0	0	0	0	115	L225 Q226	L225-G229 PolarHBondContact O-N 2.66Å; L225-G229 VanDerWaalsContact O-N 3.16Å; Q226-G229 PolarHBondContact O-N 3.39Å; Q226-G229 VanDerWaalsContact O-N 3.1Å
230	A	72.3	Confident	75.8	Confident	46 Å²	46	66.6 Å²	66.6	38%	0.38	38%	0.375	S	S	.	.	S	Bend	trans	-68.7	149.3	176.6	0	0	0	0	0	112	Q226 T227 L228 K242	Q226-A230 PolarHBondContact O-N 3.36Å; T227-A230 WeakPolarHBondContact O-CB 3.35Å; L228-A230 PolarHBondContact O-N 3.49Å; A230-K242 PolarHBondContact O-NZ 2.88Å
231	P	65.4	Low	75.8	Confident	117 Å²	117	72.7 Å²	72.7	76%	0.76	40%	0.398	S	S	*	.	S	Bend	trans	-55.9	165	-175.2	21.7	-33.3	0	0	0	114.3	K242	P231-K242 PolarHBondContact O-NZ 3.49Å
232	Q	62.3	Low	75.7	Confident	183 Å²	183	73.6 Å²	73.6	86%	0.855	40%	0.402	S	S	*	.			trans	-45.3	139.5	-169.8	-88.7	174.9	-30.6	0	0	113.7	D234	Q232-D234 PolarHBondContact O-N 3.3Å
233	A	63.5	Low	75.8	Confident	34 Å²	34	73.1 Å²	73.1	28%	0.281	40%	0.401	S	S	.	.			trans	-79.8	114.7	177.7	0	0	0	0	0	109.6	D238 F239 K242	A233-D238 HydrophobicContact CB-CB 3.73Å; A233-F239 HydrophobicContact CB-CB 4.23Å; A233-K242 HydrophobicContact CB-CD 4.42Å
234	D	60	Low	76	Confident	166 Å²	166	67.5 Å²	67.5	89%	0.888	37%	0.374	S	S	*	.	S	Bend	trans	-76.9	-27.3	176.9	-62.6	-36	0	0	0	112	Q232	Q232-D234 PolarHBondContact O-N 3.3Å
235	A	70.4	Confident	76.2	Confident	46 Å²	46	67.1 Å²	67.1	38%	0.38	37%	0.374	S	S	.	.	S	Bend	trans	-104	142.9	179.8	0	0	0	0	0	112.6	M237 D238 F239	A235-M237 VanDerWaalsContact C-N 3.27Å; A235-M237 PolarHBondContact O-N 3.1Å; A235-D238 PolarHBondContact O-N 2.77Å; A235-D238 VanDerWaalsContact O-N 3.12Å; A235-F239 PolarHBondContact O-N 3.06Å; A235-F239 VanDerWaalsContact O-N 3.09Å
236	H	72.8	Confident	76.5	Confident	31 Å²	31	68.2 Å²	68.2	14%	0.144	38%	0.38	C	S	.	.	H	α-helix	trans	-57.4	-37.3	178	175.2	77.4	0	0	0	113.5	Q111 W159 D238 F239 M240	Q111-H236 VanDerWaalsContact CD-CG 3.4Å; Q111-H236 PolarHBondContact NE2-ND1 3.2Å; Q111-H236 PolarHBondContact OE1-CD2 3.42Å; Q111-H236 PolarHBondContact OE1-ND1 3Å; Q111-H236 PolarHBondContact OE1-NE2 3.28Å; W159-H236 AromaticContact CH2-ND1 3.8Å; H236-D238 VanDerWaalsContact C-N 3.31Å; H236-D238 PolarHBondContact O-N 3.13Å; H236-F239 WeakPolarHBondContact O-CB 3.35Å; H236-F239 PolarHBondContact O-N 2.69Å; H236-M240 VanDerWaalsContact CE1-CG 3.49Å; H236-M240 WeakPolarHBondContact CE1-CG 3.15Å; H236-M240 VanDerWaalsContact NE2-CG 3.33Å; H236-M240 WeakPolarHBondContact NE2-CG 3.41Å; H236-M240 WeakPolarHBondContact O-CB 3.43Å; H236-M240 VanDerWaalsContact O-CG 3.32Å; H236-M240 WeakPolarHBondContact O-CG 3.23Å; H236-M240 PolarHBondContact O-N 3.37Å
237	M	77.6	Confident	76.9	Confident	72 Å²	72	65.9 Å²	65.9	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-63.3	-38.8	178.8	-72	-59.7	-68.9	0	0	112	A235 M240 R241 T510 Y511	A235-M237 VanDerWaalsContact C-N 3.27Å; A235-M237 PolarHBondContact O-N 3.1Å; M237-M240 PolarHBondContact O-N 3.16Å; M237-R241 WeakPolarHBondContact O-CB 3.43Å; M237-R241 PolarHBondContact O-N 2.95Å; M237-T510 HydrophobicContact CE-CG2 3.89Å; M237-Y511 HydrophobicContact CE-CD1 4.28Å; M237-Y511 HydrophobicContact CE-CE1 3.71Å; M237-Y511 HydrophobicContact SD-CE1 3.68Å
238	D	78.3	Confident	77.5	Confident	72 Å²	72	62.9 Å²	62.9	39%	0.385	35%	0.354	S	S	.	.	H	α-helix	trans	-71	-37.4	176.7	-65.6	-36	0	0	0	111.3	A233 A235 H236 R241 K242	A233-D238 HydrophobicContact CB-CB 3.73Å; A235-D238 PolarHBondContact O-N 2.77Å; A235-D238 VanDerWaalsContact O-N 3.12Å; H236-D238 VanDerWaalsContact C-N 3.31Å; H236-D238 PolarHBondContact O-N 3.13Å; D238-R241 PolarHBondContact O-N 3.43Å; D238-K242 WeakPolarHBondContact O-CB 3.35Å; D238-K242 WeakPolarHBondContact O-CG 3.42Å; D238-K242 PolarHBondContact O-N 3.38Å
239	F	82.1	Confident	78.1	Confident	76 Å²	76	61.8 Å²	61.8	33%	0.333	35%	0.35	S	S	.	.	H	α-helix	trans	-59.7	-51.2	171.1	172	-96.2	0	0	0	111.6	A233 A235 H236 R241 K242 A243 F464	A233-F239 HydrophobicContact CB-CB 4.23Å; A235-F239 PolarHBondContact O-N 3.06Å; A235-F239 VanDerWaalsContact O-N 3.09Å; H236-F239 WeakPolarHBondContact O-CB 3.35Å; H236-F239 PolarHBondContact O-N 2.69Å; F239-R241 VanDerWaalsContact C-N 3.29Å; F239-R241 PolarHBondContact O-N 2.96Å; F239-K242 PolarHBondContact O-N 3.44Å; F239-A243 WeakPolarHBondContact O-CB 3.4Å; F239-A243 PolarHBondContact O-N 3.39Å; F239-F464 HydrophobicContact CE1-CE1 4.41Å
240	M	82.1	Confident	79.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-60.8	-38.7	178.9	-72.3	-63.4	-69.2	0	0	111.8	H236 M237 N244 F464 A465 L468 L476 Y511	H236-M240 VanDerWaalsContact CE1-CG 3.49Å; H236-M240 WeakPolarHBondContact CE1-CG 3.15Å; H236-M240 VanDerWaalsContact NE2-CG 3.33Å; H236-M240 WeakPolarHBondContact NE2-CG 3.41Å; H236-M240 WeakPolarHBondContact O-CB 3.43Å; H236-M240 VanDerWaalsContact O-CG 3.32Å; H236-M240 WeakPolarHBondContact O-CG 3.23Å; H236-M240 PolarHBondContact O-N 3.37Å; M237-M240 PolarHBondContact O-N 3.16Å; M240-N244 VanDerWaalsContact O-CB 3.31Å; M240-N244 WeakPolarHBondContact O-CB 3.46Å; M240-N244 PolarHBondContact O-N 3.45Å; M240-N244 PolarHBondContact O-ND2 2.9Å; M240-N244 VanDerWaalsContact O-ND2 3.15Å; M240-F464 HydrophobicContact CE-CD1 4.1Å; M240-F464 HydrophobicContact CE-CE1 4.07Å; M240-F464 HydrophobicContact SD-CD1 4.19Å; M240-F464 HydrophobicContact SD-CE1 3.66Å; M240-A465 HydrophobicContact CE-CB 3.84Å; M240-L468 HydrophobicContact CE-CD2 3.77Å; M240-L468 HydrophobicContact SD-CD2 4.03Å; M240-L476 HydrophobicContact CE-CD2 4.41Å; M240-Y511 HydrophobicContact CB-CD1 4Å; M240-Y511 HydrophobicContact CB-CE1 3.42Å; M240-Y511 VanDerWaalsContact CB-CE1 3.42Å; M240-Y511 HydrophobicContact CE-CE1 4.33Å; M240-Y511 HydrophobicContact CE-CE2 4.42Å; M240-Y511 HydrophobicContact CG-CE1 3.9Å
241	R	83.9	Confident	80.1	Confident	150 Å²	150	64.6 Å²	64.6	57%	0.566	34%	0.342	S	S	*	.	H	α-helix	trans	-64.3	-49.3	175.5	-173.5	-179.3	-69.2	169.2	-1	111.5	M237 D238 F239 A243 N244 V245	M237-R241 WeakPolarHBondContact O-CB 3.43Å; M237-R241 PolarHBondContact O-N 2.95Å; D238-R241 PolarHBondContact O-N 3.43Å; F239-R241 VanDerWaalsContact C-N 3.29Å; F239-R241 PolarHBondContact O-N 2.96Å; R241-A243 VanDerWaalsContact C-N 3.35Å; R241-A243 PolarHBondContact O-N 2.97Å; R241-N244 PolarHBondContact O-N 3.3Å; R241-V245 WeakPolarHBondContact O-CG2 3.48Å; R241-V245 PolarHBondContact O-N 2.91Å
242	K	84.4	Confident	81.5	Confident	48 Å²	48	59.2 Å²	59.2	21%	0.209	31%	0.306	C	S	.	.	H	α-helix	trans	-61.4	-42.3	177.2	-73.5	-177	-178.6	-173.1	0	111.8	L228 A230 P231 A233 D238 F239 V245 L246	L228-K242 HydrophobicContact CD1-CB 4.31Å; A230-K242 PolarHBondContact O-NZ 2.88Å; P231-K242 PolarHBondContact O-NZ 3.49Å; A233-K242 HydrophobicContact CB-CD 4.42Å; D238-K242 WeakPolarHBondContact O-CB 3.35Å; D238-K242 WeakPolarHBondContact O-CG 3.42Å; D238-K242 PolarHBondContact O-N 3.38Å; F239-K242 PolarHBondContact O-N 3.44Å; K242-V245 PolarHBondContact O-N 3.23Å; K242-L246 WeakPolarHBondContact O-CB 3.32Å; K242-L246 PolarHBondContact O-N 3.4Å
243	A	84.3	Confident	82.9	Confident	13 Å²	13	52.9 Å²	52.9	11%	0.107	28%	0.28	C	S	.	.	H	α-helix	trans	-65.3	-42.6	177.2	0	0	0	0	0	112.4	F239 R241 V245 L246 V247 F464	F239-A243 WeakPolarHBondContact O-CB 3.4Å; F239-A243 PolarHBondContact O-N 3.39Å; R241-A243 VanDerWaalsContact C-N 3.35Å; R241-A243 PolarHBondContact O-N 2.97Å; A243-V245 PolarHBondContact O-N 2.93Å; A243-L246 PolarHBondContact O-N 3.41Å; A243-V247 WeakPolarHBondContact O-CG2 3.5Å; A243-V247 PolarHBondContact O-N 2.92Å; A243-F464 HydrophobicContact CB-CD1 3.43Å; A243-F464 VanDerWaalsContact CB-CD1 3.43Å; A243-F464 HydrophobicContact CB-CD2 4.37Å; A243-F464 HydrophobicContact CB-CE1 3.44Å; A243-F464 VanDerWaalsContact CB-CE1 3.44Å; A243-F464 HydrophobicContact CB-CE2 4.37Å; A243-F464 HydrophobicContact CB-CG 3.91Å; A243-F464 HydrophobicContact CB-CZ 3.93Å
244	N	88.9	Confident	84.3	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.011	29%	0.287	C	S	.	.	H	α-helix	trans	-58.3	-45.6	172.3	-84.4	-40.5	0	0	0	111.9	M240 R241 S248 F464 A465	M240-N244 VanDerWaalsContact O-CB 3.31Å; M240-N244 WeakPolarHBondContact O-CB 3.46Å; M240-N244 PolarHBondContact O-N 3.45Å; M240-N244 PolarHBondContact O-ND2 2.9Å; M240-N244 VanDerWaalsContact O-ND2 3.15Å; R241-N244 PolarHBondContact O-N 3.3Å; N244-S248 WeakPolarHBondContact O-CB 3.49Å; N244-S248 PolarHBondContact O-N 3.29Å; N244-F464 WeakPolarHBondContact OD1-CA 3.3Å; N244-F464 VanDerWaalsContact OD1-CB 3.24Å; N244-F464 WeakPolarHBondContact OD1-CB 3.28Å; N244-F464 PolarHBondContact OD1-N 3.46Å; N244-F464 VanDerWaalsContact OD1-N 3.11Å; N244-A465 PolarHBondContact OD1-N 3Å
245	V	87.3	Confident	86	Confident	10 Å²	10	49.1 Å²	49.1	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-46.3	177.4	171.3	0	0	0	0	110.8	R224 R241 K242 A243 S248 V249 T513	R224-V245 HydrophobicContact CB-CG1 4.04Å; R224-V245 HydrophobicContact CG-CG1 4.43Å; R241-V245 WeakPolarHBondContact O-CG2 3.48Å; R241-V245 PolarHBondContact O-N 2.91Å; K242-V245 PolarHBondContact O-N 3.23Å; A243-V245 PolarHBondContact O-N 2.93Å; V245-S248 PolarHBondContact O-N 2.9Å; V245-V249 HydrophobicContact CG1-CG2 4.44Å; V245-V249 VanDerWaalsContact O-CG2 3.3Å; V245-V249 WeakPolarHBondContact O-CG2 3.4Å; V245-V249 PolarHBondContact O-N 2.92Å; V245-T513 HydrophobicContact CG2-CG2 4.29Å
246	L	87.5	Confident	87.2	Confident	73 Å²	73	46.9 Å²	46.9	38%	0.382	24%	0.242	S	C	.	.	H	α-helix	trans	-59.4	-51.6	178.8	176.3	63.2	0	0	0	111.8	L228 K242 A243 S248 V249 L250	L228-L246 HydrophobicContact CD1-CB 4.2Å; L228-L246 HydrophobicContact CD2-CD1 3.93Å; K242-L246 WeakPolarHBondContact O-CB 3.32Å; K242-L246 PolarHBondContact O-N 3.4Å; A243-L246 PolarHBondContact O-N 3.41Å; L246-S248 VanDerWaalsContact C-N 3.34Å; L246-S248 PolarHBondContact O-N 3.45Å; L246-V249 PolarHBondContact O-N 2.97Å; L246-L250 HydrophobicContact CD1-CD1 4.12Å; L246-L250 HydrophobicContact CD1-CG 4.26Å; L246-L250 HydrophobicContact CG-CD1 4.11Å; L246-L250 WeakPolarHBondContact O-CG 3.35Å; L246-L250 PolarHBondContact O-N 2.69Å
247	V	89.5	Confident	88.3	Confident	49 Å²	49	48.1 Å²	48.1	30%	0.297	25%	0.251	S	S	.	.	H	α-helix	trans	-65	-39	-179.8	172.2	0	0	0	0	111.4	A243 L250 L251 L463 F464	A243-V247 WeakPolarHBondContact O-CG2 3.5Å; A243-V247 PolarHBondContact O-N 2.92Å; V247-L250 PolarHBondContact O-N 3.42Å; V247-L251 WeakPolarHBondContact O-CB 3.33Å; V247-L251 PolarHBondContact O-N 3.3Å; V247-L463 HydrophobicContact CG1-CB 4.06Å; V247-F464 HydrophobicContact CB-CB 4.01Å; V247-F464 HydrophobicContact CG1-CB 4.4Å; V247-F464 HydrophobicContact CG2-CB 3.92Å; V247-F464 HydrophobicContact CG2-CD2 3.86Å; V247-F464 HydrophobicContact CG2-CG 4.25Å
248	S	90.1	Very high	89.1	Confident	4 Å²	4	50 Å²	50	3%	0.028	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-46	174.7	174.6	0	0	0	0	111.6	N244 V245 L246 L251 D252 I458	N244-S248 WeakPolarHBondContact O-CB 3.49Å; N244-S248 PolarHBondContact O-N 3.29Å; V245-S248 PolarHBondContact O-N 2.9Å; L246-S248 VanDerWaalsContact C-N 3.34Å; L246-S248 PolarHBondContact O-N 3.45Å; S248-L251 PolarHBondContact O-N 2.88Å; S248-D252 WeakPolarHBondContact O-CB 3.31Å; S248-D252 PolarHBondContact O-N 3.4Å; S248-I458 PolarHBondContact OG-O 3.27Å
249	V	89.3	Confident	89.9	Confident	38 Å²	38	48.9 Å²	48.9	23%	0.23	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-44.8	176.4	170.4	0	0	0	0	111.5	V245 L246 D252 V253	V245-V249 HydrophobicContact CG1-CG2 4.44Å; V245-V249 VanDerWaalsContact O-CG2 3.3Å; V245-V249 WeakPolarHBondContact O-CG2 3.4Å; V245-V249 PolarHBondContact O-N 2.92Å; L246-V249 PolarHBondContact O-N 2.97Å; V249-D252 PolarHBondContact O-N 3.35Å; V249-V253 HydrophobicContact CG1-CG2 4.43Å; V249-V253 VanDerWaalsContact O-CG2 3.3Å; V249-V253 WeakPolarHBondContact O-CG2 3.38Å; V249-V253 PolarHBondContact O-N 3.41Å
250	L	90.3	Very high	90.5	Very high	106 Å²	106	47.3 Å²	47.3	56%	0.555	25%	0.25	S	S	*	.	H	α-helix	trans	-62.6	-45.1	178.3	-72.1	174.4	0	0	0	111.8	L246 V247 V253 S254	L246-L250 HydrophobicContact CD1-CD1 4.12Å; L246-L250 HydrophobicContact CD1-CG 4.26Å; L246-L250 HydrophobicContact CG-CD1 4.11Å; L246-L250 WeakPolarHBondContact O-CG 3.35Å; L246-L250 PolarHBondContact O-N 2.69Å; V247-L250 PolarHBondContact O-N 3.42Å; L250-V253 PolarHBondContact O-N 3.36Å; L250-S254 WeakPolarHBondContact O-CB 3.31Å; L250-S254 PolarHBondContact O-N 3.43Å; L250-S254 PolarHBondContact O-OG 3.18Å
251	L	92.3	Very high	91.1	Very high	66 Å²	66	52.7 Å²	52.7	35%	0.346	28%	0.278	S	S	.	.	H	α-helix	trans	-62.9	-46.2	176.8	-173.7	71.4	0	0	0	110.7	V247 S248 V253 S254 L255 L463	V247-L251 WeakPolarHBondContact O-CB 3.33Å; V247-L251 PolarHBondContact O-N 3.3Å; S248-L251 PolarHBondContact O-N 2.88Å; L251-V253 PolarHBondContact O-N 2.55Å; L251-S254 WeakPolarHBondContact CA-OG 2.89Å; L251-S254 PolarHBondContact O-N 3.48Å; L251-S254 VanDerWaalsContact O-N 3.14Å; L251-S254 PolarHBondContact O-OG 3.13Å; L251-L255 HydrophobicContact CD1-CG 4.47Å; L251-L255 HydrophobicContact CD2-CD1 4.3Å; L251-L255 HydrophobicContact CG-CD1 3.97Å; L251-L255 HydrophobicContact CG-CG 4.28Å; L251-L255 WeakPolarHBondContact O-CB 3.15Å; L251-L255 WeakPolarHBondContact O-CG 3.3Å; L251-L255 PolarHBondContact O-N 3.29Å; L251-L463 HydrophobicContact CB-CD1 4.14Å; L251-L463 HydrophobicContact CD2-CD1 3.34Å; L251-L463 HydrophobicContact CD2-CD2 3.95Å; L251-L463 HydrophobicContact CD2-CG 4.28Å; L251-L463 HydrophobicContact CG-CD1 4.36Å
252	D	93.8	Very high	91.5	Very high	4 Å²	4	52 Å²	52	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-42.3	-179.8	-172.7	16.8	0	0	0	112.2	R221 S248 V249 G256 G347 L348 T349 I458	R221-D252 IonicContact CZ-OD2 3.41Å; R221-D252 IonicContact NE-OD2 3.52Å; R221-D252 VanDerWaalsContact NH2-CG 3.25Å; R221-D252 IonicContact NH2-OD1 3.49Å; R221-D252 PolarHBondContact NH2-OD1 3.09Å; R221-D252 IonicContact NH2-OD2 2.64Å; R221-D252 PolarHBondContact NH2-OD2 3.11Å; S248-D252 WeakPolarHBondContact O-CB 3.31Å; S248-D252 PolarHBondContact O-N 3.4Å; V249-D252 PolarHBondContact O-N 3.35Å; D252-G256 PolarHBondContact O-N 3.38Å; D252-G347 CarbonylContact O-C 3.54Å; D252-G347 VanDerWaalsContact O-CA 3.22Å; D252-G347 WeakPolarHBondContact O-CA 3.17Å; D252-L348 PolarHBondContact O-N 3.32Å; D252-L348 WeakPolarHBondContact OD1-CA 3.34Å; D252-L348 WeakPolarHBondContact OD1-CB 3.18Å; D252-L348 PolarHBondContact OD1-N 3.04Å; D252-T349 WeakPolarHBondContact OD1-CG2 3.23Å; D252-T349 PolarHBondContact OD1-N 3.06Å; D252-T349 PolarHBondContact OD1-OG1 3.41Å; D252-T349 WeakPolarHBondContact OD2-CG2 3.49Å; D252-T349 PolarHBondContact OD2-OG1 2.93Å; D252-I458 HydrophobicContact CB-CG2 4.29Å
253	V	93.2	Very high	91.9	Very high	51 Å²	51	51 Å²	51	31%	0.309	27%	0.272	S	S	.	.	H	α-helix	trans	-63.8	-45.4	171.6	173.7	0	0	0	0	111	V249 L250 L251 L255 G256 V257	V249-V253 HydrophobicContact CG1-CG2 4.43Å; V249-V253 VanDerWaalsContact O-CG2 3.3Å; V249-V253 WeakPolarHBondContact O-CG2 3.38Å; V249-V253 PolarHBondContact O-N 3.41Å; L250-V253 PolarHBondContact O-N 3.36Å; L251-V253 PolarHBondContact O-N 2.55Å; V253-L255 PolarHBondContact O-N 3.46Å; V253-G256 CarbonylContact O-C 3.59Å; V253-G256 PolarHBondContact O-N 3.27Å; V253-G256 VanDerWaalsContact O-N 3.14Å; V253-V257 HydrophobicContact CG1-CG2 4.31Å; V253-V257 WeakPolarHBondContact O-CG2 3.29Å; V253-V257 PolarHBondContact O-N 3.44Å
254	S	93.3	Very high	92.4	Very high	60 Å²	60	53.6 Å²	53.6	42%	0.42	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-41.3	179.7	74.7	0	0	0	0	112.7	L250 L251 G256 V257 L258	L250-S254 WeakPolarHBondContact O-CB 3.31Å; L250-S254 PolarHBondContact O-N 3.43Å; L250-S254 PolarHBondContact O-OG 3.18Å; L251-S254 WeakPolarHBondContact CA-OG 2.89Å; L251-S254 PolarHBondContact O-N 3.48Å; L251-S254 VanDerWaalsContact O-N 3.14Å; L251-S254 PolarHBondContact O-OG 3.13Å; S254-G256 VanDerWaalsContact C-N 3.34Å; S254-V257 PolarHBondContact O-N 3.05Å; S254-L258 WeakPolarHBondContact O-CB 3.28Å; S254-L258 PolarHBondContact O-N 2.77Å
255	L	94.9	Very high	92.5	Very high	60 Å²	60	60.6 Å²	60.6	31%	0.314	31%	0.306	S	S	.	.	H	α-helix	trans	-66.4	-37.3	174.6	-71.4	173	0	0	0	111.3	L251 V253 L258 L259 L348	L251-L255 HydrophobicContact CD1-CG 4.47Å; L251-L255 HydrophobicContact CD2-CD1 4.3Å; L251-L255 HydrophobicContact CG-CD1 3.97Å; L251-L255 HydrophobicContact CG-CG 4.28Å; L251-L255 WeakPolarHBondContact O-CB 3.15Å; L251-L255 WeakPolarHBondContact O-CG 3.3Å; L251-L255 PolarHBondContact O-N 3.29Å; V253-L255 PolarHBondContact O-N 3.46Å; L255-L258 PolarHBondContact O-N 2.8Å; L255-L259 WeakPolarHBondContact O-CB 3.34Å; L255-L259 PolarHBondContact O-N 3.07Å; L255-L348 HydrophobicContact CB-CB 3.91Å; L255-L348 HydrophobicContact CB-CD2 3.94Å; L255-L348 HydrophobicContact CD1-CD2 4.08Å
256	G	95.8	Very high	92.3	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66.3	-41.9	174.2	0	0	0	0	0	113.2	D252 V253 S254 L259 M260 A344	D252-G256 PolarHBondContact O-N 3.38Å; V253-G256 CarbonylContact O-C 3.59Å; V253-G256 PolarHBondContact O-N 3.27Å; V253-G256 VanDerWaalsContact O-N 3.14Å; S254-G256 VanDerWaalsContact C-N 3.34Å; G256-L259 WeakPolarHBondContact O-CB 3.07Å; G256-L259 PolarHBondContact O-N 3.15Å; G256-M260 WeakPolarHBondContact O-CB 3.4Å; G256-M260 PolarHBondContact O-N 3.49Å; G256-A344 CarbonylContact C-O 3.15Å; G256-A344 WeakPolarHBondContact CA-O 3.31Å; G256-A344 WeakPolarHBondContact O-CB 3.48Å
257	V	94.6	Very high	92.2	Very high	57 Å²	57	69.9 Å²	69.9	35%	0.345	35%	0.351	S	S	.	.	H	α-helix	trans	-65.9	-41.3	173.6	172.9	0	0	0	0	110.7	V253 S254 L259 M260 L261	V253-V257 HydrophobicContact CG1-CG2 4.31Å; V253-V257 WeakPolarHBondContact O-CG2 3.29Å; V253-V257 PolarHBondContact O-N 3.44Å; S254-V257 PolarHBondContact O-N 3.05Å; V257-L259 VanDerWaalsContact C-N 3.32Å; V257-L259 PolarHBondContact O-N 2.98Å; V257-M260 WeakPolarHBondContact O-CB 3.34Å; V257-M260 PolarHBondContact O-N 2.83Å; V257-L261 HydrophobicContact CG1-CD1 4.14Å; V257-L261 HydrophobicContact CG1-CG 4.32Å; V257-L261 WeakPolarHBondContact O-CB 3.36Å; V257-L261 VanDerWaalsContact O-CG 3.31Å; V257-L261 WeakPolarHBondContact O-CG 3.37Å; V257-L261 PolarHBondContact O-N 3.37Å
258	L	95.6	Very high	92.3	Very high	112 Å²	112	69.9 Å²	69.9	59%	0.586	35%	0.348	S	S	*	.	H	α-helix	trans	-59.6	-44.3	173.9	-177	69	0	0	0	111.3	S254 L255 L261 W262	S254-L258 WeakPolarHBondContact O-CB 3.28Å; S254-L258 PolarHBondContact O-N 2.77Å; L255-L258 PolarHBondContact O-N 2.8Å; L258-L261 PolarHBondContact O-N 2.92Å; L258-W262 WeakPolarHBondContact O-CB 3.2Å; L258-W262 PolarHBondContact O-N 2.84Å
259	L	94.9	Very high	92.4	Very high	47 Å²	47	70.1 Å²	70.1	25%	0.246	35%	0.348	C	S	.	.	H	α-helix	trans	-60.7	-45.8	174.2	178.2	66.5	0	0	0	110.9	L255 G256 V257 W262 L263 A344 L348 A351	L255-L259 WeakPolarHBondContact O-CB 3.34Å; L255-L259 PolarHBondContact O-N 3.07Å; G256-L259 WeakPolarHBondContact O-CB 3.07Å; G256-L259 PolarHBondContact O-N 3.15Å; V257-L259 VanDerWaalsContact C-N 3.32Å; V257-L259 PolarHBondContact O-N 2.98Å; L259-W262 HydrophobicContact CD1-CE3 4.11Å; L259-W262 WeakPolarHBondContact O-CB 3.48Å; L259-W262 PolarHBondContact O-N 2.85Å; L259-L263 HydrophobicContact CD1-CD1 3.46Å; L259-L263 VanDerWaalsContact CD1-CD1 3.46Å; L259-L263 HydrophobicContact CD2-CD1 4.39Å; L259-L263 HydrophobicContact CG-CD1 3.54Å; L259-L263 WeakPolarHBondContact O-CD1 3.4Å; L259-L263 PolarHBondContact O-N 2.88Å; L259-A344 HydrophobicContact CD2-CB 4.27Å; L259-L348 HydrophobicContact CD2-CD1 3.68Å; L259-A351 HydrophobicContact CD2-CB 3.99Å
260	M	94.6	Very high	92.5	Very high	44 Å²	44	69.3 Å²	69.3	22%	0.217	35%	0.346	C	S	.	.	H	α-helix	trans	-59	-50.3	176.3	-174.7	-170.3	173	0	0	111.1	G256 V257 W262 L263 Y264 L342 A344 C345	G256-M260 WeakPolarHBondContact O-CB 3.4Å; G256-M260 PolarHBondContact O-N 3.49Å; V257-M260 WeakPolarHBondContact O-CB 3.34Å; V257-M260 PolarHBondContact O-N 2.83Å; M260-W262 PolarHBondContact O-N 3.39Å; M260-L263 PolarHBondContact O-N 3.41Å; M260-L263 VanDerWaalsContact O-N 3.1Å; M260-Y264 HydrophobicContact CE-CD2 4.35Å; M260-Y264 HydrophobicContact CE-CE2 3.99Å; M260-Y264 HydrophobicContact CG-CD2 3.71Å; M260-Y264 HydrophobicContact CG-CE2 3.7Å; M260-Y264 WeakPolarHBondContact O-CD2 3.38Å; M260-Y264 PolarHBondContact O-N 3.04Å; M260-L342 HydrophobicContact CE-CD1 3.58Å; M260-L342 HydrophobicContact SD-CD1 4.49Å; M260-A344 HydrophobicContact CB-CB 4.25Å; M260-C345 HydrophobicContact SD-CB 4.18Å
261	L	94.2	Very high	92.6	Very high	113 Å²	113	69.4 Å²	69.4	59%	0.592	35%	0.345	S	S	*	.	H	α-helix	trans	-57	-40	177.5	-70.6	172.7	0	0	0	111.2	V257 L258 R265	V257-L261 HydrophobicContact CG1-CD1 4.14Å; V257-L261 HydrophobicContact CG1-CG 4.32Å; V257-L261 WeakPolarHBondContact O-CB 3.36Å; V257-L261 VanDerWaalsContact O-CG 3.31Å; V257-L261 WeakPolarHBondContact O-CG 3.37Å; V257-L261 PolarHBondContact O-N 3.37Å; L258-L261 PolarHBondContact O-N 2.92Å; L261-R265 WeakPolarHBondContact O-CB 3.22Å; L261-R265 PolarHBondContact O-N 2.8Å; L261-R265 VanDerWaalsContact O-N 3.09Å
262	W	93.8	Very high	92.6	Very high	134 Å²	134	70.6 Å²	70.6	51%	0.508	35%	0.351	S	S	.	.	H	α-helix	trans	-65.9	-45.4	174.3	-179.9	78.9	0	0	0	112.7	L258 L259 M260 Y264 R265 H268	L258-W262 WeakPolarHBondContact O-CB 3.2Å; L258-W262 PolarHBondContact O-N 2.84Å; L259-W262 HydrophobicContact CD1-CE3 4.11Å; L259-W262 WeakPolarHBondContact O-CB 3.48Å; L259-W262 PolarHBondContact O-N 2.85Å; M260-W262 PolarHBondContact O-N 3.39Å; W262-Y264 VanDerWaalsContact C-N 3.35Å; W262-Y264 PolarHBondContact O-N 3.12Å; W262-R265 PolarHBondContact O-N 3.4Å; W262-H268 PolarHBondContact O-CD2 2.96Å
263	L	92.8	Very high	92.6	Very high	27 Å²	27	70.9 Å²	70.9	14%	0.141	35%	0.354	C	S	.	.	H	α-helix	trans	-62.1	-39.1	178.8	-96.2	95.4	0	0	0	113.1	L259 M260 I269	L259-L263 HydrophobicContact CD1-CD1 3.46Å; L259-L263 VanDerWaalsContact CD1-CD1 3.46Å; L259-L263 HydrophobicContact CD2-CD1 4.39Å; L259-L263 HydrophobicContact CG-CD1 3.54Å; L259-L263 WeakPolarHBondContact O-CD1 3.4Å; L259-L263 PolarHBondContact O-N 2.88Å; M260-L263 PolarHBondContact O-N 3.41Å; M260-L263 VanDerWaalsContact O-N 3.1Å; L263-I269 HydrophobicContact CB-CD1 4.18Å; L263-I269 HydrophobicContact CB-CG1 4.09Å; L263-I269 HydrophobicContact CD2-CD1 4.49Å; L263-I269 HydrophobicContact CD2-CG1 4.02Å; L263-I269 HydrophobicContact CG-CG1 4.43Å; L263-I269 WeakPolarHBondContact O-CG1 3.45Å; L263-I269 PolarHBondContact O-N 2.86Å
264	Y	92.9	Very high	92.5	Very high	69 Å²	69	71.7 Å²	71.7	27%	0.271	36%	0.362	S	S	.	.	H	α-helix	trans	-87.2	-15.6	-174.9	-78.3	-103.5	0	0	0	113.3	M260 W262 I269 W338 L342	M260-Y264 HydrophobicContact CE-CD2 4.35Å; M260-Y264 HydrophobicContact CE-CE2 3.99Å; M260-Y264 HydrophobicContact CG-CD2 3.71Å; M260-Y264 HydrophobicContact CG-CE2 3.7Å; M260-Y264 WeakPolarHBondContact O-CD2 3.38Å; M260-Y264 PolarHBondContact O-N 3.04Å; W262-Y264 VanDerWaalsContact C-N 3.35Å; W262-Y264 PolarHBondContact O-N 3.12Å; Y264-I269 HydrophobicContact CD1-CD1 4.17Å; Y264-I269 HydrophobicContact CD2-CD1 3.86Å; Y264-I269 HydrophobicContact CE1-CD1 4.2Å; Y264-I269 HydrophobicContact CE2-CD1 3.9Å; Y264-I269 HydrophobicContact CG-CD1 4.03Å; Y264-W338 AromaticContact CD1-NE1 3.93Å; Y264-W338 AromaticContact CE1-CD1 3.75Å; Y264-W338 HydrophobicContact CE1-CD2 4.12Å; Y264-W338 AromaticContact CE1-CE2 3.48Å; Y264-W338 VanDerWaalsContact CE1-CE2 3.48Å; Y264-W338 HydrophobicContact CE1-CG 4.28Å; Y264-W338 AromaticContact CE1-CZ2 3.86Å; Y264-W338 HydrophobicContact CE1-CZ2 3.86Å; Y264-W338 AromaticContact CE1-NE1 3.25Å; Y264-W338 VanDerWaalsContact CE1-NE1 3.25Å; Y264-W338 PolarHBondContact OH-O 3.48Å; Y264-L342 PolarHBondContact OH-N 3.26Å
265	R	92.5	Very high	92.5	Very high	149 Å²	149	73.2 Å²	73.2	56%	0.562	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-71.9	147.1	173	-171	167.2	73	163.8	4.7	110.5	L261 W262 Q267 H268	L261-R265 WeakPolarHBondContact O-CB 3.22Å; L261-R265 PolarHBondContact O-N 2.8Å; L261-R265 VanDerWaalsContact O-N 3.09Å; W262-R265 PolarHBondContact O-N 3.4Å; R265-Q267 PolarHBondContact O-N 2.79Å; R265-H268 PolarHBondContact O-CD2 3.18Å; R265-H268 PolarHBondContact O-N 2.83Å; R265-H268 VanDerWaalsContact O-N 3.08Å
266	D	81.6	Confident	92.4	Very high	124 Å²	124	73.2 Å²	73.2	66%	0.663	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	46.9	34.3	170	-56	-27.8	0	0	0	115.3	H268	D266-H268 PolarHBondContact O-N 3.49Å; D266-H268 VanDerWaalsContact O-N 3.14Å
267	Q	86.4	Confident	92.3	Very high	153 Å²	153	74.5 Å²	74.5	72%	0.715	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	52.6	31.1	-178.8	-57.7	-166.5	-17.6	0	0	115	R265 I269 A270 M271	R265-Q267 PolarHBondContact O-N 2.79Å; Q267-I269 PolarHBondContact O-N 3.45Å; Q267-I269 VanDerWaalsContact O-N 3.15Å; Q267-A270 HydrophobicContact CB-CB 4.15Å; Q267-A270 WeakPolarHBondContact O-CA 3.45Å; Q267-A270 WeakPolarHBondContact O-CB 3.43Å; Q267-A270 PolarHBondContact O-N 3.49Å; Q267-M271 PolarHBondContact O-N 3.39Å; Q267-M271 VanDerWaalsContact O-N 3.07Å
268	H	91.3	Very high	92.3	Very high	50 Å²	50	75.2 Å²	75.2	23%	0.231	38%	0.378	C	S	.	.	H	α-helix	trans	-55.2	-34.9	178.6	-77	-62	0	0	0	113.3	W262 R265 D266 A270 M271 L272	W262-H268 PolarHBondContact O-CD2 2.96Å; R265-H268 PolarHBondContact O-CD2 3.18Å; R265-H268 PolarHBondContact O-N 2.83Å; R265-H268 VanDerWaalsContact O-N 3.08Å; D266-H268 PolarHBondContact O-N 3.49Å; D266-H268 VanDerWaalsContact O-N 3.14Å; H268-A270 VanDerWaalsContact C-N 3.35Å; H268-A270 PolarHBondContact O-N 3.11Å; H268-M271 PolarHBondContact O-N 3.22Å; H268-L272 WeakPolarHBondContact O-CB 3.46Å; H268-L272 PolarHBondContact O-N 3.19Å
269	I	91.9	Very high	92.2	Very high	8 Å²	8	72.5 Å²	72.5	4%	0.041	37%	0.372	C	S	.	.	H	α-helix	trans	-59.4	-43.2	172.5	-72.3	157.6	0	0	0	112.1	L263 Y264 Q267 L272 A273 Q334 L337 W338	L263-I269 HydrophobicContact CB-CD1 4.18Å; L263-I269 HydrophobicContact CB-CG1 4.09Å; L263-I269 HydrophobicContact CD2-CD1 4.49Å; L263-I269 HydrophobicContact CD2-CG1 4.02Å; L263-I269 HydrophobicContact CG-CG1 4.43Å; L263-I269 WeakPolarHBondContact O-CG1 3.45Å; L263-I269 PolarHBondContact O-N 2.86Å; Y264-I269 HydrophobicContact CD1-CD1 4.17Å; Y264-I269 HydrophobicContact CD2-CD1 3.86Å; Y264-I269 HydrophobicContact CE1-CD1 4.2Å; Y264-I269 HydrophobicContact CE2-CD1 3.9Å; Y264-I269 HydrophobicContact CG-CD1 4.03Å; Q267-I269 PolarHBondContact O-N 3.45Å; Q267-I269 VanDerWaalsContact O-N 3.15Å; I269-L272 PolarHBondContact O-N 3.47Å; I269-A273 WeakPolarHBondContact O-CB 3.24Å; I269-A273 PolarHBondContact O-N 2.84Å; I269-Q334 HydrophobicContact CG2-CG 4.29Å; I269-L337 HydrophobicContact CG2-CB 3.95Å; I269-W338 HydrophobicContact CG2-CB 4.31Å
270	A	91.9	Very high	92.2	Very high	22 Å²	22	70.3 Å²	70.3	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-68.7	-40.6	180	0	0	0	0	0	111	Q267 H268 A273 S274	Q267-A270 HydrophobicContact CB-CB 4.15Å; Q267-A270 WeakPolarHBondContact O-CA 3.45Å; Q267-A270 WeakPolarHBondContact O-CB 3.43Å; Q267-A270 PolarHBondContact O-N 3.49Å; H268-A270 VanDerWaalsContact C-N 3.35Å; H268-A270 PolarHBondContact O-N 3.11Å; A270-A273 PolarHBondContact O-N 2.94Å; A270-S274 WeakPolarHBondContact O-CB 3.43Å; A270-S274 PolarHBondContact O-N 3.42Å; A270-S274 PolarHBondContact O-OG 3.44Å
271	M	93.1	Very high	92.2	Very high	107 Å²	107	71 Å²	71	53%	0.527	37%	0.365	S	S	.	.	H	α-helix	trans	-62.1	-42.9	174.1	-176	-173.9	-68	0	0	112	Q267 H268 S274 N275	Q267-M271 PolarHBondContact O-N 3.39Å; Q267-M271 VanDerWaalsContact O-N 3.07Å; H268-M271 PolarHBondContact O-N 3.22Å; M271-S274 WeakPolarHBondContact CA-OG 3.34Å; M271-S274 PolarHBondContact O-OG 3.21Å; M271-N275 WeakPolarHBondContact O-CB 3.49Å; M271-N275 PolarHBondContact O-N 3.14Å; M271-N275 VanDerWaalsContact O-N 3.1Å; M271-N275 PolarHBondContact O-ND2 2.92Å
272	L	92	Very high	92.3	Very high	91 Å²	91	68.2 Å²	68.2	48%	0.476	36%	0.355	S	S	.	.	H	α-helix	trans	-62.7	-47.8	176.7	-173.2	64.3	0	0	0	110.1	H268 I269 S274 N275 M276 L337	H268-L272 WeakPolarHBondContact O-CB 3.46Å; H268-L272 PolarHBondContact O-N 3.19Å; I269-L272 PolarHBondContact O-N 3.47Å; L272-S274 PolarHBondContact O-N 2.72Å; L272-N275 PolarHBondContact O-N 2.7Å; L272-M276 WeakPolarHBondContact O-CG 3.37Å; L272-M276 PolarHBondContact O-N 3.31Å; L272-M276 VanDerWaalsContact O-N 3.1Å; L272-L337 HydrophobicContact CB-CD1 4.28Å; L272-L337 HydrophobicContact CD2-CD1 4.02Å; L272-L337 HydrophobicContact CD2-CD2 4.09Å; L272-L337 HydrophobicContact CG-CD1 4.04Å
273	A	92.6	Very high	92.2	Very high	10 Å²	10	64.6 Å²	64.6	8%	0.083	35%	0.348	C	S	.	.	H	α-helix	trans	-59.8	-45.7	178	0	0	0	0	0	112.6	I269 A270 N275 M276 I333 Q334 L337	I269-A273 WeakPolarHBondContact O-CB 3.24Å; I269-A273 PolarHBondContact O-N 2.84Å; A270-A273 PolarHBondContact O-N 2.94Å; A273-N275 PolarHBondContact O-N 3.43Å; A273-M276 PolarHBondContact O-N 3.21Å; A273-I333 HydrophobicContact CB-CG2 4.08Å; A273-Q334 HydrophobicContact CB-CB 3.82Å; A273-Q334 HydrophobicContact CB-CG 4.31Å; A273-L337 HydrophobicContact CB-CD1 3.96Å
274	S	91.6	Very high	92.3	Very high	69 Å²	69	63.5 Å²	63.5	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-64.8	-30.2	179.5	63.9	0	0	0	0	112.6	A270 M271 L272 P278	A270-S274 WeakPolarHBondContact O-CB 3.43Å; A270-S274 PolarHBondContact O-N 3.42Å; A270-S274 PolarHBondContact O-OG 3.44Å; M271-S274 WeakPolarHBondContact CA-OG 3.34Å; M271-S274 PolarHBondContact O-OG 3.21Å; L272-S274 PolarHBondContact O-N 2.72Å; S274-P278 WeakPolarHBondContact O-CD 3.5Å; S274-P278 WeakPolarHBondContact O-CG 3.44Å
275	N	93.8	Very high	92.5	Very high	92 Å²	92	65.4 Å²	65.4	49%	0.492	35%	0.354	S	S	.	.	H	α-helix	trans	-83.6	-17.2	178.1	-66.8	-12.5	0	0	0	113.1	M271 L272 A273 A279	M271-N275 WeakPolarHBondContact O-CB 3.49Å; M271-N275 PolarHBondContact O-N 3.14Å; M271-N275 VanDerWaalsContact O-N 3.1Å; M271-N275 PolarHBondContact O-ND2 2.92Å; L272-N275 PolarHBondContact O-N 2.7Å; A273-N275 PolarHBondContact O-N 3.43Å; N275-A279 VanDerWaalsContact O-CB 3.23Å; N275-A279 WeakPolarHBondContact O-CB 3.45Å; N275-A279 PolarHBondContact O-N 3.45Å; N275-A279 VanDerWaalsContact O-N 3.12Å
276	M	93.1	Very high	92.6	Very high	60 Å²	60	64 Å²	64	30%	0.296	35%	0.353	S	S	.	.	H	α-helix	trans	-66.5	-43.1	-178.3	-66.4	-154.3	77.4	0	0	112.9	L272 A273 A279 A280 I333 L337	L272-M276 WeakPolarHBondContact O-CG 3.37Å; L272-M276 PolarHBondContact O-N 3.31Å; L272-M276 VanDerWaalsContact O-N 3.1Å; A273-M276 PolarHBondContact O-N 3.21Å; M276-A279 PolarHBondContact O-N 2.95Å; M276-A280 WeakPolarHBondContact O-CB 3.22Å; M276-A280 PolarHBondContact O-N 2.82Å; M276-I333 HydrophobicContact CB-CG2 4.4Å; M276-I333 HydrophobicContact CG-CG2 4.26Å; M276-I333 HydrophobicContact SD-CG2 3.64Å; M276-L337 HydrophobicContact SD-CD1 3.93Å
277	V	92.9	Very high	93.1	Very high	26 Å²	26	58.6 Å²	58.6	16%	0.158	33%	0.325	C	S	.	.	H	α-helix	trans	-67.1	-50.7	-177.8	179.6	0	0	0	0	111.1	A279 A280 D281 I326 A330 I333	V277-A279 VanDerWaalsContact C-N 3.27Å; V277-A279 PolarHBondContact O-N 3.24Å; V277-A280 WeakPolarHBondContact O-CA 3.44Å; V277-A280 WeakPolarHBondContact O-CB 3.36Å; V277-A280 PolarHBondContact O-N 3.5Å; V277-D281 PolarHBondContact O-N 2.88Å; V277-I326 HydrophobicContact CG2-CG2 4.48Å; V277-A330 HydrophobicContact CG2-CB 3.85Å; V277-I333 HydrophobicContact CG2-CD1 4.04Å
278	P	95.2	Very high	93.5	Very high	73 Å²	73	53.5 Å²	53.5	47%	0.474	30%	0.301	S	S	.	.	H	α-helix	trans	-59.8	-35	174.7	-23.9	34.3	0	0	0	113.7	S274 D281 S282	S274-P278 WeakPolarHBondContact O-CD 3.5Å; S274-P278 WeakPolarHBondContact O-CG 3.44Å; P278-D281 PolarHBondContact O-N 3.1Å; P278-S282 WeakPolarHBondContact O-CB 3.38Å; P278-S282 PolarHBondContact O-N 3.43Å
279	A	93.6	Very high	93.6	Very high	55 Å²	55	55.9 Å²	55.9	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-66.3	-40.6	174.3	0	0	0	0	0	111.7	N275 M276 V277 S282 V283	N275-A279 VanDerWaalsContact O-CB 3.23Å; N275-A279 WeakPolarHBondContact O-CB 3.45Å; N275-A279 PolarHBondContact O-N 3.45Å; N275-A279 VanDerWaalsContact O-N 3.12Å; M276-A279 PolarHBondContact O-N 2.95Å; V277-A279 VanDerWaalsContact C-N 3.27Å; V277-A279 PolarHBondContact O-N 3.24Å; A279-S282 PolarHBondContact O-N 2.95Å; A279-V283 WeakPolarHBondContact O-CG2 3.24Å; A279-V283 PolarHBondContact O-N 3.41Å
280	A	94.2	Very high	93.6	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-63.7	-41	174.4	0	0	0	0	0	111.7	M276 V277 V283 A284 W322 I323 I326 F362	M276-A280 WeakPolarHBondContact O-CB 3.22Å; M276-A280 PolarHBondContact O-N 2.82Å; V277-A280 WeakPolarHBondContact O-CA 3.44Å; V277-A280 WeakPolarHBondContact O-CB 3.36Å; V277-A280 PolarHBondContact O-N 3.5Å; A280-V283 PolarHBondContact O-N 2.82Å; A280-A284 WeakPolarHBondContact O-CB 3.3Å; A280-A284 PolarHBondContact O-N 2.92Å; A280-W322 HydrophobicContact CB-CH2 3.97Å; A280-W322 HydrophobicContact CB-CZ2 4.33Å; A280-I323 HydrophobicContact CB-CD1 3.84Å; A280-I326 HydrophobicContact CB-CG2 3.94Å; A280-F362 HydrophobicContact CB-CE2 4.3Å; A280-F362 HydrophobicContact CB-CZ 3.95Å
281	D	95.1	Very high	93.6	Very high	60 Å²	60	57.2 Å²	57.2	32%	0.321	32%	0.316	S	S	.	.	H	α-helix	trans	-61.1	-45.3	174.8	-70.2	-36.8	0	0	0	111.6	V277 P278 V283 A284 Q285 I323 H327	V277-D281 PolarHBondContact O-N 2.88Å; P278-D281 PolarHBondContact O-N 3.1Å; D281-V283 VanDerWaalsContact C-N 3.34Å; D281-V283 PolarHBondContact O-N 3.48Å; D281-A284 WeakPolarHBondContact O-CB 3.36Å; D281-A284 PolarHBondContact O-N 2.64Å; D281-Q285 WeakPolarHBondContact O-CB 3.25Å; D281-Q285 PolarHBondContact O-N 2.58Å; D281-I323 WeakPolarHBondContact OD1-CD1 3.48Å; D281-I323 WeakPolarHBondContact OD1-CG1 3.36Å; D281-H327 IonicContact OD1-CE1 3.09Å; D281-H327 PolarHBondContact OD1-CE1 3.21Å; D281-H327 IonicContact OD1-NE2 3.63Å; D281-H327 IonicContact OD2-NE2 3.96Å
282	S	95.1	Very high	93.5	Very high	53 Å²	53	57.6 Å²	57.6	37%	0.371	32%	0.316	S	S	.	.	H	α-helix	trans	-61.5	-41.9	176.7	-173	0	0	0	0	112	P278 A279 Q285 Q286	P278-S282 WeakPolarHBondContact O-CB 3.38Å; P278-S282 PolarHBondContact O-N 3.43Å; A279-S282 PolarHBondContact O-N 2.95Å; S282-Q285 PolarHBondContact O-N 3.01Å; S282-Q286 VanDerWaalsContact O-CG 3.3Å; S282-Q286 WeakPolarHBondContact O-CG 3.5Å; S282-Q286 PolarHBondContact O-N 2.93Å; S282-Q286 PolarHBondContact OG-NE2 2.91Å
283	V	93.1	Very high	93.4	Very high	59 Å²	59	59.7 Å²	59.7	36%	0.358	32%	0.318	S	S	.	.	H	α-helix	trans	-66.1	-41	175.5	171.3	0	0	0	0	111.4	A279 A280 D281 Q286 L287 W322	A279-V283 WeakPolarHBondContact O-CG2 3.24Å; A279-V283 PolarHBondContact O-N 3.41Å; A280-V283 PolarHBondContact O-N 2.82Å; D281-V283 VanDerWaalsContact C-N 3.34Å; D281-V283 PolarHBondContact O-N 3.48Å; V283-Q286 PolarHBondContact O-N 3.49Å; V283-L287 WeakPolarHBondContact O-CB 3.43Å; V283-L287 PolarHBondContact O-N 3.37Å; V283-W322 HydrophobicContact CB-CH2 4.47Å; V283-W322 HydrophobicContact CG1-CH2 4.28Å
284	A	94.9	Very high	93.2	Very high	4 Å²	4	59.4 Å²	59.4	3%	0.033	32%	0.315	C	S	.	.	H	α-helix	trans	-58.7	-49.9	175.3	0	0	0	0	0	110.5	A280 D281 Q286 L287 E288 I319 W322 I323	A280-A284 WeakPolarHBondContact O-CB 3.3Å; A280-A284 PolarHBondContact O-N 2.92Å; D281-A284 WeakPolarHBondContact O-CB 3.36Å; D281-A284 PolarHBondContact O-N 2.64Å; A284-Q286 PolarHBondContact O-N 3.43Å; A284-L287 PolarHBondContact O-N 2.88Å; A284-E288 WeakPolarHBondContact O-CG 3.41Å; A284-E288 PolarHBondContact O-N 3.17Å; A284-I319 HydrophobicContact CB-CG2 4.04Å; A284-W322 HydrophobicContact CB-CZ3 3.96Å; A284-I323 HydrophobicContact CB-CB 4.26Å; A284-I323 HydrophobicContact CB-CD1 4.3Å; A284-I323 HydrophobicContact CB-CG1 4.13Å
285	Q	96.1	Very high	93	Very high	109 Å²	109	58.1 Å²	58.1	51%	0.509	30%	0.302	S	S	.	.	H	α-helix	trans	-59.7	-47.6	179.2	-174.7	-177	-15.7	0	0	112	D281 S282 L287 E288 E289	D281-Q285 WeakPolarHBondContact O-CB 3.25Å; D281-Q285 PolarHBondContact O-N 2.58Å; S282-Q285 PolarHBondContact O-N 3.01Å; Q285-L287 VanDerWaalsContact C-N 3.25Å; Q285-L287 PolarHBondContact O-N 3.28Å; Q285-E288 PolarHBondContact O-N 2.91Å; Q285-E289 HydrophobicContact CG-CG 4.49Å; Q285-E289 WeakPolarHBondContact CG-OE1 3.49Å; Q285-E289 PolarHBondContact NE2-OE1 3.34Å; Q285-E289 WeakPolarHBondContact O-CB 3.46Å; Q285-E289 WeakPolarHBondContact O-CG 3.31Å; Q285-E289 PolarHBondContact O-N 3.32Å
286	Q	94.4	Very high	92.4	Very high	119 Å²	119	55.2 Å²	55.2	56%	0.556	29%	0.294	S	S	*	.	H	α-helix	trans	-60.2	-37.5	177.6	-72.8	173.5	25.5	0	0	112.1	S282 V283 A284 L290	S282-Q286 VanDerWaalsContact O-CG 3.3Å; S282-Q286 WeakPolarHBondContact O-CG 3.5Å; S282-Q286 PolarHBondContact O-N 2.93Å; S282-Q286 PolarHBondContact OG-NE2 2.91Å; V283-Q286 PolarHBondContact O-N 3.49Å; A284-Q286 PolarHBondContact O-N 3.43Å; Q286-L290 VanDerWaalsContact O-CB 3.25Å; Q286-L290 WeakPolarHBondContact O-CB 3.37Å; Q286-L290 PolarHBondContact O-N 3.23Å
287	L	93.2	Very high	91.6	Very high	11 Å²	11	55.3 Å²	55.3	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-73.7	-35.7	179	-168.4	58.7	0	0	0	112	V283 A284 Q285 L290 L291 I319 F369 L440	V283-L287 WeakPolarHBondContact O-CB 3.43Å; V283-L287 PolarHBondContact O-N 3.37Å; A284-L287 PolarHBondContact O-N 2.88Å; Q285-L287 VanDerWaalsContact C-N 3.25Å; Q285-L287 PolarHBondContact O-N 3.28Å; L287-L290 HydrophobicContact CD1-CD2 4.21Å; L287-L291 HydrophobicContact CG-CD1 4.46Å; L287-L291 WeakPolarHBondContact O-CB 3.47Å; L287-L291 PolarHBondContact O-N 2.88Å; L287-I319 HydrophobicContact CB-CD1 4.04Å; L287-I319 HydrophobicContact CD2-CD1 3.54Å; L287-I319 HydrophobicContact CD2-CG1 3.76Å; L287-I319 HydrophobicContact CG-CD1 3.45Å; L287-I319 VanDerWaalsContact CG-CD1 3.45Å; L287-I319 HydrophobicContact CG-CG1 4.24Å; L287-F369 HydrophobicContact CD2-CE2 3.99Å; L287-L440 HydrophobicContact CD1-CD1 3.66Å
288	E	94.3	Very high	90.9	Very high	45 Å²	45	54 Å²	54	21%	0.21	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-47.9	171.4	-72.3	-179.9	-165.3	0	0	111.5	A284 Q285 L290 L291 Q292 L316 I319 H320	A284-E288 WeakPolarHBondContact O-CG 3.41Å; A284-E288 PolarHBondContact O-N 3.17Å; Q285-E288 PolarHBondContact O-N 2.91Å; E288-L290 VanDerWaalsContact C-N 3.33Å; E288-L290 PolarHBondContact O-N 2.8Å; E288-L291 PolarHBondContact O-N 3.23Å; E288-Q292 WeakPolarHBondContact O-CB 3.29Å; E288-Q292 VanDerWaalsContact O-CG 3.28Å; E288-Q292 WeakPolarHBondContact O-CG 3.38Å; E288-Q292 PolarHBondContact O-N 3.49Å; E288-L316 HydrophobicContact CB-CD2 4.05Å; E288-L316 HydrophobicContact CG-CD2 3.78Å; E288-I319 HydrophobicContact CG-CG2 4.15Å; E288-H320 IonicContact OE1-CE1 3Å; E288-H320 PolarHBondContact OE1-CE1 3.47Å; E288-H320 IonicContact OE1-ND1 3.28Å; E288-H320 PolarHBondContact OE1-ND1 3.05Å; E288-H320 IonicContact OE1-NE2 3.96Å; E288-H320 IonicContact OE2-CE1 3.93Å
289	E	94.2	Very high	89.7	Confident	101 Å²	101	55.1 Å²	55.1	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-59.7	-43.1	175.7	-73.3	174.5	-168.8	0	0	111.4	Q285 L291 Q292 W293	Q285-E289 HydrophobicContact CG-CG 4.49Å; Q285-E289 WeakPolarHBondContact CG-OE1 3.49Å; Q285-E289 PolarHBondContact NE2-OE1 3.34Å; Q285-E289 WeakPolarHBondContact O-CB 3.46Å; Q285-E289 WeakPolarHBondContact O-CG 3.31Å; Q285-E289 PolarHBondContact O-N 3.32Å; E289-L291 PolarHBondContact O-N 2.64Å; E289-Q292 PolarHBondContact O-N 3.23Å; E289-W293 WeakPolarHBondContact O-CB 3.4Å; E289-W293 PolarHBondContact O-N 3.04Å
290	L	92.3	Very high	88.6	Confident	55 Å²	55	55.8 Å²	55.8	29%	0.288	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-41.7	175.5	-179.1	63.1	0	0	0	112.1	Q286 L287 E288 W293 L294 V436 L440	Q286-L290 VanDerWaalsContact O-CB 3.25Å; Q286-L290 WeakPolarHBondContact O-CB 3.37Å; Q286-L290 PolarHBondContact O-N 3.23Å; L287-L290 HydrophobicContact CD1-CD2 4.21Å; E288-L290 VanDerWaalsContact C-N 3.33Å; E288-L290 PolarHBondContact O-N 2.8Å; L290-W293 HydrophobicContact CD1-CE3 4.35Å; L290-L294 VanDerWaalsContact O-CB 3.29Å; L290-L294 WeakPolarHBondContact O-CB 3.38Å; L290-L294 PolarHBondContact O-N 3.24Å; L290-V436 HydrophobicContact CD2-CG1 3.6Å; L290-V436 HydrophobicContact CG-CG1 4.22Å; L290-L440 HydrophobicContact CD2-CD1 4.38Å
291	L	91.6	Very high	87.7	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-68.4	-40.1	176.3	-87	158.4	0	0	0	112.3	L287 E288 E289 W293 L294 M295 F315 L316 I319 Y433 F437	L287-L291 HydrophobicContact CG-CD1 4.46Å; L287-L291 WeakPolarHBondContact O-CB 3.47Å; L287-L291 PolarHBondContact O-N 2.88Å; E288-L291 PolarHBondContact O-N 3.23Å; E289-L291 PolarHBondContact O-N 2.64Å; L291-W293 VanDerWaalsContact C-N 3.35Å; L291-L294 WeakPolarHBondContact O-CB 3.46Å; L291-L294 PolarHBondContact O-N 3.18Å; L291-M295 WeakPolarHBondContact O-CB 3.39Å; L291-M295 VanDerWaalsContact O-CG 3.24Å; L291-M295 WeakPolarHBondContact O-CG 3.44Å; L291-M295 PolarHBondContact O-N 3.37Å; L291-F315 HydrophobicContact CD1-CB 3.86Å; L291-F315 HydrophobicContact CD2-CB 3.81Å; L291-F315 HydrophobicContact CD2-CD2 4.34Å; L291-F315 HydrophobicContact CD2-CG 4.45Å; L291-L316 HydrophobicContact CB-CD2 4.02Å; L291-L316 HydrophobicContact CB-CG 4.36Å; L291-L316 HydrophobicContact CD1-CD2 3.98Å; L291-L316 HydrophobicContact CD1-CG 4.24Å; L291-I319 HydrophobicContact CD1-CD1 3.21Å; L291-Y433 HydrophobicContact CD2-CD1 4.49Å; L291-Y433 HydrophobicContact CD2-CE1 3.69Å; L291-F437 HydrophobicContact CD2-CZ 4.38Å
292	Q	90.6	Very high	86.7	Confident	116 Å²	116	66.7 Å²	66.7	54%	0.542	37%	0.371	S	S	.	.	H	α-helix	trans	-64.9	-40.5	175.4	-71.9	174.6	11.4	0	0	111.3	E288 E289 L294 M295 G296	E288-Q292 WeakPolarHBondContact O-CB 3.29Å; E288-Q292 VanDerWaalsContact O-CG 3.28Å; E288-Q292 WeakPolarHBondContact O-CG 3.38Å; E288-Q292 PolarHBondContact O-N 3.49Å; E289-Q292 PolarHBondContact O-N 3.23Å; Q292-L294 VanDerWaalsContact C-N 3.33Å; Q292-M295 PolarHBondContact O-N 3.43Å; Q292-G296 PolarHBondContact O-N 2.87Å
293	W	90.1	Very high	86	Confident	135 Å²	135	64.9 Å²	64.9	51%	0.511	36%	0.357	S	S	.	.	H	α-helix	trans	-61	-43	172.6	178	84.7	0	0	0	111.6	E289 L290 L291 M295 G296 P298	E289-W293 WeakPolarHBondContact O-CB 3.4Å; E289-W293 PolarHBondContact O-N 3.04Å; L290-W293 HydrophobicContact CD1-CE3 4.35Å; L291-W293 VanDerWaalsContact C-N 3.35Å; W293-M295 VanDerWaalsContact C-N 3.34Å; W293-M295 PolarHBondContact O-N 2.87Å; W293-G296 PolarHBondContact O-N 2.95Å; W293-P298 HydrophobicContact CD2-CB 4.07Å; W293-P298 HydrophobicContact CE3-CB 3.72Å; W293-P298 HydrophobicContact CH2-CB 3.31Å; W293-P298 HydrophobicContact CZ2-CB 3.67Å; W293-P298 HydrophobicContact CZ3-CB 3.34Å
294	L	87.6	Confident	85.8	Confident	3 Å²	3	64.9 Å²	64.9	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-63.3	-38.3	177.1	-170.6	60.8	0	0	0	112.1	L290 L291 Q292 G296 P298 M303 L432 Y433	L290-L294 VanDerWaalsContact O-CB 3.29Å; L290-L294 WeakPolarHBondContact O-CB 3.38Å; L290-L294 PolarHBondContact O-N 3.24Å; L291-L294 WeakPolarHBondContact O-CB 3.46Å; L291-L294 PolarHBondContact O-N 3.18Å; Q292-L294 VanDerWaalsContact C-N 3.33Å; L294-G296 PolarHBondContact O-N 3.4Å; L294-P298 HydrophobicContact CD1-CB 4.46Å; L294-P298 HydrophobicContact CD1-CG 4.16Å; L294-P298 WeakPolarHBondContact O-CD 3.48Å; L294-M303 HydrophobicContact CD1-CE 4.04Å; L294-M303 HydrophobicContact CD1-SD 4.44Å; L294-L432 HydrophobicContact CD1-CB 4.28Å; L294-L432 HydrophobicContact CD1-CD2 3.3Å; L294-L432 HydrophobicContact CD1-CG 3.51Å; L294-Y433 HydrophobicContact CD1-CD2 4.36Å; L294-Y433 HydrophobicContact CD1-CE2 4.27Å; L294-Y433 HydrophobicContact CD2-CD1 3.47Å; L294-Y433 VanDerWaalsContact CD2-CD1 3.47Å; L294-Y433 HydrophobicContact CD2-CD2 3.58Å; L294-Y433 HydrophobicContact CD2-CE1 3.36Å; L294-Y433 HydrophobicContact CD2-CE2 3.47Å; L294-Y433 VanDerWaalsContact CD2-CE2 3.47Å; L294-Y433 HydrophobicContact CD2-CG 3.58Å; L294-Y433 HydrophobicContact CG-CD2 3.94Å; L294-Y433 HydrophobicContact CG-CE1 4.15Å; L294-Y433 HydrophobicContact CG-CE2 3.5Å; L294-Y433 VanDerWaalsContact CG-CE2 3.5Å; L294-Y433 HydrophobicContact CG-CG 4.44Å
295	M	87	Confident	85.4	Confident	43 Å²	43	71.9 Å²	71.9	21%	0.212	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-10.2	178.2	-72.4	170.1	73.9	0	0	115.1	L291 Q292 W293 D308 G312 L316	L291-M295 WeakPolarHBondContact O-CB 3.39Å; L291-M295 VanDerWaalsContact O-CG 3.24Å; L291-M295 WeakPolarHBondContact O-CG 3.44Å; L291-M295 PolarHBondContact O-N 3.37Å; Q292-M295 PolarHBondContact O-N 3.43Å; W293-M295 VanDerWaalsContact C-N 3.34Å; W293-M295 PolarHBondContact O-N 2.87Å; M295-D308 WeakPolarHBondContact CA-OD2 3.47Å; M295-G312 VanDerWaalsContact SD-CA 3.56Å; M295-L316 HydrophobicContact SD-CD1 4.12Å
296	G	82.3	Confident	85.1	Confident	31 Å²	31	69.7 Å²	69.7	32%	0.32	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-90.8	-174.5	0	0	0	0	0	112.9	Q292 W293 L294 R305	Q292-G296 PolarHBondContact O-N 2.87Å; W293-G296 PolarHBondContact O-N 2.95Å; L294-G296 PolarHBondContact O-N 3.4Å; G296-R305 PolarHBondContact O-NH2 3.45Å
297	A	76.8	Confident	84.9	Confident	61 Å²	61	65.5 Å²	65.5	50%	0.504	36%	0.363	S	S	.	.			trans	-157.2	68.4	178.4	0	0	0	0	0	109.3	A299 G300	A297-A299 PolarHBondContact O-N 3.32Å; A297-G300 PolarHBondContact O-N 3.43Å
298	P	77.1	Confident	84.8	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-61.7	126.1	-174.9	26.8	-35.5	0	0	0	110.2	W293 L294 G300 L301 M303 L432	W293-P298 HydrophobicContact CD2-CB 4.07Å; W293-P298 HydrophobicContact CE3-CB 3.72Å; W293-P298 HydrophobicContact CH2-CB 3.31Å; W293-P298 HydrophobicContact CZ2-CB 3.67Å; W293-P298 HydrophobicContact CZ3-CB 3.34Å; L294-P298 HydrophobicContact CD1-CB 4.46Å; L294-P298 HydrophobicContact CD1-CG 4.16Å; L294-P298 WeakPolarHBondContact O-CD 3.48Å; P298-G300 PolarHBondContact O-N 3.43Å; P298-L301 WeakPolarHBondContact O-CB 3.46Å; P298-L301 PolarHBondContact O-N 2.94Å; P298-M303 VanDerWaalsContact CD-SD 3.54Å; P298-M303 HydrophobicContact CG-CE 4.46Å; P298-M303 HydrophobicContact CG-CG 4.36Å; P298-M303 HydrophobicContact CG-SD 3.24Å; P298-M303 WeakPolarHBondContact CG-SD 3.43Å; P298-L432 HydrophobicContact CB-CD2 3.86Å; P298-L432 HydrophobicContact CG-CD2 3.39Å
299	A	71.4	Confident	84.6	Confident	96 Å²	96	67 Å²	67	79%	0.793	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	50.7	26.8	-179.1	0	0	0	0	0	114.9	A297 L301	A297-A299 PolarHBondContact O-N 3.32Å; A299-L301 VanDerWaalsContact C-N 3.25Å; A299-L301 PolarHBondContact O-N 2.97Å
300	G	70.3	Confident	84.5	Confident	69 Å²	69	66.9 Å²	66.9	71%	0.711	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	74.9	7.7	-177.4	0	0	0	0	0	114.9	A297 P298 K302	A297-G300 PolarHBondContact O-N 3.43Å; P298-G300 PolarHBondContact O-N 3.43Å; G300-K302 PolarHBondContact O-N 3.49Å
301	L	73.5	Confident	84.5	Confident	83 Å²	83	65.1 Å²	65.1	44%	0.435	37%	0.366	S	S	.	.			trans	-74.6	123.1	178.6	-130.6	121.1	0	0	0	110.1	P298 A299 M303 P428	P298-L301 WeakPolarHBondContact O-CB 3.46Å; P298-L301 PolarHBondContact O-N 2.94Å; A299-L301 VanDerWaalsContact C-N 3.25Å; A299-L301 PolarHBondContact O-N 2.97Å; L301-M303 PolarHBondContact O-N 3.39Å; L301-P428 HydrophobicContact CD2-CB 3.96Å
302	K	75.6	Confident	84.5	Confident	205 Å²	205	65 Å²	65	89%	0.891	37%	0.366	S	S	*	.			trans	-76.9	93.6	177	-171.9	169.9	-177.3	168.9	0	110.2	G300	G300-K302 PolarHBondContact O-N 3.49Å
303	M	80.6	Confident	84.7	Confident	15 Å²	15	67.9 Å²	67.9	7%	0.074	37%	0.371	C	S	.	.			trans	-80.6	157.7	177.8	-66.4	178.1	95.8	0	0	112.1	L294 P298 L301 R305 T429 L432 Y433	L294-M303 HydrophobicContact CD1-CE 4.04Å; L294-M303 HydrophobicContact CD1-SD 4.44Å; P298-M303 VanDerWaalsContact CD-SD 3.54Å; P298-M303 HydrophobicContact CG-CE 4.46Å; P298-M303 HydrophobicContact CG-CG 4.36Å; P298-M303 HydrophobicContact CG-SD 3.24Å; P298-M303 WeakPolarHBondContact CG-SD 3.43Å; L301-M303 PolarHBondContact O-N 3.39Å; M303-R305 PolarHBondContact O-N 3.32Å; M303-R305 VanDerWaalsContact O-N 3.15Å; M303-T429 WeakPolarHBondContact CB-OG1 3.45Å; M303-T429 VanDerWaalsContact CE-CA 3.48Å; M303-T429 HydrophobicContact CE-CG2 3.91Å; M303-L432 HydrophobicContact CE-CB 3.94Å; M303-L432 HydrophobicContact CE-CD2 3.68Å; M303-L432 HydrophobicContact CE-CG 4.35Å; M303-L432 HydrophobicContact SD-CD2 3.9Å; M303-Y433 HydrophobicContact CE-CD2 4.23Å; M303-Y433 HydrophobicContact CE-CE2 4.13Å
304	N	89.1	Confident	84.8	Confident	60 Å²	60	65.5 Å²	65.5	32%	0.321	37%	0.365	S	S	.	.			trans	-72	106.6	172	-175.8	-66	0	0	0	110	A306 L307 D308 L426 T429	N304-A306 VanDerWaalsContact C-N 3.31Å; N304-A306 PolarHBondContact O-N 2.97Å; N304-A306 PolarHBondContact OD1-N 3.23Å; N304-L307 HydrophobicContact CB-CB 4.37Å; N304-L307 PolarHBondContact O-N 3.42Å; N304-L307 PolarHBondContact OD1-N 2.88Å; N304-L307 VanDerWaalsContact OD1-N 3.14Å; N304-D308 WeakPolarHBondContact O-CB 3.12Å; N304-D308 PolarHBondContact O-N 2.88Å; N304-L426 HydrophobicContact CB-CD2 3.87Å; N304-T429 PolarHBondContact N-OG1 2.99Å; N304-T429 VanDerWaalsContact N-OG1 3.1Å
305	R	86.5	Confident	85.2	Confident	151 Å²	151	65.6 Å²	65.6	57%	0.57	37%	0.365	S	S	*	.	H	α-helix	trans	-55.7	-38	-174.7	-74.9	-74.8	172.7	117.3	-10.5	114.5	G296 M303 Q309	G296-R305 PolarHBondContact O-NH2 3.45Å; M303-R305 PolarHBondContact O-N 3.32Å; M303-R305 VanDerWaalsContact O-N 3.15Å; R305-Q309 WeakPolarHBondContact O-CB 3.47Å; R305-Q309 WeakPolarHBondContact O-CG 3.5Å; R305-Q309 PolarHBondContact O-N 2.66Å
306	A	89.2	Confident	85.6	Confident	62 Å²	62	64.9 Å²	64.9	51%	0.512	36%	0.362	S	S	.	.	H	α-helix	trans	-70.1	-47.2	-177.6	0	0	0	0	0	111.5	N304 V310	N304-A306 VanDerWaalsContact C-N 3.31Å; N304-A306 PolarHBondContact O-N 2.97Å; N304-A306 PolarHBondContact OD1-N 3.23Å; A306-V310 WeakPolarHBondContact O-CG2 3.42Å; A306-V310 PolarHBondContact O-N 3.4Å
307	L	89.7	Confident	86.2	Confident	32 Å²	32	70.6 Å²	70.6	17%	0.168	38%	0.375	C	S	.	.	H	α-helix	trans	-64.9	-43.7	178	176.1	63.4	0	0	0	111.5	N304 V310 L311 L426 T429 T430	N304-L307 HydrophobicContact CB-CB 4.37Å; N304-L307 PolarHBondContact O-N 3.42Å; N304-L307 PolarHBondContact OD1-N 2.88Å; N304-L307 VanDerWaalsContact OD1-N 3.14Å; L307-V310 PolarHBondContact O-N 3.46Å; L307-L311 HydrophobicContact CD1-CD1 3.92Å; L307-L311 HydrophobicContact CD1-CG 3.99Å; L307-L311 HydrophobicContact CD2-CD1 4.34Å; L307-L311 HydrophobicContact CG-CD1 3.86Å; L307-L311 HydrophobicContact CG-CG 4.31Å; L307-L311 WeakPolarHBondContact O-CG 3.35Å; L307-L311 PolarHBondContact O-N 3.47Å; L307-L426 HydrophobicContact CB-CD2 3.7Å; L307-L426 HydrophobicContact CD2-CB 4.06Å; L307-L426 HydrophobicContact CD2-CD2 3.59Å; L307-L426 HydrophobicContact CD2-CG 4.4Å; L307-L426 HydrophobicContact CG-CD2 4.21Å; L307-T429 HydrophobicContact CB-CG2 4.32Å; L307-T429 HydrophobicContact CD2-CG2 3.7Å; L307-T429 HydrophobicContact CG-CG2 3.88Å; L307-T430 HydrophobicContact CD2-CG2 3.76Å
308	D	90.4	Very high	87	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-60.8	-43.4	-179.2	-172.1	45.7	0	0	0	111.9	M295 N304 V310 L311 G312 T429 Y433	M295-D308 WeakPolarHBondContact CA-OD2 3.47Å; N304-D308 WeakPolarHBondContact O-CB 3.12Å; N304-D308 PolarHBondContact O-N 2.88Å; D308-V310 PolarHBondContact O-N 2.89Å; D308-L311 PolarHBondContact O-N 2.85Å; D308-G312 PolarHBondContact O-N 3.35Å; D308-T429 HydrophobicContact CB-CG2 4.14Å; D308-Y433 PolarHBondContact O-OH 3.04Å; D308-Y433 VanDerWaalsContact OD1-CE2 3.28Å; D308-Y433 WeakPolarHBondContact OD1-CE2 3.42Å; D308-Y433 PolarHBondContact OD1-OH 3.27Å; D308-Y433 VanDerWaalsContact OD1-OH 3.12Å
309	Q	90.9	Very high	87.9	Confident	88 Å²	88	69.8 Å²	69.8	41%	0.411	36%	0.361	S	S	.	.	H	α-helix	trans	-62.8	-41	173.3	-75.8	174.6	0	0	0	113.4	R305 R313	R305-Q309 WeakPolarHBondContact O-CB 3.47Å; R305-Q309 WeakPolarHBondContact O-CG 3.5Å; R305-Q309 PolarHBondContact O-N 2.66Å; Q309-R313 WeakPolarHBondContact O-CB 3.44Å; Q309-R313 VanDerWaalsContact O-CG 3.27Å; Q309-R313 WeakPolarHBondContact O-CG 3.31Å; Q309-R313 PolarHBondContact O-N 3.24Å
310	V	92.5	Very high	89	Confident	97 Å²	97	69.5 Å²	69.5	59%	0.588	34%	0.343	S	S	*	.	H	α-helix	trans	-67.6	-47.4	179.2	172.2	0	0	0	0	110.8	A306 L307 D308 F314	A306-V310 WeakPolarHBondContact O-CG2 3.42Å; A306-V310 PolarHBondContact O-N 3.4Å; L307-V310 PolarHBondContact O-N 3.46Å; D308-V310 PolarHBondContact O-N 2.89Å; V310-F314 VanDerWaalsContact O-CB 3.3Å; V310-F314 WeakPolarHBondContact O-CB 3.41Å; V310-F314 PolarHBondContact O-N 2.94Å
311	L	91.8	Very high	90.2	Very high	19 Å²	19	70.7 Å²	70.7	10%	0.099	33%	0.332	C	S	.	.	H	α-helix	trans	-64.2	-46.3	177.8	-70.9	175.9	0	0	0	111.3	L307 D308 F314 F315 L376 T429 Y433	L307-L311 HydrophobicContact CD1-CD1 3.92Å; L307-L311 HydrophobicContact CD1-CG 3.99Å; L307-L311 HydrophobicContact CD2-CD1 4.34Å; L307-L311 HydrophobicContact CG-CD1 3.86Å; L307-L311 HydrophobicContact CG-CG 4.31Å; L307-L311 WeakPolarHBondContact O-CG 3.35Å; L307-L311 PolarHBondContact O-N 3.47Å; D308-L311 PolarHBondContact O-N 2.85Å; L311-F314 WeakPolarHBondContact O-CB 3.36Å; L311-F314 PolarHBondContact O-N 3.5Å; L311-F315 HydrophobicContact CB-CD2 4.4Å; L311-F315 HydrophobicContact CB-CE2 4.21Å; L311-F315 HydrophobicContact CD2-CE2 4.18Å; L311-F315 WeakPolarHBondContact O-CD2 3.46Å; L311-F315 PolarHBondContact O-N 2.83Å; L311-L376 HydrophobicContact CD1-CD2 4.22Å; L311-L376 HydrophobicContact CD2-CD2 3.78Å; L311-T429 HydrophobicContact CD1-CG2 4.35Å; L311-Y433 HydrophobicContact CB-CD1 4.39Å; L311-Y433 HydrophobicContact CB-CE1 3.98Å; L311-Y433 HydrophobicContact CB-CE2 4.4Å; L311-Y433 HydrophobicContact CD1-CD2 4.22Å; L311-Y433 HydrophobicContact CD1-CE2 4.42Å; L311-Y433 HydrophobicContact CD1-CG 4.38Å
312	G	92.3	Very high	91.2	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-56	-52.5	177.3	0	0	0	0	0	112.7	M295 D308 F314 F315 L316	M295-G312 VanDerWaalsContact SD-CA 3.56Å; D308-G312 PolarHBondContact O-N 3.35Å; G312-F314 VanDerWaalsContact C-N 3.31Å; G312-F314 PolarHBondContact O-N 3.38Å; G312-F315 PolarHBondContact O-N 3.16Å; G312-L316 WeakPolarHBondContact O-CB 3.46Å; G312-L316 VanDerWaalsContact O-CG 3.24Å; G312-L316 WeakPolarHBondContact O-CG 3.39Å; G312-L316 PolarHBondContact O-N 3.16Å
313	R	93.5	Very high	92.2	Very high	176 Å²	176	58.7 Å²	58.7	66%	0.664	28%	0.277	S	S	*	.	H	α-helix	trans	-59.9	-40.5	176.3	-73.2	176.9	-178.7	176.7	1.8	112.6	Q309 Y317	Q309-R313 WeakPolarHBondContact O-CB 3.44Å; Q309-R313 VanDerWaalsContact O-CG 3.27Å; Q309-R313 WeakPolarHBondContact O-CG 3.31Å; Q309-R313 PolarHBondContact O-N 3.24Å; R313-Y317 WeakPolarHBondContact O-CB 3.46Å; R313-Y317 PolarHBondContact O-N 2.93Å
314	F	93.8	Very high	92.9	Very high	84 Å²	84	61.6 Å²	61.6	37%	0.368	30%	0.298	S	S	.	.	H	α-helix	trans	-61.1	-48.1	177.8	173.4	-93.8	0	0	0	111.8	V310 L311 G312 H318 Y372	V310-F314 VanDerWaalsContact O-CB 3.3Å; V310-F314 WeakPolarHBondContact O-CB 3.41Å; V310-F314 PolarHBondContact O-N 2.94Å; L311-F314 WeakPolarHBondContact O-CB 3.36Å; L311-F314 PolarHBondContact O-N 3.5Å; G312-F314 VanDerWaalsContact C-N 3.31Å; G312-F314 PolarHBondContact O-N 3.38Å; F314-H318 AromaticContact CD2-CE1 3.84Å; F314-H318 AromaticContact CE1-CE1 3.73Å; F314-H318 AromaticContact CE2-CE1 3.32Å; F314-H318 WeakPolarHBondContact CE2-CE1 3.47Å; F314-H318 AromaticContact CZ-CE1 3.25Å; F314-H318 WeakPolarHBondContact CZ-CE1 3.44Å; F314-H318 AromaticContact CZ-NE2 3.84Å; F314-H318 PolarHBondContact O-N 3.46Å; F314-H318 PolarHBondContact O-ND1 3.45Å; F314-Y372 AromaticContact CE1-CD2 3.72Å; F314-Y372 HydrophobicContact CE1-CD2 3.72Å; F314-Y372 HydrophobicContact CE1-CE2 4.14Å; F314-Y372 AromaticContact CZ-CD2 3.9Å; F314-Y372 HydrophobicContact CZ-CD2 3.9Å; F314-Y372 AromaticContact CZ-CE2 3.93Å; F314-Y372 HydrophobicContact CZ-CE2 3.93Å
315	F	94.6	Very high	93.2	Very high	5 Å²	5	65.3 Å²	65.3	2%	0.022	31%	0.309	C	S	.	.	H	α-helix	trans	-72.2	-40.1	-179.9	-68.2	-62.7	0	0	0	112.6	L291 L311 G312 Y317 H318 I319 F369 Y372 Y433 F437	L291-F315 HydrophobicContact CD1-CB 3.86Å; L291-F315 HydrophobicContact CD2-CB 3.81Å; L291-F315 HydrophobicContact CD2-CD2 4.34Å; L291-F315 HydrophobicContact CD2-CG 4.45Å; L311-F315 HydrophobicContact CB-CD2 4.4Å; L311-F315 HydrophobicContact CB-CE2 4.21Å; L311-F315 HydrophobicContact CD2-CE2 4.18Å; L311-F315 WeakPolarHBondContact O-CD2 3.46Å; L311-F315 PolarHBondContact O-N 2.83Å; G312-F315 PolarHBondContact O-N 3.16Å; F315-Y317 VanDerWaalsContact C-N 3.3Å; F315-Y317 PolarHBondContact O-N 3.02Å; F315-H318 PolarHBondContact O-N 3Å; F315-H318 VanDerWaalsContact O-N 3.08Å; F315-I319 WeakPolarHBondContact O-CG1 3.14Å; F315-I319 PolarHBondContact O-N 2.84Å; F315-F369 HydrophobicContact CD1-CB 4.32Å; F315-F369 AromaticContact CD1-CD1 3.48Å; F315-F369 HydrophobicContact CD1-CD1 3.48Å; F315-F369 VanDerWaalsContact CD1-CD1 3.48Å; F315-F369 HydrophobicContact CD1-CD2 4.25Å; F315-F369 AromaticContact CD1-CE1 3.73Å; F315-F369 HydrophobicContact CD1-CE1 3.73Å; F315-F369 HydrophobicContact CD1-CE2 4.44Å; F315-F369 AromaticContact CD1-CG 3.77Å; F315-F369 HydrophobicContact CD1-CG 3.77Å; F315-F369 HydrophobicContact CD1-CZ 4.21Å; F315-F369 HydrophobicContact CE1-CB 4.13Å; F315-F369 AromaticContact CE1-CD1 3.79Å; F315-F369 HydrophobicContact CE1-CD1 3.79Å; F315-F369 HydrophobicContact CE1-CE1 4.43Å; F315-F369 HydrophobicContact CE1-CG 4.04Å; F315-Y372 HydrophobicContact CE1-CD2 4.37Å; F315-Y433 AromaticContact CD2-CD1 3.81Å; F315-Y433 HydrophobicContact CD2-CD1 3.81Å; F315-Y433 AromaticContact CD2-CE1 3.81Å; F315-Y433 HydrophobicContact CD2-CE1 3.81Å; F315-Y433 AromaticContact CE2-CD1 3.71Å; F315-Y433 HydrophobicContact CE2-CD1 3.71Å; F315-Y433 HydrophobicContact CE2-CE1 4.12Å; F315-F437 HydrophobicContact CB-CZ 4.32Å; F315-F437 HydrophobicContact CD1-CE2 4.04Å; F315-F437 AromaticContact CD1-CZ 3.83Å; F315-F437 HydrophobicContact CD1-CZ 3.83Å; F315-F437 AromaticContact CD2-CE2 3.78Å; F315-F437 HydrophobicContact CD2-CE2 3.78Å; F315-F437 AromaticContact CD2-CZ 3.66Å; F315-F437 HydrophobicContact CD2-CZ 3.66Å; F315-F437 HydrophobicContact CE1-CD2 4.49Å; F315-F437 AromaticContact CE1-CE2 3.72Å; F315-F437 HydrophobicContact CE1-CE2 3.72Å; F315-F437 HydrophobicContact CE1-CZ 4.02Å; F315-F437 AromaticContact CE2-CE2 3.46Å; F315-F437 HydrophobicContact CE2-CE2 3.46Å; F315-F437 VanDerWaalsContact CE2-CE2 3.46Å; F315-F437 AromaticContact CE2-CZ 3.87Å; F315-F437 HydrophobicContact CE2-CZ 3.87Å; F315-F437 HydrophobicContact CG-CE2 4.08Å; F315-F437 AromaticContact CG-CZ 3.67Å; F315-F437 HydrophobicContact CG-CZ 3.67Å; F315-F437 HydrophobicContact CZ-CD2 4.28Å; F315-F437 AromaticContact CZ-CE2 3.43Å; F315-F437 HydrophobicContact CZ-CE2 3.43Å; F315-F437 VanDerWaalsContact CZ-CE2 3.43Å; F315-F437 HydrophobicContact CZ-CZ 4.05Å
316	L	94.9	Very high	93.5	Very high	28 Å²	28	58.8 Å²	58.8	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-56.8	-44	173.8	-72.6	170.8	0	0	0	111.5	E288 L291 M295 G312 H318 I319 H320	E288-L316 HydrophobicContact CB-CD2 4.05Å; E288-L316 HydrophobicContact CG-CD2 3.78Å; L291-L316 HydrophobicContact CB-CD2 4.02Å; L291-L316 HydrophobicContact CB-CG 4.36Å; L291-L316 HydrophobicContact CD1-CD2 3.98Å; L291-L316 HydrophobicContact CD1-CG 4.24Å; M295-L316 HydrophobicContact SD-CD1 4.12Å; G312-L316 WeakPolarHBondContact O-CB 3.46Å; G312-L316 VanDerWaalsContact O-CG 3.24Å; G312-L316 WeakPolarHBondContact O-CG 3.39Å; G312-L316 PolarHBondContact O-N 3.16Å; L316-H318 VanDerWaalsContact C-N 3.29Å; L316-H318 PolarHBondContact O-N 2.94Å; L316-I319 PolarHBondContact O-N 3.42Å; L316-I319 VanDerWaalsContact O-N 3.11Å; L316-H320 PolarHBondContact O-CD2 3.13Å; L316-H320 PolarHBondContact O-N 3.32Å
317	Y	95.3	Very high	93.8	Very high	152 Å²	152	60.2 Å²	60.2	60%	0.596	28%	0.281	S	S	*	.	H	α-helix	trans	-57	-41.6	175.5	176	-99.1	0	0	0	112.6	R313 F315 H320 L321	R313-Y317 WeakPolarHBondContact O-CB 3.46Å; R313-Y317 PolarHBondContact O-N 2.93Å; F315-Y317 VanDerWaalsContact C-N 3.3Å; F315-Y317 PolarHBondContact O-N 3.02Å; Y317-H320 PolarHBondContact O-N 2.85Å; Y317-L321 HydrophobicContact CE1-CD1 4.17Å; Y317-L321 WeakPolarHBondContact O-CB 3.36Å; Y317-L321 PolarHBondContact O-N 3.46Å
318	H	94.1	Very high	94	Very high	44 Å²	44	64.2 Å²	64.2	20%	0.204	30%	0.302	C	S	.	.	H	α-helix	trans	-69.9	-32.1	178.1	-74.4	74.9	0	0	0	112.9	F314 F315 L316 L321 W322 F369	F314-H318 AromaticContact CD2-CE1 3.84Å; F314-H318 AromaticContact CE1-CE1 3.73Å; F314-H318 AromaticContact CE2-CE1 3.32Å; F314-H318 WeakPolarHBondContact CE2-CE1 3.47Å; F314-H318 AromaticContact CZ-CE1 3.25Å; F314-H318 WeakPolarHBondContact CZ-CE1 3.44Å; F314-H318 AromaticContact CZ-NE2 3.84Å; F314-H318 PolarHBondContact O-N 3.46Å; F314-H318 PolarHBondContact O-ND1 3.45Å; F315-H318 PolarHBondContact O-N 3Å; F315-H318 VanDerWaalsContact O-N 3.08Å; L316-H318 VanDerWaalsContact C-N 3.29Å; L316-H318 PolarHBondContact O-N 2.94Å; H318-L321 PolarHBondContact O-N 3.33Å; H318-W322 WeakPolarHBondContact O-CB 3.43Å; H318-W322 PolarHBondContact O-N 2.94Å; H318-F369 HydrophobicContact CB-CE1 3.36Å; H318-F369 HydrophobicContact CB-CZ 3.53Å; H318-F369 AromaticContact CG-CE1 3.9Å
319	I	95.1	Very high	94.1	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-47.9	174.3	-64.2	166.3	0	0	0	109.6	A284 L287 E288 L291 F315 L316 L321 W322 I323 F369	A284-I319 HydrophobicContact CB-CG2 4.04Å; L287-I319 HydrophobicContact CB-CD1 4.04Å; L287-I319 HydrophobicContact CD2-CD1 3.54Å; L287-I319 HydrophobicContact CD2-CG1 3.76Å; L287-I319 HydrophobicContact CG-CD1 3.45Å; L287-I319 VanDerWaalsContact CG-CD1 3.45Å; L287-I319 HydrophobicContact CG-CG1 4.24Å; E288-I319 HydrophobicContact CG-CG2 4.15Å; L291-I319 HydrophobicContact CD1-CD1 3.21Å; F315-I319 WeakPolarHBondContact O-CG1 3.14Å; F315-I319 PolarHBondContact O-N 2.84Å; L316-I319 PolarHBondContact O-N 3.42Å; L316-I319 VanDerWaalsContact O-N 3.11Å; I319-L321 VanDerWaalsContact C-N 3.28Å; I319-L321 PolarHBondContact O-N 3.12Å; I319-W322 PolarHBondContact O-N 2.85Å; I319-W322 VanDerWaalsContact O-N 3.15Å; I319-I323 WeakPolarHBondContact O-CG2 3.21Å; I319-I323 PolarHBondContact O-N 3.45Å; I319-F369 HydrophobicContact CD1-CE2 4.29Å; I319-F369 HydrophobicContact CG1-CE2 3.83Å; I319-F369 HydrophobicContact CG1-CZ 3.89Å
320	H	95.6	Very high	94.2	Very high	89 Å²	89	63.9 Å²	63.9	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-59.5	-39	175.4	-68.2	-48.4	0	0	0	112.2	E288 L316 Y317 I323 S324	E288-H320 IonicContact OE1-CE1 3Å; E288-H320 PolarHBondContact OE1-CE1 3.47Å; E288-H320 IonicContact OE1-ND1 3.28Å; E288-H320 PolarHBondContact OE1-ND1 3.05Å; E288-H320 IonicContact OE1-NE2 3.96Å; E288-H320 IonicContact OE2-CE1 3.93Å; L316-H320 PolarHBondContact O-CD2 3.13Å; L316-H320 PolarHBondContact O-N 3.32Å; Y317-H320 PolarHBondContact O-N 2.85Å; H320-I323 WeakPolarHBondContact O-CG2 3.48Å; H320-S324 WeakPolarHBondContact O-CB 3.25Å; H320-S324 PolarHBondContact O-N 3.4Å; H320-S324 PolarHBondContact O-OG 2.83Å
321	L	95	Very high	94.2	Very high	94 Å²	94	64 Å²	64	49%	0.492	31%	0.31	S	S	.	.	H	α-helix	trans	-64.1	-46.3	174.6	-172.7	155.9	0	0	0	111.4	Y317 H318 I319 S324 Y325	Y317-L321 HydrophobicContact CE1-CD1 4.17Å; Y317-L321 WeakPolarHBondContact O-CB 3.36Å; Y317-L321 PolarHBondContact O-N 3.46Å; H318-L321 PolarHBondContact O-N 3.33Å; I319-L321 VanDerWaalsContact C-N 3.28Å; I319-L321 PolarHBondContact O-N 3.12Å; L321-S324 PolarHBondContact O-N 3.12Å; L321-Y325 PolarHBondContact O-N 3.15Å
322	W	95.7	Very high	94.2	Very high	21 Å²	21	68.9 Å²	68.9	8%	0.08	33%	0.331	C	S	.	.	H	α-helix	trans	-62.1	-50.3	178.7	167.9	72.1	0	0	0	111.9	A280 V283 A284 H318 I319 S324 Y325 I326 F362 H365	A280-W322 HydrophobicContact CB-CH2 3.97Å; A280-W322 HydrophobicContact CB-CZ2 4.33Å; V283-W322 HydrophobicContact CB-CH2 4.47Å; V283-W322 HydrophobicContact CG1-CH2 4.28Å; A284-W322 HydrophobicContact CB-CZ3 3.96Å; H318-W322 WeakPolarHBondContact O-CB 3.43Å; H318-W322 PolarHBondContact O-N 2.94Å; I319-W322 PolarHBondContact O-N 2.85Å; I319-W322 VanDerWaalsContact O-N 3.15Å; W322-S324 VanDerWaalsContact C-N 3.31Å; W322-S324 PolarHBondContact O-N 3.26Å; W322-Y325 WeakPolarHBondContact O-CB 3.16Å; W322-Y325 PolarHBondContact O-N 3.44Å; W322-Y325 VanDerWaalsContact O-N 3.11Å; W322-I326 HydrophobicContact CD2-CG1 4.46Å; W322-I326 HydrophobicContact CZ2-CG1 4.17Å; W322-I326 WeakPolarHBondContact O-CG1 3.42Å; W322-I326 PolarHBondContact O-N 3.35Å; W322-F362 HydrophobicContact CH2-CZ 4.28Å; W322-F362 HydrophobicContact CZ2-CE1 4.11Å; W322-F362 AromaticContact CZ2-CE2 3.91Å; W322-F362 HydrophobicContact CZ2-CE2 3.91Å; W322-F362 AromaticContact CZ2-CZ 3.67Å; W322-F362 HydrophobicContact CZ2-CZ 3.67Å; W322-F362 PolarHBondContact NE1-O 2.88Å; W322-H365 HydrophobicContact CB-CB 4.28Å; W322-H365 AromaticContact CD1-CG 3.92Å; W322-H365 AromaticContact CD1-ND1 3.38Å; W322-H365 AromaticContact CD2-CE1 3.64Å; W322-H365 AromaticContact CD2-ND1 3.69Å; W322-H365 AromaticContact CE2-CE1 3.29Å; W322-H365 AromaticContact CE2-ND1 3.46Å; W322-H365 HydrophobicContact CG-CB 4.2Å; W322-H365 AromaticContact CG-CG 3.84Å; W322-H365 AromaticContact CG-ND1 3.64Å; W322-H365 AromaticContact CZ2-CE1 3.54Å; W322-H365 AromaticContact NE1-CE1 3.54Å; W322-H365 AromaticContact NE1-ND1 3.23Å; W322-H365 PolarHBondContact NE1-ND1 2.82Å
323	I	95.9	Very high	94.2	Very high	16 Å²	16	69.9 Å²	69.9	8%	0.082	34%	0.336	C	S	.	.	H	α-helix	trans	-65.8	-36.3	-179.3	-164.6	56.5	0	0	0	111.5	A280 D281 A284 I319 H320 Y325 I326 H327	A280-I323 HydrophobicContact CB-CD1 3.84Å; D281-I323 WeakPolarHBondContact OD1-CD1 3.48Å; D281-I323 WeakPolarHBondContact OD1-CG1 3.36Å; A284-I323 HydrophobicContact CB-CB 4.26Å; A284-I323 HydrophobicContact CB-CD1 4.3Å; A284-I323 HydrophobicContact CB-CG1 4.13Å; I319-I323 WeakPolarHBondContact O-CG2 3.21Å; I319-I323 PolarHBondContact O-N 3.45Å; H320-I323 WeakPolarHBondContact O-CG2 3.48Å; I323-Y325 VanDerWaalsContact C-N 3.3Å; I323-Y325 PolarHBondContact O-N 3.49Å; I323-I326 HydrophobicContact CD1-CB 4.37Å; I323-I326 PolarHBondContact O-N 2.99Å; I323-H327 PolarHBondContact O-N 3.36Å; I323-H327 PolarHBondContact O-ND1 2.9Å
324	S	95.6	Very high	94.3	Very high	76 Å²	76	66.5 Å²	66.5	53%	0.531	33%	0.327	S	S	.	.	H	α-helix	trans	-61.7	-38.7	173	-61.9	0	0	0	0	111.9	H320 L321 W322 H327 L328	H320-S324 WeakPolarHBondContact O-CB 3.25Å; H320-S324 PolarHBondContact O-N 3.4Å; H320-S324 PolarHBondContact O-OG 2.83Å; L321-S324 PolarHBondContact O-N 3.12Å; W322-S324 VanDerWaalsContact C-N 3.31Å; W322-S324 PolarHBondContact O-N 3.26Å; S324-H327 PolarHBondContact O-N 3.31Å; S324-L328 PolarHBondContact O-N 3.31Å
325	Y	94	Very high	94.2	Very high	137 Å²	137	64 Å²	64	54%	0.537	33%	0.326	S	S	.	.	H	α-helix	trans	-67.3	-40.2	174.5	-175.6	-97.5	0	0	0	112.2	L321 W322 I323 H327 L328 M329	L321-Y325 PolarHBondContact O-N 3.15Å; W322-Y325 WeakPolarHBondContact O-CB 3.16Å; W322-Y325 PolarHBondContact O-N 3.44Å; W322-Y325 VanDerWaalsContact O-N 3.11Å; I323-Y325 VanDerWaalsContact C-N 3.3Å; I323-Y325 PolarHBondContact O-N 3.49Å; Y325-H327 VanDerWaalsContact C-N 3.33Å; Y325-H327 PolarHBondContact O-N 3.32Å; Y325-L328 WeakPolarHBondContact O-CB 3.29Å; Y325-L328 PolarHBondContact O-N 3.06Å; Y325-M329 HydrophobicContact CD1-CG 3.94Å; Y325-M329 HydrophobicContact CE1-CG 3.52Å; Y325-M329 HydrophobicContact CE1-SD 4.32Å; Y325-M329 HydrophobicContact CE2-CG 4.26Å; Y325-M329 HydrophobicContact CE2-SD 4.47Å; Y325-M329 HydrophobicContact CG-CG 4.49Å; Y325-M329 WeakPolarHBondContact O-CB 3.44Å; Y325-M329 VanDerWaalsContact O-CG 3.31Å; Y325-M329 WeakPolarHBondContact O-CG 3.46Å; Y325-M329 PolarHBondContact O-N 3.37Å
326	I	93.8	Very high	94.1	Very high	15 Å²	15	67.9 Å²	67.9	8%	0.077	35%	0.345	C	S	.	.	H	α-helix	trans	-60.3	-43.9	174.5	-65.7	-58.4	0	0	0	111	V277 A280 W322 I323 L328 M329 A330 F362	V277-I326 HydrophobicContact CG2-CG2 4.48Å; A280-I326 HydrophobicContact CB-CG2 3.94Å; W322-I326 HydrophobicContact CD2-CG1 4.46Å; W322-I326 HydrophobicContact CZ2-CG1 4.17Å; W322-I326 WeakPolarHBondContact O-CG1 3.42Å; W322-I326 PolarHBondContact O-N 3.35Å; I323-I326 HydrophobicContact CD1-CB 4.37Å; I323-I326 PolarHBondContact O-N 2.99Å; I326-L328 VanDerWaalsContact C-N 3.34Å; I326-L328 PolarHBondContact O-N 3.49Å; I326-M329 CarbonylContact O-C 3.5Å; I326-M329 PolarHBondContact O-N 3.45Å; I326-M329 VanDerWaalsContact O-N 3.12Å; I326-A330 PolarHBondContact O-N 2.96Å; I326-F362 HydrophobicContact CD1-CD2 3.85Å; I326-F362 HydrophobicContact CD1-CE2 3.69Å; I326-F362 HydrophobicContact CG1-CE2 4.28Å
327	H	95.1	Very high	94.1	Very high	92 Å²	92	67.7 Å²	67.7	43%	0.426	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-41.2	174.9	-76.5	93.3	0	0	0	112.6	D281 I323 S324 Y325 M329 A330	D281-H327 IonicContact OD1-CE1 3.09Å; D281-H327 PolarHBondContact OD1-CE1 3.21Å; D281-H327 IonicContact OD1-NE2 3.63Å; D281-H327 IonicContact OD2-NE2 3.96Å; I323-H327 PolarHBondContact O-N 3.36Å; I323-H327 PolarHBondContact O-ND1 2.9Å; S324-H327 PolarHBondContact O-N 3.31Å; Y325-H327 VanDerWaalsContact C-N 3.33Å; Y325-H327 PolarHBondContact O-N 3.32Å; H327-M329 VanDerWaalsContact C-N 3.26Å; H327-M329 PolarHBondContact O-N 2.83Å; H327-A330 VanDerWaalsContact O-CB 3.24Å; H327-A330 WeakPolarHBondContact O-CB 3.31Å; H327-A330 PolarHBondContact O-N 3.14Å
328	L	95	Very high	94	Very high	116 Å²	116	65.8 Å²	65.8	61%	0.607	34%	0.336	S	S	*	.	H	α-helix	trans	-63.2	-35.2	174.6	-174.7	69.4	0	0	0	111.9	S324 Y325 I326	S324-L328 PolarHBondContact O-N 3.31Å; Y325-L328 WeakPolarHBondContact O-CB 3.29Å; Y325-L328 PolarHBondContact O-N 3.06Å; I326-L328 VanDerWaalsContact C-N 3.34Å; I326-L328 PolarHBondContact O-N 3.49Å
329	M	91.3	Very high	93.9	Very high	45 Å²	45	71.4 Å²	71.4	22%	0.222	36%	0.357	C	S	.	.	H	α-helix	trans	-82.3	-15.8	179.1	-68	-62.9	95	0	0	113.9	Y325 I326 H327 P331 F332 I333	Y325-M329 HydrophobicContact CD1-CG 3.94Å; Y325-M329 HydrophobicContact CE1-CG 3.52Å; Y325-M329 HydrophobicContact CE1-SD 4.32Å; Y325-M329 HydrophobicContact CE2-CG 4.26Å; Y325-M329 HydrophobicContact CE2-SD 4.47Å; Y325-M329 HydrophobicContact CG-CG 4.49Å; Y325-M329 WeakPolarHBondContact O-CB 3.44Å; Y325-M329 VanDerWaalsContact O-CG 3.31Å; Y325-M329 WeakPolarHBondContact O-CG 3.46Å; Y325-M329 PolarHBondContact O-N 3.37Å; I326-M329 CarbonylContact O-C 3.5Å; I326-M329 PolarHBondContact O-N 3.45Å; I326-M329 VanDerWaalsContact O-N 3.12Å; H327-M329 VanDerWaalsContact C-N 3.26Å; H327-M329 PolarHBondContact O-N 2.83Å; M329-P331 VanDerWaalsContact C-CD 3.44Å; M329-F332 HydrophobicContact CE-CD2 4.1Å; M329-F332 HydrophobicContact CE-CE2 4.27Å; M329-F332 WeakPolarHBondContact O-CA 3.4Å; M329-F332 WeakPolarHBondContact O-CB 3.49Å; M329-F332 PolarHBondContact O-N 3.46Å; M329-F332 HydrophobicContact SD-CD2 4.41Å; M329-I333 WeakPolarHBondContact O-CG1 3.47Å; M329-I333 PolarHBondContact O-N 2.82Å
330	A	92.8	Very high	93.7	Very high	36 Å²	36	72.1 Å²	72.1	30%	0.298	36%	0.364	S	S	.	.	H	α-helix	trans	-43.3	-49.4	-178	0	0	0	0	0	115.2	V277 I326 H327 F332 I333	V277-A330 HydrophobicContact CG2-CB 3.85Å; I326-A330 PolarHBondContact O-N 2.96Å; H327-A330 VanDerWaalsContact O-CB 3.24Å; H327-A330 WeakPolarHBondContact O-CB 3.31Å; H327-A330 PolarHBondContact O-N 3.14Å; A330-F332 PolarHBondContact O-N 2.88Å; A330-I333 PolarHBondContact O-N 3.18Å
331	P	92.9	Very high	93.5	Very high	99 Å²	99	68.1 Å²	68.1	64%	0.643	35%	0.347	S	S	*	.	H	α-helix	trans	-64.6	-22	179.8	25.7	-35.5	0	0	0	113.7	M329	M329-P331 VanDerWaalsContact C-CD 3.44Å
332	F	93.1	Very high	93.4	Very high	122 Å²	122	67.2 Å²	67.2	54%	0.535	34%	0.342	S	S	.	.	H	α-helix	trans	-92.9	-18.4	-179.7	-54.2	-71.2	0	0	0	113.4	M329 A330 Q334 G335 I336	M329-F332 HydrophobicContact CE-CD2 4.1Å; M329-F332 HydrophobicContact CE-CE2 4.27Å; M329-F332 WeakPolarHBondContact O-CA 3.4Å; M329-F332 WeakPolarHBondContact O-CB 3.49Å; M329-F332 PolarHBondContact O-N 3.46Å; M329-F332 HydrophobicContact SD-CD2 4.41Å; A330-F332 PolarHBondContact O-N 2.88Å; F332-Q334 VanDerWaalsContact C-N 3.31Å; F332-Q334 PolarHBondContact O-N 2.72Å; F332-G335 PolarHBondContact O-N 3.4Å; F332-G335 VanDerWaalsContact O-N 3.07Å; F332-I336 HydrophobicContact CB-CD1 4.28Å; F332-I336 WeakPolarHBondContact O-CG1 3.37Å; F332-I336 PolarHBondContact O-N 2.94Å
333	I	92.3	Very high	93.2	Very high	21 Å²	21	67 Å²	67	11%	0.108	34%	0.344	C	S	.	.	H	α-helix	trans	-56.4	-45.1	-175.7	-67.4	178.2	0	0	0	111.3	A273 M276 V277 M329 A330 G335 I336 L337	A273-I333 HydrophobicContact CB-CG2 4.08Å; M276-I333 HydrophobicContact CB-CG2 4.4Å; M276-I333 HydrophobicContact CG-CG2 4.26Å; M276-I333 HydrophobicContact SD-CG2 3.64Å; V277-I333 HydrophobicContact CG2-CD1 4.04Å; M329-I333 WeakPolarHBondContact O-CG1 3.47Å; M329-I333 PolarHBondContact O-N 2.82Å; A330-I333 PolarHBondContact O-N 3.18Å; I333-G335 VanDerWaalsContact C-N 3.33Å; I333-G335 PolarHBondContact O-N 3.05Å; I333-I336 PolarHBondContact O-N 3.29Å; I333-L337 HydrophobicContact CG2-CD1 4Å; I333-L337 HydrophobicContact CG2-CG 4.44Å; I333-L337 WeakPolarHBondContact O-CG 3.35Å; I333-L337 PolarHBondContact O-N 3.09Å
334	Q	94.1	Very high	93	Very high	105 Å²	105	66.3 Å²	66.3	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-61.4	-42.3	178.6	-175.5	178.9	-16.8	0	0	111.8	I269 A273 F332 L337 W338	I269-Q334 HydrophobicContact CG2-CG 4.29Å; A273-Q334 HydrophobicContact CB-CB 3.82Å; A273-Q334 HydrophobicContact CB-CG 4.31Å; F332-Q334 VanDerWaalsContact C-N 3.31Å; F332-Q334 PolarHBondContact O-N 2.72Å; Q334-L337 PolarHBondContact O-N 3.35Å; Q334-W338 WeakPolarHBondContact O-CB 3.41Å; Q334-W338 PolarHBondContact O-N 3.22Å
335	G	93	Very high	92.7	Very high	32 Å²	32	65.2 Å²	65.2	33%	0.33	33%	0.332	S	S	.	.	H	α-helix	trans	-63.7	-44.5	176	0	0	0	0	0	112.1	F332 I333 L337 W338 Y339	F332-G335 PolarHBondContact O-N 3.4Å; F332-G335 VanDerWaalsContact O-N 3.07Å; I333-G335 VanDerWaalsContact C-N 3.33Å; I333-G335 PolarHBondContact O-N 3.05Å; G335-L337 PolarHBondContact O-N 3.45Å; G335-W338 WeakPolarHBondContact O-CB 3.48Å; G335-W338 PolarHBondContact O-N 3.11Å; G335-Y339 WeakPolarHBondContact O-CD2 3.37Å; G335-Y339 PolarHBondContact O-N 3Å
336	I	92.6	Very high	92.5	Very high	85 Å²	85	62.8 Å²	62.8	44%	0.436	33%	0.328	S	S	.	.	H	α-helix	trans	-60.1	-45.6	177.5	-67.3	165.1	0	0	0	110.9	F332 I333 W338 G340 M358	F332-I336 HydrophobicContact CB-CD1 4.28Å; F332-I336 WeakPolarHBondContact O-CG1 3.37Å; F332-I336 PolarHBondContact O-N 2.94Å; I333-I336 PolarHBondContact O-N 3.29Å; I336-W338 VanDerWaalsContact C-N 3.34Å; I336-G340 PolarHBondContact O-N 3.48Å; I336-M358 HydrophobicContact CG2-CE 3.51Å
337	L	93.2	Very high	92.5	Very high	24 Å²	24	62.1 Å²	62.1	13%	0.126	33%	0.325	C	S	.	.	H	α-helix	trans	-66.6	-35.2	176.7	-74	173.6	0	0	0	112.3	I269 L272 A273 M276 I333 Q334 G335 G340 G341	I269-L337 HydrophobicContact CG2-CB 3.95Å; L272-L337 HydrophobicContact CB-CD1 4.28Å; L272-L337 HydrophobicContact CD2-CD1 4.02Å; L272-L337 HydrophobicContact CD2-CD2 4.09Å; L272-L337 HydrophobicContact CG-CD1 4.04Å; A273-L337 HydrophobicContact CB-CD1 3.96Å; M276-L337 HydrophobicContact SD-CD1 3.93Å; I333-L337 HydrophobicContact CG2-CD1 4Å; I333-L337 HydrophobicContact CG2-CG 4.44Å; I333-L337 WeakPolarHBondContact O-CG 3.35Å; I333-L337 PolarHBondContact O-N 3.09Å; Q334-L337 PolarHBondContact O-N 3.35Å; G335-L337 PolarHBondContact O-N 3.45Å; L337-G340 PolarHBondContact O-N 2.9Å; L337-G341 PolarHBondContact O-N 3.24Å
338	W	93.8	Very high	92.4	Very high	112 Å²	112	59.3 Å²	59.3	42%	0.424	31%	0.313	S	S	.	.	H	α-helix	trans	-64.4	-53.2	175.6	-168.7	96.7	0	0	0	111.3	Y264 I269 Q334 G335 I336 G340 G341 L342	Y264-W338 AromaticContact CD1-NE1 3.93Å; Y264-W338 AromaticContact CE1-CD1 3.75Å; Y264-W338 HydrophobicContact CE1-CD2 4.12Å; Y264-W338 AromaticContact CE1-CE2 3.48Å; Y264-W338 VanDerWaalsContact CE1-CE2 3.48Å; Y264-W338 HydrophobicContact CE1-CG 4.28Å; Y264-W338 AromaticContact CE1-CZ2 3.86Å; Y264-W338 HydrophobicContact CE1-CZ2 3.86Å; Y264-W338 AromaticContact CE1-NE1 3.25Å; Y264-W338 VanDerWaalsContact CE1-NE1 3.25Å; Y264-W338 PolarHBondContact OH-O 3.48Å; I269-W338 HydrophobicContact CG2-CB 4.31Å; Q334-W338 WeakPolarHBondContact O-CB 3.41Å; Q334-W338 PolarHBondContact O-N 3.22Å; G335-W338 WeakPolarHBondContact O-CB 3.48Å; G335-W338 PolarHBondContact O-N 3.11Å; I336-W338 VanDerWaalsContact C-N 3.34Å; W338-G340 VanDerWaalsContact C-N 3.29Å; W338-G340 PolarHBondContact O-N 3.16Å; W338-G341 PolarHBondContact O-N 2.88Å; W338-L342 PolarHBondContact O-N 2.94Å; W338-L342 VanDerWaalsContact O-N 3.13Å
339	Y	91.8	Very high	92.4	Very high	163 Å²	163	53.8 Å²	53.8	64%	0.639	28%	0.284	S	S	*	.	H	α-helix	trans	-65.1	-34.3	176.6	-68.6	-66.3	0	0	0	112.3	G335 L342 S343	G335-Y339 WeakPolarHBondContact O-CD2 3.37Å; G335-Y339 PolarHBondContact O-N 3Å; Y339-L342 WeakPolarHBondContact O-CB 3.12Å; Y339-L342 PolarHBondContact O-N 3.19Å; Y339-S343 PolarHBondContact O-N 3.48Å
340	G	91.4	Very high	92.5	Very high	15 Å²	15	52.7 Å²	52.7	16%	0.155	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-41.1	172.9	0	0	0	0	0	112.5	I336 L337 W338 L342 S343	I336-G340 PolarHBondContact O-N 3.48Å; L337-G340 PolarHBondContact O-N 2.9Å; W338-G340 VanDerWaalsContact C-N 3.29Å; W338-G340 PolarHBondContact O-N 3.16Å; G340-L342 VanDerWaalsContact C-N 3.33Å; G340-L342 PolarHBondContact O-N 3.22Å; G340-S343 WeakPolarHBondContact O-CB 3.42Å; G340-S343 PolarHBondContact O-N 2.76Å; G340-S343 VanDerWaalsContact O-N 3.14Å; G340-S343 PolarHBondContact O-OG 3.3Å
341	G	92.1	Very high	92.6	Very high	5 Å²	5	51.8 Å²	51.8	5%	0.052	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-37.3	175.6	0	0	0	0	0	112.8	L337 W338 S343 A344	L337-G341 PolarHBondContact O-N 3.24Å; W338-G341 PolarHBondContact O-N 2.88Å; G341-S343 PolarHBondContact O-N 3.46Å; G341-A344 VanDerWaalsContact O-CB 3.24Å; G341-A344 WeakPolarHBondContact O-CB 3.27Å; G341-A344 PolarHBondContact O-N 3.28Å; G341-A344 VanDerWaalsContact O-N 3.11Å
342	L	91.4	Very high	92.7	Very high	74 Å²	74	48.5 Å²	48.5	39%	0.387	25%	0.247	S	C	.	.	H	α-helix	trans	-59	-35.6	174.9	-174.2	62	0	0	0	111.7	M260 Y264 W338 Y339 G340 A344 C345	M260-L342 HydrophobicContact CE-CD1 3.58Å; M260-L342 HydrophobicContact SD-CD1 4.49Å; Y264-L342 PolarHBondContact OH-N 3.26Å; W338-L342 PolarHBondContact O-N 2.94Å; W338-L342 VanDerWaalsContact O-N 3.13Å; Y339-L342 WeakPolarHBondContact O-CB 3.12Å; Y339-L342 PolarHBondContact O-N 3.19Å; G340-L342 VanDerWaalsContact C-N 3.33Å; G340-L342 PolarHBondContact O-N 3.22Å; L342-A344 PolarHBondContact O-N 3.05Å; L342-A344 VanDerWaalsContact O-N 3.12Å; L342-C345 WeakPolarHBondContact O-CB 3.28Å; L342-C345 PolarHBondContact O-N 2.67Å; L342-C345 PolarHBondContact O-SG 3.19Å
343	S	91.1	Very high	92.7	Very high	17 Å²	17	42.7 Å²	42.7	12%	0.119	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-63.4	-18.3	179.7	82.3	0	0	0	0	114.1	Y339 G340 G341 C345 L346 L354	Y339-S343 PolarHBondContact O-N 3.48Å; G340-S343 WeakPolarHBondContact O-CB 3.42Å; G340-S343 PolarHBondContact O-N 2.76Å; G340-S343 VanDerWaalsContact O-N 3.14Å; G340-S343 PolarHBondContact O-OG 3.3Å; G341-S343 PolarHBondContact O-N 3.46Å; S343-C345 PolarHBondContact O-N 3.47Å; S343-L346 WeakPolarHBondContact O-CB 3.38Å; S343-L346 PolarHBondContact O-N 2.79Å; S343-L354 VanDerWaalsContact OG-CD2 3.3Å; S343-L354 WeakPolarHBondContact OG-CD2 3.46Å
344	A	92.8	Very high	92.8	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.008	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-63.9	-18	173.2	0	0	0	0	0	112.7	G256 L259 M260 G341 L342 L346 G347 A351	G256-A344 CarbonylContact C-O 3.15Å; G256-A344 WeakPolarHBondContact CA-O 3.31Å; G256-A344 WeakPolarHBondContact O-CB 3.48Å; L259-A344 HydrophobicContact CD2-CB 4.27Å; M260-A344 HydrophobicContact CB-CB 4.25Å; G341-A344 VanDerWaalsContact O-CB 3.24Å; G341-A344 WeakPolarHBondContact O-CB 3.27Å; G341-A344 PolarHBondContact O-N 3.28Å; G341-A344 VanDerWaalsContact O-N 3.11Å; L342-A344 PolarHBondContact O-N 3.05Å; L342-A344 VanDerWaalsContact O-N 3.12Å; A344-L346 PolarHBondContact O-N 2.98Å; A344-G347 CarbonylContact O-C 3.59Å; A344-G347 VanDerWaalsContact O-CA 3.31Å; A344-G347 WeakPolarHBondContact O-CA 3.33Å; A344-G347 PolarHBondContact O-N 3.04Å; A344-A351 HydrophobicContact CB-CB 3.92Å
345	C	89.8	Confident	92.8	Very high	53 Å²	53	42.2 Å²	42.2	36%	0.358	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-62.4	-26.2	171.8	76.9	0	0	0	0	112.8	M260 L342 S343 G347	M260-C345 HydrophobicContact SD-CB 4.18Å; L342-C345 WeakPolarHBondContact O-CB 3.28Å; L342-C345 PolarHBondContact O-N 2.67Å; L342-C345 PolarHBondContact O-SG 3.19Å; S343-C345 PolarHBondContact O-N 3.47Å; C345-G347 PolarHBondContact O-N 3.05Å
346	L	89	Confident	92.8	Very high	87 Å²	87	40.9 Å²	40.9	46%	0.455	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-72.2	-22.8	173.4	-58.3	177.1	0	0	0	110.4	R221 S343 A344 F350	R221-L346 VanDerWaalsContact CZ-O 3.32Å; R221-L346 VanDerWaalsContact NH1-C 3.33Å; R221-L346 PolarHBondContact NH1-O 3.46Å; R221-L346 PolarHBondContact NH2-O 2.96Å; S343-L346 WeakPolarHBondContact O-CB 3.38Å; S343-L346 PolarHBondContact O-N 2.79Å; A344-L346 PolarHBondContact O-N 2.98Å; L346-F350 HydrophobicContact CB-CB 4.34Å; L346-F350 HydrophobicContact CB-CD1 4.39Å; L346-F350 HydrophobicContact CB-CG 4.27Å; L346-F350 HydrophobicContact CD1-CD1 4.12Å; L346-F350 HydrophobicContact CD1-CE1 4.04Å; L346-F350 HydrophobicContact CD1-CE2 4.41Å; L346-F350 HydrophobicContact CD1-CG 4.37Å; L346-F350 HydrophobicContact CD1-CZ 4.18Å
347	G	93.3	Very high	92.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.			trans	132.8	165.2	173.1	0	0	0	0	0	113.1	R221 D252 A344 C345 T349 F350 A351	R221-G347 VanDerWaalsContact NH2-CA 3.35Å; D252-G347 CarbonylContact O-C 3.54Å; D252-G347 VanDerWaalsContact O-CA 3.22Å; D252-G347 WeakPolarHBondContact O-CA 3.17Å; A344-G347 CarbonylContact O-C 3.59Å; A344-G347 VanDerWaalsContact O-CA 3.31Å; A344-G347 WeakPolarHBondContact O-CA 3.33Å; A344-G347 PolarHBondContact O-N 3.04Å; C345-G347 PolarHBondContact O-N 3.05Å; G347-T349 PolarHBondContact O-N 3.13Å; G347-F350 PolarHBondContact O-N 3.39Å; G347-A351 PolarHBondContact O-N 2.95Å
348	L	94.8	Very high	92.8	Very high	33 Å²	33	39.7 Å²	39.7	17%	0.173	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-43.1	-172.9	179.2	62.1	0	0	0	112.6	D252 L255 L259 F350 A351 L352 I458	D252-L348 PolarHBondContact O-N 3.32Å; D252-L348 WeakPolarHBondContact OD1-CA 3.34Å; D252-L348 WeakPolarHBondContact OD1-CB 3.18Å; D252-L348 PolarHBondContact OD1-N 3.04Å; L255-L348 HydrophobicContact CB-CB 3.91Å; L255-L348 HydrophobicContact CB-CD2 3.94Å; L255-L348 HydrophobicContact CD1-CD2 4.08Å; L259-L348 HydrophobicContact CD2-CD1 3.68Å; L348-F350 VanDerWaalsContact C-N 3.26Å; L348-F350 PolarHBondContact O-N 2.93Å; L348-A351 PolarHBondContact O-N 3.41Å; L348-A351 VanDerWaalsContact O-N 3.16Å; L348-L352 HydrophobicContact CD1-CD1 4.38Å; L348-L352 HydrophobicContact CD1-CG 4.15Å; L348-L352 HydrophobicContact CG-CD1 4.07Å; L348-L352 HydrophobicContact CG-CG 4.29Å; L348-L352 WeakPolarHBondContact O-CG 3.25Å; L348-L352 PolarHBondContact O-N 2.86Å; L348-I458 HydrophobicContact CD2-CD1 3.8Å; L348-I458 HydrophobicContact CG-CD1 4.26Å
349	T	93.8	Very high	92.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-32.2	-179.5	58.2	0	0	0	0	113.1	Q217 R221 D252 G347 S353 V455 I458	Q217-T349 VanDerWaalsContact NE2-CB 3.27Å; Q217-T349 PolarHBondContact NE2-OG1 3.12Å; R221-T349 PolarHBondContact NE-OG1 2.83Å; R221-T349 PolarHBondContact NH2-OG1 3.49Å; D252-T349 WeakPolarHBondContact OD1-CG2 3.23Å; D252-T349 PolarHBondContact OD1-N 3.06Å; D252-T349 PolarHBondContact OD1-OG1 3.41Å; D252-T349 WeakPolarHBondContact OD2-CG2 3.49Å; D252-T349 PolarHBondContact OD2-OG1 2.93Å; G347-T349 PolarHBondContact O-N 3.13Å; T349-S353 WeakPolarHBondContact O-CB 3.5Å; T349-S353 PolarHBondContact O-N 2.88Å; T349-S353 VanDerWaalsContact O-N 3.11Å; T349-S353 PolarHBondContact O-OG 3.4Å; T349-V455 HydrophobicContact CG2-CG1 4.25Å; T349-I458 HydrophobicContact CG2-CB 3.69Å; T349-I458 HydrophobicContact CG2-CD1 4.03Å; T349-I458 HydrophobicContact CG2-CG1 4.48Å; T349-I458 HydrophobicContact CG2-CG2 3.53Å
350	F	93.4	Very high	92.8	Very high	23 Å²	23	29.7 Å²	29.7	10%	0.101	17%	0.173	C	C	.	.	H	α-helix	trans	-69.1	-45	173.7	-171.4	-87.5	0	0	0	111.2	L218 L346 G347 L348 L352 S353 L354	L218-F350 HydrophobicContact CB-CE2 4.18Å; L218-F350 HydrophobicContact CD1-CE2 4.21Å; L218-F350 HydrophobicContact CD2-CE2 4.41Å; L346-F350 HydrophobicContact CB-CB 4.34Å; L346-F350 HydrophobicContact CB-CD1 4.39Å; L346-F350 HydrophobicContact CB-CG 4.27Å; L346-F350 HydrophobicContact CD1-CD1 4.12Å; L346-F350 HydrophobicContact CD1-CE1 4.04Å; L346-F350 HydrophobicContact CD1-CE2 4.41Å; L346-F350 HydrophobicContact CD1-CG 4.37Å; L346-F350 HydrophobicContact CD1-CZ 4.18Å; G347-F350 PolarHBondContact O-N 3.39Å; L348-F350 VanDerWaalsContact C-N 3.26Å; L348-F350 PolarHBondContact O-N 2.93Å; F350-L352 PolarHBondContact O-N 3.46Å; F350-S353 WeakPolarHBondContact O-CB 3.2Å; F350-S353 PolarHBondContact O-N 2.86Å; F350-L354 PolarHBondContact O-N 3.4Å
351	A	94.9	Very high	92.9	Very high	16 Å²	16	35.5 Å²	35.5	13%	0.132	20%	0.2	C	C	.	.	H	α-helix	trans	-60.8	-43	176.1	0	0	0	0	0	112.5	L259 A344 G347 L348 S353 L354 L355	L259-A351 HydrophobicContact CD2-CB 3.99Å; A344-A351 HydrophobicContact CB-CB 3.92Å; G347-A351 PolarHBondContact O-N 2.95Å; L348-A351 PolarHBondContact O-N 3.41Å; L348-A351 VanDerWaalsContact O-N 3.16Å; A351-S353 VanDerWaalsContact C-N 3.32Å; A351-S353 PolarHBondContact O-N 3.32Å; A351-L354 PolarHBondContact O-N 3.24Å; A351-L355 WeakPolarHBondContact O-CB 3.26Å; A351-L355 PolarHBondContact O-N 3.29Å
352	L	94.4	Very high	92.8	Very high	30 Å²	30	38.3 Å²	38.3	16%	0.157	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-35.7	176.1	-68.6	176.1	0	0	0	112.5	L348 F350 L355 S356 L451 V455 I458	L348-L352 HydrophobicContact CD1-CD1 4.38Å; L348-L352 HydrophobicContact CD1-CG 4.15Å; L348-L352 HydrophobicContact CG-CD1 4.07Å; L348-L352 HydrophobicContact CG-CG 4.29Å; L348-L352 WeakPolarHBondContact O-CG 3.25Å; L348-L352 PolarHBondContact O-N 2.86Å; F350-L352 PolarHBondContact O-N 3.46Å; L352-L355 PolarHBondContact O-N 2.87Å; L352-S356 PolarHBondContact O-N 3.46Å; L352-L451 HydrophobicContact CD2-CD2 4.08Å; L352-V455 HydrophobicContact CB-CG2 3.69Å; L352-V455 HydrophobicContact CD1-CG2 4.13Å; L352-I458 HydrophobicContact CD1-CD1 4.22Å
353	S	93.9	Very high	92.9	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.007	20%	0.197	C	C	.	.	H	α-helix	trans	-67	-44.4	173.9	-55.7	0	0	0	0	110.8	S213 Q217 T349 F350 A351 L355 S356 D357	S213-S353 PolarHBondContact OG-O 3.37Å; Q217-S353 WeakPolarHBondContact CB-OG 3.49Å; T349-S353 WeakPolarHBondContact O-CB 3.5Å; T349-S353 PolarHBondContact O-N 2.88Å; T349-S353 VanDerWaalsContact O-N 3.11Å; T349-S353 PolarHBondContact O-OG 3.4Å; F350-S353 WeakPolarHBondContact O-CB 3.2Å; F350-S353 PolarHBondContact O-N 2.86Å; A351-S353 VanDerWaalsContact C-N 3.32Å; A351-S353 PolarHBondContact O-N 3.32Å; S353-L355 VanDerWaalsContact C-N 3.31Å; S353-L355 PolarHBondContact O-N 2.98Å; S353-S356 WeakPolarHBondContact O-CB 3.32Å; S353-S356 PolarHBondContact O-N 3.39Å; S353-S356 VanDerWaalsContact O-N 3.14Å; S353-D357 PolarHBondContact O-N 3.13Å
354	L	94.1	Very high	93	Very high	41 Å²	41	40.1 Å²	40.1	22%	0.215	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-41.1	175.3	-177.2	64.3	0	0	0	112	T214 S343 F350 A351 S356 D357 M358	T214-L354 HydrophobicContact CG2-CB 3.65Å; T214-L354 HydrophobicContact CG2-CD1 3.9Å; T214-L354 HydrophobicContact CG2-CG 4.4Å; T214-L354 VanDerWaalsContact CG2-N 3.27Å; S343-L354 VanDerWaalsContact OG-CD2 3.3Å; S343-L354 WeakPolarHBondContact OG-CD2 3.46Å; F350-L354 PolarHBondContact O-N 3.4Å; A351-L354 PolarHBondContact O-N 3.24Å; L354-S356 VanDerWaalsContact C-N 3.34Å; L354-S356 PolarHBondContact O-N 3.15Å; L354-D357 PolarHBondContact O-N 3.48Å; L354-M358 HydrophobicContact CD1-CE 4.49Å; L354-M358 HydrophobicContact CD2-CE 4.34Å; L354-M358 HydrophobicContact CG-CE 4.27Å; L354-M358 WeakPolarHBondContact O-CG 3.39Å; L354-M358 PolarHBondContact O-N 3.26Å
355	L	93.9	Very high	93	Very high	75 Å²	75	40.8 Å²	40.8	39%	0.393	22%	0.218	S	C	.	.	H	α-helix	trans	-61.2	-42.1	174.7	-178.6	61.9	0	0	0	111.8	A351 L352 S353 D357 M358 V359 L451	A351-L355 WeakPolarHBondContact O-CB 3.26Å; A351-L355 PolarHBondContact O-N 3.29Å; L352-L355 PolarHBondContact O-N 2.87Å; S353-L355 VanDerWaalsContact C-N 3.31Å; S353-L355 PolarHBondContact O-N 2.98Å; L355-D357 VanDerWaalsContact C-N 3.33Å; L355-D357 PolarHBondContact O-N 3.5Å; L355-M358 PolarHBondContact O-N 3.35Å; L355-V359 HydrophobicContact CD1-CG2 4.32Å; L355-V359 HydrophobicContact CG-CG2 4.46Å; L355-V359 WeakPolarHBondContact O-CB 3.46Å; L355-V359 WeakPolarHBondContact O-CG2 3.35Å; L355-V359 PolarHBondContact O-N 3.12Å; L355-L451 HydrophobicContact CD2-CD1 4.39Å; L355-L451 HydrophobicContact CD2-CD2 4.13Å; L355-L451 HydrophobicContact CG-CD1 4.24Å
356	S	93.6	Very high	93.1	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-60.5	-42.3	175.8	-170.8	0	0	0	0	112.1	L352 S353 L354 V359 A360 Q448 H452	L352-S356 PolarHBondContact O-N 3.46Å; S353-S356 WeakPolarHBondContact O-CB 3.32Å; S353-S356 PolarHBondContact O-N 3.39Å; S353-S356 VanDerWaalsContact O-N 3.14Å; L354-S356 VanDerWaalsContact C-N 3.34Å; L354-S356 PolarHBondContact O-N 3.15Å; S356-V359 PolarHBondContact O-N 3.48Å; S356-A360 WeakPolarHBondContact O-CB 3.35Å; S356-A360 PolarHBondContact O-N 2.93Å; S356-Q448 PolarHBondContact O-NE2 2.84Å; S356-H452 PolarHBondContact OG-NE2 2.7Å
357	D	93.8	Very high	93.2	Very high	28 Å²	28	37.7 Å²	37.7	15%	0.15	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-41.6	176.7	-68.8	-14	0	0	0	111.5	L212 S213 T214 S353 L354 L355 A360 L361	L212-D357 WeakPolarHBondContact CB-OD2 3.41Å; S213-D357 WeakPolarHBondContact CB-OD1 3.41Å; S213-D357 PolarHBondContact N-OD1 3.3Å; S213-D357 PolarHBondContact N-OD2 3.23Å; S213-D357 PolarHBondContact OG-OD1 2.84Å; S213-D357 PolarHBondContact OG-OD2 2.67Å; T214-D357 WeakPolarHBondContact CB-OD2 3.1Å; T214-D357 VanDerWaalsContact CG2-OD2 3.25Å; T214-D357 WeakPolarHBondContact CG2-OD2 3.27Å; T214-D357 PolarHBondContact N-OD2 3.45Å; T214-D357 PolarHBondContact OG1-OD2 2.92Å; S353-D357 PolarHBondContact O-N 3.13Å; L354-D357 PolarHBondContact O-N 3.48Å; L355-D357 VanDerWaalsContact C-N 3.33Å; L355-D357 PolarHBondContact O-N 3.5Å; D357-A360 WeakPolarHBondContact O-CB 3.44Å; D357-A360 PolarHBondContact O-N 3.5Å; D357-L361 PolarHBondContact O-N 3.43Å
358	M	92.6	Very high	93.2	Very high	56 Å²	56	38.5 Å²	38.5	28%	0.276	20%	0.2	S	C	.	.	H	α-helix	trans	-61.6	-43	174.3	-74.3	-172.9	169.8	0	0	112	I336 L354 L355 A360 L361 F362	I336-M358 HydrophobicContact CG2-CE 3.51Å; L354-M358 HydrophobicContact CD1-CE 4.49Å; L354-M358 HydrophobicContact CD2-CE 4.34Å; L354-M358 HydrophobicContact CG-CE 4.27Å; L354-M358 WeakPolarHBondContact O-CG 3.39Å; L354-M358 PolarHBondContact O-N 3.26Å; L355-M358 PolarHBondContact O-N 3.35Å; M358-A360 VanDerWaalsContact C-N 3.34Å; M358-L361 PolarHBondContact O-N 3.28Å; M358-F362 WeakPolarHBondContact O-CB 3.5Å; M358-F362 PolarHBondContact O-N 3.31Å
359	V	93.3	Very high	93.1	Very high	26 Å²	26	37 Å²	37	16%	0.158	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-40.2	176.4	171.4	0	0	0	0	110.9	L355 S356 L361 F362 T363 F447 Q448	L355-V359 HydrophobicContact CD1-CG2 4.32Å; L355-V359 HydrophobicContact CG-CG2 4.46Å; L355-V359 WeakPolarHBondContact O-CB 3.46Å; L355-V359 WeakPolarHBondContact O-CG2 3.35Å; L355-V359 PolarHBondContact O-N 3.12Å; S356-V359 PolarHBondContact O-N 3.48Å; V359-L361 VanDerWaalsContact C-N 3.31Å; V359-L361 PolarHBondContact O-N 3.37Å; V359-F362 PolarHBondContact O-N 3.27Å; V359-T363 HydrophobicContact CG1-CG2 4.42Å; V359-T363 WeakPolarHBondContact O-CB 3.47Å; V359-T363 WeakPolarHBondContact O-CG2 3.46Å; V359-T363 PolarHBondContact O-N 2.91Å; V359-T363 PolarHBondContact O-OG1 3.04Å; V359-F447 HydrophobicContact CG1-CD1 4.07Å; V359-F447 HydrophobicContact CG1-CE1 4.28Å; V359-F447 HydrophobicContact CG2-CD1 4.42Å; V359-F447 HydrophobicContact CG2-CE1 3.81Å; V359-Q448 HydrophobicContact CG1-CG 4.17Å
360	A	91.9	Very high	93.1	Very high	39 Å²	39	37.3 Å²	37.3	32%	0.322	19%	0.193	S	C	.	.	H	α-helix	trans	-59.8	-42.7	176.3	0	0	0	0	0	111.7	S356 D357 M358 F364 Q448	S356-A360 WeakPolarHBondContact O-CB 3.35Å; S356-A360 PolarHBondContact O-N 2.93Å; D357-A360 WeakPolarHBondContact O-CB 3.44Å; D357-A360 PolarHBondContact O-N 3.5Å; M358-A360 VanDerWaalsContact C-N 3.34Å; A360-F364 PolarHBondContact O-N 3.41Å; A360-Q448 VanDerWaalsContact CB-NE2 3.33Å
361	L	92	Very high	93.1	Very high	137 Å²	137	37.5 Å²	37.5	72%	0.717	20%	0.196	S	C	*	.	H	α-helix	trans	-69.4	-47.3	178	-177.3	63.6	0	0	0	111.6	D357 M358 V359 T363 F364	D357-L361 PolarHBondContact O-N 3.43Å; M358-L361 PolarHBondContact O-N 3.28Å; V359-L361 VanDerWaalsContact C-N 3.31Å; V359-L361 PolarHBondContact O-N 3.37Å; L361-T363 VanDerWaalsContact C-N 3.3Å; L361-T363 PolarHBondContact O-N 3.06Å; L361-F364 WeakPolarHBondContact O-CB 3.49Å; L361-F364 PolarHBondContact O-N 3.32Å
362	F	91.9	Very high	93	Very high	64 Å²	64	41.4 Å²	41.4	28%	0.281	21%	0.208	S	C	.	.	H	α-helix	trans	-60	-40.2	-179.7	-176.4	-106.4	0	0	0	112.2	A280 W322 I326 M358 V359 H365	A280-F362 HydrophobicContact CB-CE2 4.3Å; A280-F362 HydrophobicContact CB-CZ 3.95Å; W322-F362 HydrophobicContact CH2-CZ 4.28Å; W322-F362 HydrophobicContact CZ2-CE1 4.11Å; W322-F362 AromaticContact CZ2-CE2 3.91Å; W322-F362 HydrophobicContact CZ2-CE2 3.91Å; W322-F362 AromaticContact CZ2-CZ 3.67Å; W322-F362 HydrophobicContact CZ2-CZ 3.67Å; W322-F362 PolarHBondContact NE1-O 2.88Å; I326-F362 HydrophobicContact CD1-CD2 3.85Å; I326-F362 HydrophobicContact CD1-CE2 3.69Å; I326-F362 HydrophobicContact CG1-CE2 4.28Å; M358-F362 WeakPolarHBondContact O-CB 3.5Å; M358-F362 PolarHBondContact O-N 3.31Å; V359-F362 PolarHBondContact O-N 3.27Å; F362-H365 PolarHBondContact O-ND1 3.38Å
363	T	93.3	Very high	92.9	Very high	14 Å²	14	40.2 Å²	40.2	9%	0.086	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	14.3	-179.7	62.9	0	0	0	0	113.9	V359 L361 H365 I366 Y367 V444	V359-T363 HydrophobicContact CG1-CG2 4.42Å; V359-T363 WeakPolarHBondContact O-CB 3.47Å; V359-T363 WeakPolarHBondContact O-CG2 3.46Å; V359-T363 PolarHBondContact O-N 2.91Å; V359-T363 PolarHBondContact O-OG1 3.04Å; L361-T363 VanDerWaalsContact C-N 3.3Å; L361-T363 PolarHBondContact O-N 3.06Å; T363-H365 PolarHBondContact O-N 3.16Å; T363-I366 HydrophobicContact CG2-CD1 4.39Å; T363-I366 WeakPolarHBondContact O-CB 3.38Å; T363-I366 PolarHBondContact O-N 3.38Å; T363-Y367 PolarHBondContact O-N 2.84Å; T363-V444 HydrophobicContact CG2-CG1 4.14Å; T363-V444 HydrophobicContact CG2-CG2 3.99Å; T363-V444 WeakPolarHBondContact OG1-CG1 3.49Å
364	F	91.9	Very high	92.8	Very high	116 Å²	116	40.2 Å²	40.2	51%	0.509	20%	0.203	S	C	.	.	H	α-helix	trans	-57.4	-36.4	-178.2	177.1	-107.4	0	0	0	112.9	A360 L361 I366 Y367 C368	A360-F364 PolarHBondContact O-N 3.41Å; L361-F364 WeakPolarHBondContact O-CB 3.49Å; L361-F364 PolarHBondContact O-N 3.32Å; F364-I366 VanDerWaalsContact C-N 3.32Å; F364-I366 PolarHBondContact O-N 3.37Å; F364-Y367 HydrophobicContact CD2-CD1 4.36Å; F364-Y367 HydrophobicContact CE2-CD1 4.21Å; F364-Y367 WeakPolarHBondContact O-CB 3.4Å; F364-Y367 PolarHBondContact O-N 2.96Å; F364-Y367 VanDerWaalsContact O-N 3.13Å; F364-C368 WeakPolarHBondContact CE1-SG 3.42Å; F364-C368 WeakPolarHBondContact CZ-SG 3.15Å; F364-C368 PolarHBondContact O-N 3.22Å; F364-C368 PolarHBondContact O-SG 3.41Å
365	H	92.4	Very high	92.8	Very high	15 Å²	15	45.7 Å²	45.7	7%	0.069	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-40	176.5	66.1	-81.4	0	0	0	112.5	W322 F362 T363 Y367 C368 F369	W322-H365 HydrophobicContact CB-CB 4.28Å; W322-H365 AromaticContact CD1-CG 3.92Å; W322-H365 AromaticContact CD1-ND1 3.38Å; W322-H365 AromaticContact CD2-CE1 3.64Å; W322-H365 AromaticContact CD2-ND1 3.69Å; W322-H365 AromaticContact CE2-CE1 3.29Å; W322-H365 AromaticContact CE2-ND1 3.46Å; W322-H365 HydrophobicContact CG-CB 4.2Å; W322-H365 AromaticContact CG-CG 3.84Å; W322-H365 AromaticContact CG-ND1 3.64Å; W322-H365 AromaticContact CZ2-CE1 3.54Å; W322-H365 AromaticContact NE1-CE1 3.54Å; W322-H365 AromaticContact NE1-ND1 3.23Å; W322-H365 PolarHBondContact NE1-ND1 2.82Å; F362-H365 PolarHBondContact O-ND1 3.38Å; T363-H365 PolarHBondContact O-N 3.16Å; H365-Y367 VanDerWaalsContact C-N 3.34Å; H365-Y367 PolarHBondContact O-N 3.14Å; H365-C368 WeakPolarHBondContact O-CB 3.2Å; H365-C368 PolarHBondContact O-N 3.03Å; H365-F369 VanDerWaalsContact O-CD1 3.31Å; H365-F369 WeakPolarHBondContact O-CD1 3.5Å; H365-F369 VanDerWaalsContact O-CG 3.31Å; H365-F369 WeakPolarHBondContact O-CG 3.21Å; H365-F369 PolarHBondContact O-N 3.16Å
366	I	92.5	Very high	92.7	Very high	18 Å²	18	44.8 Å²	44.8	9%	0.092	22%	0.216	C	C	.	.	H	α-helix	trans	-64.4	-40.8	175.8	-54.3	-178.9	0	0	0	110.5	T363 F364 F369 Y370 L440 V444	T363-I366 HydrophobicContact CG2-CD1 4.39Å; T363-I366 WeakPolarHBondContact O-CB 3.38Å; T363-I366 PolarHBondContact O-N 3.38Å; F364-I366 VanDerWaalsContact C-N 3.32Å; F364-I366 PolarHBondContact O-N 3.37Å; I366-F369 PolarHBondContact O-N 3.1Å; I366-Y370 PolarHBondContact O-N 3.09Å; I366-L440 HydrophobicContact CG2-CB 3.85Å; I366-V444 HydrophobicContact CD1-CG2 4.05Å
367	Y	92.3	Very high	92.7	Very high	56 Å²	56	46.1 Å²	46.1	22%	0.22	22%	0.221	C	C	.	.	H	α-helix	trans	-61.2	-44.9	173.9	174.5	-107.3	0	0	0	111.4	T363 F364 H365 F369 Y370 V371 Y538	T363-Y367 PolarHBondContact O-N 2.84Å; F364-Y367 HydrophobicContact CD2-CD1 4.36Å; F364-Y367 HydrophobicContact CE2-CD1 4.21Å; F364-Y367 WeakPolarHBondContact O-CB 3.4Å; F364-Y367 PolarHBondContact O-N 2.96Å; F364-Y367 VanDerWaalsContact O-N 3.13Å; H365-Y367 VanDerWaalsContact C-N 3.34Å; H365-Y367 PolarHBondContact O-N 3.14Å; Y367-F369 VanDerWaalsContact C-N 3.34Å; Y367-F369 PolarHBondContact O-N 3.26Å; Y367-Y370 PolarHBondContact O-N 3.08Å; Y367-V371 HydrophobicContact CD1-CG2 4.3Å; Y367-V371 HydrophobicContact CD2-CG2 4.18Å; Y367-V371 HydrophobicContact CE1-CG2 3.87Å; Y367-V371 HydrophobicContact CE2-CG2 3.74Å; Y367-V371 HydrophobicContact CG-CG2 4.45Å; Y367-V371 VanDerWaalsContact O-CG2 3.32Å; Y367-V371 WeakPolarHBondContact O-CG2 3.36Å; Y367-V371 PolarHBondContact O-N 3.44Å; Y367-Y538 HydrophobicContact CE2-CE1 4.42Å; Y367-Y538 PolarHBondContact OH-OH 3.07Å; Y367-Y538 VanDerWaalsContact OH-OH 3.13Å
368	C	92.7	Very high	92.6	Very high	18 Å²	18	45.3 Å²	45.3	12%	0.122	22%	0.217	C	C	.	.	H	α-helix	trans	-58.5	-44.7	175	-68.4	0	0	0	0	111.9	F364 H365 Y370 V371 Y372	F364-C368 WeakPolarHBondContact CE1-SG 3.42Å; F364-C368 WeakPolarHBondContact CZ-SG 3.15Å; F364-C368 PolarHBondContact O-N 3.22Å; F364-C368 PolarHBondContact O-SG 3.41Å; H365-C368 WeakPolarHBondContact O-CB 3.2Å; H365-C368 PolarHBondContact O-N 3.03Å; C368-Y370 PolarHBondContact O-N 3.39Å; C368-V371 PolarHBondContact O-N 3.46Å; C368-Y372 HydrophobicContact CB-CE2 4.07Å; C368-Y372 WeakPolarHBondContact O-CB 3.45Å; C368-Y372 VanDerWaalsContact O-CD2 3.3Å; C368-Y372 WeakPolarHBondContact O-CD2 3.22Å; C368-Y372 PolarHBondContact O-N 3.41Å
369	F	93.1	Very high	92.5	Very high	1 Å²	1	48 Å²	48	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-44.5	178.2	-65.5	-6.2	0	0	0	112.2	L287 F315 H318 I319 H365 I366 Y367 V371 Y372 G373 F437	L287-F369 HydrophobicContact CD2-CE2 3.99Å; F315-F369 HydrophobicContact CD1-CB 4.32Å; F315-F369 AromaticContact CD1-CD1 3.48Å; F315-F369 HydrophobicContact CD1-CD1 3.48Å; F315-F369 VanDerWaalsContact CD1-CD1 3.48Å; F315-F369 HydrophobicContact CD1-CD2 4.25Å; F315-F369 AromaticContact CD1-CE1 3.73Å; F315-F369 HydrophobicContact CD1-CE1 3.73Å; F315-F369 HydrophobicContact CD1-CE2 4.44Å; F315-F369 AromaticContact CD1-CG 3.77Å; F315-F369 HydrophobicContact CD1-CG 3.77Å; F315-F369 HydrophobicContact CD1-CZ 4.21Å; F315-F369 HydrophobicContact CE1-CB 4.13Å; F315-F369 AromaticContact CE1-CD1 3.79Å; F315-F369 HydrophobicContact CE1-CD1 3.79Å; F315-F369 HydrophobicContact CE1-CE1 4.43Å; F315-F369 HydrophobicContact CE1-CG 4.04Å; H318-F369 HydrophobicContact CB-CE1 3.36Å; H318-F369 HydrophobicContact CB-CZ 3.53Å; H318-F369 AromaticContact CG-CE1 3.9Å; I319-F369 HydrophobicContact CD1-CE2 4.29Å; I319-F369 HydrophobicContact CG1-CE2 3.83Å; I319-F369 HydrophobicContact CG1-CZ 3.89Å; H365-F369 VanDerWaalsContact O-CD1 3.31Å; H365-F369 WeakPolarHBondContact O-CD1 3.5Å; H365-F369 VanDerWaalsContact O-CG 3.31Å; H365-F369 WeakPolarHBondContact O-CG 3.21Å; H365-F369 PolarHBondContact O-N 3.16Å; I366-F369 PolarHBondContact O-N 3.1Å; Y367-F369 VanDerWaalsContact C-N 3.34Å; Y367-F369 PolarHBondContact O-N 3.26Å; F369-V371 PolarHBondContact O-N 3.01Å; F369-Y372 PolarHBondContact O-N 3.19Å; F369-G373 PolarHBondContact O-N 2.95Å; F369-F437 HydrophobicContact CB-CB 4.32Å; F369-F437 HydrophobicContact CB-CD1 3.77Å; F369-F437 HydrophobicContact CB-CD2 4.1Å; F369-F437 HydrophobicContact CB-CE1 4.06Å; F369-F437 HydrophobicContact CB-CE2 4.35Å; F369-F437 HydrophobicContact CB-CG 3.81Å; F369-F437 HydrophobicContact CB-CZ 4.34Å; F369-F437 HydrophobicContact CD2-CD1 4.11Å; F369-F437 AromaticContact CD2-CE1 3.8Å; F369-F437 HydrophobicContact CD2-CE1 3.8Å; F369-F437 HydrophobicContact CD2-CZ 4.36Å; F369-F437 HydrophobicContact CG-CD1 4.39Å; F369-F437 HydrophobicContact CG-CE1 4.25Å
370	Y	93.7	Very high	92.5	Very high	6 Å²	6	47.7 Å²	47.7	2%	0.024	23%	0.229	C	C	.	.	H	α-helix	trans	-58.3	-47.9	173.2	166.9	-105.8	0	0	0	111.7	I366 Y367 C368 Y372 G373 A374 Y434 T438 R441 E535 L536 I537	I366-Y370 PolarHBondContact O-N 3.09Å; Y367-Y370 PolarHBondContact O-N 3.08Å; C368-Y370 PolarHBondContact O-N 3.39Å; Y370-Y372 PolarHBondContact O-N 3.45Å; Y370-G373 PolarHBondContact O-N 3.28Å; Y370-A374 HydrophobicContact CE2-CB 4.47Å; Y370-A374 WeakPolarHBondContact O-CB 3.37Å; Y370-A374 PolarHBondContact O-N 3.47Å; Y370-Y434 HydrophobicContact CD2-CE2 4.32Å; Y370-Y434 AromaticContact CE2-CE2 3.89Å; Y370-Y434 HydrophobicContact CE2-CE2 3.89Å; Y370-T438 HydrophobicContact CE2-CG2 4.36Å; Y370-T438 WeakPolarHBondContact CE2-OG1 3.35Å; Y370-R441 HydrophobicContact CD1-CG 4.19Å; Y370-R441 HydrophobicContact CD2-CB 4.4Å; Y370-R441 HydrophobicContact CG-CB 4.15Å; Y370-R441 HydrophobicContact CG-CG 4.07Å; Y370-E535 PolarHBondContact OH-O 3.25Å; Y370-L536 HydrophobicContact CE1-CG 4.46Å; Y370-I537 PolarHBondContact OH-N 2.9Å
371	V	92.6	Very high	92.5	Very high	27 Å²	27	48.2 Å²	48.2	16%	0.164	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-45.6	179.4	171.7	0	0	0	0	111.3	Y367 C368 F369 A374 R375 L536	Y367-V371 HydrophobicContact CD1-CG2 4.3Å; Y367-V371 HydrophobicContact CD2-CG2 4.18Å; Y367-V371 HydrophobicContact CE1-CG2 3.87Å; Y367-V371 HydrophobicContact CE2-CG2 3.74Å; Y367-V371 HydrophobicContact CG-CG2 4.45Å; Y367-V371 VanDerWaalsContact O-CG2 3.32Å; Y367-V371 WeakPolarHBondContact O-CG2 3.36Å; Y367-V371 PolarHBondContact O-N 3.44Å; C368-V371 PolarHBondContact O-N 3.46Å; F369-V371 PolarHBondContact O-N 3.01Å; V371-A374 PolarHBondContact O-N 3.07Å; V371-R375 HydrophobicContact CG1-CG 4.33Å; V371-R375 WeakPolarHBondContact O-CB 3.45Å; V371-R375 WeakPolarHBondContact O-CG 3.31Å; V371-R375 PolarHBondContact O-N 3.03Å; V371-L536 HydrophobicContact CG1-CD2 4.22Å; V371-L536 HydrophobicContact CG2-CD2 3.8Å
372	Y	93	Very high	92.5	Very high	99 Å²	99	47.8 Å²	47.8	39%	0.388	22%	0.215	S	C	.	.	H	α-helix	trans	-63.1	-47.2	178.7	-61.3	-24.3	0	0	0	111.6	F314 F315 C368 F369 Y370 R375 L376	F314-Y372 AromaticContact CE1-CD2 3.72Å; F314-Y372 HydrophobicContact CE1-CD2 3.72Å; F314-Y372 HydrophobicContact CE1-CE2 4.14Å; F314-Y372 AromaticContact CZ-CD2 3.9Å; F314-Y372 HydrophobicContact CZ-CD2 3.9Å; F314-Y372 AromaticContact CZ-CE2 3.93Å; F314-Y372 HydrophobicContact CZ-CE2 3.93Å; F315-Y372 HydrophobicContact CE1-CD2 4.37Å; C368-Y372 HydrophobicContact CB-CE2 4.07Å; C368-Y372 WeakPolarHBondContact O-CB 3.45Å; C368-Y372 VanDerWaalsContact O-CD2 3.3Å; C368-Y372 WeakPolarHBondContact O-CD2 3.22Å; C368-Y372 PolarHBondContact O-N 3.41Å; F369-Y372 PolarHBondContact O-N 3.19Å; Y370-Y372 PolarHBondContact O-N 3.45Å; Y372-R375 PolarHBondContact O-N 3.4Å; Y372-L376 WeakPolarHBondContact O-CB 3.07Å; Y372-L376 PolarHBondContact O-N 2.94Å
373	G	92.8	Very high	92.5	Very high	5 Å²	5	45.8 Å²	45.8	5%	0.052	21%	0.213	C	C	.	.	H	α-helix	trans	-60.6	-47.1	176.2	0	0	0	0	0	112.3	F369 Y370 R375 L376 Y377	F369-G373 PolarHBondContact O-N 2.95Å; Y370-G373 PolarHBondContact O-N 3.28Å; G373-R375 PolarHBondContact O-N 3.23Å; G373-L376 PolarHBondContact O-N 3.31Å; G373-Y377 VanDerWaalsContact O-CB 3.27Å; G373-Y377 WeakPolarHBondContact O-CB 3.44Å; G373-Y377 PolarHBondContact O-N 3.2Å
374	A	92.4	Very high	92.5	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60	-46.9	178.4	0	0	0	0	0	111.8	Y370 V371 Y377 C378 Y434 L536	Y370-A374 HydrophobicContact CE2-CB 4.47Å; Y370-A374 WeakPolarHBondContact O-CB 3.37Å; Y370-A374 PolarHBondContact O-N 3.47Å; V371-A374 PolarHBondContact O-N 3.07Å; A374-Y377 PolarHBondContact O-N 2.82Å; A374-C378 WeakPolarHBondContact O-CB 3.37Å; A374-C378 PolarHBondContact O-N 3Å; A374-C378 PolarHBondContact O-SG 3.4Å; A374-Y434 HydrophobicContact CB-CD2 4.06Å; A374-Y434 HydrophobicContact CB-CE2 3.65Å; A374-L536 HydrophobicContact CB-CD1 4.44Å
375	R	92.4	Very high	92.5	Very high	157 Å²	157	43.1 Å²	43.1	59%	0.592	21%	0.208	S	C	*	.	H	α-helix	trans	-65	-43.4	179	-70.6	-64.6	-174.3	-178.7	1.1	112.2	V371 Y372 G373 L379	V371-R375 HydrophobicContact CG1-CG 4.33Å; V371-R375 WeakPolarHBondContact O-CB 3.45Å; V371-R375 WeakPolarHBondContact O-CG 3.31Å; V371-R375 PolarHBondContact O-N 3.03Å; Y372-R375 PolarHBondContact O-N 3.4Å; G373-R375 PolarHBondContact O-N 3.23Å; R375-L379 WeakPolarHBondContact O-CB 3.32Å; R375-L379 PolarHBondContact O-N 3.38Å
376	L	92.1	Very high	92.4	Very high	56 Å²	56	45.2 Å²	45.2	29%	0.293	22%	0.224	S	C	.	.	H	α-helix	trans	-63.1	-46	177.2	-174.8	64.1	0	0	0	110.8	L311 Y372 G373 L379 K380 T430	L311-L376 HydrophobicContact CD1-CD2 4.22Å; L311-L376 HydrophobicContact CD2-CD2 3.78Å; Y372-L376 WeakPolarHBondContact O-CB 3.07Å; Y372-L376 PolarHBondContact O-N 2.94Å; G373-L376 PolarHBondContact O-N 3.31Å; L376-L379 PolarHBondContact O-N 3.36Å; L376-K380 WeakPolarHBondContact O-CG 3.14Å; L376-K380 PolarHBondContact O-N 2.97Å; L376-T430 HydrophobicContact CD2-CG2 3.84Å; L376-T430 HydrophobicContact CG-CG2 4.07Å
377	Y	93.5	Very high	92.4	Very high	30 Å²	30	45.4 Å²	45.4	12%	0.118	23%	0.225	C	C	.	.	H	α-helix	trans	-63.7	-45.8	177.8	177.8	-105.5	0	0	0	112.1	G373 A374 L379 K380 I381 L427 A431 Y434 F532	G373-Y377 VanDerWaalsContact O-CB 3.27Å; G373-Y377 WeakPolarHBondContact O-CB 3.44Å; G373-Y377 PolarHBondContact O-N 3.2Å; A374-Y377 PolarHBondContact O-N 2.82Å; Y377-L379 VanDerWaalsContact C-N 3.32Å; Y377-L379 PolarHBondContact O-N 3.01Å; Y377-K380 WeakPolarHBondContact O-CB 3.33Å; Y377-K380 PolarHBondContact O-N 3.39Å; Y377-K380 VanDerWaalsContact O-N 3.1Å; Y377-I381 HydrophobicContact CD1-CG1 4.31Å; Y377-I381 HydrophobicContact CD2-CG1 4.38Å; Y377-I381 HydrophobicContact CE1-CG1 3.86Å; Y377-I381 HydrophobicContact CE2-CD1 3.98Å; Y377-I381 HydrophobicContact CE2-CG1 3.93Å; Y377-I381 WeakPolarHBondContact O-CG1 3.47Å; Y377-I381 PolarHBondContact O-N 3.04Å; Y377-L427 HydrophobicContact CD2-CD1 4.26Å; Y377-L427 HydrophobicContact CE2-CD1 4.06Å; Y377-A431 HydrophobicContact CD2-CB 4.15Å; Y377-A431 HydrophobicContact CE2-CB 3.87Å; Y377-Y434 AromaticContact CD1-CD1 3.69Å; Y377-Y434 HydrophobicContact CD1-CD1 3.69Å; Y377-Y434 AromaticContact CD1-CE1 3.84Å; Y377-Y434 HydrophobicContact CD1-CE1 3.84Å; Y377-Y434 HydrophobicContact CD1-CG 4.28Å; Y377-Y434 HydrophobicContact CD2-CD1 4.44Å; Y377-Y434 HydrophobicContact CE1-CD1 4.11Å; Y377-Y434 HydrophobicContact CE1-CE1 4.07Å; Y377-Y434 AromaticContact CG-CD1 3.88Å; Y377-Y434 HydrophobicContact CG-CD1 3.88Å; Y377-Y434 HydrophobicContact CG-CE1 4.48Å; Y377-Y434 HydrophobicContact CG-CG 4.16Å; Y377-F532 WeakPolarHBondContact CE1-O 3.46Å; Y377-F532 PolarHBondContact OH-O 3.36Å
378	C	91.6	Very high	92.3	Very high	12 Å²	12	49.5 Å²	49.5	8%	0.081	24%	0.24	C	C	.	.	H	α-helix	trans	-53.7	-48.7	171.9	-83.4	0	0	0	0	111.6	A374 K380 I381 Y382 I533 G534	A374-C378 WeakPolarHBondContact O-CB 3.37Å; A374-C378 PolarHBondContact O-N 3Å; A374-C378 PolarHBondContact O-SG 3.4Å; C378-K380 VanDerWaalsContact C-N 3.25Å; C378-K380 PolarHBondContact O-N 2.86Å; C378-I381 PolarHBondContact O-N 2.94Å; C378-Y382 HydrophobicContact CB-CD2 4.25Å; C378-Y382 HydrophobicContact CB-CE2 4.35Å; C378-Y382 WeakPolarHBondContact O-CB 3.49Å; C378-Y382 WeakPolarHBondContact O-CD2 3.4Å; C378-Y382 PolarHBondContact O-N 3.21Å; C378-I533 PolarHBondContact SG-O 3.46Å; C378-G534 VanDerWaalsContact SG-CA 3.54Å; C378-G534 PolarHBondContact SG-O 3.3Å
379	L	91.9	Very high	92.2	Very high	111 Å²	111	51.6 Å²	51.6	58%	0.581	25%	0.246	S	C	*	.	H	α-helix	trans	-58.1	-40.2	179.3	-178.7	147.3	0	0	0	111.2	R375 L376 Y377 G383	R375-L379 WeakPolarHBondContact O-CB 3.32Å; R375-L379 PolarHBondContact O-N 3.38Å; L376-L379 PolarHBondContact O-N 3.36Å; Y377-L379 VanDerWaalsContact C-N 3.32Å; Y377-L379 PolarHBondContact O-N 3.01Å; L379-G383 PolarHBondContact O-N 2.67Å
380	K	92	Very high	92	Very high	20 Å²	20	52.9 Å²	52.9	9%	0.087	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-46.5	175.2	-64.7	-66.4	-174.3	176	0	112.2	L376 Y377 C378 G383 L384 L423 L427 T430	L376-K380 WeakPolarHBondContact O-CG 3.14Å; L376-K380 PolarHBondContact O-N 2.97Å; Y377-K380 WeakPolarHBondContact O-CB 3.33Å; Y377-K380 PolarHBondContact O-N 3.39Å; Y377-K380 VanDerWaalsContact O-N 3.1Å; C378-K380 VanDerWaalsContact C-N 3.25Å; C378-K380 PolarHBondContact O-N 2.86Å; K380-G383 PolarHBondContact O-N 2.83Å; K380-L384 WeakPolarHBondContact O-CB 3.24Å; K380-L384 VanDerWaalsContact O-CG 3.31Å; K380-L384 WeakPolarHBondContact O-CG 3.34Å; K380-L384 PolarHBondContact O-N 3.11Å; K380-L423 HydrophobicContact CD-CD2 3.65Å; K380-L423 VanDerWaalsContact NZ-CD2 3.29Å; K380-L427 HydrophobicContact CB-CD1 3.71Å; K380-T430 HydrophobicContact CG-CG2 4.15Å
381	I	92.2	Very high	91.5	Very high	50 Å²	50	55.3 Å²	55.3	26%	0.256	26%	0.263	S	S	.	.	H	α-helix	trans	-65.2	-46.6	179.8	-65.2	-61.8	0	0	0	111.7	Y377 C378 L384 S385 L427	Y377-I381 HydrophobicContact CD1-CG1 4.31Å; Y377-I381 HydrophobicContact CD2-CG1 4.38Å; Y377-I381 HydrophobicContact CE1-CG1 3.86Å; Y377-I381 HydrophobicContact CE2-CD1 3.98Å; Y377-I381 HydrophobicContact CE2-CG1 3.93Å; Y377-I381 WeakPolarHBondContact O-CG1 3.47Å; Y377-I381 PolarHBondContact O-N 3.04Å; C378-I381 PolarHBondContact O-N 2.94Å; I381-L384 PolarHBondContact O-N 3.28Å; I381-S385 VanDerWaalsContact O-CB 3.25Å; I381-S385 WeakPolarHBondContact O-CB 3.34Å; I381-S385 PolarHBondContact O-N 3.41Å; I381-L427 HydrophobicContact CD1-CD1 3.92Å; I381-L427 HydrophobicContact CD1-CD2 4.32Å
382	Y	91.6	Very high	91.2	Very high	129 Å²	129	61.2 Å²	61.2	51%	0.506	28%	0.282	S	S	.	.	H	α-helix	trans	-65.9	-38.4	176.1	-76.9	-67.5	0	0	0	112	C378 S385 S386	C378-Y382 HydrophobicContact CB-CD2 4.25Å; C378-Y382 HydrophobicContact CB-CE2 4.35Å; C378-Y382 WeakPolarHBondContact O-CB 3.49Å; C378-Y382 WeakPolarHBondContact O-CD2 3.4Å; C378-Y382 PolarHBondContact O-N 3.21Å; Y382-S385 PolarHBondContact O-N 2.91Å; Y382-S386 WeakPolarHBondContact O-CB 3.46Å; Y382-S386 PolarHBondContact O-N 3.14Å
383	G	91.9	Very high	90.9	Very high	22 Å²	22	57.6 Å²	57.6	23%	0.227	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-50.2	174.3	0	0	0	0	0	112.2	L379 K380 S386 L387	L379-G383 PolarHBondContact O-N 2.67Å; K380-G383 PolarHBondContact O-N 2.83Å; G383-S386 PolarHBondContact O-N 3.48Å; G383-L387 WeakPolarHBondContact O-CG 3.33Å; G383-L387 PolarHBondContact O-N 3.31Å
384	L	93.4	Very high	90.8	Very high	17 Å²	17	61.1 Å²	61.1	9%	0.089	29%	0.289	C	S	.	.	H	α-helix	trans	-61.6	-44.5	175.9	-75.4	170.1	0	0	0	112.1	K380 I381 S386 L387 W388 F420 L423 L424 L427	K380-L384 WeakPolarHBondContact O-CB 3.24Å; K380-L384 VanDerWaalsContact O-CG 3.31Å; K380-L384 WeakPolarHBondContact O-CG 3.34Å; K380-L384 PolarHBondContact O-N 3.11Å; I381-L384 PolarHBondContact O-N 3.28Å; L384-S386 VanDerWaalsContact C-N 3.3Å; L384-S386 PolarHBondContact O-N 2.94Å; L384-L387 PolarHBondContact O-N 3.46Å; L384-W388 VanDerWaalsContact O-CB 3.24Å; L384-W388 WeakPolarHBondContact O-CB 3.44Å; L384-W388 PolarHBondContact O-N 3.38Å; L384-F420 HydrophobicContact CB-CE2 4.44Å; L384-F420 HydrophobicContact CD2-CD2 3.52Å; L384-F420 HydrophobicContact CD2-CE2 3.63Å; L384-F420 HydrophobicContact CD2-CG 4.22Å; L384-F420 HydrophobicContact CD2-CZ 4.4Å; L384-L423 HydrophobicContact CD2-CB 3.71Å; L384-L423 HydrophobicContact CG-CB 4.07Å; L384-L424 HydrophobicContact CD2-CB 4.12Å; L384-L427 HydrophobicContact CD1-CB 4.32Å; L384-L427 HydrophobicContact CD1-CD1 4.1Å; L384-L427 HydrophobicContact CD1-CD2 3.77Å; L384-L427 HydrophobicContact CD1-CG 4.29Å
385	S	91.4	Very high	90.6	Very high	57 Å²	57	66.8 Å²	66.8	40%	0.399	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-40	175.8	179.3	0	0	0	0	111.8	I381 Y382 R389	I381-S385 VanDerWaalsContact O-CB 3.25Å; I381-S385 WeakPolarHBondContact O-CB 3.34Å; I381-S385 PolarHBondContact O-N 3.41Å; Y382-S385 PolarHBondContact O-N 2.91Å; S385-R389 WeakPolarHBondContact O-CG 3.31Å; S385-R389 PolarHBondContact O-N 3.27Å
386	S	91.1	Very high	90.5	Very high	59 Å²	59	64 Å²	64	41%	0.413	30%	0.303	S	S	.	.	H	α-helix	trans	-67.9	-46.3	178	-158.1	0	0	0	0	112.6	Y382 G383 L384 W388 R389 L390	Y382-S386 WeakPolarHBondContact O-CB 3.46Å; Y382-S386 PolarHBondContact O-N 3.14Å; G383-S386 PolarHBondContact O-N 3.48Å; L384-S386 VanDerWaalsContact C-N 3.3Å; L384-S386 PolarHBondContact O-N 2.94Å; S386-W388 VanDerWaalsContact C-N 3.33Å; S386-W388 PolarHBondContact O-N 2.91Å; S386-R389 WeakPolarHBondContact O-CB 3.31Å; S386-R389 PolarHBondContact O-N 3.27Å; S386-R389 PolarHBondContact OG-NH2 3.44Å; S386-L390 PolarHBondContact O-N 3.14Å; S386-L390 VanDerWaalsContact O-N 3.15Å
387	L	92.2	Very high	90.3	Very high	21 Å²	21	63 Å²	63	11%	0.11	30%	0.299	C	S	.	.	H	α-helix	trans	-67.9	-32.9	177.6	-68.3	168.7	0	0	0	112.3	G383 L384 R389 L390 F391 L419 F420 L423	G383-L387 WeakPolarHBondContact O-CG 3.33Å; G383-L387 PolarHBondContact O-N 3.31Å; L384-L387 PolarHBondContact O-N 3.46Å; L387-R389 VanDerWaalsContact C-N 3.26Å; L387-R389 PolarHBondContact O-N 2.61Å; L387-L390 HydrophobicContact CD2-CD2 3.98Å; L387-L390 VanDerWaalsContact O-CB 3.27Å; L387-L390 WeakPolarHBondContact O-CB 3.32Å; L387-L390 PolarHBondContact O-N 2.89Å; L387-L390 VanDerWaalsContact O-N 3.12Å; L387-F391 HydrophobicContact CB-CE2 4.49Å; L387-F391 VanDerWaalsContact O-CD2 3.28Å; L387-F391 WeakPolarHBondContact O-CD2 3.36Å; L387-F391 WeakPolarHBondContact O-CE2 3.27Å; L387-F391 PolarHBondContact O-N 3.03Å; L387-F391 VanDerWaalsContact O-N 3.13Å; L387-L419 HydrophobicContact CD1-CB 4.05Å; L387-L419 HydrophobicContact CD1-CD2 3.95Å; L387-L419 HydrophobicContact CD1-CG 3.79Å; L387-L419 HydrophobicContact CD2-CD2 4.28Å; L387-F420 HydrophobicContact CB-CB 4.08Å; L387-F420 HydrophobicContact CB-CD2 3.93Å; L387-F420 HydrophobicContact CB-CG 4.49Å; L387-F420 HydrophobicContact CD1-CB 4.05Å; L387-L423 HydrophobicContact CD1-CD1 3.77Å
388	W	90.4	Very high	89.9	Confident	142 Å²	142	66.4 Å²	66.4	54%	0.538	32%	0.322	S	S	.	.	H	α-helix	trans	-60.8	-37.1	171.9	-176.9	-108.9	0	0	0	112.4	L384 S386 F391 F420	L384-W388 VanDerWaalsContact O-CB 3.24Å; L384-W388 WeakPolarHBondContact O-CB 3.44Å; L384-W388 PolarHBondContact O-N 3.38Å; S386-W388 VanDerWaalsContact C-N 3.33Å; S386-W388 PolarHBondContact O-N 2.91Å; W388-F391 HydrophobicContact CE3-CD2 4.24Å; W388-F420 HydrophobicContact CB-CE2 4.38Å; W388-F420 HydrophobicContact CE3-CE2 4.19Å; W388-F420 AromaticContact CE3-CZ 3.9Å; W388-F420 HydrophobicContact CE3-CZ 3.9Å; W388-F420 HydrophobicContact CZ3-CZ 4.37Å
389	R	89.9	Confident	89.7	Confident	63 Å²	63	73.8 Å²	73.8	24%	0.238	36%	0.36	C	S	.	.	H	α-helix	trans	-67.7	-39.6	173.4	-66.1	178.2	-62.7	-151.2	2.3	111.5	S385 S386 L387 F391 R392 G393 K394	S385-R389 WeakPolarHBondContact O-CG 3.31Å; S385-R389 PolarHBondContact O-N 3.27Å; S386-R389 WeakPolarHBondContact O-CB 3.31Å; S386-R389 PolarHBondContact O-N 3.27Å; S386-R389 PolarHBondContact OG-NH2 3.44Å; L387-R389 VanDerWaalsContact C-N 3.26Å; L387-R389 PolarHBondContact O-N 2.61Å; R389-F391 VanDerWaalsContact C-N 3.34Å; R389-F391 PolarHBondContact O-N 3.2Å; R389-R392 CarbonylContact O-C 3.6Å; R389-R392 PolarHBondContact O-N 3.11Å; R389-G393 PolarHBondContact O-N 3.28Å; R389-K394 CarbonylContact C-O 3.58Å; R389-K394 HydrophobicContact CB-CB 4.18Å; R389-K394 VanDerWaalsContact CB-O 3.31Å; R389-K394 WeakPolarHBondContact CB-O 3.32Å; R389-K394 WeakPolarHBondContact O-CA 3.21Å; R389-K394 PolarHBondContact O-N 2.98Å; R389-K394 VanDerWaalsContact O-O 3.05Å
390	L	89.6	Confident	89.4	Confident	28 Å²	28	76.4 Å²	76.4	15%	0.147	36%	0.362	C	S	.	.	H	α-helix	trans	-54.8	-46.6	175.9	178.9	66.4	0	0	0	111.4	S386 L387 R392 G393 Y408	S386-L390 PolarHBondContact O-N 3.14Å; S386-L390 VanDerWaalsContact O-N 3.15Å; L387-L390 HydrophobicContact CD2-CD2 3.98Å; L387-L390 VanDerWaalsContact O-CB 3.27Å; L387-L390 WeakPolarHBondContact O-CB 3.32Å; L387-L390 PolarHBondContact O-N 2.89Å; L387-L390 VanDerWaalsContact O-N 3.12Å; L390-R392 PolarHBondContact O-N 3.05Å; L390-G393 PolarHBondContact O-N 2.98Å; L390-Y408 HydrophobicContact CD1-CD1 3.44Å; L390-Y408 VanDerWaalsContact CD1-CD1 3.44Å; L390-Y408 HydrophobicContact CD1-CD2 3.7Å; L390-Y408 HydrophobicContact CD1-CE1 3.35Å; L390-Y408 HydrophobicContact CD1-CE2 3.62Å; L390-Y408 HydrophobicContact CD1-CG 3.6Å; L390-Y408 VanDerWaalsContact CD1-CZ 3.43Å
391	F	84.4	Confident	89.1	Confident	57 Å²	57	81.5 Å²	81.5	25%	0.25	39%	0.386	C	S	.	.	H	α-helix	trans	-62.5	-28.1	176.8	-57.5	-43.1	0	0	0	114.6	L387 W388 R389 G393 L413 G416 T417 F420	L387-F391 HydrophobicContact CB-CE2 4.49Å; L387-F391 VanDerWaalsContact O-CD2 3.28Å; L387-F391 WeakPolarHBondContact O-CD2 3.36Å; L387-F391 WeakPolarHBondContact O-CE2 3.27Å; L387-F391 PolarHBondContact O-N 3.03Å; L387-F391 VanDerWaalsContact O-N 3.13Å; W388-F391 HydrophobicContact CE3-CD2 4.24Å; R389-F391 VanDerWaalsContact C-N 3.34Å; R389-F391 PolarHBondContact O-N 3.2Å; F391-G393 VanDerWaalsContact C-N 3.25Å; F391-G393 PolarHBondContact O-N 3.12Å; F391-L413 HydrophobicContact CD1-CD1 3.73Å; F391-L413 HydrophobicContact CE1-CD1 4.44Å; F391-G416 WeakPolarHBondContact CZ-O 3.36Å; F391-T417 HydrophobicContact CE1-CG2 4.4Å; F391-T417 VanDerWaalsContact CE1-N 3.29Å; F391-T417 WeakPolarHBondContact CE1-OG1 3.44Å; F391-T417 VanDerWaalsContact CZ-CA 3.4Å; F391-F420 HydrophobicContact CE2-CB 3.53Å; F391-F420 AromaticContact CE2-CD1 3.7Å; F391-F420 HydrophobicContact CE2-CD1 3.7Å; F391-F420 AromaticContact CE2-CD2 3.69Å; F391-F420 HydrophobicContact CE2-CD2 3.69Å; F391-F420 HydrophobicContact CE2-CE1 4.27Å; F391-F420 HydrophobicContact CE2-CE2 4.25Å; F391-F420 AromaticContact CE2-CG 3.37Å; F391-F420 HydrophobicContact CE2-CG 3.37Å; F391-F420 HydrophobicContact CZ-CB 3.4Å; F391-F420 VanDerWaalsContact CZ-CB 3.4Å; F391-F420 HydrophobicContact CZ-CD1 4.26Å; F391-F420 HydrophobicContact CZ-CD2 4.42Å; F391-F420 AromaticContact CZ-CG 3.83Å; F391-F420 HydrophobicContact CZ-CG 3.83Å
392	R	85.7	Confident	89	Confident	150 Å²	150	84.9 Å²	84.9	57%	0.566	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	5.1	179.1	-64.8	-177.1	67.7	-175.1	5.5	112.6	R389 L390 K394	R389-R392 CarbonylContact O-C 3.6Å; R389-R392 PolarHBondContact O-N 3.11Å; L390-R392 PolarHBondContact O-N 3.05Å; R392-K394 VanDerWaalsContact C-N 3.28Å; R392-K394 HydrophobicContact CB-CD 4.27Å; R392-K394 HydrophobicContact CB-CG 4.23Å; R392-K394 PolarHBondContact O-N 3.41Å
393	G	87.4	Confident	88.8	Confident	24 Å²	24	82 Å²	82	25%	0.247	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	31.9	-173.3	0	0	0	0	0	112.6	R389 L390 F391 S405 C406	R389-G393 PolarHBondContact O-N 3.28Å; L390-G393 PolarHBondContact O-N 2.98Å; F391-G393 VanDerWaalsContact C-N 3.25Å; F391-G393 PolarHBondContact O-N 3.12Å; G393-S405 CarbonylContact O-C 3.55Å; G393-S405 WeakPolarHBondContact O-CA 3.14Å; G393-C406 CarbonylContact C-O 3.55Å; G393-C406 PolarHBondContact O-N 3.42Å
394	K	88.9	Confident	88.6	Confident	78 Å²	78	82.8 Å²	82.8	34%	0.339	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.8	-174.4	-69.4	-175	-176.7	-169.7	0	111.6	R389 R392 V403 D404 Y408	R389-K394 CarbonylContact C-O 3.58Å; R389-K394 HydrophobicContact CB-CB 4.18Å; R389-K394 VanDerWaalsContact CB-O 3.31Å; R389-K394 WeakPolarHBondContact CB-O 3.32Å; R389-K394 WeakPolarHBondContact O-CA 3.21Å; R389-K394 PolarHBondContact O-N 2.98Å; R389-K394 VanDerWaalsContact O-O 3.05Å; R392-K394 VanDerWaalsContact C-N 3.28Å; R392-K394 HydrophobicContact CB-CD 4.27Å; R392-K394 HydrophobicContact CB-CG 4.23Å; R392-K394 PolarHBondContact O-N 3.41Å; K394-V403 HydrophobicContact CB-CG1 3.64Å; K394-V403 HydrophobicContact CD-CG1 3.91Å; K394-V403 HydrophobicContact CG-CG1 4.06Å; K394-D404 CarbonylContact C-O 3.58Å; K394-D404 WeakPolarHBondContact CA-O 3.39Å; K394-Y408 PolarHBondContact O-OH 2.81Å
395	K	89.9	Confident	88.4	Confident	120 Å²	120	87.4 Å²	87.4	52%	0.522	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	140.6	178	-174.8	177.3	173	179.6	0	110.6	V403 D404 C406 Y408	K395-V403 CarbonylContact O-C 3.55Å; K395-V403 WeakPolarHBondContact O-CA 3.47Å; K395-D404 PolarHBondContact N-O 3.39Å; K395-D404 PolarHBondContact O-N 2.88Å; K395-C406 HydrophobicContact CB-CB 4.27Å; K395-Y408 WeakPolarHBondContact CB-OH 3.38Å
396	W	89.4	Confident	88.1	Confident	97 Å²	97	87 Å²	87	37%	0.367	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.6	167.8	-176.7	-103.6	0	0	0	110.4	Q401 V403	W396-Q401 VanDerWaalsContact CH2-C 3.43Å; W396-Q401 WeakPolarHBondContact CH2-O 3.38Å; W396-Q401 HydrophobicContact CZ2-CB 4.32Å; W396-V403 HydrophobicContact CE3-CG2 3.62Å; W396-V403 HydrophobicContact CZ3-CG2 3.9Å
397	N	87	Confident	87.9	Confident	37 Å²	37	89.8 Å²	89.8	20%	0.198	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	107.3	175.9	-173.8	-12.2	0	0	0	109.5	L399 R400 Q401 R402 D404	N397-L399 VanDerWaalsContact C-N 3.28Å; N397-L399 PolarHBondContact O-N 3.4Å; N397-L399 WeakPolarHBondContact OD1-CB 3.42Å; N397-L399 PolarHBondContact OD1-N 2.87Å; N397-L399 VanDerWaalsContact OD1-N 3.12Å; N397-R400 PolarHBondContact O-N 3.26Å; N397-Q401 WeakPolarHBondContact O-CA 3.25Å; N397-Q401 PolarHBondContact O-N 3.45Å; N397-R402 PolarHBondContact N-O 3.29Å; N397-R402 PolarHBondContact O-N 3.36Å; N397-D404 WeakPolarHBondContact CB-OD2 3.3Å; N397-D404 PolarHBondContact ND2-OD2 2.97Å
398	V	87	Confident	87.6	Confident	100 Å²	100	91.9 Å²	91.9	61%	0.606	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-33.5	-178.9	-178.8	0	0	0	0	111.7	R400 Q401	V398-R400 PolarHBondContact O-N 3.4Å; V398-Q401 PolarHBondContact O-NE2 3.1Å
399	L	86.2	Confident	87.6	Confident	168 Å²	168	90.2 Å²	90.2	88%	0.88	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-33	-177.7	-62.1	175	0	0	0	112.5	N397	N397-L399 VanDerWaalsContact C-N 3.28Å; N397-L399 PolarHBondContact O-N 3.4Å; N397-L399 WeakPolarHBondContact OD1-CB 3.42Å; N397-L399 PolarHBondContact OD1-N 2.87Å; N397-L399 VanDerWaalsContact OD1-N 3.12Å
400	R	85.1	Confident	87.5	Confident	165 Å²	165	94.1 Å²	94.1	62%	0.623	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	3.5	-178.6	-64.5	-175.7	-178.1	178.3	-0.6	113.8	N397 V398 R402	N397-R400 PolarHBondContact O-N 3.26Å; V398-R400 PolarHBondContact O-N 3.4Å; R400-R402 HydrophobicContact CB-CG 3.95Å; R400-R402 PolarHBondContact O-N 3.05Å; R400-R402 VanDerWaalsContact O-N 3.12Å
401	Q	86.8	Confident	87.5	Confident	127 Å²	127	98.9 Å²	98.9	59%	0.593	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	41.5	-178.6	-63.8	-69.4	-41.7	0	0	113.5	W396 N397 V398	W396-Q401 VanDerWaalsContact CH2-C 3.43Å; W396-Q401 WeakPolarHBondContact CH2-O 3.38Å; W396-Q401 HydrophobicContact CZ2-CB 4.32Å; N397-Q401 WeakPolarHBondContact O-CA 3.25Å; N397-Q401 PolarHBondContact O-N 3.45Å; V398-Q401 PolarHBondContact O-NE2 3.1Å
402	R	88.8	Confident	87.7	Confident	121 Å²	121	100.5 Å²	100.5	46%	0.457	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	165.3	-176.8	73.8	-176.8	-164.5	174.4	7.5	112.4	N397 R400 D404	N397-R402 PolarHBondContact N-O 3.29Å; N397-R402 PolarHBondContact O-N 3.36Å; R400-R402 HydrophobicContact CB-CG 3.95Å; R400-R402 PolarHBondContact O-N 3.05Å; R400-R402 VanDerWaalsContact O-N 3.12Å; R402-D404 IonicContact CZ-OD1 3.54Å; R402-D404 VanDerWaalsContact CZ-OD1 3.25Å; R402-D404 IonicContact NE-OD1 2.8Å; R402-D404 PolarHBondContact NE-OD1 2.83Å; R402-D404 IonicContact NE-OD2 3.45Å; R402-D404 IonicContact NH2-OD1 3.19Å; R402-D404 PolarHBondContact NH2-OD1 3.42Å
403	V	87.9	Confident	87.9	Confident	70 Å²	70	96.4 Å²	96.4	42%	0.424	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	117.1	174.5	-177	0	0	0	0	109.5	K394 K395 W396	K394-V403 HydrophobicContact CB-CG1 3.64Å; K394-V403 HydrophobicContact CD-CG1 3.91Å; K394-V403 HydrophobicContact CG-CG1 4.06Å; K395-V403 CarbonylContact O-C 3.55Å; K395-V403 WeakPolarHBondContact O-CA 3.47Å; W396-V403 HydrophobicContact CE3-CG2 3.62Å; W396-V403 HydrophobicContact CZ3-CG2 3.9Å
404	D	89.3	Confident	88.1	Confident	38 Å²	38	102 Å²	102	20%	0.203	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	152	176.5	-69.2	-42.1	0	0	0	110.5	K394 K395 N397 R402	K394-D404 CarbonylContact C-O 3.58Å; K394-D404 WeakPolarHBondContact CA-O 3.39Å; K395-D404 PolarHBondContact N-O 3.39Å; K395-D404 PolarHBondContact O-N 2.88Å; N397-D404 WeakPolarHBondContact CB-OD2 3.3Å; N397-D404 PolarHBondContact ND2-OD2 2.97Å; R402-D404 IonicContact CZ-OD1 3.54Å; R402-D404 VanDerWaalsContact CZ-OD1 3.25Å; R402-D404 IonicContact NE-OD1 2.8Å; R402-D404 PolarHBondContact NE-OD1 2.83Å; R402-D404 IonicContact NE-OD2 3.45Å; R402-D404 IonicContact NH2-OD1 3.19Å; R402-D404 PolarHBondContact NH2-OD1 3.42Å
405	S	87.9	Confident	88.2	Confident	113 Å²	113	103.6 Å²	103.6	79%	0.79	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	140.9	169.7	50.2	0	0	0	0	110.8	G393	G393-S405 CarbonylContact O-C 3.55Å; G393-S405 WeakPolarHBondContact O-CA 3.14Å
406	C	85.1	Confident	88.3	Confident	50 Å²	50	98 Å²	98	34%	0.338	50%	0.503	S	S	.	.			trans	-142.8	135.1	-179.9	-166.2	0	0	0	0	109.5	G393 K395 Y408	G393-C406 CarbonylContact C-O 3.55Å; G393-C406 PolarHBondContact O-N 3.42Å; K395-C406 HydrophobicContact CB-CB 4.27Å; C406-Y408 HydrophobicContact CB-CE1 4.48Å; C406-Y408 HydrophobicContact CB-CE2 3.89Å; C406-Y408 WeakPolarHBondContact O-CD2 3.47Å
407	S	86.3	Confident	88.3	Confident	116 Å²	116	96.3 Å²	96.3	81%	0.811	50%	0.503	S	S	*	.			trans	-81.5	122.9	171.7	50.8	0	0	0	0	109.1
408	Y	86.3	Confident	88.6	Confident	65 Å²	65	98.7 Å²	98.7	26%	0.255	52%	0.515	S	S	.	.			trans	-110.9	143.8	177.9	-64.3	-75.6	0	0	0	110.1	L390 K394 K395 C406	L390-Y408 HydrophobicContact CD1-CD1 3.44Å; L390-Y408 VanDerWaalsContact CD1-CD1 3.44Å; L390-Y408 HydrophobicContact CD1-CD2 3.7Å; L390-Y408 HydrophobicContact CD1-CE1 3.35Å; L390-Y408 HydrophobicContact CD1-CE2 3.62Å; L390-Y408 HydrophobicContact CD1-CG 3.6Å; L390-Y408 VanDerWaalsContact CD1-CZ 3.43Å; K394-Y408 PolarHBondContact O-OH 2.81Å; K395-Y408 WeakPolarHBondContact CB-OH 3.38Å; C406-Y408 HydrophobicContact CB-CE1 4.48Å; C406-Y408 HydrophobicContact CB-CE2 3.89Å; C406-Y408 WeakPolarHBondContact O-CD2 3.47Å
409	D	90.1	Very high	88.8	Confident	107 Å²	107	97.9 Å²	97.9	57%	0.572	51%	0.507	S	S	*	.			trans	-70.7	156.9	174.1	-58.6	-41.1	0	0	0	111	D411 Q412 L413	D409-D411 VanDerWaalsContact C-N 3.27Å; D409-D411 PolarHBondContact O-N 3.48Å; D409-Q412 HydrophobicContact CB-CG 4.32Å; D409-Q412 PolarHBondContact O-N 3.44Å; D409-Q412 VanDerWaalsContact O-N 3.14Å; D409-L413 PolarHBondContact O-N 3.43Å; D409-L413 VanDerWaalsContact O-N 3.08Å
410	L	87.6	Confident	89.2	Confident	146 Å²	146	91.4 Å²	91.4	76%	0.764	47%	0.472	S	S	*	.	H	α-helix	trans	-57.1	-40.4	-179.3	-66	177.7	0	0	0	112.3	Q412 L413 F414	L410-Q412 VanDerWaalsContact C-N 3.35Å; L410-Q412 PolarHBondContact O-N 2.94Å; L410-L413 PolarHBondContact O-N 3.47Å; L410-F414 WeakPolarHBondContact O-CB 3.29Å; L410-F414 PolarHBondContact O-N 3.5Å
411	D	91.2	Very high	89.5	Confident	127 Å²	127	86.2 Å²	86.2	68%	0.679	46%	0.458	S	S	*	.	H	α-helix	trans	-64.2	-39.7	179.6	-61.3	-21.7	0	0	0	111.9	D409 F414 I415	D409-D411 VanDerWaalsContact C-N 3.27Å; D409-D411 PolarHBondContact O-N 3.48Å; D411-F414 PolarHBondContact O-N 2.91Å; D411-I415 WeakPolarHBondContact O-CG1 3.39Å; D411-I415 PolarHBondContact O-N 3.5Å
412	Q	87.9	Confident	89.8	Confident	92 Å²	92	83.9 Å²	83.9	43%	0.43	45%	0.449	S	S	.	.	H	α-helix	trans	-67	-40.1	177.6	-64	176.5	0.6	0	0	111.2	D409 L410 G416	D409-Q412 HydrophobicContact CB-CG 4.32Å; D409-Q412 PolarHBondContact O-N 3.44Å; D409-Q412 VanDerWaalsContact O-N 3.14Å; L410-Q412 VanDerWaalsContact C-N 3.35Å; L410-Q412 PolarHBondContact O-N 2.94Å; Q412-G416 PolarHBondContact O-N 3.45Å
413	L	90	Very high	90	Very high	64 Å²	64	79 Å²	79	34%	0.335	43%	0.432	S	S	.	.	H	α-helix	trans	-66	-40.5	175.9	-171.1	66.6	0	0	0	111.4	F391 D409 L410 G416 T417	F391-L413 HydrophobicContact CD1-CD1 3.73Å; F391-L413 HydrophobicContact CE1-CD1 4.44Å; D409-L413 PolarHBondContact O-N 3.43Å; D409-L413 VanDerWaalsContact O-N 3.08Å; L410-L413 PolarHBondContact O-N 3.47Å; L413-G416 PolarHBondContact O-N 2.82Å; L413-T417 WeakPolarHBondContact O-CB 3.33Å; L413-T417 PolarHBondContact O-N 3.44Å; L413-T417 PolarHBondContact O-OG1 3.41Å
414	F	90.5	Very high	90.1	Very high	142 Å²	142	79.4 Å²	79.4	62%	0.623	43%	0.431	S	S	*	.	H	α-helix	trans	-62.4	-51.6	177	-178.7	-102.4	0	0	0	111.8	L410 D411 G416 T417 L418	L410-F414 WeakPolarHBondContact O-CB 3.29Å; L410-F414 PolarHBondContact O-N 3.5Å; D411-F414 PolarHBondContact O-N 2.91Å; F414-G416 VanDerWaalsContact C-N 3.29Å; F414-G416 PolarHBondContact O-N 2.85Å; F414-T417 PolarHBondContact O-N 3.28Å; F414-T417 VanDerWaalsContact O-N 3.1Å; F414-L418 PolarHBondContact O-N 3.19Å
415	I	92.1	Very high	90.2	Very high	110 Å²	110	84.9 Å²	84.9	56%	0.564	45%	0.454	S	S	*	.	H	α-helix	trans	-59.7	-42.5	176.8	-66.5	166.2	0	0	0	110.6	D411 T417 L418 L419	D411-I415 WeakPolarHBondContact O-CG1 3.39Å; D411-I415 PolarHBondContact O-N 3.5Å; I415-T417 VanDerWaalsContact C-N 3.3Å; I415-T417 PolarHBondContact O-N 3.49Å; I415-L418 PolarHBondContact O-N 3.39Å; I415-L419 WeakPolarHBondContact O-CB 3.45Å; I415-L419 PolarHBondContact O-N 2.88Å
416	G	91.7	Very high	90.4	Very high	4 Å²	4	80.7 Å²	80.7	4%	0.041	42%	0.422	C	S	.	.	H	α-helix	trans	-57.3	-43	175.4	0	0	0	0	0	112.7	F391 Q412 L413 F414 L419 F420	F391-G416 WeakPolarHBondContact CZ-O 3.36Å; Q412-G416 PolarHBondContact O-N 3.45Å; L413-G416 PolarHBondContact O-N 2.82Å; F414-G416 VanDerWaalsContact C-N 3.29Å; F414-G416 PolarHBondContact O-N 2.85Å; G416-L419 PolarHBondContact O-N 3.06Å; G416-F420 VanDerWaalsContact O-CB 3.31Å; G416-F420 WeakPolarHBondContact O-CB 3.4Å; G416-F420 PolarHBondContact O-N 2.68Å
417	T	90.2	Very high	90.7	Very high	60 Å²	60	80 Å²	80	37%	0.368	42%	0.415	S	S	.	.	H	α-helix	trans	-67.3	-43.2	-178.6	-52.1	0	0	0	0	110.9	F391 L413 F414 I415 F420 T421	F391-T417 HydrophobicContact CE1-CG2 4.4Å; F391-T417 VanDerWaalsContact CE1-N 3.29Å; F391-T417 WeakPolarHBondContact CE1-OG1 3.44Å; F391-T417 VanDerWaalsContact CZ-CA 3.4Å; L413-T417 WeakPolarHBondContact O-CB 3.33Å; L413-T417 PolarHBondContact O-N 3.44Å; L413-T417 PolarHBondContact O-OG1 3.41Å; F414-T417 PolarHBondContact O-N 3.28Å; F414-T417 VanDerWaalsContact O-N 3.1Å; I415-T417 VanDerWaalsContact C-N 3.3Å; I415-T417 PolarHBondContact O-N 3.49Å; T417-F420 PolarHBondContact O-N 2.71Å; T417-T421 WeakPolarHBondContact O-CG2 3.24Å; T417-T421 PolarHBondContact O-N 2.96Å; T417-T421 PolarHBondContact O-OG1 2.94Å
418	L	92.1	Very high	90.9	Very high	88 Å²	88	77.2 Å²	77.2	46%	0.461	39%	0.394	S	S	.	.	H	α-helix	trans	-62.4	-47.9	175	-173.3	152.7	0	0	0	111.1	F414 I415 F420 T421 I422	F414-L418 PolarHBondContact O-N 3.19Å; I415-L418 PolarHBondContact O-N 3.39Å; L418-F420 VanDerWaalsContact C-N 3.33Å; L418-F420 PolarHBondContact O-N 3.1Å; L418-T421 PolarHBondContact O-N 2.9Å; L418-T421 PolarHBondContact O-OG1 3.28Å; L418-I422 HydrophobicContact CD2-CD1 3.43Å; L418-I422 VanDerWaalsContact CD2-CD1 3.43Å; L418-I422 HydrophobicContact CD2-CG1 4.37Å; L418-I422 HydrophobicContact CG-CD1 4.35Å; L418-I422 VanDerWaalsContact O-CG1 3.31Å; L418-I422 WeakPolarHBondContact O-CG1 3.34Å; L418-I422 PolarHBondContact O-N 3.41Å
419	L	92.8	Very high	91.2	Very high	82 Å²	82	74.1 Å²	74.1	43%	0.429	38%	0.382	S	S	.	.	H	α-helix	trans	-64.9	-38.3	179.3	-173.3	62.4	0	0	0	111.9	L387 I415 G416 I422 L423	L387-L419 HydrophobicContact CD1-CB 4.05Å; L387-L419 HydrophobicContact CD1-CD2 3.95Å; L387-L419 HydrophobicContact CD1-CG 3.79Å; L387-L419 HydrophobicContact CD2-CD2 4.28Å; I415-L419 WeakPolarHBondContact O-CB 3.45Å; I415-L419 PolarHBondContact O-N 2.88Å; G416-L419 PolarHBondContact O-N 3.06Å; L419-I422 PolarHBondContact O-N 3.08Å; L419-L423 HydrophobicContact CD1-CG 4.43Å; L419-L423 HydrophobicContact CG-CD1 4.32Å; L419-L423 HydrophobicContact CG-CG 4.44Å; L419-L423 WeakPolarHBondContact O-CB 3.33Å; L419-L423 VanDerWaalsContact O-CG 3.32Å; L419-L423 WeakPolarHBondContact O-CG 3.4Å; L419-L423 PolarHBondContact O-N 3.45Å
420	F	93.4	Very high	91.3	Very high	33 Å²	33	69.1 Å²	69.1	15%	0.145	36%	0.355	C	S	.	.	H	α-helix	trans	-64.8	-47.1	178.1	176.5	-98.2	0	0	0	111.9	L384 L387 W388 F391 G416 T417 L418 I422 L423 L424	L384-F420 HydrophobicContact CB-CE2 4.44Å; L384-F420 HydrophobicContact CD2-CD2 3.52Å; L384-F420 HydrophobicContact CD2-CE2 3.63Å; L384-F420 HydrophobicContact CD2-CG 4.22Å; L384-F420 HydrophobicContact CD2-CZ 4.4Å; L387-F420 HydrophobicContact CB-CB 4.08Å; L387-F420 HydrophobicContact CB-CD2 3.93Å; L387-F420 HydrophobicContact CB-CG 4.49Å; L387-F420 HydrophobicContact CD1-CB 4.05Å; W388-F420 HydrophobicContact CB-CE2 4.38Å; W388-F420 HydrophobicContact CE3-CE2 4.19Å; W388-F420 AromaticContact CE3-CZ 3.9Å; W388-F420 HydrophobicContact CE3-CZ 3.9Å; W388-F420 HydrophobicContact CZ3-CZ 4.37Å; F391-F420 HydrophobicContact CE2-CB 3.53Å; F391-F420 AromaticContact CE2-CD1 3.7Å; F391-F420 HydrophobicContact CE2-CD1 3.7Å; F391-F420 AromaticContact CE2-CD2 3.69Å; F391-F420 HydrophobicContact CE2-CD2 3.69Å; F391-F420 HydrophobicContact CE2-CE1 4.27Å; F391-F420 HydrophobicContact CE2-CE2 4.25Å; F391-F420 AromaticContact CE2-CG 3.37Å; F391-F420 HydrophobicContact CE2-CG 3.37Å; F391-F420 HydrophobicContact CZ-CB 3.4Å; F391-F420 VanDerWaalsContact CZ-CB 3.4Å; F391-F420 HydrophobicContact CZ-CD1 4.26Å; F391-F420 HydrophobicContact CZ-CD2 4.42Å; F391-F420 AromaticContact CZ-CG 3.83Å; F391-F420 HydrophobicContact CZ-CG 3.83Å; G416-F420 VanDerWaalsContact O-CB 3.31Å; G416-F420 WeakPolarHBondContact O-CB 3.4Å; G416-F420 PolarHBondContact O-N 2.68Å; T417-F420 PolarHBondContact O-N 2.71Å; L418-F420 VanDerWaalsContact C-N 3.33Å; L418-F420 PolarHBondContact O-N 3.1Å; F420-I422 VanDerWaalsContact C-N 3.32Å; F420-I422 PolarHBondContact O-N 2.96Å; F420-L423 PolarHBondContact O-N 3.37Å; F420-L424 HydrophobicContact CE1-CD2 4.05Å; F420-L424 VanDerWaalsContact O-CB 3.22Å; F420-L424 WeakPolarHBondContact O-CB 3.37Å; F420-L424 PolarHBondContact O-N 3.14Å
421	T	92	Very high	91.5	Very high	56 Å²	56	63.6 Å²	63.6	34%	0.344	33%	0.331	S	S	.	.	H	α-helix	trans	-61.4	-42.5	177.9	51.1	0	0	0	0	111	T417 L418 L424 F425	T417-T421 WeakPolarHBondContact O-CG2 3.24Å; T417-T421 PolarHBondContact O-N 2.96Å; T417-T421 PolarHBondContact O-OG1 2.94Å; L418-T421 PolarHBondContact O-N 2.9Å; L418-T421 PolarHBondContact O-OG1 3.28Å; T421-L424 PolarHBondContact O-N 3.36Å; T421-F425 WeakPolarHBondContact O-CD2 3.35Å; T421-F425 PolarHBondContact O-N 3.29Å
422	I	92.1	Very high	91.5	Very high	78 Å²	78	59.4 Å²	59.4	40%	0.4	31%	0.308	S	S	.	.	H	α-helix	trans	-59.5	-50.6	173.3	-70	175.9	0	0	0	111.5	L418 L419 F420 L424 F425 L426	L418-I422 HydrophobicContact CD2-CD1 3.43Å; L418-I422 VanDerWaalsContact CD2-CD1 3.43Å; L418-I422 HydrophobicContact CD2-CG1 4.37Å; L418-I422 HydrophobicContact CG-CD1 4.35Å; L418-I422 VanDerWaalsContact O-CG1 3.31Å; L418-I422 WeakPolarHBondContact O-CG1 3.34Å; L418-I422 PolarHBondContact O-N 3.41Å; L419-I422 PolarHBondContact O-N 3.08Å; F420-I422 VanDerWaalsContact C-N 3.32Å; F420-I422 PolarHBondContact O-N 2.96Å; I422-L424 VanDerWaalsContact C-N 3.3Å; I422-L424 PolarHBondContact O-N 3.28Å; I422-F425 PolarHBondContact O-N 3.05Å; I422-L426 HydrophobicContact CG2-CD1 3.52Å; I422-L426 HydrophobicContact CG2-CG 4.44Å; I422-L426 WeakPolarHBondContact O-CB 3.1Å; I422-L426 WeakPolarHBondContact O-CD1 3.25Å; I422-L426 WeakPolarHBondContact O-CG 3.21Å; I422-L426 PolarHBondContact O-N 3.42Å
423	L	92.6	Very high	91.7	Very high	19 Å²	19	55.2 Å²	55.2	10%	0.099	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-37.1	179.7	-72.1	-177.2	0	0	0	112.2	K380 L384 L387 L419 F420 L426 L427	K380-L423 HydrophobicContact CD-CD2 3.65Å; K380-L423 VanDerWaalsContact NZ-CD2 3.29Å; L384-L423 HydrophobicContact CD2-CB 3.71Å; L384-L423 HydrophobicContact CG-CB 4.07Å; L387-L423 HydrophobicContact CD1-CD1 3.77Å; L419-L423 HydrophobicContact CD1-CG 4.43Å; L419-L423 HydrophobicContact CG-CD1 4.32Å; L419-L423 HydrophobicContact CG-CG 4.44Å; L419-L423 WeakPolarHBondContact O-CB 3.33Å; L419-L423 VanDerWaalsContact O-CG 3.32Å; L419-L423 WeakPolarHBondContact O-CG 3.4Å; L419-L423 PolarHBondContact O-N 3.45Å; F420-L423 PolarHBondContact O-N 3.37Å; L423-L426 PolarHBondContact O-N 3.07Å; L423-L427 PolarHBondContact O-N 3.17Å
424	L	91.7	Very high	91.8	Very high	77 Å²	77	52.7 Å²	52.7	40%	0.403	28%	0.275	S	S	.	.	H	α-helix	trans	-66.4	-43.2	179.7	-174.5	67.4	0	0	0	110.9	L384 F420 T421 I422 L426 L427 P428	L384-L424 HydrophobicContact CD2-CB 4.12Å; F420-L424 HydrophobicContact CE1-CD2 4.05Å; F420-L424 VanDerWaalsContact O-CB 3.22Å; F420-L424 WeakPolarHBondContact O-CB 3.37Å; F420-L424 PolarHBondContact O-N 3.14Å; T421-L424 PolarHBondContact O-N 3.36Å; I422-L424 VanDerWaalsContact C-N 3.3Å; I422-L424 PolarHBondContact O-N 3.28Å; L424-L426 VanDerWaalsContact C-N 3.34Å; L424-L427 WeakPolarHBondContact O-CB 3.42Å; L424-L427 PolarHBondContact O-N 2.84Å; L424-P428 WeakPolarHBondContact O-CD 3.28Å
425	F	91.1	Very high	91.9	Very high	154 Å²	154	50 Å²	50	68%	0.675	27%	0.266	S	S	*	.	H	α-helix	trans	-73.1	-23.8	176.6	-69.6	-50.7	0	0	0	113.8	T421 I422	T421-F425 WeakPolarHBondContact O-CD2 3.35Å; T421-F425 PolarHBondContact O-N 3.29Å; I422-F425 PolarHBondContact O-N 3.05Å
426	L	91.8	Very high	92	Very high	25 Å²	25	45.9 Å²	45.9	13%	0.131	25%	0.246	C	C	.	.	H	α-helix	trans	-82.3	-19.9	173.6	-69.7	163.4	0	0	0	113	N304 L307 I422 L423 L424 T429 T430	N304-L426 HydrophobicContact CB-CD2 3.87Å; L307-L426 HydrophobicContact CB-CD2 3.7Å; L307-L426 HydrophobicContact CD2-CB 4.06Å; L307-L426 HydrophobicContact CD2-CD2 3.59Å; L307-L426 HydrophobicContact CD2-CG 4.4Å; L307-L426 HydrophobicContact CG-CD2 4.21Å; I422-L426 HydrophobicContact CG2-CD1 3.52Å; I422-L426 HydrophobicContact CG2-CG 4.44Å; I422-L426 WeakPolarHBondContact O-CB 3.1Å; I422-L426 WeakPolarHBondContact O-CD1 3.25Å; I422-L426 WeakPolarHBondContact O-CG 3.21Å; I422-L426 PolarHBondContact O-N 3.42Å; L423-L426 PolarHBondContact O-N 3.07Å; L424-L426 VanDerWaalsContact C-N 3.34Å; L426-T429 PolarHBondContact O-N 3.42Å; L426-T430 PolarHBondContact O-N 3.31Å
427	L	91.3	Very high	92	Very high	34 Å²	34	45.8 Å²	45.8	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-47.2	-173.4	-175.5	72.7	0	0	0	113.2	Y377 K380 I381 L384 L423 L424 T429 T430 A431	Y377-L427 HydrophobicContact CD2-CD1 4.26Å; Y377-L427 HydrophobicContact CE2-CD1 4.06Å; K380-L427 HydrophobicContact CB-CD1 3.71Å; I381-L427 HydrophobicContact CD1-CD1 3.92Å; I381-L427 HydrophobicContact CD1-CD2 4.32Å; L384-L427 HydrophobicContact CD1-CB 4.32Å; L384-L427 HydrophobicContact CD1-CD1 4.1Å; L384-L427 HydrophobicContact CD1-CD2 3.77Å; L384-L427 HydrophobicContact CD1-CG 4.29Å; L423-L427 PolarHBondContact O-N 3.17Å; L424-L427 WeakPolarHBondContact O-CB 3.42Å; L424-L427 PolarHBondContact O-N 2.84Å; L427-T429 PolarHBondContact O-N 2.96Å; L427-T430 PolarHBondContact O-N 3.13Å; L427-T430 VanDerWaalsContact O-N 3.11Å; L427-T430 PolarHBondContact O-OG1 3.45Å; L427-A431 WeakPolarHBondContact O-CB 3.31Å; L427-A431 PolarHBondContact O-N 3.23Å
428	P	91	Very high	92.1	Very high	58 Å²	58	43.7 Å²	43.7	38%	0.377	23%	0.232	S	C	.	.	H	α-helix	trans	-57.1	-38.9	-178.7	-24.9	34.7	0	0	0	112.5	L301 L424 A431 L432	L301-P428 HydrophobicContact CD2-CB 3.96Å; L424-P428 WeakPolarHBondContact O-CD 3.28Å; P428-A431 PolarHBondContact O-N 3.29Å; P428-L432 PolarHBondContact O-N 3.03Å; P428-L432 VanDerWaalsContact O-N 3.08Å
429	T	91.4	Very high	92.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61	-53	175.7	-64.4	0	0	0	0	111.1	M303 N304 L307 D308 L311 L426 L427 A431 L432 Y433	M303-T429 WeakPolarHBondContact CB-OG1 3.45Å; M303-T429 VanDerWaalsContact CE-CA 3.48Å; M303-T429 HydrophobicContact CE-CG2 3.91Å; N304-T429 PolarHBondContact N-OG1 2.99Å; N304-T429 VanDerWaalsContact N-OG1 3.1Å; L307-T429 HydrophobicContact CB-CG2 4.32Å; L307-T429 HydrophobicContact CD2-CG2 3.7Å; L307-T429 HydrophobicContact CG-CG2 3.88Å; D308-T429 HydrophobicContact CB-CG2 4.14Å; L311-T429 HydrophobicContact CD1-CG2 4.35Å; L426-T429 PolarHBondContact O-N 3.42Å; L427-T429 PolarHBondContact O-N 2.96Å; T429-A431 VanDerWaalsContact C-N 3.33Å; T429-A431 PolarHBondContact O-N 2.99Å; T429-L432 PolarHBondContact O-N 2.91Å; T429-Y433 HydrophobicContact CG2-CD2 4.45Å; T429-Y433 HydrophobicContact CG2-CE2 4.38Å; T429-Y433 WeakPolarHBondContact O-CD2 3.47Å; T429-Y433 PolarHBondContact O-N 3.08Å
430	T	92.1	Very high	92.2	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-35.6	179.4	55.8	0	0	0	0	113.7	L307 L376 K380 L426 L427 Y434	L307-T430 HydrophobicContact CD2-CG2 3.76Å; L376-T430 HydrophobicContact CD2-CG2 3.84Å; L376-T430 HydrophobicContact CG-CG2 4.07Å; K380-T430 HydrophobicContact CG-CG2 4.15Å; L426-T430 PolarHBondContact O-N 3.31Å; L427-T430 PolarHBondContact O-N 3.13Å; L427-T430 VanDerWaalsContact O-N 3.11Å; L427-T430 PolarHBondContact O-OG1 3.45Å; T430-Y434 WeakPolarHBondContact O-CB 3.36Å; T430-Y434 PolarHBondContact O-N 2.92Å
431	A	91.8	Very high	92.1	Very high	30 Å²	30	43.4 Å²	43.4	25%	0.248	23%	0.229	C	C	.	.	H	α-helix	trans	-66.8	-40.1	-179.4	0	0	0	0	0	111.5	Y377 L427 P428 T429 Y434 L435	Y377-A431 HydrophobicContact CD2-CB 4.15Å; Y377-A431 HydrophobicContact CE2-CB 3.87Å; L427-A431 WeakPolarHBondContact O-CB 3.31Å; L427-A431 PolarHBondContact O-N 3.23Å; P428-A431 PolarHBondContact O-N 3.29Å; T429-A431 VanDerWaalsContact C-N 3.33Å; T429-A431 PolarHBondContact O-N 2.99Å; A431-Y434 PolarHBondContact O-N 3.25Å; A431-L435 WeakPolarHBondContact O-CB 3.48Å; A431-L435 PolarHBondContact O-N 3.3Å
432	L	91.6	Very high	92.1	Very high	39 Å²	39	45.9 Å²	45.9	20%	0.204	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-45.2	179.5	-169.6	61.7	0	0	0	112	L294 P298 M303 P428 T429 Y434 L435 V436	L294-L432 HydrophobicContact CD1-CB 4.28Å; L294-L432 HydrophobicContact CD1-CD2 3.3Å; L294-L432 HydrophobicContact CD1-CG 3.51Å; P298-L432 HydrophobicContact CB-CD2 3.86Å; P298-L432 HydrophobicContact CG-CD2 3.39Å; M303-L432 HydrophobicContact CE-CB 3.94Å; M303-L432 HydrophobicContact CE-CD2 3.68Å; M303-L432 HydrophobicContact CE-CG 4.35Å; M303-L432 HydrophobicContact SD-CD2 3.9Å; P428-L432 PolarHBondContact O-N 3.03Å; P428-L432 VanDerWaalsContact O-N 3.08Å; T429-L432 PolarHBondContact O-N 2.91Å; L432-Y434 VanDerWaalsContact C-N 3.35Å; L432-Y434 PolarHBondContact O-N 3.03Å; L432-L435 PolarHBondContact O-N 3.41Å; L432-V436 WeakPolarHBondContact O-CG2 3.31Å; L432-V436 PolarHBondContact O-N 3.19Å
433	Y	92.3	Very high	92.1	Very high	3 Å²	3	46.9 Å²	46.9	1%	0.012	25%	0.249	C	C	.	.	H	α-helix	trans	-58.5	-46.3	173.1	-85.7	-98.7	0	0	0	111.5	L291 L294 M303 D308 L311 F315 T429 L435 V436 F437	L291-Y433 HydrophobicContact CD2-CD1 4.49Å; L291-Y433 HydrophobicContact CD2-CE1 3.69Å; L294-Y433 HydrophobicContact CD1-CD2 4.36Å; L294-Y433 HydrophobicContact CD1-CE2 4.27Å; L294-Y433 HydrophobicContact CD2-CD1 3.47Å; L294-Y433 VanDerWaalsContact CD2-CD1 3.47Å; L294-Y433 HydrophobicContact CD2-CD2 3.58Å; L294-Y433 HydrophobicContact CD2-CE1 3.36Å; L294-Y433 HydrophobicContact CD2-CE2 3.47Å; L294-Y433 VanDerWaalsContact CD2-CE2 3.47Å; L294-Y433 HydrophobicContact CD2-CG 3.58Å; L294-Y433 HydrophobicContact CG-CD2 3.94Å; L294-Y433 HydrophobicContact CG-CE1 4.15Å; L294-Y433 HydrophobicContact CG-CE2 3.5Å; L294-Y433 VanDerWaalsContact CG-CE2 3.5Å; L294-Y433 HydrophobicContact CG-CG 4.44Å; M303-Y433 HydrophobicContact CE-CD2 4.23Å; M303-Y433 HydrophobicContact CE-CE2 4.13Å; D308-Y433 PolarHBondContact O-OH 3.04Å; D308-Y433 VanDerWaalsContact OD1-CE2 3.28Å; D308-Y433 WeakPolarHBondContact OD1-CE2 3.42Å; D308-Y433 PolarHBondContact OD1-OH 3.27Å; D308-Y433 VanDerWaalsContact OD1-OH 3.12Å; L311-Y433 HydrophobicContact CB-CD1 4.39Å; L311-Y433 HydrophobicContact CB-CE1 3.98Å; L311-Y433 HydrophobicContact CB-CE2 4.4Å; L311-Y433 HydrophobicContact CD1-CD2 4.22Å; L311-Y433 HydrophobicContact CD1-CE2 4.42Å; L311-Y433 HydrophobicContact CD1-CG 4.38Å; F315-Y433 AromaticContact CD2-CD1 3.81Å; F315-Y433 HydrophobicContact CD2-CD1 3.81Å; F315-Y433 AromaticContact CD2-CE1 3.81Å; F315-Y433 HydrophobicContact CD2-CE1 3.81Å; F315-Y433 AromaticContact CE2-CD1 3.71Å; F315-Y433 HydrophobicContact CE2-CD1 3.71Å; F315-Y433 HydrophobicContact CE2-CE1 4.12Å; T429-Y433 HydrophobicContact CG2-CD2 4.45Å; T429-Y433 HydrophobicContact CG2-CE2 4.38Å; T429-Y433 WeakPolarHBondContact O-CD2 3.47Å; T429-Y433 PolarHBondContact O-N 3.08Å; Y433-L435 VanDerWaalsContact C-N 3.34Å; Y433-L435 PolarHBondContact O-N 3.45Å; Y433-V436 PolarHBondContact O-N 3.23Å; Y433-F437 AromaticContact CD1-CE2 3.74Å; Y433-F437 HydrophobicContact CD1-CE2 3.74Å; Y433-F437 AromaticContact CD1-CZ 3.98Å; Y433-F437 HydrophobicContact CD1-CZ 3.98Å; Y433-F437 HydrophobicContact CG-CE2 4.46Å; Y433-F437 WeakPolarHBondContact O-CD2 3.44Å; Y433-F437 WeakPolarHBondContact O-CG 3.42Å; Y433-F437 PolarHBondContact O-N 3.35Å; Y433-F437 VanDerWaalsContact O-N 3.07Å
434	Y	93.3	Very high	92.1	Very high	12 Å²	12	46.7 Å²	46.7	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-43.9	177.2	169.7	-118	0	0	0	112.3	Y370 A374 Y377 T430 A431 L432 T438 L531	Y370-Y434 HydrophobicContact CD2-CE2 4.32Å; Y370-Y434 AromaticContact CE2-CE2 3.89Å; Y370-Y434 HydrophobicContact CE2-CE2 3.89Å; A374-Y434 HydrophobicContact CB-CD2 4.06Å; A374-Y434 HydrophobicContact CB-CE2 3.65Å; Y377-Y434 AromaticContact CD1-CD1 3.69Å; Y377-Y434 HydrophobicContact CD1-CD1 3.69Å; Y377-Y434 AromaticContact CD1-CE1 3.84Å; Y377-Y434 HydrophobicContact CD1-CE1 3.84Å; Y377-Y434 HydrophobicContact CD1-CG 4.28Å; Y377-Y434 HydrophobicContact CD2-CD1 4.44Å; Y377-Y434 HydrophobicContact CE1-CD1 4.11Å; Y377-Y434 HydrophobicContact CE1-CE1 4.07Å; Y377-Y434 AromaticContact CG-CD1 3.88Å; Y377-Y434 HydrophobicContact CG-CD1 3.88Å; Y377-Y434 HydrophobicContact CG-CE1 4.48Å; Y377-Y434 HydrophobicContact CG-CG 4.16Å; T430-Y434 WeakPolarHBondContact O-CB 3.36Å; T430-Y434 PolarHBondContact O-N 2.92Å; A431-Y434 PolarHBondContact O-N 3.25Å; L432-Y434 VanDerWaalsContact C-N 3.35Å; L432-Y434 PolarHBondContact O-N 3.03Å; Y434-T438 WeakPolarHBondContact CE2-OG1 3.3Å; Y434-T438 VanDerWaalsContact O-CB 3.25Å; Y434-T438 WeakPolarHBondContact O-CB 3.35Å; Y434-T438 PolarHBondContact O-N 3.36Å; Y434-T438 PolarHBondContact O-OG1 2.97Å; Y434-L531 WeakPolarHBondContact CE1-O 3.49Å; Y434-L531 WeakPolarHBondContact OH-CD1 3.36Å; Y434-L531 PolarHBondContact OH-O 2.93Å; Y434-L531 VanDerWaalsContact OH-O 3.09Å
435	L	92.3	Very high	92	Very high	86 Å²	86	44 Å²	44	45%	0.45	24%	0.235	S	C	.	.	H	α-helix	trans	-60.6	-50.5	178	178.9	64.2	0	0	0	111.2	A431 L432 Y433 F437 T438 L439	A431-L435 WeakPolarHBondContact O-CB 3.48Å; A431-L435 PolarHBondContact O-N 3.3Å; L432-L435 PolarHBondContact O-N 3.41Å; Y433-L435 VanDerWaalsContact C-N 3.34Å; Y433-L435 PolarHBondContact O-N 3.45Å; L435-F437 PolarHBondContact O-N 3.31Å; L435-T438 WeakPolarHBondContact O-CB 3.31Å; L435-T438 PolarHBondContact O-N 3.1Å; L435-L439 HydrophobicContact CD1-CD1 4.45Å; L435-L439 HydrophobicContact CD1-CG 4.46Å; L435-L439 HydrophobicContact CG-CD1 4.29Å; L435-L439 WeakPolarHBondContact O-CG 3.48Å; L435-L439 PolarHBondContact O-N 3.46Å
436	V	92.8	Very high	92	Very high	23 Å²	23	42.3 Å²	42.3	14%	0.139	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-49.4	-179.3	171.2	0	0	0	0	111.4	L290 L432 Y433 T438 L439 L440	L290-V436 HydrophobicContact CD2-CG1 3.6Å; L290-V436 HydrophobicContact CG-CG1 4.22Å; L432-V436 WeakPolarHBondContact O-CG2 3.31Å; L432-V436 PolarHBondContact O-N 3.19Å; Y433-V436 PolarHBondContact O-N 3.23Å; V436-T438 VanDerWaalsContact C-N 3.3Å; V436-T438 PolarHBondContact O-N 3.35Å; V436-L439 PolarHBondContact O-N 3.32Å; V436-L440 HydrophobicContact CG1-CD1 4.27Å; V436-L440 PolarHBondContact O-N 3.35Å
437	F	93.2	Very high	92	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.009	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-29.9	179.4	-61	-45.7	0	0	0	113.3	L291 F315 F369 Y433 L435 L440 R441	L291-F437 HydrophobicContact CD2-CZ 4.38Å; F315-F437 HydrophobicContact CB-CZ 4.32Å; F315-F437 HydrophobicContact CD1-CE2 4.04Å; F315-F437 AromaticContact CD1-CZ 3.83Å; F315-F437 HydrophobicContact CD1-CZ 3.83Å; F315-F437 AromaticContact CD2-CE2 3.78Å; F315-F437 HydrophobicContact CD2-CE2 3.78Å; F315-F437 AromaticContact CD2-CZ 3.66Å; F315-F437 HydrophobicContact CD2-CZ 3.66Å; F315-F437 HydrophobicContact CE1-CD2 4.49Å; F315-F437 AromaticContact CE1-CE2 3.72Å; F315-F437 HydrophobicContact CE1-CE2 3.72Å; F315-F437 HydrophobicContact CE1-CZ 4.02Å; F315-F437 AromaticContact CE2-CE2 3.46Å; F315-F437 HydrophobicContact CE2-CE2 3.46Å; F315-F437 VanDerWaalsContact CE2-CE2 3.46Å; F315-F437 AromaticContact CE2-CZ 3.87Å; F315-F437 HydrophobicContact CE2-CZ 3.87Å; F315-F437 HydrophobicContact CG-CE2 4.08Å; F315-F437 AromaticContact CG-CZ 3.67Å; F315-F437 HydrophobicContact CG-CZ 3.67Å; F315-F437 HydrophobicContact CZ-CD2 4.28Å; F315-F437 AromaticContact CZ-CE2 3.43Å; F315-F437 HydrophobicContact CZ-CE2 3.43Å; F315-F437 VanDerWaalsContact CZ-CE2 3.43Å; F315-F437 HydrophobicContact CZ-CZ 4.05Å; F369-F437 HydrophobicContact CB-CB 4.32Å; F369-F437 HydrophobicContact CB-CD1 3.77Å; F369-F437 HydrophobicContact CB-CD2 4.1Å; F369-F437 HydrophobicContact CB-CE1 4.06Å; F369-F437 HydrophobicContact CB-CE2 4.35Å; F369-F437 HydrophobicContact CB-CG 3.81Å; F369-F437 HydrophobicContact CB-CZ 4.34Å; F369-F437 HydrophobicContact CD2-CD1 4.11Å; F369-F437 AromaticContact CD2-CE1 3.8Å; F369-F437 HydrophobicContact CD2-CE1 3.8Å; F369-F437 HydrophobicContact CD2-CZ 4.36Å; F369-F437 HydrophobicContact CG-CD1 4.39Å; F369-F437 HydrophobicContact CG-CE1 4.25Å; Y433-F437 AromaticContact CD1-CE2 3.74Å; Y433-F437 HydrophobicContact CD1-CE2 3.74Å; Y433-F437 AromaticContact CD1-CZ 3.98Å; Y433-F437 HydrophobicContact CD1-CZ 3.98Å; Y433-F437 HydrophobicContact CG-CE2 4.46Å; Y433-F437 WeakPolarHBondContact O-CD2 3.44Å; Y433-F437 WeakPolarHBondContact O-CG 3.42Å; Y433-F437 PolarHBondContact O-N 3.35Å; Y433-F437 VanDerWaalsContact O-N 3.07Å; L435-F437 PolarHBondContact O-N 3.31Å; F437-L440 HydrophobicContact CD1-CD1 4.14Å; F437-R441 VanDerWaalsContact O-CB 3.32Å; F437-R441 WeakPolarHBondContact O-CB 3.45Å; F437-R441 PolarHBondContact O-N 3.22Å
438	T	92.6	Very high	92	Very high	16 Å²	16	45.4 Å²	45.4	10%	0.098	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-45.2	171.2	-64	0	0	0	0	111	Y370 Y434 L435 V436 R441 L442 L531	Y370-T438 HydrophobicContact CE2-CG2 4.36Å; Y370-T438 WeakPolarHBondContact CE2-OG1 3.35Å; Y434-T438 WeakPolarHBondContact CE2-OG1 3.3Å; Y434-T438 VanDerWaalsContact O-CB 3.25Å; Y434-T438 WeakPolarHBondContact O-CB 3.35Å; Y434-T438 PolarHBondContact O-N 3.36Å; Y434-T438 PolarHBondContact O-OG1 2.97Å; L435-T438 WeakPolarHBondContact O-CB 3.31Å; L435-T438 PolarHBondContact O-N 3.1Å; V436-T438 VanDerWaalsContact C-N 3.3Å; V436-T438 PolarHBondContact O-N 3.35Å; T438-R441 PolarHBondContact O-N 3.03Å; T438-L442 WeakPolarHBondContact O-CB 3.42Å; T438-L442 PolarHBondContact O-N 3.49Å; T438-L531 HydrophobicContact CG2-CD1 3.3Å; T438-L531 HydrophobicContact CG2-CD2 4.13Å; T438-L531 HydrophobicContact CG2-CG 4.25Å
439	L	92.4	Very high	91.9	Very high	97 Å²	97	43.1 Å²	43.1	51%	0.508	23%	0.231	S	C	.	.	H	α-helix	trans	-62.1	-46.1	178.4	-69.1	172.2	0	0	0	111.1	L435 V436 R441 L442 V443	L435-L439 HydrophobicContact CD1-CD1 4.45Å; L435-L439 HydrophobicContact CD1-CG 4.46Å; L435-L439 HydrophobicContact CG-CD1 4.29Å; L435-L439 WeakPolarHBondContact O-CG 3.48Å; L435-L439 PolarHBondContact O-N 3.46Å; V436-L439 PolarHBondContact O-N 3.32Å; L439-R441 VanDerWaalsContact C-N 3.32Å; L439-R441 PolarHBondContact O-N 3.32Å; L439-L442 WeakPolarHBondContact O-CB 3.19Å; L439-L442 PolarHBondContact O-N 3.32Å; L439-L442 VanDerWaalsContact O-N 3.15Å; L439-V443 PolarHBondContact O-N 2.94Å; L439-V443 VanDerWaalsContact O-N 3.12Å
440	L	92.7	Very high	91.9	Very high	55 Å²	55	47 Å²	47	29%	0.288	25%	0.254	S	S	.	.	H	α-helix	trans	-58.1	-44.5	174.4	-70.1	170.3	0	0	0	111.7	L287 L290 I366 V436 F437 L442 V443 V444	L287-L440 HydrophobicContact CD1-CD1 3.66Å; L290-L440 HydrophobicContact CD2-CD1 4.38Å; I366-L440 HydrophobicContact CG2-CB 3.85Å; V436-L440 HydrophobicContact CG1-CD1 4.27Å; V436-L440 PolarHBondContact O-N 3.35Å; F437-L440 HydrophobicContact CD1-CD1 4.14Å; L440-L442 VanDerWaalsContact C-N 3.33Å; L440-L442 PolarHBondContact O-N 3.13Å; L440-V443 PolarHBondContact O-N 3.38Å; L440-V444 PolarHBondContact O-N 3.22Å
441	R	92.8	Very high	91.9	Very high	45 Å²	45	47.5 Å²	47.5	17%	0.17	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-37.9	176.6	-179.9	58.6	179	173.3	2.6	112.3	Y370 F437 T438 L439 V443 V444 V445	Y370-R441 HydrophobicContact CD1-CG 4.19Å; Y370-R441 HydrophobicContact CD2-CB 4.4Å; Y370-R441 HydrophobicContact CG-CB 4.15Å; Y370-R441 HydrophobicContact CG-CG 4.07Å; F437-R441 VanDerWaalsContact O-CB 3.32Å; F437-R441 WeakPolarHBondContact O-CB 3.45Å; F437-R441 PolarHBondContact O-N 3.22Å; T438-R441 PolarHBondContact O-N 3.03Å; L439-R441 VanDerWaalsContact C-N 3.32Å; L439-R441 PolarHBondContact O-N 3.32Å; R441-V443 VanDerWaalsContact C-N 3.34Å; R441-V444 PolarHBondContact O-N 2.98Å; R441-V445 HydrophobicContact CG-CG2 4.29Å; R441-V445 WeakPolarHBondContact O-CB 3.33Å; R441-V445 VanDerWaalsContact O-CG2 3.29Å; R441-V445 WeakPolarHBondContact O-CG2 3.36Å; R441-V445 PolarHBondContact O-N 3.36Å
442	L	91.3	Very high	91.8	Very high	107 Å²	107	47.7 Å²	47.7	56%	0.56	25%	0.252	S	S	*	.	H	α-helix	trans	-63.7	-40.4	179	-175.7	65.8	0	0	0	111.4	T438 L439 L440 V445 L446	T438-L442 WeakPolarHBondContact O-CB 3.42Å; T438-L442 PolarHBondContact O-N 3.49Å; L439-L442 WeakPolarHBondContact O-CB 3.19Å; L439-L442 PolarHBondContact O-N 3.32Å; L439-L442 VanDerWaalsContact O-N 3.15Å; L440-L442 VanDerWaalsContact C-N 3.33Å; L440-L442 PolarHBondContact O-N 3.13Å; L442-V445 PolarHBondContact O-N 3.06Å; L442-L446 VanDerWaalsContact O-CB 3.31Å; L442-L446 WeakPolarHBondContact O-CB 3.49Å; L442-L446 PolarHBondContact O-N 3.21Å
443	V	92.5	Very high	91.8	Very high	100 Å²	100	50.2 Å²	50.2	61%	0.606	27%	0.266	S	S	*	.	H	α-helix	trans	-60	-47.5	175.6	174.4	0	0	0	0	111	L439 L440 R441 V445 L446 F447	L439-V443 PolarHBondContact O-N 2.94Å; L439-V443 VanDerWaalsContact O-N 3.12Å; L440-V443 PolarHBondContact O-N 3.38Å; R441-V443 VanDerWaalsContact C-N 3.34Å; V443-V445 PolarHBondContact O-N 3.18Å; V443-L446 PolarHBondContact O-N 3.26Å; V443-F447 PolarHBondContact O-N 3.23Å
444	V	92.5	Very high	91.7	Very high	15 Å²	15	52.2 Å²	52.2	9%	0.091	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-46.6	177.2	175.2	0	0	0	0	111.3	T363 I366 L440 R441 L446 F447 Q448	T363-V444 HydrophobicContact CG2-CG1 4.14Å; T363-V444 HydrophobicContact CG2-CG2 3.99Å; T363-V444 WeakPolarHBondContact OG1-CG1 3.49Å; I366-V444 HydrophobicContact CD1-CG2 4.05Å; L440-V444 PolarHBondContact O-N 3.22Å; R441-V444 PolarHBondContact O-N 2.98Å; V444-L446 VanDerWaalsContact C-N 3.31Å; V444-L446 PolarHBondContact O-N 3.42Å; V444-F447 PolarHBondContact O-N 3.3Å; V444-Q448 WeakPolarHBondContact O-CG 3.45Å; V444-Q448 PolarHBondContact O-N 3.18Å
445	V	90	Very high	91.6	Very high	19 Å²	19	51.7 Å²	51.7	12%	0.115	28%	0.278	C	S	.	.	H	α-helix	trans	-63.6	-37.2	179.2	165.3	0	0	0	0	111.7	R441 L442 V443 Q448 G449 P539	R441-V445 HydrophobicContact CG-CG2 4.29Å; R441-V445 WeakPolarHBondContact O-CB 3.33Å; R441-V445 VanDerWaalsContact O-CG2 3.29Å; R441-V445 WeakPolarHBondContact O-CG2 3.36Å; R441-V445 PolarHBondContact O-N 3.36Å; L442-V445 PolarHBondContact O-N 3.06Å; V443-V445 PolarHBondContact O-N 3.18Å; V445-Q448 PolarHBondContact O-N 3.5Å; V445-G449 PolarHBondContact O-N 3.38Å; V445-P539 HydrophobicContact CG1-CB 4.38Å; V445-P539 HydrophobicContact CG1-CG 3.52Å; V445-P539 HydrophobicContact CG2-CG 4.48Å
446	L	90.6	Very high	91.4	Very high	120 Å²	120	47.8 Å²	47.8	63%	0.628	26%	0.258	S	S	*	.	H	α-helix	trans	-63	-47.9	176.3	178.4	65.4	0	0	0	110.5	L442 V443 V444 Q448 G449 V450	L442-L446 VanDerWaalsContact O-CB 3.31Å; L442-L446 WeakPolarHBondContact O-CB 3.49Å; L442-L446 PolarHBondContact O-N 3.21Å; V443-L446 PolarHBondContact O-N 3.26Å; V444-L446 VanDerWaalsContact C-N 3.31Å; V444-L446 PolarHBondContact O-N 3.42Å; L446-Q448 PolarHBondContact O-N 2.88Å; L446-G449 WeakPolarHBondContact O-CA 3.3Å; L446-G449 PolarHBondContact O-N 3.43Å; L446-G449 VanDerWaalsContact O-N 3.11Å; L446-V450 WeakPolarHBondContact O-CG2 3.08Å; L446-V450 PolarHBondContact O-N 3.13Å
447	F	92.6	Very high	91.3	Very high	105 Å²	105	52.7 Å²	52.7	46%	0.461	28%	0.277	S	S	.	.	H	α-helix	trans	-59.4	-47.7	176.7	179.7	-99.2	0	0	0	112	V359 V443 V444 G449 V450 L451	V359-F447 HydrophobicContact CG1-CD1 4.07Å; V359-F447 HydrophobicContact CG1-CE1 4.28Å; V359-F447 HydrophobicContact CG2-CD1 4.42Å; V359-F447 HydrophobicContact CG2-CE1 3.81Å; V443-F447 PolarHBondContact O-N 3.23Å; V444-F447 PolarHBondContact O-N 3.3Å; F447-G449 VanDerWaalsContact C-N 3.27Å; F447-G449 PolarHBondContact O-N 2.8Å; F447-V450 PolarHBondContact O-N 3.21Å; F447-L451 HydrophobicContact CD1-CD1 4.26Å; F447-L451 HydrophobicContact CE1-CD1 3.77Å; F447-L451 HydrophobicContact CE1-CG 4.31Å; F447-L451 HydrophobicContact CZ-CD1 4.34Å; F447-L451 PolarHBondContact O-N 3.41Å
448	Q	91.1	Very high	91.2	Very high	18 Å²	18	53.9 Å²	53.9	8%	0.084	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-38.1	173.9	-69.7	-176.1	-50.6	0	0	112	S356 V359 A360 V444 V445 L446 V450 L451 H452	S356-Q448 PolarHBondContact O-NE2 2.84Å; V359-Q448 HydrophobicContact CG1-CG 4.17Å; A360-Q448 VanDerWaalsContact CB-NE2 3.33Å; V444-Q448 WeakPolarHBondContact O-CG 3.45Å; V444-Q448 PolarHBondContact O-N 3.18Å; V445-Q448 PolarHBondContact O-N 3.5Å; L446-Q448 PolarHBondContact O-N 2.88Å; Q448-V450 VanDerWaalsContact C-N 3.33Å; Q448-V450 PolarHBondContact O-N 3.39Å; Q448-L451 WeakPolarHBondContact O-CB 3.43Å; Q448-L451 PolarHBondContact O-N 3.04Å; Q448-H452 PolarHBondContact O-CD2 2.86Å; Q448-H452 PolarHBondContact O-N 3.46Å
449	G	89	Confident	90.9	Very high	11 Å²	11	53.3 Å²	53.3	11%	0.113	28%	0.28	C	S	.	.	H	α-helix	trans	-60.8	-38.7	175.4	0	0	0	0	0	113.2	V445 L446 F447 H452 L453	V445-G449 PolarHBondContact O-N 3.38Å; L446-G449 WeakPolarHBondContact O-CA 3.3Å; L446-G449 PolarHBondContact O-N 3.43Å; L446-G449 VanDerWaalsContact O-N 3.11Å; F447-G449 VanDerWaalsContact C-N 3.27Å; F447-G449 PolarHBondContact O-N 2.8Å; G449-H452 PolarHBondContact O-N 2.87Å; G449-L453 VanDerWaalsContact O-CB 3.28Å; G449-L453 WeakPolarHBondContact O-CB 3.49Å; G449-L453 PolarHBondContact O-N 3.44Å
450	V	91.1	Very high	90.7	Very high	80 Å²	80	48.9 Å²	48.9	49%	0.485	26%	0.257	S	S	.	.	H	α-helix	trans	-64.8	-41.6	174.2	173.8	0	0	0	0	111.1	L446 F447 Q448 L453 S454	L446-V450 WeakPolarHBondContact O-CG2 3.08Å; L446-V450 PolarHBondContact O-N 3.13Å; F447-V450 PolarHBondContact O-N 3.21Å; Q448-V450 VanDerWaalsContact C-N 3.33Å; Q448-V450 PolarHBondContact O-N 3.39Å; V450-L453 PolarHBondContact O-N 2.79Å; V450-S454 WeakPolarHBondContact O-CB 3.49Å; V450-S454 PolarHBondContact O-N 3Å; V450-S454 PolarHBondContact O-OG 2.85Å
451	L	92.1	Very high	90.5	Very high	15 Å²	15	49.3 Å²	49.3	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-48.7	175.1	-64.1	177	0	0	0	111.3	L352 L355 F447 Q448 L453 S454 V455	L352-L451 HydrophobicContact CD2-CD2 4.08Å; L355-L451 HydrophobicContact CD2-CD1 4.39Å; L355-L451 HydrophobicContact CD2-CD2 4.13Å; L355-L451 HydrophobicContact CG-CD1 4.24Å; F447-L451 HydrophobicContact CD1-CD1 4.26Å; F447-L451 HydrophobicContact CE1-CD1 3.77Å; F447-L451 HydrophobicContact CE1-CG 4.31Å; F447-L451 HydrophobicContact CZ-CD1 4.34Å; F447-L451 PolarHBondContact O-N 3.41Å; Q448-L451 WeakPolarHBondContact O-CB 3.43Å; Q448-L451 PolarHBondContact O-N 3.04Å; L451-L453 PolarHBondContact O-N 2.95Å; L451-S454 WeakPolarHBondContact O-CB 3.28Å; L451-S454 PolarHBondContact O-N 2.92Å; L451-V455 WeakPolarHBondContact O-CG2 3.29Å; L451-V455 PolarHBondContact O-N 2.9Å
452	H	89.9	Confident	90.4	Very high	33 Å²	33	47.2 Å²	47.2	15%	0.153	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-43.7	178	-77.2	-67.1	0	0	0	112.5	S356 Q448 G449 S454 V455 D456	S356-H452 PolarHBondContact OG-NE2 2.7Å; Q448-H452 PolarHBondContact O-CD2 2.86Å; Q448-H452 PolarHBondContact O-N 3.46Å; G449-H452 PolarHBondContact O-N 2.87Å; H452-S454 VanDerWaalsContact C-N 3.28Å; H452-S454 PolarHBondContact O-N 3.37Å; H452-V455 WeakPolarHBondContact O-CB 3.24Å; H452-V455 PolarHBondContact O-N 3.41Å; H452-D456 VanDerWaalsContact O-CG 3.26Å; H452-D456 PolarHBondContact O-N 2.99Å
453	L	89.9	Confident	90.2	Very high	93 Å²	93	44.2 Å²	44.2	49%	0.487	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-38.3	176.1	-177.5	66.2	0	0	0	111.7	G449 V450 L451 D456 F457 Y519	G449-L453 VanDerWaalsContact O-CB 3.28Å; G449-L453 WeakPolarHBondContact O-CB 3.49Å; G449-L453 PolarHBondContact O-N 3.44Å; V450-L453 PolarHBondContact O-N 2.79Å; L451-L453 PolarHBondContact O-N 2.95Å; L453-D456 PolarHBondContact O-N 3.31Å; L453-F457 WeakPolarHBondContact O-CB 3.38Å; L453-F457 PolarHBondContact O-N 3.48Å; L453-Y519 HydrophobicContact CD1-CE1 4.42Å
454	S	91.4	Very high	90	Very high	45 Å²	45	41.6 Å²	41.6	32%	0.315	21%	0.214	S	C	.	.	H	α-helix	trans	-64.3	-43.6	176.4	-56.9	0	0	0	0	111.1	V450 L451 H452 F457 I458	V450-S454 WeakPolarHBondContact O-CB 3.49Å; V450-S454 PolarHBondContact O-N 3Å; V450-S454 PolarHBondContact O-OG 2.85Å; L451-S454 WeakPolarHBondContact O-CB 3.28Å; L451-S454 PolarHBondContact O-N 2.92Å; H452-S454 VanDerWaalsContact C-N 3.28Å; H452-S454 PolarHBondContact O-N 3.37Å; S454-F457 PolarHBondContact O-N 3Å; S454-I458 WeakPolarHBondContact O-CD1 3.42Å; S454-I458 VanDerWaalsContact O-CG1 3.31Å; S454-I458 WeakPolarHBondContact O-CG1 3.47Å; S454-I458 PolarHBondContact O-N 3.46Å
455	V	91.4	Very high	89.7	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-60.9	-46.1	174.4	169.8	0	0	0	0	111.1	T349 L352 L451 H452 F457 I458 N459	T349-V455 HydrophobicContact CG2-CG1 4.25Å; L352-V455 HydrophobicContact CB-CG2 3.69Å; L352-V455 HydrophobicContact CD1-CG2 4.13Å; L451-V455 WeakPolarHBondContact O-CG2 3.29Å; L451-V455 PolarHBondContact O-N 2.9Å; H452-V455 WeakPolarHBondContact O-CB 3.24Å; H452-V455 PolarHBondContact O-N 3.41Å; V455-F457 VanDerWaalsContact C-N 3.33Å; V455-F457 PolarHBondContact O-N 3.3Å; V455-I458 PolarHBondContact O-N 2.9Å; V455-N459 WeakPolarHBondContact CG1-ND2 3.36Å; V455-N459 WeakPolarHBondContact O-CB 3.35Å; V455-N459 VanDerWaalsContact O-CG 3.3Å; V455-N459 PolarHBondContact O-N 3.26Å; V455-N459 PolarHBondContact O-ND2 3.14Å
456	D	88.5	Confident	89.7	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-39.1	178.4	-69.3	-26.9	0	0	0	112.7	H452 L453 N459 S460 S517	H452-D456 VanDerWaalsContact O-CG 3.26Å; H452-D456 PolarHBondContact O-N 2.99Å; L453-D456 PolarHBondContact O-N 3.31Å; D456-N459 PolarHBondContact O-N 3.27Å; D456-S460 WeakPolarHBondContact O-CB 3.44Å; D456-S460 PolarHBondContact O-N 3.44Å; D456-S460 PolarHBondContact O-OG 2.87Å; D456-S517 WeakPolarHBondContact OD1-CB 3.37Å; D456-S517 PolarHBondContact OD1-OG 3.37Å; D456-S517 WeakPolarHBondContact OD2-CB 3.23Å; D456-S517 PolarHBondContact OD2-OG 3.36Å
457	F	89.3	Confident	89.5	Confident	126 Å²	126	37.3 Å²	37.3	55%	0.553	20%	0.197	S	C	*	.	H	α-helix	trans	-62.6	-50.8	177	179.4	-101.1	0	0	0	110.9	L453 S454 V455 N459 S460 F461	L453-F457 WeakPolarHBondContact O-CB 3.38Å; L453-F457 PolarHBondContact O-N 3.48Å; S454-F457 PolarHBondContact O-N 3Å; V455-F457 VanDerWaalsContact C-N 3.33Å; V455-F457 PolarHBondContact O-N 3.3Å; F457-N459 VanDerWaalsContact C-N 3.31Å; F457-N459 PolarHBondContact O-N 2.96Å; F457-S460 PolarHBondContact O-N 2.96Å; F457-F461 HydrophobicContact CE2-CD2 4.01Å; F457-F461 HydrophobicContact CZ-CD2 4.09Å; F457-F461 HydrophobicContact CZ-CG 4.38Å; F457-F461 VanDerWaalsContact O-CB 3.29Å; F457-F461 WeakPolarHBondContact O-CB 3.5Å; F457-F461 PolarHBondContact O-N 3.31Å; F457-F461 VanDerWaalsContact O-N 3.07Å
458	I	90.5	Very high	89.1	Confident	28 Å²	28	32.9 Å²	32.9	14%	0.144	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-41.7	178.8	-63.8	162.4	0	0	0	111	S248 D252 L348 T349 L352 S454 V455	S248-I458 PolarHBondContact OG-O 3.27Å; D252-I458 HydrophobicContact CB-CG2 4.29Å; L348-I458 HydrophobicContact CD2-CD1 3.8Å; L348-I458 HydrophobicContact CG-CD1 4.26Å; T349-I458 HydrophobicContact CG2-CB 3.69Å; T349-I458 HydrophobicContact CG2-CD1 4.03Å; T349-I458 HydrophobicContact CG2-CG1 4.48Å; T349-I458 HydrophobicContact CG2-CG2 3.53Å; L352-I458 HydrophobicContact CD1-CD1 4.22Å; S454-I458 WeakPolarHBondContact O-CD1 3.42Å; S454-I458 VanDerWaalsContact O-CG1 3.31Å; S454-I458 WeakPolarHBondContact O-CG1 3.47Å; S454-I458 PolarHBondContact O-N 3.46Å; V455-I458 PolarHBondContact O-N 2.9Å
459	N	88.3	Confident	88.9	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-68.8	-41.8	179.7	-76.8	-34	0	0	0	112	Q217 Y220 R224 V455 D456 F457 T513 T515	Q217-N459 PolarHBondContact NE2-ND2 3.47Å; Q217-N459 PolarHBondContact NE2-OD1 2.97Å; Q217-N459 PolarHBondContact OE1-ND2 3.19Å; Q217-N459 VanDerWaalsContact OE1-ND2 3.13Å; Y220-N459 HydrophobicContact CE1-CB 4.03Å; R224-N459 VanDerWaalsContact CZ-O 3.32Å; R224-N459 PolarHBondContact NH1-O 2.86Å; R224-N459 PolarHBondContact NH2-O 3.34Å; V455-N459 WeakPolarHBondContact CG1-ND2 3.36Å; V455-N459 WeakPolarHBondContact O-CB 3.35Å; V455-N459 VanDerWaalsContact O-CG 3.3Å; V455-N459 PolarHBondContact O-N 3.26Å; V455-N459 PolarHBondContact O-ND2 3.14Å; D456-N459 PolarHBondContact O-N 3.27Å; F457-N459 VanDerWaalsContact C-N 3.31Å; F457-N459 PolarHBondContact O-N 2.96Å; N459-T513 PolarHBondContact O-OG1 2.83Å; N459-T515 HydrophobicContact CB-CG2 4.13Å
460	S	87.7	Confident	88.7	Confident	5 Å²	5	41 Å²	41	4%	0.035	21%	0.213	C	C	.	.	H	α-helix	trans	-84.6	-28.7	-170.5	61.5	0	0	0	0	115.1	D456 F457 T513	D456-S460 WeakPolarHBondContact O-CB 3.44Å; D456-S460 PolarHBondContact O-N 3.44Å; D456-S460 PolarHBondContact O-OG 2.87Å; F457-S460 PolarHBondContact O-N 2.96Å; S460-T513 WeakPolarHBondContact CA-OG1 3.14Å; S460-T513 PolarHBondContact O-N 2.87Å; S460-T513 PolarHBondContact O-OG1 3.21Å
461	F	88.5	Confident	88.4	Confident	64 Å²	64	42 Å²	42	28%	0.281	22%	0.223	S	C	.	.			trans	-68.8	123.7	-169.2	-168.6	-99	0	0	0	112	F457 L463 M466	F457-F461 HydrophobicContact CE2-CD2 4.01Å; F457-F461 HydrophobicContact CZ-CD2 4.09Å; F457-F461 HydrophobicContact CZ-CG 4.38Å; F457-F461 VanDerWaalsContact O-CB 3.29Å; F457-F461 WeakPolarHBondContact O-CB 3.5Å; F457-F461 PolarHBondContact O-N 3.31Å; F457-F461 VanDerWaalsContact O-N 3.07Å; F461-L463 VanDerWaalsContact C-N 3.29Å; F461-L463 HydrophobicContact CD1-CD2 3.53Å; F461-L463 HydrophobicContact CD1-CG 3.81Å; F461-L463 HydrophobicContact CE1-CD2 3.86Å; F461-L463 HydrophobicContact CE1-CG 4.47Å; F461-L463 PolarHBondContact O-N 3.17Å; F461-M466 HydrophobicContact CE1-CB 4.37Å; F461-M466 HydrophobicContact CE1-CG 4.02Å; F461-M466 HydrophobicContact CZ-CG 3.91Å
462	P	89.4	Confident	87.9	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.006	23%	0.225	C	C	.	.			trans	-80.1	74.5	-175.9	32.2	-34.1	0	0	0	111.9	F464 A465 M466	P462-F464 VanDerWaalsContact C-N 3.34Å; P462-F464 PolarHBondContact O-N 3.03Å; P462-A465 HydrophobicContact CB-CB 4.27Å; P462-A465 PolarHBondContact O-N 3.47Å; P462-M466 WeakPolarHBondContact O-CB 3.1Å; P462-M466 WeakPolarHBondContact O-CG 3.45Å; P462-M466 PolarHBondContact O-N 2.85Å
463	L	87.8	Confident	87.4	Confident	43 Å²	43	43.3 Å²	43.3	23%	0.225	23%	0.233	C	C	.	.	H	α-helix	trans	-56.9	-42.9	-175.5	-70.6	159.9	0	0	0	113.2	V247 L251 F461 M466 A467	V247-L463 HydrophobicContact CG1-CB 4.06Å; L251-L463 HydrophobicContact CB-CD1 4.14Å; L251-L463 HydrophobicContact CD2-CD1 3.34Å; L251-L463 HydrophobicContact CD2-CD2 3.95Å; L251-L463 HydrophobicContact CD2-CG 4.28Å; L251-L463 HydrophobicContact CG-CD1 4.36Å; F461-L463 VanDerWaalsContact C-N 3.29Å; F461-L463 HydrophobicContact CD1-CD2 3.53Å; F461-L463 HydrophobicContact CD1-CG 3.81Å; F461-L463 HydrophobicContact CE1-CD2 3.86Å; F461-L463 HydrophobicContact CE1-CG 4.47Å; F461-L463 PolarHBondContact O-N 3.17Å; L463-M466 PolarHBondContact O-N 3.43Å; L463-A467 VanDerWaalsContact O-CB 3.31Å; L463-A467 WeakPolarHBondContact O-CB 3.44Å; L463-A467 PolarHBondContact O-N 3.4Å
464	F	88.1	Confident	86.6	Confident	45 Å²	45	40.1 Å²	40.1	20%	0.197	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-45.6	-178	174.9	-102.4	0	0	0	111.6	F239 M240 A243 N244 V247 P462 M466 A467 L468	F239-F464 HydrophobicContact CE1-CE1 4.41Å; M240-F464 HydrophobicContact CE-CD1 4.1Å; M240-F464 HydrophobicContact CE-CE1 4.07Å; M240-F464 HydrophobicContact SD-CD1 4.19Å; M240-F464 HydrophobicContact SD-CE1 3.66Å; A243-F464 HydrophobicContact CB-CD1 3.43Å; A243-F464 VanDerWaalsContact CB-CD1 3.43Å; A243-F464 HydrophobicContact CB-CD2 4.37Å; A243-F464 HydrophobicContact CB-CE1 3.44Å; A243-F464 VanDerWaalsContact CB-CE1 3.44Å; A243-F464 HydrophobicContact CB-CE2 4.37Å; A243-F464 HydrophobicContact CB-CG 3.91Å; A243-F464 HydrophobicContact CB-CZ 3.93Å; N244-F464 WeakPolarHBondContact OD1-CA 3.3Å; N244-F464 VanDerWaalsContact OD1-CB 3.24Å; N244-F464 WeakPolarHBondContact OD1-CB 3.28Å; N244-F464 PolarHBondContact OD1-N 3.46Å; N244-F464 VanDerWaalsContact OD1-N 3.11Å; V247-F464 HydrophobicContact CB-CB 4.01Å; V247-F464 HydrophobicContact CG1-CB 4.4Å; V247-F464 HydrophobicContact CG2-CB 3.92Å; V247-F464 HydrophobicContact CG2-CD2 3.86Å; V247-F464 HydrophobicContact CG2-CG 4.25Å; P462-F464 VanDerWaalsContact C-N 3.34Å; P462-F464 PolarHBondContact O-N 3.03Å; F464-M466 VanDerWaalsContact C-N 3.26Å; F464-M466 PolarHBondContact O-N 3.31Å; F464-A467 PolarHBondContact O-N 2.96Å; F464-L468 VanDerWaalsContact O-CB 3.24Å; F464-L468 WeakPolarHBondContact O-CB 3.43Å; F464-L468 PolarHBondContact O-N 3.27Å
465	A	87.3	Confident	85.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.1	-36.3	176.4	0	0	0	0	0	111.8	M240 N244 P462 R469 L476 V507 Y511	M240-A465 HydrophobicContact CE-CB 3.84Å; N244-A465 PolarHBondContact OD1-N 3Å; P462-A465 HydrophobicContact CB-CB 4.27Å; P462-A465 PolarHBondContact O-N 3.47Å; A465-R469 WeakPolarHBondContact O-CB 3.48Å; A465-R469 PolarHBondContact O-N 3.23Å; A465-L476 WeakPolarHBondContact O-CD1 3.4Å; A465-V507 HydrophobicContact CB-CG1 3.74Å; A465-Y511 HydrophobicContact CB-CD2 3.81Å; A465-Y511 HydrophobicContact CB-CE2 4.44Å; A465-Y511 HydrophobicContact CB-CG 3.94Å
466	M	88.7	Confident	85.3	Confident	17 Å²	17	39.2 Å²	39.2	8%	0.084	20%	0.204	C	C	.	.	H	α-helix	trans	-69.2	-46.1	175	-74.1	-59.9	-176.8	0	0	113.4	F461 P462 L463 F464 L468 R469 I470 C504 V507 V508	F461-M466 HydrophobicContact CE1-CB 4.37Å; F461-M466 HydrophobicContact CE1-CG 4.02Å; F461-M466 HydrophobicContact CZ-CG 3.91Å; P462-M466 WeakPolarHBondContact O-CB 3.1Å; P462-M466 WeakPolarHBondContact O-CG 3.45Å; P462-M466 PolarHBondContact O-N 2.85Å; L463-M466 PolarHBondContact O-N 3.43Å; F464-M466 VanDerWaalsContact C-N 3.26Å; F464-M466 PolarHBondContact O-N 3.31Å; M466-L468 VanDerWaalsContact C-N 3.27Å; M466-L468 PolarHBondContact O-N 3.01Å; M466-R469 WeakPolarHBondContact O-CB 3.39Å; M466-R469 PolarHBondContact O-N 3.45Å; M466-R469 VanDerWaalsContact O-N 3.17Å; M466-I470 WeakPolarHBondContact O-CG1 3.36Å; M466-I470 PolarHBondContact O-N 3.44Å; M466-I470 VanDerWaalsContact O-N 3.14Å; M466-C504 WeakPolarHBondContact CE-O 3.24Å; M466-C504 WeakPolarHBondContact CE-SG 3.38Å; M466-V507 HydrophobicContact CE-CB 4.03Å; M466-V507 HydrophobicContact CE-CG1 3.97Å; M466-V507 HydrophobicContact CG-CG1 4.5Å; M466-V507 HydrophobicContact SD-CB 4.29Å; M466-V507 HydrophobicContact SD-CG1 3.91Å; M466-V508 HydrophobicContact CE-CB 4.19Å; M466-V508 HydrophobicContact CE-CG2 3.07Å
467	A	86.6	Confident	84.5	Confident	48 Å²	48	39 Å²	39	40%	0.397	20%	0.203	S	C	.	.	H	α-helix	trans	-60.1	-42.6	174.7	0	0	0	0	0	110.6	L463 F464 R469 I470 C471	L463-A467 VanDerWaalsContact O-CB 3.31Å; L463-A467 WeakPolarHBondContact O-CB 3.44Å; L463-A467 PolarHBondContact O-N 3.4Å; F464-A467 PolarHBondContact O-N 2.96Å; A467-R469 VanDerWaalsContact C-N 3.29Å; A467-R469 PolarHBondContact O-N 3.02Å; A467-I470 PolarHBondContact O-N 3.12Å; A467-C471 PolarHBondContact O-N 3.1Å; A467-C471 PolarHBondContact O-SG 2.92Å
468	L	85.5	Confident	83.5	Confident	12 Å²	12	36 Å²	36	6%	0.063	19%	0.191	C	C	.	.	H	α-helix	trans	-60.8	-40.2	176.3	-169.8	67.9	0	0	0	111.5	M240 F464 M466 I470 Q472 R475 L476	M240-L468 HydrophobicContact CE-CD2 3.77Å; M240-L468 HydrophobicContact SD-CD2 4.03Å; F464-L468 VanDerWaalsContact O-CB 3.24Å; F464-L468 WeakPolarHBondContact O-CB 3.43Å; F464-L468 PolarHBondContact O-N 3.27Å; M466-L468 VanDerWaalsContact C-N 3.27Å; M466-L468 PolarHBondContact O-N 3.01Å; L468-I470 VanDerWaalsContact C-N 3.3Å; L468-I470 PolarHBondContact O-N 3.18Å; L468-Q472 HydrophobicContact CD1-CB 4.19Å; L468-Q472 CarbonylContact O-C 3.15Å; L468-Q472 VanDerWaalsContact O-CA 3.31Å; L468-Q472 WeakPolarHBondContact O-CA 3.44Å; L468-Q472 PolarHBondContact O-N 3.25Å; L468-Q472 VanDerWaalsContact O-O 3.09Å; L468-R475 HydrophobicContact CD2-CB 4.25Å; L468-R475 HydrophobicContact CG-CB 4.42Å; L468-L476 HydrophobicContact CB-CD1 3.99Å; L468-L476 HydrophobicContact CD2-CD1 3.94Å; L468-L476 HydrophobicContact CD2-CG 4.29Å; L468-L476 HydrophobicContact CG-CD1 3.99Å
469	R	86.7	Confident	82.3	Confident	59 Å²	59	35.6 Å²	35.6	22%	0.223	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-33.5	177.9	-177.6	55.9	-179.7	81.1	7	113.6	A465 M466 A467 P473 L476 P501 L502 V507	A465-R469 WeakPolarHBondContact O-CB 3.48Å; A465-R469 PolarHBondContact O-N 3.23Å; M466-R469 WeakPolarHBondContact O-CB 3.39Å; M466-R469 PolarHBondContact O-N 3.45Å; M466-R469 VanDerWaalsContact O-N 3.17Å; A467-R469 VanDerWaalsContact C-N 3.29Å; A467-R469 PolarHBondContact O-N 3.02Å; R469-P473 WeakPolarHBondContact O-CA 3.46Å; R469-L476 HydrophobicContact CB-CD1 3.82Å; R469-P501 PolarHBondContact NH2-O 3.04Å; R469-L502 VanDerWaalsContact CZ-O 3.29Å; R469-L502 PolarHBondContact NE-O 3.38Å; R469-L502 PolarHBondContact NH2-O 3.23Å; R469-V507 HydrophobicContact CG-CG2 4.48Å
470	I	84.9	Confident	81.1	Confident	140 Å²	140	37.3 Å²	37.3	72%	0.718	20%	0.204	S	C	*	.	H	α-helix	trans	-79.2	-49.8	179.7	-65.1	166.5	0	0	0	110.1	M466 A467 L468	M466-I470 WeakPolarHBondContact O-CG1 3.36Å; M466-I470 PolarHBondContact O-N 3.44Å; M466-I470 VanDerWaalsContact O-N 3.14Å; A467-I470 PolarHBondContact O-N 3.12Å; L468-I470 VanDerWaalsContact C-N 3.3Å; L468-I470 PolarHBondContact O-N 3.18Å
471	C	83.8	Confident	79.7	Confident	102 Å²	102	42.3 Å²	42.3	69%	0.689	23%	0.225	S	C	*	.	H	α-helix	trans	-78.5	-38.5	-175.1	-60	0	0	0	0	112.8	A467	A467-C471 PolarHBondContact O-N 3.1Å; A467-C471 PolarHBondContact O-SG 2.92Å
472	Q	81.4	Confident	78.3	Confident	27 Å²	27	43.4 Å²	43.4	13%	0.126	23%	0.23	C	C	.	.			trans	-136.8	70	-174.2	-68.3	-178.7	-16.6	0	0	110.7	E162 L468 Y474 R475	E162-Q472 PolarHBondContact OE2-NE2 3.37Å; L468-Q472 HydrophobicContact CD1-CB 4.19Å; L468-Q472 CarbonylContact O-C 3.15Å; L468-Q472 VanDerWaalsContact O-CA 3.31Å; L468-Q472 WeakPolarHBondContact O-CA 3.44Å; L468-Q472 PolarHBondContact O-N 3.25Å; L468-Q472 VanDerWaalsContact O-O 3.09Å; Q472-Y474 HydrophobicContact CB-CE1 3.96Å; Q472-Y474 HydrophobicContact CG-CE1 4.16Å; Q472-Y474 PolarHBondContact O-N 3.1Å; Q472-Y474 VanDerWaalsContact O-N 3.14Å; Q472-R475 HydrophobicContact CB-CG 4.3Å; Q472-R475 PolarHBondContact O-N 3.34Å; Q472-R475 VanDerWaalsContact O-N 3.15Å
473	P	79.4	Confident	76.6	Confident	47 Å²	47	51 Å²	51	31%	0.305	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-58.6	-32.5	-173.5	23.5	-34.8	0	0	0	113.3	R469 R475 L476 P501	R469-P473 WeakPolarHBondContact O-CA 3.46Å; P473-R475 PolarHBondContact O-N 3.5Å; P473-L476 PolarHBondContact O-N 2.94Å; P473-P501 HydrophobicContact CB-CB 3.69Å; P473-P501 HydrophobicContact CB-CG 3.95Å; P473-P501 WeakPolarHBondContact O-CB 3.5Å
474	Y	74.3	Confident	75.3	Confident	27 Å²	27	52.4 Å²	52.4	11%	0.106	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-65.3	-19.5	-178.2	58.5	-90.2	0	0	0	114.2	K106 L109 S110 Q472 L476	K106-Y474 HydrophobicContact CB-CD2 4.37Å; K106-Y474 HydrophobicContact CB-CG 4.33Å; K106-Y474 HydrophobicContact CG-CD1 4.31Å; K106-Y474 HydrophobicContact CG-CD2 4.3Å; K106-Y474 HydrophobicContact CG-CG 4.05Å; L109-Y474 HydrophobicContact CB-CD2 4.2Å; L109-Y474 HydrophobicContact CB-CE2 3.85Å; L109-Y474 HydrophobicContact CD1-CE2 3.98Å; S110-Y474 VanDerWaalsContact CA-O 3.28Å; S110-Y474 WeakPolarHBondContact CA-O 3.03Å; S110-Y474 WeakPolarHBondContact CB-O 3.48Å; Q472-Y474 HydrophobicContact CB-CE1 3.96Å; Q472-Y474 HydrophobicContact CG-CE1 4.16Å; Q472-Y474 PolarHBondContact O-N 3.1Å; Q472-Y474 VanDerWaalsContact O-N 3.14Å; Y474-L476 VanDerWaalsContact C-N 3.34Å
475	R	75.8	Confident	74	Confident	26 Å²	26	53.1 Å²	53.1	10%	0.098	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-74.7	-23.8	178.1	-72.7	-178.5	64	-176.4	-2.5	113.6	Q111 L468 Q472 P473	Q111-R475 PolarHBondContact N-O 3Å; L468-R475 HydrophobicContact CD2-CB 4.25Å; L468-R475 HydrophobicContact CG-CB 4.42Å; Q472-R475 HydrophobicContact CB-CG 4.3Å; Q472-R475 PolarHBondContact O-N 3.34Å; Q472-R475 VanDerWaalsContact O-N 3.15Å; P473-R475 PolarHBondContact O-N 3.5Å
476	L	79.8	Confident	72.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	73.6	-179.9	-76.9	148.1	0	0	0	108.5	M240 A465 L468 R469 P473 Y474 P501 L502 Y511	M240-L476 HydrophobicContact CE-CD2 4.41Å; A465-L476 WeakPolarHBondContact O-CD1 3.4Å; L468-L476 HydrophobicContact CB-CD1 3.99Å; L468-L476 HydrophobicContact CD2-CD1 3.94Å; L468-L476 HydrophobicContact CD2-CG 4.29Å; L468-L476 HydrophobicContact CG-CD1 3.99Å; R469-L476 HydrophobicContact CB-CD1 3.82Å; P473-L476 PolarHBondContact O-N 2.94Å; Y474-L476 VanDerWaalsContact C-N 3.34Å; L476-P501 CarbonylContact O-C 3.55Å; L476-P501 VanDerWaalsContact O-CA 3.3Å; L476-P501 WeakPolarHBondContact O-CA 3.05Å; L476-L502 HydrophobicContact CB-CB 4.47Å; L476-L502 HydrophobicContact CB-CD1 3.98Å; L476-L502 HydrophobicContact CD2-CD1 3.91Å; L476-L502 PolarHBondContact O-N 3.08Å; L476-Y511 HydrophobicContact CD2-CD2 4.5Å; L476-Y511 HydrophobicContact CD2-CE2 3.62Å
477	A	71.3	Confident	70.6	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.8	-172.3	0	0	0	0	0	111.5	Q111 L112 H113 I499	Q111-A477 WeakPolarHBondContact O-CB 3.1Å; Q111-A477 PolarHBondContact O-N 2.87Å; L112-A477 WeakPolarHBondContact CA-O 3.48Å; L112-A477 HydrophobicContact CD1-CB 4.26Å; H113-A477 PolarHBondContact N-O 3.43Å; A477-I499 HydrophobicContact CB-CG2 3.54Å
478	E	68.6	Low	68.9	Low	63 Å²	63	66.9 Å²	66.9	29%	0.294	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-34.6	168.1	-170.2	174.2	160.4	0	0	110.2	N500 L502 K503	E478-N500 PolarHBondContact N-O 2.96Å; E478-L502 HydrophobicContact CB-CD2 4Å; E478-L502 HydrophobicContact CB-CG 4.16Å; E478-L502 HydrophobicContact CG-CD2 4.21Å; E478-K503 PolarHBondContact OE2-N 3.38Å
479	G	63.8	Low	66.9	Low	19 Å²	19	72.9 Å²	72.9	20%	0.196	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.6	-159.1	179.6	0	0	0	0	0	112.3	N500	G479-N500 PolarHBondContact N-O 3.3Å; G479-N500 PolarHBondContact O-N 3.22Å
480	V	63.4	Low	65.3	Low	38 Å²	38	73.3 Å²	73.3	23%	0.23	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.4	-174.6	179.4	0	0	0	0	108.8	F134 F482 M497	F134-V480 HydrophobicContact CD2-CG2 4.48Å; F134-V480 HydrophobicContact CE1-CG2 4.32Å; F134-V480 HydrophobicContact CE2-CG2 4.15Å; F134-V480 HydrophobicContact CZ-CG2 4.09Å; V480-F482 HydrophobicContact CG1-CE1 4.29Å; V480-F482 HydrophobicContact CG1-CE2 4.26Å; V480-F482 HydrophobicContact CG1-CZ 4Å; V480-M497 HydrophobicContact CG1-CB 4.47Å; V480-M497 HydrophobicContact CG1-CG 3.1Å; V480-M497 HydrophobicContact CG1-SD 3.79Å
481	K	58.9	Low	63.5	Low	110 Å²	110	70.1 Å²	70.1	48%	0.478	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	145.7	170.6	59.3	171.1	164.7	149.6	0	109.3	E498	K481-E498 HydrophobicContact CD-CB 4.34Å; K481-E498 WeakPolarHBondContact CE-OE2 3.25Å; K481-E498 HydrophobicContact CG-CB 3.84Å; K481-E498 WeakPolarHBondContact CG-O 3.33Å; K481-E498 PolarHBondContact N-O 3.07Å; K481-E498 IonicContact NZ-OE2 2.84Å; K481-E498 PolarHBondContact NZ-OE2 2.91Å; K481-E498 PolarHBondContact O-N 3.22Å
482	F	58.7	Low	62.1	Low	88 Å²	88	66.3 Å²	66.3	39%	0.386	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.6	176.1	-61.9	-81.4	0	0	0	109.1	V100 V480 L495 L496 M497	V100-F482 HydrophobicContact CG1-CD1 4.28Å; V100-F482 HydrophobicContact CG1-CE1 3.86Å; V480-F482 HydrophobicContact CG1-CE1 4.29Å; V480-F482 HydrophobicContact CG1-CE2 4.26Å; V480-F482 HydrophobicContact CG1-CZ 4Å; F482-L495 HydrophobicContact CB-CB 4.49Å; F482-L495 HydrophobicContact CB-CD2 4.47Å; F482-L495 HydrophobicContact CD1-CB 4.4Å; F482-L496 CarbonylContact C-O 3.58Å; F482-L496 WeakPolarHBondContact CA-O 3.45Å; F482-M497 HydrophobicContact CD1-CB 4.06Å; F482-M497 HydrophobicContact CD1-CG 4.04Å; F482-M497 HydrophobicContact CE1-CB 3.89Å; F482-M497 HydrophobicContact CE1-CG 3.54Å; F482-M497 HydrophobicContact CE1-SD 3.9Å; F482-M497 HydrophobicContact CZ-CG 4.2Å; F482-M497 HydrophobicContact CZ-SD 4.3Å
483	R	53.4	Low	60.6	Low	159 Å²	159	67.1 Å²	67.1	60%	0.6	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	127.1	174.1	-175.5	177.8	-178.9	-174.6	-1.7	108.7	L485 L495 L496	R483-L485 PolarHBondContact O-N 2.89Å; R483-L495 CarbonylContact O-C 3.48Å; R483-L496 HydrophobicContact CB-CB 4.4Å; R483-L496 PolarHBondContact N-O 3.14Å; R483-L496 PolarHBondContact O-N 3.47Å
484	V	61.3	Low	59.3	Low	73 Å²	73	67 Å²	67	44%	0.442	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	125.9	176.6	-173.8	0	0	0	0	108.7	E487 L493 L495	V484-E487 HydrophobicContact CG1-CB 4.27Å; V484-L493 HydrophobicContact CG1-CD1 3.9Å; V484-L495 HydrophobicContact CB-CD2 4.45Å; V484-L495 HydrophobicContact CG2-CD2 3.83Å
485	L	60.5	Low	58.3	Low	61 Å²	61	67 Å²	67	32%	0.319	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-42.5	-180	-71.4	169.8	0	0	0	111.8	M6 R483 H494 L496	M6-L485 HydrophobicContact CE-CB 4.21Å; M6-L485 HydrophobicContact CE-CD1 3.85Å; M6-L485 HydrophobicContact CE-CD2 4.34Å; M6-L485 HydrophobicContact CE-CG 4.37Å; R483-L485 PolarHBondContact O-N 2.89Å; L485-H494 HydrophobicContact CB-CB 4.11Å; L485-H494 PolarHBondContact N-O 3.15Å; L485-L496 HydrophobicContact CD1-CB 3.83Å; L485-L496 HydrophobicContact CD2-CB 4.14Å; L485-L496 HydrophobicContact CG-CB 3.9Å
486	C	53.8	Low	57.5	Low	55 Å²	55	67.8 Å²	67.8	37%	0.372	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	136.7	176	-66.5	0	0	0	0	110.4
487	E	51.5	Low	56.8	Low	171 Å²	171	68.6 Å²	68.6	80%	0.799	37%	0.372	S	S	*	.			trans	-131.8	81.2	172.2	-168.3	171	-160.8	0	0	107.6	V484	V484-E487 HydrophobicContact CG1-CB 4.27Å
488	E	49.7	Very low	56.4	Low	128 Å²	128	71.2 Å²	71.2	60%	0.598	38%	0.384	S	S	*	.			trans	-107.9	139	172.2	-66.1	178.1	177.3	0	0	109.1	G490 T491	E488-G490 PolarHBondContact O-N 3.24Å; E488-T491 WeakPolarHBondContact CB-OG1 3.32Å; E488-T491 PolarHBondContact O-N 3.31Å; E488-T491 PolarHBondContact O-OG1 3.15Å
489	P	44.8	Very low	56.5	Low	138 Å²	138	69.4 Å²	69.4	90%	0.896	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	126.7	176.9	25.9	-31.6	0	0	0	110.1
490	G	51.3	Low	56.8	Low	67 Å²	67	72 Å²	72	69%	0.691	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	-1.5	179.7	0	0	0	0	0	116	E488	E488-G490 PolarHBondContact O-N 3.24Å
491	T	49.1	Very low	57.5	Low	74 Å²	74	71.5 Å²	71.5	45%	0.454	38%	0.384	S	S	.	.	S	Bend	trans	-110.5	157	173.8	60	0	0	0	0	112.4	E488	E488-T491 WeakPolarHBondContact CB-OG1 3.32Å; E488-T491 PolarHBondContact O-N 3.31Å; E488-T491 PolarHBondContact O-OG1 3.15Å
492	A	52.4	Low	58.5	Low	22 Å²	22	66.8 Å²	66.8	18%	0.182	36%	0.363	C	S	.	.			trans	-61.4	140.4	178.5	0	0	0	0	0	111.2	V97 F99 H494	V97-A492 HydrophobicContact CB-CB 3.86Å; V97-A492 HydrophobicContact CG1-CB 4.09Å; V97-A492 CarbonylContact O-C 3.57Å; V97-A492 WeakPolarHBondContact O-CA 3.46Å; V97-A492 VanDerWaalsContact O-CB 3.31Å; V97-A492 WeakPolarHBondContact O-CB 3.47Å; F99-A492 HydrophobicContact CD2-CB 3.45Å; F99-A492 VanDerWaalsContact CD2-CB 3.45Å; F99-A492 HydrophobicContact CE2-CB 3.32Å; A492-H494 PolarHBondContact O-CD2 3.12Å; A492-H494 PolarHBondContact O-N 2.99Å
493	L	51.1	Low	59.6	Low	44 Å²	44	68.4 Å²	68.4	23%	0.23	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	115.9	-180	-178.8	72.2	0	0	0	109.8	V97 I98 F99 V484 L495	V97-L493 PolarHBondContact O-N 3.46Å; I98-L493 CarbonylContact C-O 3.53Å; I98-L493 WeakPolarHBondContact CA-O 3.38Å; I98-L493 HydrophobicContact CD1-CD2 4.43Å; I98-L493 HydrophobicContact CG1-CB 4.25Å; I98-L493 HydrophobicContact CG1-CD2 4.33Å; I98-L493 HydrophobicContact CG2-CB 4.4Å; I98-L493 HydrophobicContact CG2-CD2 4.24Å; F99-L493 PolarHBondContact N-O 2.83Å; V484-L493 HydrophobicContact CG1-CD1 3.9Å; L493-L495 HydrophobicContact CD2-CD1 4.29Å; L493-L495 HydrophobicContact CD2-CD2 4.06Å; L493-L495 HydrophobicContact CD2-CG 4.15Å; L493-L495 HydrophobicContact CG-CD2 4.15Å; L493-L495 HydrophobicContact CG-CG 4.21Å
494	H	52.8	Low	61.1	Low	45 Å²	45	64.6 Å²	64.6	21%	0.208	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	116	175.2	-73	-104.7	0	0	0	110.7	F99 H101 L485 A492	F99-H494 AromaticContact CD2-CE1 3.5Å; F99-H494 AromaticContact CD2-NE2 3.47Å; F99-H494 WeakPolarHBondContact CD2-NE2 3.45Å; F99-H494 AromaticContact CG-CE1 3.86Å; F99-H494 CarbonylContact O-C 3.54Å; F99-H494 WeakPolarHBondContact O-CA 3.48Å; H101-H494 AromaticContact CD2-ND1 3.79Å; H101-H494 AromaticContact CE1-ND1 3.89Å; H101-H494 AromaticContact NE2-CE1 3.78Å; H101-H494 AromaticContact NE2-CG 3.98Å; H101-H494 AromaticContact NE2-ND1 2.96Å; H101-H494 PolarHBondContact NE2-ND1 3.5Å; L485-H494 HydrophobicContact CB-CB 4.11Å; L485-H494 PolarHBondContact N-O 3.15Å; A492-H494 PolarHBondContact O-CD2 3.12Å; A492-H494 PolarHBondContact O-N 2.99Å
495	L	53.3	Low	62.2	Low	25 Å²	25	64.4 Å²	64.4	13%	0.131	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.6	176.2	-62.4	176.5	0	0	0	110.1	I98 F99 V100 H101 F482 R483 V484 L493	I98-L495 HydrophobicContact CG2-CD1 3.66Å; I98-L495 HydrophobicContact CG2-CG 4.09Å; F99-L495 PolarHBondContact O-N 3.43Å; V100-L495 CarbonylContact C-O 3.57Å; V100-L495 WeakPolarHBondContact CA-O 3.33Å; V100-L495 HydrophobicContact CG2-CB 4.42Å; V100-L495 HydrophobicContact CG2-CD1 4.42Å; H101-L495 PolarHBondContact N-O 2.95Å; F482-L495 HydrophobicContact CB-CB 4.49Å; F482-L495 HydrophobicContact CB-CD2 4.47Å; F482-L495 HydrophobicContact CD1-CB 4.4Å; R483-L495 CarbonylContact O-C 3.48Å; V484-L495 HydrophobicContact CB-CD2 4.45Å; V484-L495 HydrophobicContact CG2-CD2 3.83Å; L493-L495 HydrophobicContact CD2-CD1 4.29Å; L493-L495 HydrophobicContact CD2-CD2 4.06Å; L493-L495 HydrophobicContact CD2-CG 4.15Å; L493-L495 HydrophobicContact CG-CD2 4.15Å; L493-L495 HydrophobicContact CG-CG 4.21Å
496	L	58.9	Low	63.3	Low	44 Å²	44	62.7 Å²	62.7	23%	0.23	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	126.3	166.3	-175.2	68.8	0	0	0	109.7	H101 F482 R483 L485 E498	H101-L496 HydrophobicContact CB-CD1 4.04Å; F482-L496 CarbonylContact C-O 3.58Å; F482-L496 WeakPolarHBondContact CA-O 3.45Å; R483-L496 HydrophobicContact CB-CB 4.4Å; R483-L496 PolarHBondContact N-O 3.14Å; R483-L496 PolarHBondContact O-N 3.47Å; L485-L496 HydrophobicContact CD1-CB 3.83Å; L485-L496 HydrophobicContact CD2-CB 4.14Å; L485-L496 HydrophobicContact CG-CB 3.9Å; L496-E498 HydrophobicContact CD2-CG 4.25Å; L496-E498 HydrophobicContact CG-CG 4.39Å
497	M	63.3	Low	64.7	Low	17 Å²	17	60 Å²	60	8%	0.084	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	116.9	177.1	-166.7	176.9	91	0	0	111.1	V100 H101 Y102 V107 F134 V480 F482	V100-M497 HydrophobicContact CG1-CB 4.14Å; H101-M497 WeakPolarHBondContact O-CB 3.39Å; H101-M497 PolarHBondContact O-N 3.19Å; Y102-M497 HydrophobicContact CG-CE 4.25Å; V107-M497 HydrophobicContact CB-CE 4.31Å; V107-M497 HydrophobicContact CG1-CE 4.21Å; V107-M497 HydrophobicContact CG2-CE 3.13Å; F134-M497 HydrophobicContact CE1-CE 3.53Å; F134-M497 HydrophobicContact CE1-SD 3.61Å; F134-M497 HydrophobicContact CZ-CE 3.94Å; F134-M497 HydrophobicContact CZ-SD 3.35Å; F134-M497 WeakPolarHBondContact CZ-SD 3.41Å; V480-M497 HydrophobicContact CG1-CB 4.47Å; V480-M497 HydrophobicContact CG1-CG 3.1Å; V480-M497 HydrophobicContact CG1-SD 3.79Å; F482-M497 HydrophobicContact CD1-CB 4.06Å; F482-M497 HydrophobicContact CD1-CG 4.04Å; F482-M497 HydrophobicContact CE1-CB 3.89Å; F482-M497 HydrophobicContact CE1-CG 3.54Å; F482-M497 HydrophobicContact CE1-SD 3.9Å; F482-M497 HydrophobicContact CZ-CG 4.2Å; F482-M497 HydrophobicContact CZ-SD 4.3Å
498	E	64.8	Low	66.4	Low	54 Å²	54	53.7 Å²	53.7	25%	0.252	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.6	175.5	-60.9	176.3	-179	0	0	110.2	K481 L496	K481-E498 HydrophobicContact CD-CB 4.34Å; K481-E498 WeakPolarHBondContact CE-OE2 3.25Å; K481-E498 HydrophobicContact CG-CB 3.84Å; K481-E498 WeakPolarHBondContact CG-O 3.33Å; K481-E498 PolarHBondContact N-O 3.07Å; K481-E498 IonicContact NZ-OE2 2.84Å; K481-E498 PolarHBondContact NZ-OE2 2.91Å; K481-E498 PolarHBondContact O-N 3.22Å; L496-E498 HydrophobicContact CD2-CG 4.25Å; L496-E498 HydrophobicContact CG-CG 4.39Å
499	I	69.9	Low	68.1	Low	26 Å²	26	53.6 Å²	53.6	13%	0.133	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	128	179.6	-58.6	-177.7	0	0	0	109	K106 V107 A477 P501	K106-I499 HydrophobicContact CB-CD1 3.87Å; K106-I499 VanDerWaalsContact O-CD1 3.29Å; K106-I499 WeakPolarHBondContact O-CD1 3.48Å; V107-I499 HydrophobicContact CG2-CD1 4.49Å; A477-I499 HydrophobicContact CB-CG2 3.54Å; I499-P501 VanDerWaalsContact O-CD 3.31Å; I499-P501 WeakPolarHBondContact O-CD 3.42Å
500	N	70	Confident	69.9	Low	73 Å²	73	49 Å²	49	39%	0.39	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	114.4	174.5	-168.5	24.9	0	0	0	109.9	E478 G479	E478-N500 PolarHBondContact N-O 2.96Å; G479-N500 PolarHBondContact N-O 3.3Å; G479-N500 PolarHBondContact O-N 3.22Å
501	P	77.9	Confident	71.4	Confident	28 Å²	28	46.3 Å²	46.3	18%	0.182	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	146.4	-176	36.5	-40.3	0	0	0	112.1	R469 P473 L476 I499	R469-P501 PolarHBondContact NH2-O 3.04Å; P473-P501 HydrophobicContact CB-CB 3.69Å; P473-P501 HydrophobicContact CB-CG 3.95Å; P473-P501 WeakPolarHBondContact O-CB 3.5Å; L476-P501 CarbonylContact O-C 3.55Å; L476-P501 VanDerWaalsContact O-CA 3.3Å; L476-P501 WeakPolarHBondContact O-CA 3.05Å; I499-P501 VanDerWaalsContact O-CD 3.31Å; I499-P501 WeakPolarHBondContact O-CD 3.42Å
502	L	79.4	Confident	73.1	Confident	10 Å²	10	48.8 Å²	48.8	5%	0.052	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-48.6	144.3	-176.6	-85.4	162.1	0	0	0	114.2	H113 R469 L476 E478 V507	H113-L502 HydrophobicContact CB-CD1 3.95Å; H113-L502 HydrophobicContact CB-CD2 4.32Å; H113-L502 HydrophobicContact CB-CG 4.49Å; H113-L502 VanDerWaalsContact ND1-CD1 3.35Å; H113-L502 WeakPolarHBondContact ND1-CD1 3.18Å; R469-L502 VanDerWaalsContact CZ-O 3.29Å; R469-L502 PolarHBondContact NE-O 3.38Å; R469-L502 PolarHBondContact NH2-O 3.23Å; L476-L502 HydrophobicContact CB-CB 4.47Å; L476-L502 HydrophobicContact CB-CD1 3.98Å; L476-L502 HydrophobicContact CD2-CD1 3.91Å; L476-L502 PolarHBondContact O-N 3.08Å; E478-L502 HydrophobicContact CB-CD2 4Å; E478-L502 HydrophobicContact CB-CG 4.16Å; E478-L502 HydrophobicContact CG-CD2 4.21Å; L502-V507 HydrophobicContact CB-CG2 3.71Å; L502-V507 HydrophobicContact CD1-CG2 4.32Å
503	K	82.4	Confident	74.4	Confident	123 Å²	123	48.3 Å²	48.3	54%	0.535	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-62.7	144.3	170.5	-64.4	173.6	-168.4	167.2	0	111.1	E478 S505 S506 V507	E478-K503 PolarHBondContact OE2-N 3.38Å; K503-S505 VanDerWaalsContact C-N 3.29Å; K503-S505 PolarHBondContact O-N 3.42Å; K503-S506 WeakPolarHBondContact O-CB 3.45Å; K503-S506 PolarHBondContact O-N 2.93Å; K503-S506 VanDerWaalsContact O-N 3.09Å; K503-V507 WeakPolarHBondContact O-CG2 3.36Å; K503-V507 PolarHBondContact O-N 3.27Å
504	C	84.5	Confident	75.6	Confident	79 Å²	79	51.5 Å²	51.5	53%	0.534	27%	0.274	S	S	.	.	H	α-helix	trans	-56.1	-43.1	179	-173.4	0	0	0	0	111.7	M466 S506 V507 V508	M466-C504 WeakPolarHBondContact CE-O 3.24Å; M466-C504 WeakPolarHBondContact CE-SG 3.38Å; C504-S506 PolarHBondContact O-N 2.92Å; C504-V507 PolarHBondContact O-N 3.46Å; C504-V508 PolarHBondContact O-N 3.47Å
505	S	85.1	Confident	76.5	Confident	69 Å²	69	51 Å²	51	48%	0.483	27%	0.274	S	S	.	.	H	α-helix	trans	-58.8	-43.8	175.9	52.4	0	0	0	0	112.8	K503 V508 Q509	K503-S505 VanDerWaalsContact C-N 3.29Å; K503-S505 PolarHBondContact O-N 3.42Å; S505-V508 PolarHBondContact O-N 2.94Å; S505-Q509 WeakPolarHBondContact O-CG 3.41Å; S505-Q509 PolarHBondContact O-N 3.19Å
506	S	82.3	Confident	77.2	Confident	24 Å²	24	52.2 Å²	52.2	17%	0.168	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-40.2	177.5	-56.3	0	0	0	0	111.3	K503 C504 V508 Q509 T510	K503-S506 WeakPolarHBondContact O-CB 3.45Å; K503-S506 PolarHBondContact O-N 2.93Å; K503-S506 VanDerWaalsContact O-N 3.09Å; C504-S506 PolarHBondContact O-N 2.92Å; S506-V508 VanDerWaalsContact C-N 3.32Å; S506-V508 PolarHBondContact O-N 2.92Å; S506-Q509 PolarHBondContact O-N 2.89Å; S506-T510 WeakPolarHBondContact O-CB 3.39Å; S506-T510 PolarHBondContact O-N 3.09Å; S506-T510 PolarHBondContact O-OG1 2.9Å
507	V	85	Confident	77.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-43.2	173.1	177.4	0	0	0	0	111.2	A465 M466 R469 L502 K503 C504 Y511	A465-V507 HydrophobicContact CB-CG1 3.74Å; M466-V507 HydrophobicContact CE-CB 4.03Å; M466-V507 HydrophobicContact CE-CG1 3.97Å; M466-V507 HydrophobicContact CG-CG1 4.5Å; M466-V507 HydrophobicContact SD-CB 4.29Å; M466-V507 HydrophobicContact SD-CG1 3.91Å; R469-V507 HydrophobicContact CG-CG2 4.48Å; L502-V507 HydrophobicContact CB-CG2 3.71Å; L502-V507 HydrophobicContact CD1-CG2 4.32Å; K503-V507 WeakPolarHBondContact O-CG2 3.36Å; K503-V507 PolarHBondContact O-N 3.27Å; C504-V507 PolarHBondContact O-N 3.46Å; V507-Y511 HydrophobicContact CG1-CD2 4.15Å; V507-Y511 WeakPolarHBondContact O-CB 3.3Å; V507-Y511 PolarHBondContact O-N 3.22Å; V507-Y511 VanDerWaalsContact O-N 3.12Å
508	V	86.8	Confident	77.1	Confident	37 Å²	37	53.8 Å²	53.8	22%	0.224	29%	0.293	C	S	.	.	H	α-helix	trans	-60.2	-53	173.5	-177.9	0	0	0	0	109.8	M466 C504 S505 S506 T510 Y511 R512	M466-V508 HydrophobicContact CE-CB 4.19Å; M466-V508 HydrophobicContact CE-CG2 3.07Å; C504-V508 PolarHBondContact O-N 3.47Å; S505-V508 PolarHBondContact O-N 2.94Å; S506-V508 VanDerWaalsContact C-N 3.32Å; S506-V508 PolarHBondContact O-N 2.92Å; V508-T510 PolarHBondContact O-N 3.43Å; V508-Y511 PolarHBondContact O-N 2.85Å; V508-R512 WeakPolarHBondContact O-CA 3.37Å; V508-R512 WeakPolarHBondContact O-CB 3.27Å; V508-R512 PolarHBondContact O-N 2.88Å
509	Q	85.2	Confident	76.8	Confident	126 Å²	126	57 Å²	57	59%	0.589	30%	0.304	S	S	*	.	H	α-helix	trans	-59.4	-47.1	-174.4	-74.9	170.6	-26.6	0	0	112.6	S505 S506	S505-Q509 WeakPolarHBondContact O-CG 3.41Å; S505-Q509 PolarHBondContact O-N 3.19Å; S506-Q509 PolarHBondContact O-N 2.89Å
510	T	81.4	Confident	76.2	Confident	41 Å²	41	59.4 Å²	59.4	25%	0.252	32%	0.321	S	S	.	.	H	α-helix	trans	-72.2	-33.5	-176.5	-50.9	0	0	0	0	112.9	E116 M237 S506 V508	E116-T510 PolarHBondContact OE1-OG1 3.18Å; E116-T510 VanDerWaalsContact OE1-OG1 3.05Å; M237-T510 HydrophobicContact CE-CG2 3.89Å; S506-T510 WeakPolarHBondContact O-CB 3.39Å; S506-T510 PolarHBondContact O-N 3.09Å; S506-T510 PolarHBondContact O-OG1 2.9Å; V508-T510 PolarHBondContact O-N 3.43Å
511	Y	83.8	Confident	75.5	Confident	12 Å²	12	67.8 Å²	67.8	5%	0.047	35%	0.347	C	S	.	.	H	α-helix	trans	-109.9	-0.6	-173.6	-68.9	-67	0	0	0	115.6	H113 M237 M240 A465 L476 V507 V508 T513	H113-Y511 PolarHBondContact CD2-OH 3.18Å; H113-Y511 AromaticContact NE2-CE2 3.77Å; H113-Y511 AromaticContact NE2-CZ 3.61Å; H113-Y511 PolarHBondContact NE2-OH 2.86Å; M237-Y511 HydrophobicContact CE-CD1 4.28Å; M237-Y511 HydrophobicContact CE-CE1 3.71Å; M237-Y511 HydrophobicContact SD-CE1 3.68Å; M240-Y511 HydrophobicContact CB-CD1 4Å; M240-Y511 HydrophobicContact CB-CE1 3.42Å; M240-Y511 VanDerWaalsContact CB-CE1 3.42Å; M240-Y511 HydrophobicContact CE-CE1 4.33Å; M240-Y511 HydrophobicContact CE-CE2 4.42Å; M240-Y511 HydrophobicContact CG-CE1 3.9Å; A465-Y511 HydrophobicContact CB-CD2 3.81Å; A465-Y511 HydrophobicContact CB-CE2 4.44Å; A465-Y511 HydrophobicContact CB-CG 3.94Å; L476-Y511 HydrophobicContact CD2-CD2 4.5Å; L476-Y511 HydrophobicContact CD2-CE2 3.62Å; V507-Y511 HydrophobicContact CG1-CD2 4.15Å; V507-Y511 WeakPolarHBondContact O-CB 3.3Å; V507-Y511 PolarHBondContact O-N 3.22Å; V507-Y511 VanDerWaalsContact O-N 3.12Å; V508-Y511 PolarHBondContact O-N 2.85Å; Y511-T513 PolarHBondContact O-N 3.35Å
512	R	84.4	Confident	74.8	Confident	126 Å²	126	68.7 Å²	68.7	48%	0.475	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-56.4	129.8	177.3	-173.5	169.7	-168.8	166.5	1.2	110.2	V508	V508-R512 WeakPolarHBondContact O-CA 3.37Å; V508-R512 WeakPolarHBondContact O-CB 3.27Å; V508-R512 PolarHBondContact O-N 2.88Å
513	T	80	Confident	74.7	Confident	12 Å²	12	71.7 Å²	71.7	7%	0.074	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-82.8	138.8	176.5	52.9	0	0	0	0	110	R224 V245 N459 S460 Y511 T515	R224-T513 PolarHBondContact NH2-OG1 3.03Å; V245-T513 HydrophobicContact CG2-CG2 4.29Å; N459-T513 PolarHBondContact O-OG1 2.83Å; S460-T513 WeakPolarHBondContact CA-OG1 3.14Å; S460-T513 PolarHBondContact O-N 2.87Å; S460-T513 PolarHBondContact O-OG1 3.21Å; Y511-T513 PolarHBondContact O-N 3.35Å; T513-T515 PolarHBondContact O-N 3.28Å
514	P	76	Confident	74.4	Confident	110 Å²	110	76.2 Å²	76.2	71%	0.714	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-66.9	132.1	179.2	26.7	-33.1	0	0	0	110.5	Y220	Y220-P514 PolarHBondContact OH-O 3Å
515	T	71.6	Confident	74.1	Confident	35 Å²	35	76 Å²	76	22%	0.215	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-101.5	153.6	175.9	44.3	0	0	0	0	111.3	N459 T513 S517	N459-T515 HydrophobicContact CB-CG2 4.13Å; T513-T515 PolarHBondContact O-N 3.28Å; T515-S517 VanDerWaalsContact C-N 3.26Å; T515-S517 PolarHBondContact O-N 3.02Å
516	Y	69.3	Low	73.9	Confident	51 Å²	51	74.2 Å²	74.2	20%	0.2	38%	0.38	C	S	.	.	S	Bend	trans	-73.3	-20	175.7	63.1	-91.9	0	0	0	112.9	V216 Q217 Y220 C518	V216-Y516 HydrophobicContact CG1-CD2 3.58Å; V216-Y516 HydrophobicContact CG1-CE2 3.56Å; V216-Y516 HydrophobicContact CG1-CG 4.13Å; Q217-Y516 VanDerWaalsContact OE1-CE1 3.3Å; Q217-Y516 PolarHBondContact OE1-OH 3.22Å; Y220-Y516 AromaticContact CD1-CD1 3.95Å; Y220-Y516 HydrophobicContact CD1-CD1 3.95Å; Y220-Y516 HydrophobicContact CD1-CE1 4.05Å; Y220-Y516 AromaticContact CD2-CD1 3.67Å; Y220-Y516 HydrophobicContact CD2-CD1 3.67Å; Y220-Y516 HydrophobicContact CD2-CG 4.47Å; Y220-Y516 HydrophobicContact CE1-CD1 4.32Å; Y220-Y516 HydrophobicContact CE2-CD1 4.06Å; Y220-Y516 AromaticContact CG-CD1 3.58Å; Y220-Y516 HydrophobicContact CG-CD1 3.58Å; Y220-Y516 HydrophobicContact CG-CE1 4.03Å; Y516-C518 PolarHBondContact O-N 3.04Å
517	S	63.1	Low	73.9	Confident	21 Å²	21	74.9 Å²	74.9	15%	0.147	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-69.5	121.6	-176.2	-65.9	0	0	0	0	112.4	D456 T515	D456-S517 WeakPolarHBondContact OD1-CB 3.37Å; D456-S517 PolarHBondContact OD1-OG 3.37Å; D456-S517 WeakPolarHBondContact OD2-CB 3.23Å; D456-S517 PolarHBondContact OD2-OG 3.36Å; T515-S517 VanDerWaalsContact C-N 3.26Å; T515-S517 PolarHBondContact O-N 3.02Å
518	C	56.5	Low	73.7	Confident	73 Å²	73	78.3 Å²	78.3	49%	0.493	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-89.9	116.5	170.6	-70.9	0	0	0	0	108.8	Y516 H542	Y516-C518 PolarHBondContact O-N 3.04Å; C518-H542 PolarHBondContact SG-CE1 2.91Å; C518-H542 PolarHBondContact SG-ND1 3Å
519	Y	57.9	Low	73.6	Confident	122 Å²	122	83.3 Å²	83.3	48%	0.478	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-61.4	143.8	167.5	-63.4	-76.7	0	0	0	109.8	L453 R521	L453-Y519 HydrophobicContact CD1-CE1 4.42Å; Y519-R521 PolarHBondContact O-N 2.77Å
520	P	57.4	Low	73.5	Confident	76 Å²	76	79.9 Å²	79.9	49%	0.494	40%	0.404	S	S	.	.			trans	-57	112.5	179	21.3	-31.1	0	0	0	109.5	D522	P520-D522 VanDerWaalsContact C-N 3.26Å
521	R	54.9	Low	73.7	Confident	248 Å²	248	80.5 Å²	80.5	94%	0.936	41%	0.405	S	S	*	.			trans	-79.2	-9.7	174.9	-76.4	-171.5	174.1	-174.9	-1.2	113	Y519 S523	Y519-R521 PolarHBondContact O-N 2.77Å; R521-S523 PolarHBondContact O-N 2.96Å
522	D	63.8	Low	73.7	Confident	48 Å²	48	86.9 Å²	86.9	26%	0.257	43%	0.434	S	S	.	.	S	Bend	trans	-73.2	126	176.8	-76.2	-5.6	0	0	0	108.6	P520 L527 K530 K543	P520-D522 VanDerWaalsContact C-N 3.26Å; D522-L527 HydrophobicContact CB-CD2 4.31Å; D522-L527 HydrophobicContact CB-CG 4.24Å; D522-K530 IonicContact OD2-NZ 2.69Å; D522-K530 PolarHBondContact OD2-NZ 3.44Å; D522-K543 IonicContact OD1-NZ 3.42Å; D522-K543 PolarHBondContact OD1-NZ 3.37Å
523	S	76.4	Confident	73.5	Confident	73 Å²	73	83.3 Å²	83.3	51%	0.51	42%	0.423	S	S	.	.			trans	-61.1	148.2	174.1	63.2	0	0	0	0	110.5	R521 A525 A526 L527	R521-S523 PolarHBondContact O-N 2.96Å; S523-A525 PolarHBondContact O-N 2.92Å; S523-A525 VanDerWaalsContact O-N 3.11Å; S523-A526 WeakPolarHBondContact O-CA 3.44Å; S523-A526 WeakPolarHBondContact O-CB 3.49Å; S523-A526 PolarHBondContact O-N 3.46Å; S523-A526 PolarHBondContact OG-N 3.31Å; S523-L527 PolarHBondContact O-N 3.11Å; S523-L527 VanDerWaalsContact O-N 3.12Å
524	W	77.3	Confident	73.4	Confident	217 Å²	217	82.7 Å²	82.7	82%	0.822	42%	0.42	S	S	*	.	H	α-helix	trans	-51	-37.7	176.2	-75.7	102.4	0	0	0	112.4	A526 L527 V528	W524-A526 PolarHBondContact O-N 2.95Å; W524-L527 PolarHBondContact O-N 3.47Å; W524-V528 VanDerWaalsContact O-CG2 3.3Å; W524-V528 WeakPolarHBondContact O-CG2 3.48Å; W524-V528 PolarHBondContact O-N 2.87Å
525	A	79.1	Confident	73.6	Confident	75 Å²	75	81.3 Å²	81.3	62%	0.62	40%	0.404	S	S	*	.	H	α-helix	trans	-62	-38.4	174.6	0	0	0	0	0	113.2	S523 K529	S523-A525 PolarHBondContact O-N 2.92Å; S523-A525 VanDerWaalsContact O-N 3.11Å; A525-K529 WeakPolarHBondContact O-CB 3.48Å; A525-K529 PolarHBondContact O-N 3.35Å
526	A	80.8	Confident	74	Confident	32 Å²	32	81.2 Å²	81.2	26%	0.264	40%	0.402	S	S	.	.	H	α-helix	trans	-69	-38.9	176.3	0	0	0	0	0	112	S523 W524 K529 K530	S523-A526 WeakPolarHBondContact O-CA 3.44Å; S523-A526 WeakPolarHBondContact O-CB 3.49Å; S523-A526 PolarHBondContact O-N 3.46Å; S523-A526 PolarHBondContact OG-N 3.31Å; W524-A526 PolarHBondContact O-N 2.95Å; A526-K529 PolarHBondContact O-N 3.47Å; A526-K530 VanDerWaalsContact O-CG 3.31Å; A526-K530 WeakPolarHBondContact O-CG 3.41Å; A526-K530 PolarHBondContact O-N 3.21Å
527	L	80.6	Confident	73.9	Confident	37 Å²	37	80.9 Å²	80.9	19%	0.194	40%	0.403	C	S	.	.	H	α-helix	trans	-64.1	-46.1	175	-71.5	173.6	0	0	0	111.7	D522 S523 W524 K529 K530 L531 I537	D522-L527 HydrophobicContact CB-CD2 4.31Å; D522-L527 HydrophobicContact CB-CG 4.24Å; S523-L527 PolarHBondContact O-N 3.11Å; S523-L527 VanDerWaalsContact O-N 3.12Å; W524-L527 PolarHBondContact O-N 3.47Å; L527-K529 VanDerWaalsContact C-N 3.33Å; L527-K529 PolarHBondContact O-N 2.98Å; L527-K530 PolarHBondContact O-N 3Å; L527-L531 PolarHBondContact O-N 3.41Å; L527-I537 HydrophobicContact CD2-CG2 3.93Å
528	V	81.9	Confident	74.1	Confident	73 Å²	73	84.9 Å²	84.9	44%	0.442	42%	0.416	S	S	.	.	H	α-helix	trans	-60.3	-44.4	176.1	170.7	0	0	0	0	110.5	W524 K530 L531 F532	W524-V528 VanDerWaalsContact O-CG2 3.3Å; W524-V528 WeakPolarHBondContact O-CG2 3.48Å; W524-V528 PolarHBondContact O-N 2.87Å; V528-K530 PolarHBondContact O-N 3.15Å; V528-L531 WeakPolarHBondContact O-CB 3.31Å; V528-L531 PolarHBondContact O-N 3Å; V528-F532 HydrophobicContact CG1-CD2 3.6Å; V528-F532 HydrophobicContact CG1-CE2 3.45Å; V528-F532 VanDerWaalsContact CG1-CE2 3.45Å; V528-F532 VanDerWaalsContact O-CD2 3.24Å; V528-F532 WeakPolarHBondContact O-CD2 3.47Å; V528-F532 PolarHBondContact O-N 2.88Å
529	K	84.1	Confident	74	Confident	141 Å²	141	83.4 Å²	83.4	61%	0.613	41%	0.405	S	S	*	.	H	α-helix	trans	-59.8	-44.4	175.7	-177.2	178.1	178.1	179.8	0	112.5	A525 A526 L527 L531 F532 I533	A525-K529 WeakPolarHBondContact O-CB 3.48Å; A525-K529 PolarHBondContact O-N 3.35Å; A526-K529 PolarHBondContact O-N 3.47Å; L527-K529 VanDerWaalsContact C-N 3.33Å; L527-K529 PolarHBondContact O-N 2.98Å; K529-L531 VanDerWaalsContact C-N 3.31Å; K529-L531 PolarHBondContact O-N 3.45Å; K529-F532 PolarHBondContact O-N 3.3Å; K529-I533 HydrophobicContact CG-CD1 4.02Å; K529-I533 WeakPolarHBondContact O-CG1 3.24Å; K529-I533 PolarHBondContact O-N 3.12Å
530	K	83.6	Confident	73.9	Confident	55 Å²	55	82.9 Å²	82.9	24%	0.239	40%	0.402	C	S	.	.	H	α-helix	trans	-60.9	-41.8	176.3	-74.7	176.2	178.5	178	0	111.5	D522 A526 L527 V528 I533 G534 E535	D522-K530 IonicContact OD2-NZ 2.69Å; D522-K530 PolarHBondContact OD2-NZ 3.44Å; A526-K530 VanDerWaalsContact O-CG 3.31Å; A526-K530 WeakPolarHBondContact O-CG 3.41Å; A526-K530 PolarHBondContact O-N 3.21Å; L527-K530 PolarHBondContact O-N 3Å; V528-K530 PolarHBondContact O-N 3.15Å; K530-I533 PolarHBondContact O-N 3.41Å; K530-G534 PolarHBondContact O-N 2.97Å; K530-E535 HydrophobicContact CB-CB 4.18Å; K530-E535 HydrophobicContact CG-CB 4.48Å; K530-E535 PolarHBondContact O-N 3.23Å
531	L	84.4	Confident	73.5	Confident	53 Å²	53	86.5 Å²	86.5	28%	0.277	41%	0.406	S	S	.	.	H	α-helix	trans	-63.1	-43.4	176.4	-163	72.8	0	0	0	112.1	Y434 T438 L527 V528 K529 I533 G534 I537	Y434-L531 WeakPolarHBondContact CE1-O 3.49Å; Y434-L531 WeakPolarHBondContact OH-CD1 3.36Å; Y434-L531 PolarHBondContact OH-O 2.93Å; Y434-L531 VanDerWaalsContact OH-O 3.09Å; T438-L531 HydrophobicContact CG2-CD1 3.3Å; T438-L531 HydrophobicContact CG2-CD2 4.13Å; T438-L531 HydrophobicContact CG2-CG 4.25Å; L527-L531 PolarHBondContact O-N 3.41Å; V528-L531 WeakPolarHBondContact O-CB 3.31Å; V528-L531 PolarHBondContact O-N 3Å; K529-L531 VanDerWaalsContact C-N 3.31Å; K529-L531 PolarHBondContact O-N 3.45Å; L531-I533 VanDerWaalsContact C-N 3.25Å; L531-I533 PolarHBondContact O-N 3.42Å; L531-G534 PolarHBondContact O-N 3.11Å; L531-I537 HydrophobicContact CB-CD1 4.11Å; L531-I537 HydrophobicContact CD1-CD1 3.62Å; L531-I537 HydrophobicContact CG-CD1 4.47Å
532	F	84.3	Confident	72.9	Confident	146 Å²	146	80.1 Å²	80.1	64%	0.64	39%	0.387	S	S	*	.	H	α-helix	trans	-61.5	-32.5	176.6	-89	-68.8	0	0	0	113.6	Y377 V528 K529	Y377-F532 WeakPolarHBondContact CE1-O 3.46Å; Y377-F532 PolarHBondContact OH-O 3.36Å; V528-F532 HydrophobicContact CG1-CD2 3.6Å; V528-F532 HydrophobicContact CG1-CE2 3.45Å; V528-F532 VanDerWaalsContact CG1-CE2 3.45Å; V528-F532 VanDerWaalsContact O-CD2 3.24Å; V528-F532 WeakPolarHBondContact O-CD2 3.47Å; V528-F532 PolarHBondContact O-N 2.88Å; K529-F532 PolarHBondContact O-N 3.3Å
533	I	81.6	Confident	71.6	Confident	51 Å²	51	86 Å²	86	26%	0.262	41%	0.41	S	S	.	.	H	α-helix	trans	-82.1	-18.1	177.7	-62.6	166.1	0	0	0	111.4	C378 K529 K530 L531 E535	C378-I533 PolarHBondContact SG-O 3.46Å; K529-I533 HydrophobicContact CG-CD1 4.02Å; K529-I533 WeakPolarHBondContact O-CG1 3.24Å; K529-I533 PolarHBondContact O-N 3.12Å; K530-I533 PolarHBondContact O-N 3.41Å; L531-I533 VanDerWaalsContact C-N 3.25Å; L531-I533 PolarHBondContact O-N 3.42Å; I533-E535 HydrophobicContact CB-CG 4.43Å; I533-E535 HydrophobicContact CG2-CG 4.02Å
534	G	76.3	Confident	69.7	Low	0 Å²	0	87.5 Å²	87.5	0%	0	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	11.6	-174.1	0	0	0	0	0	114.3	C378 K530 L531	C378-G534 VanDerWaalsContact SG-CA 3.54Å; C378-G534 PolarHBondContact SG-O 3.3Å; K530-G534 PolarHBondContact O-N 2.97Å; L531-G534 PolarHBondContact O-N 3.11Å
535	E	81.4	Confident	67.5	Low	81 Å²	81	83 Å²	83	38%	0.379	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-65.8	142.9	178.8	-71.5	-172.4	175.8	0	0	111.1	Y370 K530 I533 I537	Y370-E535 PolarHBondContact OH-O 3.25Å; K530-E535 HydrophobicContact CB-CB 4.18Å; K530-E535 HydrophobicContact CG-CB 4.48Å; K530-E535 PolarHBondContact O-N 3.23Å; I533-E535 HydrophobicContact CB-CG 4.43Å; I533-E535 HydrophobicContact CG2-CG 4.02Å; E535-I537 PolarHBondContact O-N 3.2Å
536	L	78.6	Confident	65.2	Low	32 Å²	32	89.1 Å²	89.1	17%	0.168	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-67.2	123.6	179.5	-77.6	79.4	0	0	0	110.1	Y370 V371 A374 Y538	Y370-L536 HydrophobicContact CE1-CG 4.46Å; V371-L536 HydrophobicContact CG1-CD2 4.22Å; V371-L536 HydrophobicContact CG2-CD2 3.8Å; A374-L536 HydrophobicContact CB-CD1 4.44Å; L536-Y538 HydrophobicContact CB-CD2 4.41Å; L536-Y538 HydrophobicContact CB-CE2 3.71Å; L536-Y538 HydrophobicContact CD2-CE2 4.34Å; L536-Y538 VanDerWaalsContact CD2-OH 3.23Å; L536-Y538 WeakPolarHBondContact CD2-OH 3.19Å
537	I	68.9	Low	62.7	Low	44 Å²	44	92.7 Å²	92.7	23%	0.226	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-89.9	120.8	178.6	-58.6	175.4	0	0	0	109	Y370 L527 L531 E535	Y370-I537 PolarHBondContact OH-N 2.9Å; L527-I537 HydrophobicContact CD2-CG2 3.93Å; L531-I537 HydrophobicContact CB-CD1 4.11Å; L531-I537 HydrophobicContact CD1-CD1 3.62Å; L531-I537 HydrophobicContact CG-CD1 4.47Å; E535-I537 PolarHBondContact O-N 3.2Å
538	Y	65.8	Low	60.2	Low	106 Å²	106	101.9 Å²	101.9	42%	0.416	50%	0.498	S	S	.	.			trans	-115.7	95.4	171.3	-63.9	-76	0	0	0	108.6	Y367 L536 W540	Y367-Y538 HydrophobicContact CE2-CE1 4.42Å; Y367-Y538 PolarHBondContact OH-OH 3.07Å; Y367-Y538 VanDerWaalsContact OH-OH 3.13Å; L536-Y538 HydrophobicContact CB-CD2 4.41Å; L536-Y538 HydrophobicContact CB-CE2 3.71Å; L536-Y538 HydrophobicContact CD2-CE2 4.34Å; L536-Y538 VanDerWaalsContact CD2-OH 3.23Å; L536-Y538 WeakPolarHBondContact CD2-OH 3.19Å; Y538-W540 VanDerWaalsContact C-N 3.29Å; Y538-W540 PolarHBondContact O-N 3.17Å
539	P	54.8	Low	59.1	Low	41 Å²	41	103.3 Å²	103.3	27%	0.266	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.1	-170	11.5	-13.8	0	0	0	113.7	V445	V445-P539 HydrophobicContact CG1-CB 4.38Å; V445-P539 HydrophobicContact CG1-CG 3.52Å; V445-P539 HydrophobicContact CG2-CG 4.48Å
540	W	56	Low	57.8	Low	111 Å²	111	101.3 Å²	101.3	42%	0.42	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	19.6	-169.5	-49.2	103.4	0	0	0	113.8	Y538	Y538-W540 VanDerWaalsContact C-N 3.29Å; Y538-W540 PolarHBondContact O-N 3.17Å
541	R	48.1	Very low	56.3	Low	152 Å²	152	103.9 Å²	103.9	57%	0.574	51%	0.509	S	S	*	.			trans	-84.2	125.9	-179.9	-155.7	178.3	179.7	170.3	-1.2	109.4	K543	R541-K543 PolarHBondContact O-N 2.85Å
542	H	43.7	Very low	54.7	Low	115 Å²	115	106.9 Å²	106.9	53%	0.532	52%	0.523	S	S	.	.			trans	-51.6	119.1	156	-70.8	-67.8	0	0	0	106.9	C518 T544	C518-H542 PolarHBondContact SG-CE1 2.91Å; C518-H542 PolarHBondContact SG-ND1 3Å; H542-T544 PolarHBondContact O-N 2.81Å
543	K	36.9	Very low	52.8	Low	170 Å²	170	104.4 Å²	104.4	74%	0.739	52%	0.515	S	S	*	.			trans	-62	88.1	150.3	-89.7	175.6	177	159.8	0	104	D522 R541 T545	D522-K543 IonicContact OD1-NZ 3.42Å; D522-K543 PolarHBondContact OD1-NZ 3.37Å; R541-K543 PolarHBondContact O-N 2.85Å; K543-T545 PolarHBondContact O-N 3.19Å
544	T	36.8	Very low	50.9	Low	105 Å²	105	108 Å²	108	64%	0.644	53%	0.532	S	S	*	.			trans	-51.1	108.2	145.6	47	0	0	0	0	102.7	H542 K546	H542-T544 PolarHBondContact O-N 2.81Å; T544-K546 PolarHBondContact O-N 2.66Å
545	T	30.9	Very low	49.1	Very low	124 Å²	124	115.7 Å²	115.7	76%	0.761	57%	0.57	S	S	*	*			trans	-34.4	121	161.7	36.4	0	0	0	0	106.3	K543 S547	K543-T545 PolarHBondContact O-N 3.19Å; T545-S547 VanDerWaalsContact C-N 3.35Å; T545-S547 PolarHBondContact O-N 3.03Å
546	K	29.8	Very low	46.6	Very low	202 Å²	202	118.4 Å²	118.4	88%	0.878	59%	0.585	S	S	*	*			trans	-44.1	106.8	173.9	-74.7	178.3	171.4	-176.7	0	107	T544	T544-K546 PolarHBondContact O-N 2.66Å
547	S	27.6	Very low	44	Very low	108 Å²	108	125.6 Å²	125.6	76%	0.755	62%	0.62	S	S	*	*			trans	-98.1	89.3	153.5	54.8	0	0	0	0	103.2	T545	T545-S547 VanDerWaalsContact C-N 3.35Å; T545-S547 PolarHBondContact O-N 3.03Å
548	D	28.5	Very low	41.7	Very low	229 Å²	229	133 Å²	133	100%	1.225	66%	0.656	S	S	*	*			trans	50	0	164.6	-55.6	-28.3	0	0	0	119.8

Retrieved 548 of 548 residues in 99.6 ms (Link to these results)

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