A0A077ZCM3_TRITR Loading...

Protein Lines N-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZCM3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 526 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	33.9	Very low	40.2	Very low	226 Å²	226	112.3 Å²	112.3	100%	1.113	52%	0.524	S	S	*	.				0	-22.5	0	-138.6	179.1	-70.6	0	0	111.6
2	E	31.7	Very low	40.3	Very low	148 Å²	148	109.5 Å²	109.5	69%	0.692	52%	0.515	S	S	*	.			trans	-77.2	-35.9	-179.1	-68.5	169.4	153.5	0	0	115.1	N4 F5	E2-N4 PolarHBondContact O-N 2.99Å; E2-N4 VanDerWaalsContact O-N 3.11Å; E2-F5 PolarHBondContact O-N 3.21Å
3	E	34.2	Very low	40.4	Very low	164 Å²	164	101.4 Å²	101.4	77%	0.766	48%	0.477	S	S	*	.	H	α-helix	trans	-58.7	-28.2	179.5	-77.7	-177.4	143.3	0	0	114	Q7	E3-Q7 PolarHBondContact O-N 2.84Å
4	N	43.3	Very low	40.6	Very low	110 Å²	110	101.1 Å²	101.1	59%	0.588	47%	0.473	S	S	*	.	H	α-helix	trans	-79.5	-27.3	-175.1	-139.8	1.8	0	0	0	112.3	E2 N8	E2-N4 PolarHBondContact O-N 2.99Å; E2-N4 VanDerWaalsContact O-N 3.11Å; N4-N8 WeakPolarHBondContact O-CB 3.47Å; N4-N8 VanDerWaalsContact O-CG 3.23Å; N4-N8 PolarHBondContact O-N 3.28Å; N4-N8 PolarHBondContact O-ND2 3.47Å
5	F	39.3	Very low	40.8	Very low	172 Å²	172	102.5 Å²	102.5	75%	0.754	48%	0.483	S	S	*	.	H	α-helix	trans	-71.6	-39.4	177.2	-121.2	-85.9	0	0	0	111	E2 N8 F9	E2-F5 PolarHBondContact O-N 3.21Å; F5-N8 PolarHBondContact O-N 3.36Å; F5-F9 PolarHBondContact O-N 3.21Å
6	W	41.3	Very low	40.6	Very low	45 Å²	45	101.6 Å²	101.6	17%	0.17	48%	0.483	C	S	.	.	H	α-helix	trans	-76.1	-39.9	-176	-168.6	-112.7	0	0	0	113.8	N8 F9 V10 A34 W43	W6-N8 PolarHBondContact O-N 3.25Å; W6-F9 HydrophobicContact CD2-CB 4.45Å; W6-F9 AromaticContact CD2-CD1 3.86Å; W6-F9 HydrophobicContact CD2-CD1 3.86Å; W6-F9 HydrophobicContact CD2-CG 4.48Å; W6-F9 AromaticContact CE2-CD1 3.9Å; W6-F9 HydrophobicContact CE3-CB 3.97Å; W6-F9 AromaticContact CE3-CD1 3.51Å; W6-F9 HydrophobicContact CE3-CD1 3.51Å; W6-F9 HydrophobicContact CE3-CE1 4.22Å; W6-F9 AromaticContact CE3-CG 3.85Å; W6-F9 HydrophobicContact CE3-CG 3.85Å; W6-F9 AromaticContact CH2-CD1 3.32Å; W6-F9 HydrophobicContact CH2-CD1 3.32Å; W6-F9 AromaticContact CH2-CE1 3.15Å; W6-F9 HydrophobicContact CH2-CE1 3.15Å; W6-F9 HydrophobicContact CH2-CG 4.26Å; W6-F9 AromaticContact CH2-CZ 3.99Å; W6-F9 HydrophobicContact CH2-CZ 3.99Å; W6-F9 AromaticContact CZ2-CD1 3.65Å; W6-F9 HydrophobicContact CZ2-CD1 3.65Å; W6-F9 AromaticContact CZ2-CE1 3.64Å; W6-F9 HydrophobicContact CZ2-CE1 3.64Å; W6-F9 HydrophobicContact CZ3-CB 4.36Å; W6-F9 AromaticContact CZ3-CD1 3.23Å; W6-F9 HydrophobicContact CZ3-CD1 3.23Å; W6-F9 HydrophobicContact CZ3-CD2 4.39Å; W6-F9 AromaticContact CZ3-CE1 3.49Å; W6-F9 HydrophobicContact CZ3-CE1 3.49Å; W6-F9 VanDerWaalsContact CZ3-CE1 3.49Å; W6-F9 AromaticContact CZ3-CG 3.74Å; W6-F9 HydrophobicContact CZ3-CG 3.74Å; W6-F9 HydrophobicContact CZ3-CZ 4.17Å; W6-F9 WeakPolarHBondContact O-CA 3.22Å; W6-F9 WeakPolarHBondContact O-CB 3.12Å; W6-F9 PolarHBondContact O-N 3.42Å; W6-V10 PolarHBondContact O-N 3.19Å; W6-A34 HydrophobicContact CZ2-CB 3.71Å; W6-W43 HydrophobicContact CZ3-CH2 4.29Å
7	Q	44.2	Very low	40.5	Very low	113 Å²	113	96.8 Å²	96.8	53%	0.528	46%	0.462	S	S	.	.	H	α-helix	trans	-60.8	-35.7	172.2	-71.3	-170.3	2.7	0	0	111.5	E3 R11	E3-Q7 PolarHBondContact O-N 2.84Å; Q7-R11 WeakPolarHBondContact O-CB 3.43Å; Q7-R11 WeakPolarHBondContact O-CG 3.49Å; Q7-R11 PolarHBondContact O-N 3.17Å
8	N	42.1	Very low	40.7	Very low	72 Å²	72	99.8 Å²	99.8	39%	0.385	48%	0.482	S	S	.	.	H	α-helix	trans	-68.3	-37.4	172.9	-72.6	-25.2	0	0	0	112	N4 F5 W6 R11 L12	N4-N8 WeakPolarHBondContact O-CB 3.47Å; N4-N8 VanDerWaalsContact O-CG 3.23Å; N4-N8 PolarHBondContact O-N 3.28Å; N4-N8 PolarHBondContact O-ND2 3.47Å; F5-N8 PolarHBondContact O-N 3.36Å; W6-N8 PolarHBondContact O-N 3.25Å; N8-R11 PolarHBondContact O-N 2.67Å; N8-L12 WeakPolarHBondContact O-CB 3.35Å; N8-L12 PolarHBondContact O-N 3.42Å
9	F	41.9	Very low	40.5	Very low	11 Å²	11	101.9 Å²	101.9	5%	0.048	49%	0.491	C	S	.	.	H	α-helix	trans	-60.7	-53.5	172.6	169	-97.9	0	0	0	112.5	F5 W6 R11 L12 V13 A30 I68 L72	F5-F9 PolarHBondContact O-N 3.21Å; W6-F9 HydrophobicContact CD2-CB 4.45Å; W6-F9 AromaticContact CD2-CD1 3.86Å; W6-F9 HydrophobicContact CD2-CD1 3.86Å; W6-F9 HydrophobicContact CD2-CG 4.48Å; W6-F9 AromaticContact CE2-CD1 3.9Å; W6-F9 HydrophobicContact CE3-CB 3.97Å; W6-F9 AromaticContact CE3-CD1 3.51Å; W6-F9 HydrophobicContact CE3-CD1 3.51Å; W6-F9 HydrophobicContact CE3-CE1 4.22Å; W6-F9 AromaticContact CE3-CG 3.85Å; W6-F9 HydrophobicContact CE3-CG 3.85Å; W6-F9 AromaticContact CH2-CD1 3.32Å; W6-F9 HydrophobicContact CH2-CD1 3.32Å; W6-F9 AromaticContact CH2-CE1 3.15Å; W6-F9 HydrophobicContact CH2-CE1 3.15Å; W6-F9 HydrophobicContact CH2-CG 4.26Å; W6-F9 AromaticContact CH2-CZ 3.99Å; W6-F9 HydrophobicContact CH2-CZ 3.99Å; W6-F9 AromaticContact CZ2-CD1 3.65Å; W6-F9 HydrophobicContact CZ2-CD1 3.65Å; W6-F9 AromaticContact CZ2-CE1 3.64Å; W6-F9 HydrophobicContact CZ2-CE1 3.64Å; W6-F9 HydrophobicContact CZ3-CB 4.36Å; W6-F9 AromaticContact CZ3-CD1 3.23Å; W6-F9 HydrophobicContact CZ3-CD1 3.23Å; W6-F9 HydrophobicContact CZ3-CD2 4.39Å; W6-F9 AromaticContact CZ3-CE1 3.49Å; W6-F9 HydrophobicContact CZ3-CE1 3.49Å; W6-F9 VanDerWaalsContact CZ3-CE1 3.49Å; W6-F9 AromaticContact CZ3-CG 3.74Å; W6-F9 HydrophobicContact CZ3-CG 3.74Å; W6-F9 HydrophobicContact CZ3-CZ 4.17Å; W6-F9 WeakPolarHBondContact O-CA 3.22Å; W6-F9 WeakPolarHBondContact O-CB 3.12Å; W6-F9 PolarHBondContact O-N 3.42Å; F9-R11 PolarHBondContact O-N 3.33Å; F9-L12 WeakPolarHBondContact O-CB 3.36Å; F9-L12 PolarHBondContact O-N 3.31Å; F9-L12 VanDerWaalsContact O-N 3.07Å; F9-V13 HydrophobicContact CD2-CG2 4.34Å; F9-V13 HydrophobicContact CE1-CG2 4.1Å; F9-V13 HydrophobicContact CE2-CG2 3.88Å; F9-V13 HydrophobicContact CZ-CG2 3.76Å; F9-V13 WeakPolarHBondContact O-CG2 3.32Å; F9-V13 PolarHBondContact O-N 3.43Å; F9-A30 HydrophobicContact CE1-CB 4.19Å; F9-I68 HydrophobicContact CE2-CG2 3.84Å; F9-I68 HydrophobicContact CZ-CB 4.41Å; F9-I68 HydrophobicContact CZ-CD1 4.43Å; F9-I68 HydrophobicContact CZ-CG1 4.07Å; F9-I68 HydrophobicContact CZ-CG2 3.76Å; F9-L72 HydrophobicContact CD2-CD2 3.93Å; F9-L72 HydrophobicContact CD2-CG 4.33Å; F9-L72 HydrophobicContact CE2-CD1 4.48Å; F9-L72 HydrophobicContact CE2-CD2 4.27Å; F9-L72 HydrophobicContact CE2-CG 4.22Å
10	V	44.9	Very low	40.5	Very low	26 Å²	26	104.9 Å²	104.9	16%	0.158	51%	0.509	C	S	.	.	H	α-helix	trans	-60.5	-37.3	178.3	175.1	0	0	0	0	110.7	W6 K14	W6-V10 PolarHBondContact O-N 3.19Å; V10-K14 HydrophobicContact CG1-CD 4.05Å; V10-K14 WeakPolarHBondContact O-CB 3.36Å; V10-K14 WeakPolarHBondContact O-CG 3.08Å; V10-K14 PolarHBondContact O-N 3.09Å
11	R	45.2	Very low	40.4	Very low	148 Å²	148	105.7 Å²	105.7	56%	0.558	52%	0.52	S	S	*	.	H	α-helix	trans	-65.2	-43.5	173.2	-78	174.7	177.3	173.3	1.1	112.4	Q7 N8 F9 K14 I15	Q7-R11 WeakPolarHBondContact O-CB 3.43Å; Q7-R11 WeakPolarHBondContact O-CG 3.49Å; Q7-R11 PolarHBondContact O-N 3.17Å; N8-R11 PolarHBondContact O-N 2.67Å; F9-R11 PolarHBondContact O-N 3.33Å; R11-K14 WeakPolarHBondContact O-CB 3.36Å; R11-K14 PolarHBondContact O-N 2.89Å; R11-I15 WeakPolarHBondContact O-CB 3.46Å; R11-I15 WeakPolarHBondContact O-CD1 3.46Å; R11-I15 WeakPolarHBondContact O-CG1 3.26Å; R11-I15 PolarHBondContact O-N 3.36Å
12	L	41.9	Very low	41	Very low	79 Å²	79	97.6 Å²	97.6	41%	0.414	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-44.9	177.9	-101.3	150.1	0	0	0	112.2	N8 F9 K14 I15 N16 L71	N8-L12 WeakPolarHBondContact O-CB 3.35Å; N8-L12 PolarHBondContact O-N 3.42Å; F9-L12 WeakPolarHBondContact O-CB 3.36Å; F9-L12 PolarHBondContact O-N 3.31Å; F9-L12 VanDerWaalsContact O-N 3.07Å; L12-K14 VanDerWaalsContact C-N 3.32Å; L12-K14 PolarHBondContact O-N 2.74Å; L12-I15 PolarHBondContact O-N 3.18Å; L12-N16 PolarHBondContact O-N 3.24Å; L12-L71 HydrophobicContact CD2-CD2 4.26Å
13	V	41.8	Very low	41.5	Very low	4 Å²	4	96.2 Å²	96.2	2%	0.024	47%	0.47	C	S	.	.	H	α-helix	trans	-59.1	-45	172.7	175.9	0	0	0	0	110.3	F9 I15 S17 L26 L71	F9-V13 HydrophobicContact CD2-CG2 4.34Å; F9-V13 HydrophobicContact CE1-CG2 4.1Å; F9-V13 HydrophobicContact CE2-CG2 3.88Å; F9-V13 HydrophobicContact CZ-CG2 3.76Å; F9-V13 WeakPolarHBondContact O-CG2 3.32Å; F9-V13 PolarHBondContact O-N 3.43Å; V13-I15 VanDerWaalsContact C-N 3.29Å; V13-I15 PolarHBondContact O-N 2.92Å; V13-S17 PolarHBondContact O-N 3.35Å; V13-L26 HydrophobicContact CG1-CB 4.16Å; V13-L26 HydrophobicContact CG1-CD2 4.3Å; V13-L71 HydrophobicContact CB-CD1 4.41Å; V13-L71 HydrophobicContact CG2-CD1 3.59Å
14	K	43.3	Very low	42.1	Very low	98 Å²	98	95 Å²	95	43%	0.426	46%	0.464	S	S	.	.	H	α-helix	trans	-64	-28.2	178.3	-79.5	173	-179.2	178.2	0	114.5	V10 R11 L12 R23 L27	V10-K14 HydrophobicContact CG1-CD 4.05Å; V10-K14 WeakPolarHBondContact O-CB 3.36Å; V10-K14 WeakPolarHBondContact O-CG 3.08Å; V10-K14 PolarHBondContact O-N 3.09Å; R11-K14 WeakPolarHBondContact O-CB 3.36Å; R11-K14 PolarHBondContact O-N 2.89Å; L12-K14 VanDerWaalsContact C-N 3.32Å; L12-K14 PolarHBondContact O-N 2.74Å; K14-R23 PolarHBondContact O-NH2 2.85Å; K14-L27 HydrophobicContact CD-CD2 4.33Å; K14-L27 HydrophobicContact CG-CD2 3.72Å
15	I	43.3	Very low	42.2	Very low	121 Å²	121	92.6 Å²	92.6	62%	0.621	45%	0.449	S	S	*	.	H	α-helix	trans	-85.7	-39.2	-178	-70.8	163.9	0	0	0	111.3	R11 L12 V13	R11-I15 WeakPolarHBondContact O-CB 3.46Å; R11-I15 WeakPolarHBondContact O-CD1 3.46Å; R11-I15 WeakPolarHBondContact O-CG1 3.26Å; R11-I15 PolarHBondContact O-N 3.36Å; L12-I15 PolarHBondContact O-N 3.18Å; V13-I15 VanDerWaalsContact C-N 3.29Å; V13-I15 PolarHBondContact O-N 2.92Å
16	N	37.8	Very low	42.5	Very low	89 Å²	89	84.8 Å²	84.8	48%	0.476	42%	0.415	S	S	.	.	H	α-helix	trans	-95	-6.3	-170.2	-72.7	-31.9	0	0	0	115.2	L12 N18	L12-N16 PolarHBondContact O-N 3.24Å; N16-N18 PolarHBondContact O-N 3.49Å
17	S	39.2	Very low	42.9	Very low	20 Å²	20	84.5 Å²	84.5	14%	0.14	42%	0.416	C	S	.	.			trans	-75.1	85.5	174.5	68.8	0	0	0	0	111.1	V13 R23	V13-S17 PolarHBondContact O-N 3.35Å; S17-R23 WeakPolarHBondContact OG-CD 3.42Å; S17-R23 VanDerWaalsContact OG-CG 3.31Å; S17-R23 WeakPolarHBondContact OG-CG 3.27Å
18	N	42.9	Very low	43.3	Very low	151 Å²	151	82.2 Å²	82.2	81%	0.807	41%	0.408	S	S	*	.			trans	-86.7	-8.8	177.2	-81.9	-19.6	0	0	0	114	N16	N16-N18 PolarHBondContact O-N 3.49Å
19	E	37.9	Very low	43.6	Very low	140 Å²	140	79.3 Å²	79.3	65%	0.654	39%	0.393	S	S	*	.			trans	-92.5	114.2	175.2	-66.2	-169.6	-174	0	0	109.9	V21 D22	E19-V21 PolarHBondContact O-N 3.48Å; E19-V21 VanDerWaalsContact O-N 3.09Å; E19-D22 PolarHBondContact O-N 3.05Å; E19-D22 VanDerWaalsContact O-N 3.12Å
20	N	40.8	Very low	44	Very low	161 Å²	161	78.9 Å²	78.9	86%	0.861	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.4	-176.6	-83.5	-28.3	0	0	0	114.1
21	V	36.7	Very low	44.3	Very low	121 Å²	121	82.1 Å²	82.1	73%	0.733	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-26.3	179.8	-174.8	0	0	0	0	111.6	E19	E19-V21 PolarHBondContact O-N 3.48Å; E19-V21 VanDerWaalsContact O-N 3.09Å
22	D	46.8	Very low	44.6	Very low	56 Å²	56	76 Å²	76	30%	0.299	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-13.1	-173.4	-82.4	-11.2	0	0	0	114.7	E19 H24 E25 L26	E19-D22 PolarHBondContact O-N 3.05Å; E19-D22 VanDerWaalsContact O-N 3.12Å; D22-H24 PolarHBondContact O-N 3.18Å; D22-E25 PolarHBondContact O-N 2.91Å; D22-L26 HydrophobicContact CB-CD1 3.96Å; D22-L26 WeakPolarHBondContact O-CB 3.33Å; D22-L26 WeakPolarHBondContact O-CG 3.39Å; D22-L26 PolarHBondContact O-N 3.21Å
23	R	42.2	Very low	45	Very low	120 Å²	120	72.4 Å²	72.4	45%	0.453	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-43.2	-171.9	-174.6	172.9	-169.4	-171.9	7.9	113.4	K14 S17 L27	K14-R23 PolarHBondContact O-NH2 2.85Å; S17-R23 WeakPolarHBondContact OG-CD 3.42Å; S17-R23 VanDerWaalsContact OG-CG 3.31Å; S17-R23 WeakPolarHBondContact OG-CG 3.27Å; R23-L27 HydrophobicContact CG-CD1 4.1Å; R23-L27 WeakPolarHBondContact O-CB 3.19Å; R23-L27 WeakPolarHBondContact O-CD1 3.44Å; R23-L27 WeakPolarHBondContact O-CG 3.32Å; R23-L27 PolarHBondContact O-N 2.96Å; R23-L27 VanDerWaalsContact O-N 3.09Å
24	H	46.7	Very low	45.2	Very low	138 Å²	138	72.6 Å²	72.6	64%	0.639	37%	0.37	S	S	*	.	H	α-helix	trans	-69.6	-39.1	-179.4	-170.6	52.1	0	0	0	111.4	D22 L27 L28	D22-H24 PolarHBondContact O-N 3.18Å; H24-L27 PolarHBondContact O-N 3.14Å; H24-L28 PolarHBondContact O-N 3.26Å
25	E	46.4	Very low	45.5	Very low	60 Å²	60	71.9 Å²	71.9	28%	0.28	37%	0.368	S	S	.	.	H	α-helix	trans	-72.2	-38	179.3	-61.9	-170.9	176	0	0	112.7	D22 L27 L28 S29 F60	D22-E25 PolarHBondContact O-N 2.91Å; E25-L27 VanDerWaalsContact C-N 3.34Å; E25-L28 PolarHBondContact O-N 3.43Å; E25-S29 WeakPolarHBondContact O-CB 3.29Å; E25-S29 PolarHBondContact O-N 3.44Å; E25-S29 PolarHBondContact O-OG 3.48Å; E25-F60 WeakPolarHBondContact OE2-CD2 3.17Å
26	L	45.7	Very low	45.8	Very low	8 Å²	8	66.4 Å²	66.4	4%	0.042	34%	0.341	C	S	.	.	H	α-helix	trans	-61.1	-42.1	170	-90.5	158.2	0	0	0	111.7	V13 D22 A30 V64	V13-L26 HydrophobicContact CG1-CB 4.16Å; V13-L26 HydrophobicContact CG1-CD2 4.3Å; D22-L26 HydrophobicContact CB-CD1 3.96Å; D22-L26 WeakPolarHBondContact O-CB 3.33Å; D22-L26 WeakPolarHBondContact O-CG 3.39Å; D22-L26 PolarHBondContact O-N 3.21Å; L26-A30 WeakPolarHBondContact O-CB 3.29Å; L26-A30 PolarHBondContact O-N 3.22Å; L26-V64 HydrophobicContact CD2-CG1 3.81Å; L26-V64 HydrophobicContact CD2-CG2 4.44Å; L26-V64 HydrophobicContact CG-CG1 4.5Å; L26-V64 HydrophobicContact CG-CG2 4.46Å
27	L	49.8	Very low	46.1	Very low	38 Å²	38	64.9 Å²	64.9	20%	0.199	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-46.4	177.4	-74.8	169.6	0	0	0	111.2	K14 R23 H24 E25 S29 A30 D31	K14-L27 HydrophobicContact CD-CD2 4.33Å; K14-L27 HydrophobicContact CG-CD2 3.72Å; R23-L27 HydrophobicContact CG-CD1 4.1Å; R23-L27 WeakPolarHBondContact O-CB 3.19Å; R23-L27 WeakPolarHBondContact O-CD1 3.44Å; R23-L27 WeakPolarHBondContact O-CG 3.32Å; R23-L27 PolarHBondContact O-N 2.96Å; R23-L27 VanDerWaalsContact O-N 3.09Å; H24-L27 PolarHBondContact O-N 3.14Å; E25-L27 VanDerWaalsContact C-N 3.34Å; L27-S29 PolarHBondContact O-N 3.03Å; L27-A30 PolarHBondContact O-N 3.42Å; L27-D31 WeakPolarHBondContact O-CB 3.44Å; L27-D31 VanDerWaalsContact O-CG 3.23Å; L27-D31 PolarHBondContact O-N 3Å
28	L	51.4	Low	46.5	Very low	66 Å²	66	70.2 Å²	70.2	35%	0.346	35%	0.353	S	S	.	.	H	α-helix	trans	-59.5	-45.9	174.6	-97	151.1	0	0	0	112	H24 E25 A30 D31 V32	H24-L28 PolarHBondContact O-N 3.26Å; E25-L28 PolarHBondContact O-N 3.43Å; L28-A30 VanDerWaalsContact C-N 3.34Å; L28-A30 PolarHBondContact O-N 3.36Å; L28-D31 PolarHBondContact O-N 3.08Å; L28-V32 WeakPolarHBondContact O-CB 3.48Å; L28-V32 VanDerWaalsContact O-CG2 3.23Å; L28-V32 WeakPolarHBondContact O-CG2 3.5Å; L28-V32 PolarHBondContact O-N 3.41Å
29	S	49.7	Very low	46.9	Very low	11 Å²	11	72 Å²	72	8%	0.077	35%	0.348	C	S	.	.	H	α-helix	trans	-64.6	-38.9	177.8	-58.5	0	0	0	0	112.1	E25 L27 L33	E25-S29 WeakPolarHBondContact O-CB 3.29Å; E25-S29 PolarHBondContact O-N 3.44Å; E25-S29 PolarHBondContact O-OG 3.48Å; L27-S29 PolarHBondContact O-N 3.03Å; S29-L33 WeakPolarHBondContact O-CB 3.47Å; S29-L33 WeakPolarHBondContact O-CG 3.37Å; S29-L33 PolarHBondContact O-N 3.17Å
30	A	49.1	Very low	47.4	Very low	1 Å²	1	68.6 Å²	68.6	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-65.8	-37.9	173.7	0	0	0	0	0	111.9	F9 L26 L27 L28 A34	F9-A30 HydrophobicContact CE1-CB 4.19Å; L26-A30 WeakPolarHBondContact O-CB 3.29Å; L26-A30 PolarHBondContact O-N 3.22Å; L27-A30 PolarHBondContact O-N 3.42Å; L28-A30 VanDerWaalsContact C-N 3.34Å; L28-A30 PolarHBondContact O-N 3.36Å; A30-A34 VanDerWaalsContact O-CB 3.28Å; A30-A34 WeakPolarHBondContact O-CB 3.37Å; A30-A34 PolarHBondContact O-N 2.98Å
31	D	51.3	Low	47.6	Very low	94 Å²	94	64.5 Å²	64.5	50%	0.503	33%	0.333	S	S	.	.	H	α-helix	trans	-68.9	-42.2	176	-72.5	-21.2	0	0	0	111.4	L27 L28 A34 E35	L27-D31 WeakPolarHBondContact O-CB 3.44Å; L27-D31 VanDerWaalsContact O-CG 3.23Å; L27-D31 PolarHBondContact O-N 3Å; L28-D31 PolarHBondContact O-N 3.08Å; D31-A34 WeakPolarHBondContact O-CB 3.34Å; D31-A34 PolarHBondContact O-N 3.4Å; D31-E35 WeakPolarHBondContact O-CB 3.36Å; D31-E35 PolarHBondContact O-N 3.4Å
32	V	51.3	Low	48.1	Very low	20 Å²	20	59.9 Å²	59.9	12%	0.121	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-43.5	174.2	170.5	0	0	0	0	111	L28 E35 A36 V52 F55	L28-V32 WeakPolarHBondContact O-CB 3.48Å; L28-V32 VanDerWaalsContact O-CG2 3.23Å; L28-V32 WeakPolarHBondContact O-CG2 3.5Å; L28-V32 PolarHBondContact O-N 3.41Å; V32-E35 PolarHBondContact O-N 3.19Å; V32-A36 WeakPolarHBondContact O-CB 3.34Å; V32-A36 PolarHBondContact O-N 3.24Å; V32-V52 HydrophobicContact CG1-CB 4.39Å; V32-V52 HydrophobicContact CG1-CG1 3.63Å; V32-F55 HydrophobicContact CG1-CD2 4.05Å
33	L	50.2	Low	48	Very low	3 Å²	3	60 Å²	60	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-65.2	-39.6	173	-84.9	164.5	0	0	0	112.4	S29 E35 A36 W37 L49 F65 I68	S29-L33 WeakPolarHBondContact O-CB 3.47Å; S29-L33 WeakPolarHBondContact O-CG 3.37Å; S29-L33 PolarHBondContact O-N 3.17Å; L33-E35 VanDerWaalsContact C-N 3.34Å; L33-A36 PolarHBondContact O-N 2.89Å; L33-W37 VanDerWaalsContact O-CB 3.27Å; L33-W37 WeakPolarHBondContact O-CB 3.31Å; L33-W37 PolarHBondContact O-N 3.47Å; L33-L49 HydrophobicContact CD2-CD2 3.62Å; L33-F65 HydrophobicContact CD1-CE1 3.98Å; L33-F65 HydrophobicContact CD1-CZ 3.7Å; L33-F65 HydrophobicContact CD2-CE1 3.97Å; L33-F65 HydrophobicContact CD2-CZ 3.83Å; L33-F65 HydrophobicContact CG-CE1 4.43Å; L33-F65 HydrophobicContact CG-CZ 3.96Å; L33-I68 HydrophobicContact CD1-CD1 3.44Å; L33-I68 VanDerWaalsContact CD1-CD1 3.44Å; L33-I68 HydrophobicContact CD1-CG2 4.47Å
34	A	47.4	Very low	48.1	Very low	9 Å²	9	54.5 Å²	54.5	7%	0.074	29%	0.286	C	S	.	.	H	α-helix	trans	-62.2	-44	175.6	0	0	0	0	0	110.8	W6 A30 D31 W37 M38	W6-A34 HydrophobicContact CZ2-CB 3.71Å; A30-A34 VanDerWaalsContact O-CB 3.28Å; A30-A34 WeakPolarHBondContact O-CB 3.37Å; A30-A34 PolarHBondContact O-N 2.98Å; D31-A34 WeakPolarHBondContact O-CB 3.34Å; D31-A34 PolarHBondContact O-N 3.4Å; A34-W37 PolarHBondContact O-N 2.99Å; A34-M38 HydrophobicContact CB-CE 4.41Å; A34-M38 VanDerWaalsContact O-CB 3.31Å; A34-M38 WeakPolarHBondContact O-CB 3.49Å; A34-M38 VanDerWaalsContact O-CG 3.25Å; A34-M38 WeakPolarHBondContact O-CG 3.46Å; A34-M38 PolarHBondContact O-N 2.92Å
35	E	49.9	Very low	47.8	Very low	83 Å²	83	50.8 Å²	50.8	39%	0.388	28%	0.275	S	S	.	.	H	α-helix	trans	-63.1	-46.1	177	-173.4	176.2	-177.9	0	0	111.2	D31 V32 L33 W37 M38 R39	D31-E35 WeakPolarHBondContact O-CB 3.36Å; D31-E35 PolarHBondContact O-N 3.4Å; V32-E35 PolarHBondContact O-N 3.19Å; L33-E35 VanDerWaalsContact C-N 3.34Å; E35-W37 PolarHBondContact O-N 3.09Å; E35-M38 PolarHBondContact O-N 3.34Å; E35-R39 WeakPolarHBondContact O-CB 3.3Å; E35-R39 VanDerWaalsContact O-CG 3.29Å; E35-R39 WeakPolarHBondContact O-CG 3.19Å; E35-R39 PolarHBondContact O-N 3.46Å; E35-R39 IonicContact OE1-CZ 2.68Å; E35-R39 IonicContact OE1-NE 3.12Å; E35-R39 PolarHBondContact OE1-NE 3.39Å; E35-R39 IonicContact OE1-NH2 3.98Å; E35-R39 PolarHBondContact OE1-NH2 2.89Å
36	A	48.7	Very low	47.5	Very low	6 Å²	6	49.9 Å²	49.9	5%	0.05	28%	0.275	C	S	.	.	H	α-helix	trans	-62	-41.5	176.1	0	0	0	0	0	112.3	V32 L33 R39 T40 P44 L49 V52	V32-A36 WeakPolarHBondContact O-CB 3.34Å; V32-A36 PolarHBondContact O-N 3.24Å; L33-A36 PolarHBondContact O-N 2.89Å; A36-R39 PolarHBondContact O-N 2.97Å; A36-T40 WeakPolarHBondContact O-CB 3.33Å; A36-T40 WeakPolarHBondContact O-CG2 3.45Å; A36-T40 PolarHBondContact O-N 3.15Å; A36-T40 PolarHBondContact O-OG1 2.91Å; A36-P44 HydrophobicContact CB-CB 4.2Å; A36-P44 HydrophobicContact CB-CG 3.96Å; A36-L49 HydrophobicContact CB-CD2 4.31Å; A36-V52 HydrophobicContact CB-CG2 4.1Å
37	W	44.9	Very low	47.2	Very low	57 Å²	57	58.7 Å²	58.7	22%	0.216	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-47.3	175.4	-178.5	89.7	0	0	0	111.9	L33 A34 E35 R39 T40 G41 G42	L33-W37 VanDerWaalsContact O-CB 3.27Å; L33-W37 WeakPolarHBondContact O-CB 3.31Å; L33-W37 PolarHBondContact O-N 3.47Å; A34-W37 PolarHBondContact O-N 2.99Å; E35-W37 PolarHBondContact O-N 3.09Å; W37-R39 VanDerWaalsContact C-N 3.33Å; W37-R39 PolarHBondContact O-N 2.97Å; W37-T40 PolarHBondContact O-N 2.87Å; W37-T40 PolarHBondContact O-OG1 3.36Å; W37-G41 PolarHBondContact O-N 3.01Å; W37-G42 WeakPolarHBondContact CA-O 3.45Å; W37-G42 PolarHBondContact O-N 2.87Å
38	M	47.6	Very low	46.9	Very low	131 Å²	131	58 Å²	58	65%	0.645	31%	0.308	S	S	*	.	H	α-helix	trans	-61.7	-40.5	177	-76.1	-169.5	-71.6	0	0	111.8	A34 E35	A34-M38 HydrophobicContact CB-CE 4.41Å; A34-M38 VanDerWaalsContact O-CB 3.31Å; A34-M38 WeakPolarHBondContact O-CB 3.49Å; A34-M38 VanDerWaalsContact O-CG 3.25Å; A34-M38 WeakPolarHBondContact O-CG 3.46Å; A34-M38 PolarHBondContact O-N 2.92Å; E35-M38 PolarHBondContact O-N 3.34Å
39	R	50.2	Low	46.5	Very low	188 Å²	188	54.9 Å²	54.9	71%	0.709	29%	0.291	S	S	*	.	H	α-helix	trans	-66.7	-36.9	176.9	-76.9	178.7	-178.4	-163.9	2.3	112.8	E35 A36 W37	E35-R39 WeakPolarHBondContact O-CB 3.3Å; E35-R39 VanDerWaalsContact O-CG 3.29Å; E35-R39 WeakPolarHBondContact O-CG 3.19Å; E35-R39 PolarHBondContact O-N 3.46Å; E35-R39 IonicContact OE1-CZ 2.68Å; E35-R39 IonicContact OE1-NE 3.12Å; E35-R39 PolarHBondContact OE1-NE 3.39Å; E35-R39 IonicContact OE1-NH2 3.98Å; E35-R39 PolarHBondContact OE1-NH2 2.89Å; A36-R39 PolarHBondContact O-N 2.97Å; W37-R39 VanDerWaalsContact C-N 3.33Å; W37-R39 PolarHBondContact O-N 2.97Å
40	T	48.5	Very low	46.1	Very low	70 Å²	70	58.3 Å²	58.3	43%	0.429	31%	0.308	S	S	.	.	H	α-helix	trans	-91.1	-8.7	-174.9	54	0	0	0	0	113.8	A36 W37 G42 P44 A48	A36-T40 WeakPolarHBondContact O-CB 3.33Å; A36-T40 WeakPolarHBondContact O-CG2 3.45Å; A36-T40 PolarHBondContact O-N 3.15Å; A36-T40 PolarHBondContact O-OG1 2.91Å; W37-T40 PolarHBondContact O-N 2.87Å; W37-T40 PolarHBondContact O-OG1 3.36Å; T40-G42 PolarHBondContact O-N 3.34Å; T40-G42 PolarHBondContact OG1-O 3.35Å; T40-P44 HydrophobicContact CG2-CB 4.17Å; T40-A48 HydrophobicContact CG2-CB 4.48Å
41	G	45.7	Very low	45.7	Very low	74 Å²	74	66 Å²	66	76%	0.763	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	25.2	-177.8	0	0	0	0	0	113	W37	W37-G41 PolarHBondContact O-N 3.01Å
42	G	46	Very low	45.4	Very low	24 Å²	24	62.8 Å²	62.8	25%	0.247	33%	0.328	C	S	.	.	S	Bend	trans	171.8	-173	-172.2	0	0	0	0	0	111	W37 T40	W37-G42 WeakPolarHBondContact CA-O 3.45Å; W37-G42 PolarHBondContact O-N 2.87Å; T40-G42 PolarHBondContact O-N 3.34Å; T40-G42 PolarHBondContact OG1-O 3.35Å
43	W	44.7	Very low	44.7	Very low	59 Å²	59	71 Å²	71	22%	0.223	37%	0.365	C	S	.	.	S	Bend	trans	-65.9	127.7	172.7	-76.8	93.3	0	0	0	110.2	W6 L72 L88	W6-W43 HydrophobicContact CZ3-CH2 4.29Å; W43-L72 HydrophobicContact CH2-CD1 3.52Å; W43-L72 HydrophobicContact CH2-CD2 4.47Å; W43-L72 HydrophobicContact CZ2-CD1 3.99Å; W43-L72 HydrophobicContact CZ2-CD2 4.32Å; W43-L72 HydrophobicContact CZ3-CD1 4.47Å; W43-L88 HydrophobicContact CD2-CD1 4.47Å; W43-L88 HydrophobicContact CE3-CD1 3.76Å; W43-L88 HydrophobicContact CZ3-CD1 4.03Å
44	P	44.6	Very low	44.2	Very low	5 Å²	5	72 Å²	72	3%	0.032	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-62	143.4	178.4	25.6	-34.4	0	0	0	110.3	A36 T40 A48 L49	A36-P44 HydrophobicContact CB-CB 4.2Å; A36-P44 HydrophobicContact CB-CG 3.96Å; T40-P44 HydrophobicContact CG2-CB 4.17Å; P44-A48 HydrophobicContact CB-CB 4.04Å; P44-L49 HydrophobicContact CB-CD2 4.07Å; P44-L49 HydrophobicContact CB-CG 4.03Å; P44-L49 HydrophobicContact CG-CD1 4.29Å; P44-L49 HydrophobicContact CG-CD2 3.42Å; P44-L49 VanDerWaalsContact CG-CD2 3.42Å; P44-L49 HydrophobicContact CG-CG 3.73Å
45	S	40	Very low	43.8	Very low	59 Å²	59	72.2 Å²	72.2	41%	0.413	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-62.2	154.4	170.1	75.9	0	0	0	0	110.1	W47 A48 L49	S45-W47 PolarHBondContact O-N 2.75Å; S45-A48 PolarHBondContact O-N 3.04Å; S45-A48 PolarHBondContact OG-N 2.78Å; S45-L49 PolarHBondContact O-N 2.61Å; S45-L49 VanDerWaalsContact O-N 3.14Å
46	P	41.8	Very low	43	Very low	42 Å²	42	71 Å²	71	27%	0.273	37%	0.373	S	S	.	.	H	α-helix	trans	-46.7	-37.4	173.4	-33.3	38.4	0	0	0	114.1	L50 I91	P46-L50 WeakPolarHBondContact O-CG 3.38Å; P46-L50 PolarHBondContact O-N 2.87Å; P46-I91 HydrophobicContact CB-CD1 3.47Å; P46-I91 VanDerWaalsContact CB-CD1 3.47Å; P46-I91 HydrophobicContact CB-CG1 3.87Å; P46-I91 HydrophobicContact CG-CD1 3.97Å; P46-I91 HydrophobicContact CG-CG1 4.3Å
47	W	39.1	Very low	42.4	Very low	192 Å²	192	75.1 Å²	75.1	73%	0.727	40%	0.402	S	S	*	.	H	α-helix	trans	-70.9	-41.3	178.2	-59.9	109.7	0	0	0	112.7	S45 L49 L50 E51	S45-W47 PolarHBondContact O-N 2.75Å; W47-L49 PolarHBondContact O-N 3.48Å; W47-L50 HydrophobicContact CE3-CD1 3.88Å; W47-L50 HydrophobicContact CZ3-CD1 4.13Å; W47-L50 WeakPolarHBondContact O-CB 3.25Å; W47-L50 PolarHBondContact O-N 3.03Å; W47-L50 VanDerWaalsContact O-N 3.11Å; W47-E51 PolarHBondContact O-N 3.41Å
48	A	43.5	Very low	42	Very low	24 Å²	24	75.1 Å²	75.1	20%	0.198	40%	0.403	C	S	.	.	H	α-helix	trans	-65.1	-28.4	177.2	0	0	0	0	0	112.5	T40 P44 S45 V52	T40-A48 HydrophobicContact CG2-CB 4.48Å; P44-A48 HydrophobicContact CB-CB 4.04Å; S45-A48 PolarHBondContact O-N 3.04Å; S45-A48 PolarHBondContact OG-N 2.78Å; A48-V52 WeakPolarHBondContact O-CG2 3.38Å
49	L	43.2	Very low	41.5	Very low	1 Å²	1	72 Å²	72	1%	0.005	39%	0.393	C	S	.	.	H	α-helix	trans	-69.5	-37.1	172.5	-73	173.6	0	0	0	112.5	L33 A36 P44 S45 W47 E51 V52 F55 F65 L88 I91	L33-L49 HydrophobicContact CD2-CD2 3.62Å; A36-L49 HydrophobicContact CB-CD2 4.31Å; P44-L49 HydrophobicContact CB-CD2 4.07Å; P44-L49 HydrophobicContact CB-CG 4.03Å; P44-L49 HydrophobicContact CG-CD1 4.29Å; P44-L49 HydrophobicContact CG-CD2 3.42Å; P44-L49 VanDerWaalsContact CG-CD2 3.42Å; P44-L49 HydrophobicContact CG-CG 3.73Å; S45-L49 PolarHBondContact O-N 2.61Å; S45-L49 VanDerWaalsContact O-N 3.14Å; W47-L49 PolarHBondContact O-N 3.48Å; L49-E51 VanDerWaalsContact C-N 3.26Å; L49-E51 PolarHBondContact O-N 2.79Å; L49-V52 PolarHBondContact O-N 3.37Å; L49-F55 HydrophobicContact CB-CD1 4.37Å; L49-F55 HydrophobicContact CB-CE1 3.82Å; L49-F55 HydrophobicContact CB-CE2 4.24Å; L49-F55 HydrophobicContact CB-CZ 3.72Å; L49-F55 HydrophobicContact CD1-CZ 4.13Å; L49-F55 HydrophobicContact CD2-CE2 3.8Å; L49-F55 HydrophobicContact CD2-CZ 3.96Å; L49-F55 HydrophobicContact CG-CE2 4.48Å; L49-F55 HydrophobicContact CG-CZ 4.16Å; L49-F55 WeakPolarHBondContact O-CB 3.47Å; L49-F55 WeakPolarHBondContact O-CD1 3.05Å; L49-F55 WeakPolarHBondContact O-CG 2.92Å; L49-F65 HydrophobicContact CD1-CE1 4.49Å; L49-L88 HydrophobicContact CD1-CD2 3.35Å; L49-I91 HydrophobicContact CD1-CD1 4.33Å
50	L	40.1	Very low	40.9	Very low	83 Å²	83	67.3 Å²	67.3	44%	0.435	38%	0.378	S	S	.	.	H	α-helix	trans	-68.2	-26.3	176.5	-66.7	170.8	0	0	0	112.7	P46 W47 V52 V56	P46-L50 WeakPolarHBondContact O-CG 3.38Å; P46-L50 PolarHBondContact O-N 2.87Å; W47-L50 HydrophobicContact CE3-CD1 3.88Å; W47-L50 HydrophobicContact CZ3-CD1 4.13Å; W47-L50 WeakPolarHBondContact O-CB 3.25Å; W47-L50 PolarHBondContact O-N 3.03Å; W47-L50 VanDerWaalsContact O-N 3.11Å; L50-V52 VanDerWaalsContact C-N 3.32Å; L50-V56 HydrophobicContact CB-CG2 4.49Å; L50-V56 HydrophobicContact CD2-CG2 3.96Å; L50-V56 WeakPolarHBondContact O-CG2 3.43Å
51	E	40.3	Very low	40.5	Very low	162 Å²	162	65 Å²	65	76%	0.757	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-9.8	178.3	-70.6	179.8	175.3	0	0	113.7	W47 L49 E53	W47-E51 PolarHBondContact O-N 3.41Å; L49-E51 VanDerWaalsContact C-N 3.26Å; L49-E51 PolarHBondContact O-N 2.79Å; E51-E53 PolarHBondContact O-N 3.47Å
52	V	44.8	Very low	40.5	Very low	27 Å²	27	61.9 Å²	61.9	16%	0.164	33%	0.329	C	S	.	.	S	Bend	trans	-76.6	115.4	178.3	-170.4	0	0	0	0	109.7	V32 A36 A48 L49 L50 G54 F55	V32-V52 HydrophobicContact CG1-CB 4.39Å; V32-V52 HydrophobicContact CG1-CG1 3.63Å; A36-V52 HydrophobicContact CB-CG2 4.1Å; A48-V52 WeakPolarHBondContact O-CG2 3.38Å; L49-V52 PolarHBondContact O-N 3.37Å; L50-V52 VanDerWaalsContact C-N 3.32Å; V52-G54 PolarHBondContact O-N 3Å; V52-F55 HydrophobicContact CB-CB 4.02Å; V52-F55 WeakPolarHBondContact O-CB 3.29Å; V52-F55 PolarHBondContact O-N 3.37Å
53	E	38.3	Very low	40.2	Very low	191 Å²	191	63.7 Å²	63.7	89%	0.893	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	127	172.7	-88	-173.8	150.7	0	0	110.5	E51	E51-E53 PolarHBondContact O-N 3.47Å
54	G	39.2	Very low	40.2	Very low	24 Å²	24	61.1 Å²	61.1	25%	0.247	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.6	-32.9	-175.1	0	0	0	0	0	113.8	V52 V56 S57 F58	V52-G54 PolarHBondContact O-N 3Å; G54-V56 PolarHBondContact O-N 3.05Å; G54-S57 WeakPolarHBondContact CA-OG 3.48Å; G54-S57 PolarHBondContact O-N 2.84Å; G54-S57 PolarHBondContact O-OG 3.26Å; G54-S57 VanDerWaalsContact O-OG 3.06Å; G54-F58 WeakPolarHBondContact O-CD2 3.23Å; G54-F58 PolarHBondContact O-N 2.83Å; G54-F58 VanDerWaalsContact O-N 3.15Å
55	F	37.8	Very low	40.3	Very low	14 Å²	14	62.3 Å²	62.3	6%	0.061	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-41	-171.7	-167.7	-90.5	0	0	0	114	V32 L49 V52 V61 F65	V32-F55 HydrophobicContact CG1-CD2 4.05Å; L49-F55 HydrophobicContact CB-CD1 4.37Å; L49-F55 HydrophobicContact CB-CE1 3.82Å; L49-F55 HydrophobicContact CB-CE2 4.24Å; L49-F55 HydrophobicContact CB-CZ 3.72Å; L49-F55 HydrophobicContact CD1-CZ 4.13Å; L49-F55 HydrophobicContact CD2-CE2 3.8Å; L49-F55 HydrophobicContact CD2-CZ 3.96Å; L49-F55 HydrophobicContact CG-CE2 4.48Å; L49-F55 HydrophobicContact CG-CZ 4.16Å; L49-F55 WeakPolarHBondContact O-CB 3.47Å; L49-F55 WeakPolarHBondContact O-CD1 3.05Å; L49-F55 WeakPolarHBondContact O-CG 2.92Å; V52-F55 HydrophobicContact CB-CB 4.02Å; V52-F55 WeakPolarHBondContact O-CB 3.29Å; V52-F55 PolarHBondContact O-N 3.37Å; F55-V61 HydrophobicContact CE1-CG1 4.11Å; F55-V61 HydrophobicContact CZ-CG1 4.32Å; F55-V61 WeakPolarHBondContact O-CG2 3.43Å; F55-F65 HydrophobicContact CD2-CE2 4.41Å; F55-F65 HydrophobicContact CD2-CZ 4.46Å; F55-F65 HydrophobicContact CE1-CE2 4.16Å; F55-F65 HydrophobicContact CE1-CZ 4.3Å; F55-F65 HydrophobicContact CE2-CE1 4.33Å; F55-F65 AromaticContact CE2-CE2 3.35Å; F55-F65 HydrophobicContact CE2-CE2 3.35Å; F55-F65 AromaticContact CE2-CZ 3.18Å; F55-F65 HydrophobicContact CE2-CZ 3.18Å; F55-F65 HydrophobicContact CZ-CD2 4.22Å; F55-F65 AromaticContact CZ-CE1 3.95Å; F55-F65 HydrophobicContact CZ-CE1 3.95Å; F55-F65 AromaticContact CZ-CE2 3.18Å; F55-F65 HydrophobicContact CZ-CE2 3.18Å; F55-F65 AromaticContact CZ-CZ 3.05Å; F55-F65 HydrophobicContact CZ-CZ 3.05Å
56	V	34.5	Very low	40.7	Very low	58 Å²	58	59.8 Å²	59.8	35%	0.352	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-25.8	177.3	-175.2	0	0	0	0	111.2	L50 G54 Y140	L50-V56 HydrophobicContact CB-CG2 4.49Å; L50-V56 HydrophobicContact CD2-CG2 3.96Å; L50-V56 WeakPolarHBondContact O-CG2 3.43Å; G54-V56 PolarHBondContact O-N 3.05Å; V56-Y140 PolarHBondContact O-OH 3.35Å
57	S	35.5	Very low	40.8	Very low	92 Å²	92	61.6 Å²	61.6	64%	0.643	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-7.6	-176.2	35.2	0	0	0	0	114.7	G54 P59	G54-S57 WeakPolarHBondContact CA-OG 3.48Å; G54-S57 PolarHBondContact O-N 2.84Å; G54-S57 PolarHBondContact O-OG 3.26Å; G54-S57 VanDerWaalsContact O-OG 3.06Å; S57-P59 WeakPolarHBondContact O-CD 3.36Å
58	F	37.7	Very low	41.1	Very low	58 Å²	58	52.8 Å²	52.8	25%	0.254	29%	0.286	S	S	.	.			trans	-79.5	117.6	174	-82.6	-70.4	0	0	0	111	G54 F60 V61	G54-F58 WeakPolarHBondContact O-CD2 3.23Å; G54-F58 PolarHBondContact O-N 2.83Å; G54-F58 VanDerWaalsContact O-N 3.15Å; F58-F60 PolarHBondContact O-N 3.32Å; F58-F60 VanDerWaalsContact O-N 3.08Å; F58-V61 HydrophobicContact CB-CG2 3.33Å; F58-V61 HydrophobicContact CG-CG2 4.42Å; F58-V61 WeakPolarHBondContact O-CG2 3.47Å; F58-V61 PolarHBondContact O-N 3.05Å
59	P	36.1	Very low	41.3	Very low	64 Å²	64	52.1 Å²	52.1	42%	0.416	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.8	-179.6	23.5	-30.7	0	0	0	114.1	S57	S57-P59 WeakPolarHBondContact O-CD 3.36Å
60	F	38.1	Very low	41.4	Very low	91 Å²	91	53.5 Å²	53.5	40%	0.399	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	11.1	-174.5	-57.5	-71.6	0	0	0	114.7	E25 F58 P63 V64	E25-F60 WeakPolarHBondContact OE2-CD2 3.17Å; F58-F60 PolarHBondContact O-N 3.32Å; F58-F60 VanDerWaalsContact O-N 3.08Å; F60-P63 VanDerWaalsContact O-CD 3.25Å; F60-P63 WeakPolarHBondContact O-CD 3.5Å; F60-V64 WeakPolarHBondContact O-CG2 3.39Å; F60-V64 PolarHBondContact O-N 3.47Å
61	V	40.1	Very low	41.6	Very low	21 Å²	21	51.3 Å²	51.3	13%	0.127	27%	0.274	C	S	.	.	H	α-helix	trans	-49.8	-51	175	165.4	0	0	0	0	111.2	F55 F58 V64 F65	F55-V61 HydrophobicContact CE1-CG1 4.11Å; F55-V61 HydrophobicContact CZ-CG1 4.32Å; F55-V61 WeakPolarHBondContact O-CG2 3.43Å; F58-V61 HydrophobicContact CB-CG2 3.33Å; F58-V61 HydrophobicContact CG-CG2 4.42Å; F58-V61 WeakPolarHBondContact O-CG2 3.47Å; F58-V61 PolarHBondContact O-N 3.05Å; V61-V64 PolarHBondContact O-N 3.01Å; V61-F65 HydrophobicContact CB-CD2 4.29Å; V61-F65 HydrophobicContact CG1-CD2 3.37Å; V61-F65 HydrophobicContact CG1-CE2 3.59Å; V61-F65 WeakPolarHBondContact O-CB 3.44Å; V61-F65 WeakPolarHBondContact O-CD2 3.41Å; V61-F65 PolarHBondContact O-N 2.7Å
62	P	44.4	Very low	41.8	Very low	8 Å²	8	45.5 Å²	45.5	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-48.7	-174.3	-14.6	26.3	0	0	0	114.1	V64 F65 I66 W95	P62-V64 PolarHBondContact O-N 2.83Å; P62-F65 PolarHBondContact O-N 3.34Å; P62-I66 VanDerWaalsContact O-CD1 3.28Å; P62-I66 WeakPolarHBondContact O-CD1 3.28Å; P62-I66 VanDerWaalsContact O-CG1 3.3Å; P62-I66 WeakPolarHBondContact O-CG1 3.27Å; P62-I66 PolarHBondContact O-N 3.24Å; P62-W95 HydrophobicContact CB-CB 3.81Å; P62-W95 HydrophobicContact CB-CD2 3.71Å; P62-W95 HydrophobicContact CB-CE3 4.03Å; P62-W95 HydrophobicContact CB-CG 3.6Å; P62-W95 HydrophobicContact CG-CB 4.42Å; P62-W95 HydrophobicContact CG-CD2 3.46Å; P62-W95 VanDerWaalsContact CG-CD2 3.46Å; P62-W95 HydrophobicContact CG-CE3 3.95Å; P62-W95 HydrophobicContact CG-CG 3.67Å; P62-W95 HydrophobicContact CG-CH2 4.49Å; P62-W95 HydrophobicContact CG-CZ2 4.08Å; P62-W95 HydrophobicContact CG-CZ3 4.42Å
63	P	41.6	Very low	41.9	Very low	62 Å²	62	45.2 Å²	45.2	40%	0.403	25%	0.246	S	C	.	.	H	α-helix	trans	-57.4	-42.9	173.4	-25.9	32.6	0	0	0	114.1	F60 I66 H67	F60-P63 VanDerWaalsContact O-CD 3.25Å; F60-P63 WeakPolarHBondContact O-CD 3.5Å; P63-I66 PolarHBondContact O-N 2.89Å; P63-H67 PolarHBondContact O-N 2.95Å
64	V	43.2	Very low	42.2	Very low	6 Å²	6	41.4 Å²	41.4	4%	0.036	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-41.2	179.9	172.3	0	0	0	0	111	L26 F60 V61 P62 I66 H67 I68	L26-V64 HydrophobicContact CD2-CG1 3.81Å; L26-V64 HydrophobicContact CD2-CG2 4.44Å; L26-V64 HydrophobicContact CG-CG1 4.5Å; L26-V64 HydrophobicContact CG-CG2 4.46Å; F60-V64 WeakPolarHBondContact O-CG2 3.39Å; F60-V64 PolarHBondContact O-N 3.47Å; V61-V64 PolarHBondContact O-N 3.01Å; P62-V64 PolarHBondContact O-N 2.83Å; V64-I66 PolarHBondContact O-N 3.35Å; V64-H67 PolarHBondContact O-N 3.22Å; V64-H67 VanDerWaalsContact O-N 3.17Å; V64-I68 HydrophobicContact CG1-CD1 3.74Å; V64-I68 HydrophobicContact CG1-CG1 4.27Å; V64-I68 WeakPolarHBondContact O-CB 3.27Å; V64-I68 VanDerWaalsContact O-CG1 3.27Å; V64-I68 WeakPolarHBondContact O-CG1 3.22Å; V64-I68 PolarHBondContact O-N 3.16Å
65	F	47.9	Very low	42.4	Very low	29 Å²	29	45.9 Å²	45.9	13%	0.127	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-43.4	174	-93.2	-82.9	0	0	0	112.5	L33 L49 F55 V61 P62 H67 I68 F69	L33-F65 HydrophobicContact CD1-CE1 3.98Å; L33-F65 HydrophobicContact CD1-CZ 3.7Å; L33-F65 HydrophobicContact CD2-CE1 3.97Å; L33-F65 HydrophobicContact CD2-CZ 3.83Å; L33-F65 HydrophobicContact CG-CE1 4.43Å; L33-F65 HydrophobicContact CG-CZ 3.96Å; L49-F65 HydrophobicContact CD1-CE1 4.49Å; F55-F65 HydrophobicContact CD2-CE2 4.41Å; F55-F65 HydrophobicContact CD2-CZ 4.46Å; F55-F65 HydrophobicContact CE1-CE2 4.16Å; F55-F65 HydrophobicContact CE1-CZ 4.3Å; F55-F65 HydrophobicContact CE2-CE1 4.33Å; F55-F65 AromaticContact CE2-CE2 3.35Å; F55-F65 HydrophobicContact CE2-CE2 3.35Å; F55-F65 AromaticContact CE2-CZ 3.18Å; F55-F65 HydrophobicContact CE2-CZ 3.18Å; F55-F65 HydrophobicContact CZ-CD2 4.22Å; F55-F65 AromaticContact CZ-CE1 3.95Å; F55-F65 HydrophobicContact CZ-CE1 3.95Å; F55-F65 AromaticContact CZ-CE2 3.18Å; F55-F65 HydrophobicContact CZ-CE2 3.18Å; F55-F65 AromaticContact CZ-CZ 3.05Å; F55-F65 HydrophobicContact CZ-CZ 3.05Å; V61-F65 HydrophobicContact CB-CD2 4.29Å; V61-F65 HydrophobicContact CG1-CD2 3.37Å; V61-F65 HydrophobicContact CG1-CE2 3.59Å; V61-F65 WeakPolarHBondContact O-CB 3.44Å; V61-F65 WeakPolarHBondContact O-CD2 3.41Å; V61-F65 PolarHBondContact O-N 2.7Å; P62-F65 PolarHBondContact O-N 3.34Å; F65-H67 VanDerWaalsContact C-N 3.33Å; F65-I68 PolarHBondContact O-N 3.02Å; F65-F69 WeakPolarHBondContact O-CB 3.42Å; F65-F69 PolarHBondContact O-N 2.8Å
66	I	47.2	Very low	43	Very low	6 Å²	6	47 Å²	47	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-40.5	174.8	-70.3	155.8	0	0	0	110.5	P62 P63 V64 F69 Q70 I100 L104	P62-I66 VanDerWaalsContact O-CD1 3.28Å; P62-I66 WeakPolarHBondContact O-CD1 3.28Å; P62-I66 VanDerWaalsContact O-CG1 3.3Å; P62-I66 WeakPolarHBondContact O-CG1 3.27Å; P62-I66 PolarHBondContact O-N 3.24Å; P63-I66 PolarHBondContact O-N 2.89Å; V64-I66 PolarHBondContact O-N 3.35Å; I66-F69 CarbonylContact O-C 3.58Å; I66-F69 WeakPolarHBondContact O-CB 3.3Å; I66-F69 PolarHBondContact O-N 3.42Å; I66-Q70 WeakPolarHBondContact O-CG 3.3Å; I66-Q70 PolarHBondContact O-N 3.34Å; I66-I100 HydrophobicContact CD1-CB 4.24Å; I66-I100 HydrophobicContact CD1-CD1 3.6Å; I66-I100 HydrophobicContact CD1-CG1 3.89Å; I66-I100 HydrophobicContact CD1-CG2 3.34Å; I66-I100 HydrophobicContact CG1-CG2 3.95Å; I66-I100 HydrophobicContact CG2-CG2 3.92Å; I66-L104 HydrophobicContact CG2-CD2 4.01Å; I66-L104 HydrophobicContact CG2-CG 4.28Å
67	H	43.9	Very low	43.9	Very low	81 Å²	81	50.9 Å²	50.9	38%	0.375	28%	0.278	S	S	.	.	H	α-helix	trans	-68.2	-43.9	178.1	-124.3	53.2	0	0	0	112.6	P63 V64 F65 F69 Q70 L71	P63-H67 PolarHBondContact O-N 2.95Å; V64-H67 PolarHBondContact O-N 3.22Å; V64-H67 VanDerWaalsContact O-N 3.17Å; F65-H67 VanDerWaalsContact C-N 3.33Å; H67-F69 PolarHBondContact O-N 2.62Å; H67-Q70 PolarHBondContact CE1-OE1 3Å; H67-Q70 PolarHBondContact ND1-OE1 3.47Å; H67-Q70 WeakPolarHBondContact O-CB 3.43Å; H67-Q70 PolarHBondContact O-N 2.65Å; H67-L71 WeakPolarHBondContact O-CG 3.44Å; H67-L71 PolarHBondContact O-N 2.98Å
68	I	46.5	Very low	44.9	Very low	6 Å²	6	50.5 Å²	50.5	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-58.8	-41.2	172.4	-72.5	174.5	0	0	0	109.9	F9 L33 V64 F65 L71 L72	F9-I68 HydrophobicContact CE2-CG2 3.84Å; F9-I68 HydrophobicContact CZ-CB 4.41Å; F9-I68 HydrophobicContact CZ-CD1 4.43Å; F9-I68 HydrophobicContact CZ-CG1 4.07Å; F9-I68 HydrophobicContact CZ-CG2 3.76Å; L33-I68 HydrophobicContact CD1-CD1 3.44Å; L33-I68 VanDerWaalsContact CD1-CD1 3.44Å; L33-I68 HydrophobicContact CD1-CG2 4.47Å; V64-I68 HydrophobicContact CG1-CD1 3.74Å; V64-I68 HydrophobicContact CG1-CG1 4.27Å; V64-I68 WeakPolarHBondContact O-CB 3.27Å; V64-I68 VanDerWaalsContact O-CG1 3.27Å; V64-I68 WeakPolarHBondContact O-CG1 3.22Å; V64-I68 PolarHBondContact O-N 3.16Å; F65-I68 PolarHBondContact O-N 3.02Å; I68-L71 PolarHBondContact O-N 3.08Å; I68-L72 HydrophobicContact CG2-CD1 3.72Å; I68-L72 VanDerWaalsContact O-CG 3.25Å; I68-L72 WeakPolarHBondContact O-CG 3.12Å; I68-L72 PolarHBondContact O-N 3.46Å
69	F	47.6	Very low	45.5	Very low	11 Å²	11	50 Å²	50	5%	0.048	28%	0.279	C	S	.	.	H	α-helix	trans	-67.3	-40.5	174.8	-171.7	-89	0	0	0	113.3	F65 I66 H67 L71 L72 C73 L85 L89 L104 L109	F65-F69 WeakPolarHBondContact O-CB 3.42Å; F65-F69 PolarHBondContact O-N 2.8Å; I66-F69 CarbonylContact O-C 3.58Å; I66-F69 WeakPolarHBondContact O-CB 3.3Å; I66-F69 PolarHBondContact O-N 3.42Å; H67-F69 PolarHBondContact O-N 2.62Å; F69-L71 PolarHBondContact O-N 2.96Å; F69-L72 PolarHBondContact O-N 3.3Å; F69-C73 HydrophobicContact CD1-CB 4.34Å; F69-C73 VanDerWaalsContact CD1-SG 3.53Å; F69-C73 HydrophobicContact CE1-CB 4.09Å; F69-C73 WeakPolarHBondContact CE1-SG 3.43Å; F69-C73 WeakPolarHBondContact CZ-SG 3.5Å; F69-C73 VanDerWaalsContact O-CB 3.24Å; F69-C73 WeakPolarHBondContact O-CB 3.23Å; F69-C73 PolarHBondContact O-N 3.49Å; F69-C73 PolarHBondContact O-SG 3.45Å; F69-L85 HydrophobicContact CD2-CB 4.29Å; F69-L85 HydrophobicContact CD2-CD2 3.85Å; F69-L85 HydrophobicContact CE2-CB 3.56Å; F69-L85 HydrophobicContact CE2-CD2 3.98Å; F69-L85 HydrophobicContact CE2-CG 4.22Å; F69-L85 WeakPolarHBondContact CE2-O 3.29Å; F69-L85 HydrophobicContact CZ-CB 4.37Å; F69-L89 HydrophobicContact CD1-CD1 4.31Å; F69-L89 HydrophobicContact CD1-CD2 3.82Å; F69-L89 HydrophobicContact CD1-CG 4.27Å; F69-L89 HydrophobicContact CD2-CD1 4.12Å; F69-L89 HydrophobicContact CD2-CD2 3.83Å; F69-L89 HydrophobicContact CD2-CG 3.65Å; F69-L89 HydrophobicContact CE1-CD1 3.51Å; F69-L89 HydrophobicContact CE1-CD2 3.86Å; F69-L89 HydrophobicContact CE1-CG 3.95Å; F69-L89 HydrophobicContact CE2-CD1 3.27Å; F69-L89 HydrophobicContact CE2-CD2 3.87Å; F69-L89 HydrophobicContact CE2-CG 3.27Å; F69-L89 HydrophobicContact CG-CD2 3.81Å; F69-L89 HydrophobicContact CG-CG 4.14Å; F69-L89 HydrophobicContact CZ-CD1 2.95Å; F69-L89 HydrophobicContact CZ-CD2 3.94Å; F69-L89 HydrophobicContact CZ-CG 3.49Å; F69-L89 VanDerWaalsContact CZ-CG 3.49Å; F69-L104 HydrophobicContact CD1-CD2 3.7Å; F69-L104 HydrophobicContact CE1-CD2 4.19Å; F69-L109 HydrophobicContact CE1-CD1 3.62Å; F69-L109 HydrophobicContact CE1-CD2 3.84Å; F69-L109 HydrophobicContact CE1-CG 4.38Å; F69-L109 HydrophobicContact CZ-CD1 4Å
70	Q	44.6	Very low	46.2	Very low	30 Å²	30	53 Å²	53	14%	0.14	29%	0.286	C	S	.	.	H	α-helix	trans	-57.3	-37.7	172.3	-76.6	179	-56.1	0	0	111.2	I66 H67 R103 L104 A107	I66-Q70 WeakPolarHBondContact O-CG 3.3Å; I66-Q70 PolarHBondContact O-N 3.34Å; H67-Q70 PolarHBondContact CE1-OE1 3Å; H67-Q70 PolarHBondContact ND1-OE1 3.47Å; H67-Q70 WeakPolarHBondContact O-CB 3.43Å; H67-Q70 PolarHBondContact O-N 2.65Å; Q70-R103 VanDerWaalsContact NE2-C 3.32Å; Q70-R103 PolarHBondContact NE2-O 2.9Å; Q70-L104 HydrophobicContact CG-CD2 4.02Å; Q70-A107 HydrophobicContact CB-CB 4.06Å; Q70-A107 HydrophobicContact CG-CB 3.77Å
71	L	44	Very low	46.9	Very low	36 Å²	36	50.5 Å²	50.5	19%	0.188	28%	0.278	C	S	.	.	H	α-helix	trans	-73	-36.7	176.5	-70.2	166.5	0	0	0	112.8	L12 V13 H67 I68 F69	L12-L71 HydrophobicContact CD2-CD2 4.26Å; V13-L71 HydrophobicContact CB-CD1 4.41Å; V13-L71 HydrophobicContact CG2-CD1 3.59Å; H67-L71 WeakPolarHBondContact O-CG 3.44Å; H67-L71 PolarHBondContact O-N 2.98Å; I68-L71 PolarHBondContact O-N 3.08Å; F69-L71 PolarHBondContact O-N 2.96Å
72	L	46	Very low	47.4	Very low	40 Å²	40	52.4 Å²	52.4	21%	0.209	29%	0.286	C	S	.	.	H	α-helix	trans	-79.4	-25.3	-179.6	-68.3	165.2	0	0	0	113.6	F9 W43 I68 F69 I74 L85	F9-L72 HydrophobicContact CD2-CD2 3.93Å; F9-L72 HydrophobicContact CD2-CG 4.33Å; F9-L72 HydrophobicContact CE2-CD1 4.48Å; F9-L72 HydrophobicContact CE2-CD2 4.27Å; F9-L72 HydrophobicContact CE2-CG 4.22Å; W43-L72 HydrophobicContact CH2-CD1 3.52Å; W43-L72 HydrophobicContact CH2-CD2 4.47Å; W43-L72 HydrophobicContact CZ2-CD1 3.99Å; W43-L72 HydrophobicContact CZ2-CD2 4.32Å; W43-L72 HydrophobicContact CZ3-CD1 4.47Å; I68-L72 HydrophobicContact CG2-CD1 3.72Å; I68-L72 VanDerWaalsContact O-CG 3.25Å; I68-L72 WeakPolarHBondContact O-CG 3.12Å; I68-L72 PolarHBondContact O-N 3.46Å; F69-L72 PolarHBondContact O-N 3.3Å; L72-I74 VanDerWaalsContact C-N 3.33Å; L72-I74 PolarHBondContact O-N 3.39Å; L72-L85 HydrophobicContact CB-CD1 4.3Å; L72-L85 HydrophobicContact CB-CD2 4.02Å; L72-L85 HydrophobicContact CD1-CD2 3.83Å
73	C	46.5	Very low	47.8	Very low	21 Å²	21	57.2 Å²	57.2	14%	0.142	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-0.5	-174.1	-83.5	0	0	0	0	116.3	F69 N75 L109	F69-C73 HydrophobicContact CD1-CB 4.34Å; F69-C73 VanDerWaalsContact CD1-SG 3.53Å; F69-C73 HydrophobicContact CE1-CB 4.09Å; F69-C73 WeakPolarHBondContact CE1-SG 3.43Å; F69-C73 WeakPolarHBondContact CZ-SG 3.5Å; F69-C73 VanDerWaalsContact O-CB 3.24Å; F69-C73 WeakPolarHBondContact O-CB 3.23Å; F69-C73 PolarHBondContact O-N 3.49Å; F69-C73 PolarHBondContact O-SG 3.45Å; C73-N75 PolarHBondContact O-N 2.84Å; C73-L109 HydrophobicContact CB-CD1 3.73Å; C73-L109 WeakPolarHBondContact SG-CD1 3.48Å
74	I	44.4	Very low	48.2	Very low	112 Å²	112	56.1 Å²	56.1	57%	0.574	30%	0.297	S	S	*	.	S	Bend	trans	-72.5	84.7	170.2	-51.3	178.7	0	0	0	107.7	L72	L72-I74 VanDerWaalsContact C-N 3.33Å; L72-I74 PolarHBondContact O-N 3.39Å
75	N	42.6	Very low	48.7	Very low	117 Å²	117	56.2 Å²	56.2	63%	0.626	30%	0.297	S	S	*	.			trans	68.9	46.6	157.8	-54.3	-36.3	0	0	0	118.6	C73 D77	C73-N75 PolarHBondContact O-N 2.84Å; N75-D77 PolarHBondContact O-N 2.78Å
76	S	50.2	Low	48.8	Very low	37 Å²	37	55.5 Å²	55.5	26%	0.259	30%	0.295	S	S	.	.			trans	-76.2	116.7	157.8	-175.7	0	0	0	0	110.1	D78 Q82	S76-D78 PolarHBondContact O-N 2.78Å; S76-D78 WeakPolarHBondContact OG-CB 3.05Å; S76-D78 PolarHBondContact OG-N 3.4Å; S76-Q82 PolarHBondContact O-NE2 3.31Å
77	D	54.6	Low	49	Very low	141 Å²	141	57 Å²	57	75%	0.754	31%	0.307	S	S	*	.			trans	-79.1	-1.2	168.7	-72.9	-33	0	0	0	112.9	N75 G79 K110	N75-D77 PolarHBondContact O-N 2.78Å; D77-G79 PolarHBondContact O-N 3.17Å; D77-K110 IonicContact OD1-NZ 2.65Å; D77-K110 PolarHBondContact OD1-NZ 3.26Å
78	D	56.1	Low	49.3	Very low	83 Å²	83	54 Å²	54	44%	0.444	29%	0.293	S	S	.	.			trans	-77.6	118.2	177	-168.1	-36.4	0	0	0	111.4	S76 F80 V81 Q82	S76-D78 PolarHBondContact O-N 2.78Å; S76-D78 WeakPolarHBondContact OG-CB 3.05Å; S76-D78 PolarHBondContact OG-N 3.4Å; D78-F80 VanDerWaalsContact C-N 3.29Å; D78-F80 PolarHBondContact O-N 3.29Å; D78-F80 VanDerWaalsContact OD1-CB 3.32Å; D78-F80 WeakPolarHBondContact OD1-CB 3.32Å; D78-F80 PolarHBondContact OD1-N 2.82Å; D78-V81 HydrophobicContact CB-CB 4.13Å; D78-V81 HydrophobicContact CB-CG2 3.89Å; D78-V81 PolarHBondContact O-N 3.09Å; D78-Q82 WeakPolarHBondContact O-CG 3.37Å; D78-Q82 PolarHBondContact O-N 3.3Å
79	G	50.7	Low	49.7	Very low	47 Å²	47	54 Å²	54	49%	0.485	29%	0.293	S	S	.	.	H	α-helix	trans	-64	-28.8	179.1	0	0	0	0	0	114.1	D77 H83	D77-G79 PolarHBondContact O-N 3.17Å; G79-H83 WeakPolarHBondContact O-CB 3.24Å; G79-H83 PolarHBondContact O-N 2.83Å
80	F	50.8	Low	49.9	Very low	128 Å²	128	57 Å²	57	56%	0.561	31%	0.308	S	S	*	.	H	α-helix	trans	-71.5	-45.7	176.7	-178.9	-103.6	0	0	0	111	D78 Q82 H83 Q84	D78-F80 VanDerWaalsContact C-N 3.29Å; D78-F80 PolarHBondContact O-N 3.29Å; D78-F80 VanDerWaalsContact OD1-CB 3.32Å; D78-F80 WeakPolarHBondContact OD1-CB 3.32Å; D78-F80 PolarHBondContact OD1-N 2.82Å; F80-Q82 VanDerWaalsContact C-N 3.34Å; F80-Q82 PolarHBondContact O-N 3.39Å; F80-H83 WeakPolarHBondContact O-CB 3.34Å; F80-H83 PolarHBondContact O-N 3.24Å; F80-H83 VanDerWaalsContact O-N 3.12Å; F80-Q84 HydrophobicContact CD1-CG 4.45Å; F80-Q84 HydrophobicContact CE1-CG 4.07Å; F80-Q84 HydrophobicContact CE2-CG 4.36Å; F80-Q84 VanDerWaalsContact CZ-CD 3.4Å; F80-Q84 HydrophobicContact CZ-CG 4.03Å; F80-Q84 PolarHBondContact O-N 2.98Å
81	V	52.3	Low	50.1	Low	38 Å²	38	57.9 Å²	57.9	23%	0.23	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-46.1	175.4	176.9	0	0	0	0	110	D78 H83 Q84 L85	D78-V81 HydrophobicContact CB-CB 4.13Å; D78-V81 HydrophobicContact CB-CG2 3.89Å; D78-V81 PolarHBondContact O-N 3.09Å; V81-H83 VanDerWaalsContact C-N 3.3Å; V81-H83 PolarHBondContact O-N 2.69Å; V81-Q84 PolarHBondContact O-N 3.33Å; V81-L85 HydrophobicContact CG1-CD1 3.65Å; V81-L85 HydrophobicContact CG1-CG 4.15Å; V81-L85 WeakPolarHBondContact O-CB 3.48Å; V81-L85 WeakPolarHBondContact O-CG 3.39Å; V81-L85 PolarHBondContact O-N 3.4Å
82	Q	51.4	Low	50.7	Low	61 Å²	61	56.7 Å²	56.7	29%	0.285	31%	0.308	S	S	.	.	H	α-helix	trans	-58.6	-39.4	174.9	-72.2	172.7	17.9	0	0	112.7	S76 D78 F80 T86 K110	S76-Q82 PolarHBondContact O-NE2 3.31Å; D78-Q82 WeakPolarHBondContact O-CG 3.37Å; D78-Q82 PolarHBondContact O-N 3.3Å; F80-Q82 VanDerWaalsContact C-N 3.34Å; F80-Q82 PolarHBondContact O-N 3.39Å; Q82-T86 WeakPolarHBondContact O-CB 3.06Å; Q82-T86 PolarHBondContact O-N 2.85Å; Q82-T86 PolarHBondContact O-OG1 2.74Å; Q82-K110 VanDerWaalsContact NE2-NZ 3.19Å
83	H	51.5	Low	51.5	Low	109 Å²	109	55 Å²	55	51%	0.505	30%	0.299	S	S	.	.	H	α-helix	trans	-68.2	-46.8	178.7	-178.5	76.4	0	0	0	112.8	G79 F80 V81 T86 S87	G79-H83 WeakPolarHBondContact O-CB 3.24Å; G79-H83 PolarHBondContact O-N 2.83Å; F80-H83 WeakPolarHBondContact O-CB 3.34Å; F80-H83 PolarHBondContact O-N 3.24Å; F80-H83 VanDerWaalsContact O-N 3.12Å; V81-H83 VanDerWaalsContact C-N 3.3Å; V81-H83 PolarHBondContact O-N 2.69Å; H83-T86 PolarHBondContact O-N 3.23Å; H83-S87 PolarHBondContact O-N 2.89Å; H83-S87 PolarHBondContact O-OG 3.47Å
84	Q	51	Low	52	Low	39 Å²	39	54.9 Å²	54.9	18%	0.182	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-43.6	177.1	-70.4	-170.3	-42.4	0	0	111.2	F80 V81 T86 S87 L88	F80-Q84 HydrophobicContact CD1-CG 4.45Å; F80-Q84 HydrophobicContact CE1-CG 4.07Å; F80-Q84 HydrophobicContact CE2-CG 4.36Å; F80-Q84 VanDerWaalsContact CZ-CD 3.4Å; F80-Q84 HydrophobicContact CZ-CG 4.03Å; F80-Q84 PolarHBondContact O-N 2.98Å; V81-Q84 PolarHBondContact O-N 3.33Å; Q84-T86 PolarHBondContact O-N 2.87Å; Q84-S87 CarbonylContact O-C 3.59Å; Q84-S87 WeakPolarHBondContact O-CB 3.18Å; Q84-S87 PolarHBondContact O-N 3.11Å; Q84-S87 VanDerWaalsContact O-N 3.1Å; Q84-L88 WeakPolarHBondContact O-CG 3.32Å; Q84-L88 PolarHBondContact O-N 2.85Å
85	L	52	Low	52.8	Low	9 Å²	9	52.6 Å²	52.6	5%	0.047	28%	0.282	C	S	.	.	H	α-helix	trans	-58.3	-45.4	173.4	-79	-179.2	0	0	0	111.8	F69 L72 V81 S87 L88 L89	F69-L85 HydrophobicContact CD2-CB 4.29Å; F69-L85 HydrophobicContact CD2-CD2 3.85Å; F69-L85 HydrophobicContact CE2-CB 3.56Å; F69-L85 HydrophobicContact CE2-CD2 3.98Å; F69-L85 HydrophobicContact CE2-CG 4.22Å; F69-L85 WeakPolarHBondContact CE2-O 3.29Å; F69-L85 HydrophobicContact CZ-CB 4.37Å; L72-L85 HydrophobicContact CB-CD1 4.3Å; L72-L85 HydrophobicContact CB-CD2 4.02Å; L72-L85 HydrophobicContact CD1-CD2 3.83Å; V81-L85 HydrophobicContact CG1-CD1 3.65Å; V81-L85 HydrophobicContact CG1-CG 4.15Å; V81-L85 WeakPolarHBondContact O-CB 3.48Å; V81-L85 WeakPolarHBondContact O-CG 3.39Å; V81-L85 PolarHBondContact O-N 3.4Å; L85-S87 VanDerWaalsContact C-N 3.29Å; L85-S87 PolarHBondContact O-N 3.4Å; L85-L88 PolarHBondContact O-N 3.4Å; L85-L89 WeakPolarHBondContact O-CG 3.19Å; L85-L89 PolarHBondContact O-N 3.17Å
86	T	51.9	Low	53.8	Low	14 Å²	14	47.2 Å²	47.2	9%	0.086	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-39.5	174.5	-56.9	0	0	0	0	111.6	Q82 H83 Q84 L89 M90 K116	Q82-T86 WeakPolarHBondContact O-CB 3.06Å; Q82-T86 PolarHBondContact O-N 2.85Å; Q82-T86 PolarHBondContact O-OG1 2.74Å; H83-T86 PolarHBondContact O-N 3.23Å; Q84-T86 PolarHBondContact O-N 2.87Å; T86-L89 WeakPolarHBondContact O-CB 3.39Å; T86-L89 PolarHBondContact O-N 3.47Å; T86-M90 WeakPolarHBondContact O-CG 3.49Å; T86-M90 PolarHBondContact O-N 2.8Å; T86-M90 VanDerWaalsContact O-N 3.08Å; T86-K116 HydrophobicContact CG2-CD 3.91Å
87	S	51.1	Low	54.6	Low	38 Å²	38	46.8 Å²	46.8	27%	0.266	25%	0.248	S	C	.	.	H	α-helix	trans	-69.2	-32.6	178.5	-56.8	0	0	0	0	112.5	H83 Q84 L85 M90	H83-S87 PolarHBondContact O-N 2.89Å; H83-S87 PolarHBondContact O-OG 3.47Å; Q84-S87 CarbonylContact O-C 3.59Å; Q84-S87 WeakPolarHBondContact O-CB 3.18Å; Q84-S87 PolarHBondContact O-N 3.11Å; Q84-S87 VanDerWaalsContact O-N 3.1Å; L85-S87 VanDerWaalsContact C-N 3.29Å; L85-S87 PolarHBondContact O-N 3.4Å; S87-M90 VanDerWaalsContact O-CB 3.27Å; S87-M90 WeakPolarHBondContact O-CB 3.39Å; S87-M90 PolarHBondContact O-N 3.44Å
88	L	50.1	Low	55.3	Low	18 Å²	18	40.1 Å²	40.1	9%	0.094	21%	0.213	C	C	.	.	H	α-helix	trans	-70.1	-42.4	172	-73.1	167.4	0	0	0	111.4	W43 L49 Q84 L85 M90 I91	W43-L88 HydrophobicContact CD2-CD1 4.47Å; W43-L88 HydrophobicContact CE3-CD1 3.76Å; W43-L88 HydrophobicContact CZ3-CD1 4.03Å; L49-L88 HydrophobicContact CD1-CD2 3.35Å; Q84-L88 WeakPolarHBondContact O-CG 3.32Å; Q84-L88 PolarHBondContact O-N 2.85Å; L85-L88 PolarHBondContact O-N 3.4Å; L88-M90 PolarHBondContact O-N 2.96Å; L88-I91 HydrophobicContact CD2-CD1 4.26Å; L88-I91 WeakPolarHBondContact O-CB 3.39Å; L88-I91 PolarHBondContact O-N 3.45Å
89	L	53.5	Low	56.1	Low	5 Å²	5	42.9 Å²	42.9	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-57.9	-32.3	172.8	-80	171.4	0	0	0	112.8	F69 L85 T86 I91 S92 I93 V113 L117	F69-L89 HydrophobicContact CD1-CD1 4.31Å; F69-L89 HydrophobicContact CD1-CD2 3.82Å; F69-L89 HydrophobicContact CD1-CG 4.27Å; F69-L89 HydrophobicContact CD2-CD1 4.12Å; F69-L89 HydrophobicContact CD2-CD2 3.83Å; F69-L89 HydrophobicContact CD2-CG 3.65Å; F69-L89 HydrophobicContact CE1-CD1 3.51Å; F69-L89 HydrophobicContact CE1-CD2 3.86Å; F69-L89 HydrophobicContact CE1-CG 3.95Å; F69-L89 HydrophobicContact CE2-CD1 3.27Å; F69-L89 HydrophobicContact CE2-CD2 3.87Å; F69-L89 HydrophobicContact CE2-CG 3.27Å; F69-L89 HydrophobicContact CG-CD2 3.81Å; F69-L89 HydrophobicContact CG-CG 4.14Å; F69-L89 HydrophobicContact CZ-CD1 2.95Å; F69-L89 HydrophobicContact CZ-CD2 3.94Å; F69-L89 HydrophobicContact CZ-CG 3.49Å; F69-L89 VanDerWaalsContact CZ-CG 3.49Å; L85-L89 WeakPolarHBondContact O-CG 3.19Å; L85-L89 PolarHBondContact O-N 3.17Å; T86-L89 WeakPolarHBondContact O-CB 3.39Å; T86-L89 PolarHBondContact O-N 3.47Å; L89-I91 PolarHBondContact O-N 3.29Å; L89-S92 WeakPolarHBondContact CA-OG 3.44Å; L89-S92 CarbonylContact O-C 3.28Å; L89-S92 WeakPolarHBondContact O-CA 3.46Å; L89-S92 PolarHBondContact O-N 3.24Å; L89-S92 PolarHBondContact O-OG 3.39Å; L89-I93 PolarHBondContact O-N 3.32Å; L89-V113 HydrophobicContact CD1-CG1 4.22Å; L89-L117 HydrophobicContact CB-CD2 3.62Å; L89-L117 HydrophobicContact CD1-CD1 3.68Å; L89-L117 HydrophobicContact CD1-CD2 3.59Å; L89-L117 HydrophobicContact CD1-CG 3.81Å; L89-L117 HydrophobicContact CD2-CD1 4.37Å; L89-L117 HydrophobicContact CD2-CD2 4.2Å; L89-L117 HydrophobicContact CG-CD2 4.02Å
90	M	51.8	Low	57	Low	75 Å²	75	41.7 Å²	41.7	37%	0.369	20%	0.203	S	C	.	.	H	α-helix	trans	-54.2	-38.9	176.1	-69.4	-67.9	-55.5	0	0	111.9	T86 S87 L88 S92 I93 L120	T86-M90 WeakPolarHBondContact O-CG 3.49Å; T86-M90 PolarHBondContact O-N 2.8Å; T86-M90 VanDerWaalsContact O-N 3.08Å; S87-M90 VanDerWaalsContact O-CB 3.27Å; S87-M90 WeakPolarHBondContact O-CB 3.39Å; S87-M90 PolarHBondContact O-N 3.44Å; L88-M90 PolarHBondContact O-N 2.96Å; M90-S92 VanDerWaalsContact C-N 3.29Å; M90-S92 PolarHBondContact O-N 3Å; M90-I93 HydrophobicContact CB-CD1 4.18Å; M90-I93 HydrophobicContact CE-CD1 3.55Å; M90-I93 HydrophobicContact CG-CD1 4.44Å; M90-I93 WeakPolarHBondContact O-CB 3.5Å; M90-I93 WeakPolarHBondContact O-CD1 3.36Å; M90-I93 WeakPolarHBondContact O-CG1 3.24Å; M90-I93 PolarHBondContact O-N 3.15Å; M90-I93 HydrophobicContact SD-CD1 3.51Å; M90-I93 VanDerWaalsContact SD-CD1 3.51Å; M90-L120 HydrophobicContact CE-CB 4.49Å; M90-L120 HydrophobicContact CE-CD1 4.45Å; M90-L120 HydrophobicContact CE-CD2 3.87Å; M90-L120 HydrophobicContact CE-CG 4.48Å; M90-L120 HydrophobicContact SD-CB 4.14Å; M90-L120 HydrophobicContact SD-CD1 3.22Å; M90-L120 WeakPolarHBondContact SD-CD1 3.35Å; M90-L120 HydrophobicContact SD-CD2 3.66Å; M90-L120 HydrophobicContact SD-CG 3.84Å
91	I	50.1	Low	58	Low	48 Å²	48	35.6 Å²	35.6	25%	0.246	18%	0.176	C	C	.	.	H	α-helix	trans	-64.2	-40.8	178.6	-51.4	172	0	0	0	109.4	P46 L49 L88 L89 I93 P94 W95	P46-I91 HydrophobicContact CB-CD1 3.47Å; P46-I91 VanDerWaalsContact CB-CD1 3.47Å; P46-I91 HydrophobicContact CB-CG1 3.87Å; P46-I91 HydrophobicContact CG-CD1 3.97Å; P46-I91 HydrophobicContact CG-CG1 4.3Å; L49-I91 HydrophobicContact CD1-CD1 4.33Å; L88-I91 HydrophobicContact CD2-CD1 4.26Å; L88-I91 WeakPolarHBondContact O-CB 3.39Å; L88-I91 PolarHBondContact O-N 3.45Å; L89-I91 PolarHBondContact O-N 3.29Å; I91-I93 VanDerWaalsContact C-N 3.26Å; I91-I93 PolarHBondContact O-N 3.22Å; I91-P94 VanDerWaalsContact O-CD 3.23Å; I91-P94 WeakPolarHBondContact O-CD 3.31Å; I91-W95 VanDerWaalsContact O-CZ3 3.26Å; I91-W95 WeakPolarHBondContact O-CZ3 3.33Å
92	S	56.6	Low	59.1	Low	11 Å²	11	35.9 Å²	35.9	8%	0.077	18%	0.176	C	C	.	.	H	α-helix	trans	-77.2	-4.8	-178.8	70.9	0	0	0	0	114.9	L89 M90 P94 W95 L96	L89-S92 WeakPolarHBondContact CA-OG 3.44Å; L89-S92 CarbonylContact O-C 3.28Å; L89-S92 WeakPolarHBondContact O-CA 3.46Å; L89-S92 PolarHBondContact O-N 3.24Å; L89-S92 PolarHBondContact O-OG 3.39Å; M90-S92 VanDerWaalsContact C-N 3.29Å; M90-S92 PolarHBondContact O-N 3Å; S92-P94 VanDerWaalsContact C-CD 3.45Å; S92-W95 PolarHBondContact O-N 2.74Å; S92-L96 PolarHBondContact O-N 3.03Å
93	I	61.5	Low	60	Low	4 Å²	4	40 Å²	40	2%	0.021	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-52.3	-45.6	-176.3	-76.1	169.5	0	0	0	113.5	L89 M90 I91 W95 L96 L120 K121 A124	L89-I93 PolarHBondContact O-N 3.32Å; M90-I93 HydrophobicContact CB-CD1 4.18Å; M90-I93 HydrophobicContact CE-CD1 3.55Å; M90-I93 HydrophobicContact CG-CD1 4.44Å; M90-I93 WeakPolarHBondContact O-CB 3.5Å; M90-I93 WeakPolarHBondContact O-CD1 3.36Å; M90-I93 WeakPolarHBondContact O-CG1 3.24Å; M90-I93 PolarHBondContact O-N 3.15Å; M90-I93 HydrophobicContact SD-CD1 3.51Å; M90-I93 VanDerWaalsContact SD-CD1 3.51Å; I91-I93 VanDerWaalsContact C-N 3.26Å; I91-I93 PolarHBondContact O-N 3.22Å; I93-W95 PolarHBondContact O-N 2.97Å; I93-L96 WeakPolarHBondContact O-CB 3.46Å; I93-L96 PolarHBondContact O-N 2.89Å; I93-L120 HydrophobicContact CD1-CB 3.42Å; I93-L120 VanDerWaalsContact CD1-CB 3.42Å; I93-L120 HydrophobicContact CD1-CD1 4.37Å; I93-L120 HydrophobicContact CD1-CG 4.43Å; I93-L120 HydrophobicContact CG1-CB 4.39Å; I93-K121 VanDerWaalsContact CG2-CA 3.48Å; I93-K121 HydrophobicContact CG2-CB 4.08Å; I93-K121 HydrophobicContact CG2-CD 4.05Å; I93-K121 WeakPolarHBondContact O-CD 3.49Å; I93-K121 PolarHBondContact O-NZ 3.03Å; I93-A124 HydrophobicContact CG2-CB 3.61Å
94	P	58.1	Low	60.9	Low	18 Å²	18	34.9 Å²	34.9	12%	0.117	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-54.6	-30.3	-178.5	-27.8	37	0	0	0	113	I91 S92 K121	I91-P94 VanDerWaalsContact O-CD 3.23Å; I91-P94 WeakPolarHBondContact O-CD 3.31Å; S92-P94 VanDerWaalsContact C-CD 3.45Å; P94-K121 PolarHBondContact O-NZ 3.03Å
95	W	59.8	Low	61.9	Low	64 Å²	64	36.2 Å²	36.2	24%	0.242	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-94.7	-3.2	-179.6	-58.7	-86.1	0	0	0	114.6	P62 I91 S92 I93 D97 I100	P62-W95 HydrophobicContact CB-CB 3.81Å; P62-W95 HydrophobicContact CB-CD2 3.71Å; P62-W95 HydrophobicContact CB-CE3 4.03Å; P62-W95 HydrophobicContact CB-CG 3.6Å; P62-W95 HydrophobicContact CG-CB 4.42Å; P62-W95 HydrophobicContact CG-CD2 3.46Å; P62-W95 VanDerWaalsContact CG-CD2 3.46Å; P62-W95 HydrophobicContact CG-CE3 3.95Å; P62-W95 HydrophobicContact CG-CG 3.67Å; P62-W95 HydrophobicContact CG-CH2 4.49Å; P62-W95 HydrophobicContact CG-CZ2 4.08Å; P62-W95 HydrophobicContact CG-CZ3 4.42Å; I91-W95 VanDerWaalsContact O-CZ3 3.26Å; I91-W95 WeakPolarHBondContact O-CZ3 3.33Å; S92-W95 PolarHBondContact O-N 2.74Å; I93-W95 PolarHBondContact O-N 2.97Å; W95-D97 PolarHBondContact O-N 3.4Å; W95-I100 WeakPolarHBondContact O-CD1 3.29Å
96	L	64.1	Low	62.8	Low	5 Å²	5	43.1 Å²	43.1	3%	0.026	20%	0.203	C	C	.	.			trans	-67.6	103.1	177.4	-178.5	65	0	0	0	110.1	S92 I93 I100 F101 L104 L117 K121 F152	S92-L96 PolarHBondContact O-N 3.03Å; I93-L96 WeakPolarHBondContact O-CB 3.46Å; I93-L96 PolarHBondContact O-N 2.89Å; L96-I100 HydrophobicContact CD1-CB 4.16Å; L96-I100 HydrophobicContact CD1-CG2 3.5Å; L96-I100 VanDerWaalsContact CD1-CG2 3.5Å; L96-F101 HydrophobicContact CD1-CB 4.07Å; L96-F101 HydrophobicContact CD1-CD2 4.28Å; L96-F101 HydrophobicContact CD2-CD2 4.27Å; L96-L104 HydrophobicContact CD1-CD1 4.08Å; L96-L117 HydrophobicContact CD2-CB 4.12Å; L96-K121 HydrophobicContact CB-CD 4.21Å; L96-K121 HydrophobicContact CD2-CB 4.02Å; L96-K121 WeakPolarHBondContact O-CD 3.41Å; L96-K121 WeakPolarHBondContact O-CE 3.37Å; L96-K121 PolarHBondContact O-NZ 3.33Å; L96-K121 VanDerWaalsContact O-NZ 3.12Å; L96-F152 HydrophobicContact CD2-CE2 4.1Å; L96-F152 HydrophobicContact CG-CE2 4.17Å
97	D	67.9	Low	63.5	Low	27 Å²	27	44 Å²	44	14%	0.144	21%	0.212	C	C	.	.			trans	-103.6	178.8	170.8	72.3	6.8	0	0	0	111.6	W95 K99 I100 F101 A149	W95-D97 PolarHBondContact O-N 3.4Å; D97-K99 VanDerWaalsContact C-N 3.33Å; D97-K99 PolarHBondContact O-N 2.96Å; D97-K99 WeakPolarHBondContact OD1-CB 3.35Å; D97-K99 PolarHBondContact OD1-N 3.45Å; D97-K99 VanDerWaalsContact OD1-N 3.14Å; D97-I100 PolarHBondContact O-N 3.34Å; D97-I100 WeakPolarHBondContact OD1-CB 3.48Å; D97-I100 WeakPolarHBondContact OD1-CG1 3.05Å; D97-I100 PolarHBondContact OD1-N 2.88Å; D97-F101 VanDerWaalsContact O-CB 3.26Å; D97-F101 WeakPolarHBondContact O-CB 3.44Å; D97-F101 PolarHBondContact O-N 3.32Å; D97-A149 HydrophobicContact CB-CB 3.61Å
98	G	68.6	Low	64.3	Low	1 Å²	1	44.5 Å²	44.5	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-34.4	179.5	0	0	0	0	0	113.6	N102 D151	G98-N102 WeakPolarHBondContact O-CB 3.37Å; G98-N102 PolarHBondContact O-N 3.23Å; G98-N102 PolarHBondContact O-ND2 3.32Å; G98-D151 VanDerWaalsContact CA-CG 3.41Å; G98-D151 VanDerWaalsContact CA-OD2 3.29Å; G98-D151 WeakPolarHBondContact CA-OD2 3.42Å; G98-D151 VanDerWaalsContact N-CG 3.25Å; G98-D151 PolarHBondContact N-OD1 2.88Å; G98-D151 PolarHBondContact N-OD2 2.6Å
99	K	72.8	Confident	65.1	Low	142 Å²	142	44.3 Å²	44.3	62%	0.617	22%	0.222	S	C	*	.	H	α-helix	trans	-63.6	-50.3	175.2	-69.7	175.3	-173.5	173.5	0	111.7	D97 N102 R103 D151	D97-K99 VanDerWaalsContact C-N 3.33Å; D97-K99 PolarHBondContact O-N 2.96Å; D97-K99 WeakPolarHBondContact OD1-CB 3.35Å; D97-K99 PolarHBondContact OD1-N 3.45Å; D97-K99 VanDerWaalsContact OD1-N 3.14Å; K99-N102 PolarHBondContact O-N 3.34Å; K99-R103 WeakPolarHBondContact O-CB 3.31Å; K99-R103 WeakPolarHBondContact O-CG 3.25Å; K99-R103 PolarHBondContact O-N 3.45Å; K99-D151 PolarHBondContact N-OD2 3.15Å
100	I	69.5	Low	66	Low	22 Å²	22	47.8 Å²	47.8	11%	0.113	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-45.4	177.7	-73	163.2	0	0	0	109.9	I66 W95 L96 D97 N102 R103 L104	I66-I100 HydrophobicContact CD1-CB 4.24Å; I66-I100 HydrophobicContact CD1-CD1 3.6Å; I66-I100 HydrophobicContact CD1-CG1 3.89Å; I66-I100 HydrophobicContact CD1-CG2 3.34Å; I66-I100 HydrophobicContact CG1-CG2 3.95Å; I66-I100 HydrophobicContact CG2-CG2 3.92Å; W95-I100 WeakPolarHBondContact O-CD1 3.29Å; L96-I100 HydrophobicContact CD1-CB 4.16Å; L96-I100 HydrophobicContact CD1-CG2 3.5Å; L96-I100 VanDerWaalsContact CD1-CG2 3.5Å; D97-I100 PolarHBondContact O-N 3.34Å; D97-I100 WeakPolarHBondContact OD1-CB 3.48Å; D97-I100 WeakPolarHBondContact OD1-CG1 3.05Å; D97-I100 PolarHBondContact OD1-N 2.88Å; I100-N102 VanDerWaalsContact C-N 3.31Å; I100-N102 PolarHBondContact O-N 3.33Å; I100-R103 WeakPolarHBondContact O-CB 3.24Å; I100-R103 PolarHBondContact O-N 3.26Å; I100-R103 VanDerWaalsContact O-N 3.12Å; I100-L104 HydrophobicContact CG2-CD1 4.14Å; I100-L104 HydrophobicContact CG2-CG 4.45Å; I100-L104 WeakPolarHBondContact O-CG 3.45Å; I100-L104 PolarHBondContact O-N 3.45Å
101	F	72.6	Confident	67.4	Low	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.9	-45	177.5	-171.2	-98	0	0	0	112	L96 D97 L104 R105 L114 A118 F152 A155 L156 L159	L96-F101 HydrophobicContact CD1-CB 4.07Å; L96-F101 HydrophobicContact CD1-CD2 4.28Å; L96-F101 HydrophobicContact CD2-CD2 4.27Å; D97-F101 VanDerWaalsContact O-CB 3.26Å; D97-F101 WeakPolarHBondContact O-CB 3.44Å; D97-F101 PolarHBondContact O-N 3.32Å; F101-L104 PolarHBondContact O-N 3.12Å; F101-R105 WeakPolarHBondContact O-CB 3.25Å; F101-R105 PolarHBondContact O-N 3.08Å; F101-L114 HydrophobicContact CD2-CD2 4.36Å; F101-L114 HydrophobicContact CE2-CB 4.18Å; F101-L114 HydrophobicContact CE2-CD2 4.02Å; F101-L114 WeakPolarHBondContact CE2-O 3.17Å; F101-L114 HydrophobicContact CZ-CB 4.02Å; F101-L114 HydrophobicContact CZ-CD2 4.2Å; F101-A118 HydrophobicContact CE2-CB 3.87Å; F101-A118 HydrophobicContact CZ-CB 4.19Å; F101-F152 HydrophobicContact CB-CD2 4.2Å; F101-F152 HydrophobicContact CB-CE2 4.14Å; F101-F152 AromaticContact CD2-CE2 3.7Å; F101-F152 HydrophobicContact CD2-CE2 3.7Å; F101-F152 HydrophobicContact CD2-CZ 4.48Å; F101-F152 HydrophobicContact CE2-CE2 4.22Å; F101-F152 HydrophobicContact CG-CD2 4.39Å; F101-F152 AromaticContact CG-CE2 3.93Å; F101-F152 HydrophobicContact CG-CE2 3.93Å; F101-A155 HydrophobicContact CB-CB 4.39Å; F101-A155 HydrophobicContact CD1-CB 3.81Å; F101-L156 HydrophobicContact CZ-CD1 4.45Å; F101-L159 HydrophobicContact CE1-CB 4.08Å; F101-L159 HydrophobicContact CE1-CD2 3.78Å; F101-L159 HydrophobicContact CZ-CD2 3.5Å
102	N	74.6	Confident	68.7	Low	43 Å²	43	46.4 Å²	46.4	23%	0.23	24%	0.237	C	C	.	.	H	α-helix	trans	-66	-37.3	175.4	-82.7	-39.7	0	0	0	112.8	G98 K99 I100 R105 M106 A155	G98-N102 WeakPolarHBondContact O-CB 3.37Å; G98-N102 PolarHBondContact O-N 3.23Å; G98-N102 PolarHBondContact O-ND2 3.32Å; K99-N102 PolarHBondContact O-N 3.34Å; I100-N102 VanDerWaalsContact C-N 3.31Å; I100-N102 PolarHBondContact O-N 3.33Å; N102-R105 WeakPolarHBondContact O-CB 3.33Å; N102-R105 PolarHBondContact O-N 3.08Å; N102-R105 VanDerWaalsContact OD1-CZ 3.26Å; N102-R105 PolarHBondContact OD1-NH2 3.47Å; N102-M106 WeakPolarHBondContact O-CB 3.3Å; N102-M106 VanDerWaalsContact O-CG 3.28Å; N102-M106 WeakPolarHBondContact O-CG 3.38Å; N102-M106 PolarHBondContact O-N 2.82Å; N102-A155 WeakPolarHBondContact ND2-CB 3.23Å
103	R	71.8	Confident	69.5	Low	147 Å²	147	46.8 Å²	46.8	56%	0.555	24%	0.239	S	C	*	.	H	α-helix	trans	-62.2	-43.4	174	-78.3	177.7	178.8	-169	-1.1	111.7	Q70 K99 I100 R105 M106 A107	Q70-R103 VanDerWaalsContact NE2-C 3.32Å; Q70-R103 PolarHBondContact NE2-O 2.9Å; K99-R103 WeakPolarHBondContact O-CB 3.31Å; K99-R103 WeakPolarHBondContact O-CG 3.25Å; K99-R103 PolarHBondContact O-N 3.45Å; I100-R103 WeakPolarHBondContact O-CB 3.24Å; I100-R103 PolarHBondContact O-N 3.26Å; I100-R103 VanDerWaalsContact O-N 3.12Å; R103-R105 VanDerWaalsContact C-N 3.34Å; R103-M106 PolarHBondContact O-N 3.45Å; R103-A107 WeakPolarHBondContact O-CB 3.41Å; R103-A107 PolarHBondContact O-N 2.87Å
104	L	68.8	Low	70.2	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-63	-41.3	174.1	-70.3	173.1	0	0	0	111.5	I66 F69 Q70 L96 I100 F101 A107 L109 L114 L117	I66-L104 HydrophobicContact CG2-CD2 4.01Å; I66-L104 HydrophobicContact CG2-CG 4.28Å; F69-L104 HydrophobicContact CD1-CD2 3.7Å; F69-L104 HydrophobicContact CE1-CD2 4.19Å; Q70-L104 HydrophobicContact CG-CD2 4.02Å; L96-L104 HydrophobicContact CD1-CD1 4.08Å; I100-L104 HydrophobicContact CG2-CD1 4.14Å; I100-L104 HydrophobicContact CG2-CG 4.45Å; I100-L104 WeakPolarHBondContact O-CG 3.45Å; I100-L104 PolarHBondContact O-N 3.45Å; F101-L104 PolarHBondContact O-N 3.12Å; L104-A107 PolarHBondContact O-N 3.41Å; L104-L109 HydrophobicContact CB-CD2 4.15Å; L104-L109 VanDerWaalsContact O-CB 3.26Å; L104-L109 WeakPolarHBondContact O-CB 3.47Å; L104-L109 PolarHBondContact O-N 2.96Å; L104-L114 HydrophobicContact CB-CD2 4Å; L104-L117 HydrophobicContact CD1-CD1 3.86Å
105	R	72	Confident	71.3	Confident	68 Å²	68	46.1 Å²	46.1	26%	0.257	23%	0.234	S	C	.	.	H	α-helix	trans	-62	-49.3	175	-174.8	-175.9	72.4	173.8	-0.4	112.4	F101 N102 R103 A107 G108 L114 D158	F101-R105 WeakPolarHBondContact O-CB 3.25Å; F101-R105 PolarHBondContact O-N 3.08Å; N102-R105 WeakPolarHBondContact O-CB 3.33Å; N102-R105 PolarHBondContact O-N 3.08Å; N102-R105 VanDerWaalsContact OD1-CZ 3.26Å; N102-R105 PolarHBondContact OD1-NH2 3.47Å; R103-R105 VanDerWaalsContact C-N 3.34Å; R105-A107 PolarHBondContact O-N 3.41Å; R105-G108 PolarHBondContact O-N 3.02Å; R105-L114 HydrophobicContact CB-CD1 3.95Å; R105-L114 HydrophobicContact CB-CD2 4.31Å; R105-L114 HydrophobicContact CG-CD1 3.97Å; R105-D158 VanDerWaalsContact NH1-CB 3.29Å
106	M	72.2	Confident	72.1	Confident	153 Å²	153	47.8 Å²	47.8	75%	0.754	24%	0.243	S	C	*	.	H	α-helix	trans	-65.4	-25.8	179	-69.6	-59.3	-62.3	0	0	112.7	N102 R103 G108	N102-M106 WeakPolarHBondContact O-CB 3.3Å; N102-M106 VanDerWaalsContact O-CG 3.28Å; N102-M106 WeakPolarHBondContact O-CG 3.38Å; N102-M106 PolarHBondContact O-N 2.82Å; R103-M106 PolarHBondContact O-N 3.45Å; M106-G108 PolarHBondContact O-N 3.46Å
107	A	66.1	Low	72.6	Confident	33 Å²	33	47.7 Å²	47.7	27%	0.273	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-1.7	173.6	0	0	0	0	0	113.9	Q70 R103 L104 R105	Q70-A107 HydrophobicContact CB-CB 4.06Å; Q70-A107 HydrophobicContact CG-CB 3.77Å; R103-A107 WeakPolarHBondContact O-CB 3.41Å; R103-A107 PolarHBondContact O-N 2.87Å; L104-A107 PolarHBondContact O-N 3.41Å; R105-A107 PolarHBondContact O-N 3.41Å
108	G	67.7	Low	73.1	Confident	48 Å²	48	46.4 Å²	46.4	50%	0.495	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	19.9	176.9	0	0	0	0	0	114.3	R105 M106 K110	R105-G108 PolarHBondContact O-N 3.02Å; M106-G108 PolarHBondContact O-N 3.46Å; G108-K110 PolarHBondContact O-N 3.04Å
109	L	66.3	Low	73.5	Confident	14 Å²	14	48.7 Å²	48.7	7%	0.073	25%	0.248	C	C	.	.			trans	-58.5	133.7	174.3	-170.3	61.1	0	0	0	110.6	F69 C73 L104 V111 V113 L114 L117	F69-L109 HydrophobicContact CE1-CD1 3.62Å; F69-L109 HydrophobicContact CE1-CD2 3.84Å; F69-L109 HydrophobicContact CE1-CG 4.38Å; F69-L109 HydrophobicContact CZ-CD1 4Å; C73-L109 HydrophobicContact CB-CD1 3.73Å; C73-L109 WeakPolarHBondContact SG-CD1 3.48Å; L104-L109 HydrophobicContact CB-CD2 4.15Å; L104-L109 VanDerWaalsContact O-CB 3.26Å; L104-L109 WeakPolarHBondContact O-CB 3.47Å; L104-L109 PolarHBondContact O-N 2.96Å; L109-V111 PolarHBondContact O-N 3.39Å; L109-V113 HydrophobicContact CD1-CB 4.05Å; L109-V113 HydrophobicContact CD1-CG1 3.9Å; L109-V113 HydrophobicContact CD2-CB 4.21Å; L109-V113 HydrophobicContact CD2-CG1 3.83Å; L109-V113 HydrophobicContact CG-CB 3.95Å; L109-V113 HydrophobicContact CG-CG1 4.01Å; L109-L114 HydrophobicContact CB-CD1 4.46Å; L109-L114 HydrophobicContact CB-CD2 4.23Å; L109-L114 HydrophobicContact CB-CG 4.12Å; L109-L114 HydrophobicContact CD2-CD2 3.76Å; L109-L114 HydrophobicContact CD2-CG 3.98Å; L109-L114 HydrophobicContact CG-CD2 4.36Å; L109-L114 HydrophobicContact CG-CG 4.15Å; L109-L114 WeakPolarHBondContact O-CD1 3.3Å; L109-L117 HydrophobicContact CD2-CD1 3.78Å
110	K	72.7	Confident	73.4	Confident	79 Å²	79	43.1 Å²	43.1	34%	0.343	23%	0.225	S	C	.	.			trans	-54.1	137.5	179.1	-68.9	-177	179.7	173.5	0	110.1	D77 Q82 G108 S112 V113 L114	D77-K110 IonicContact OD1-NZ 2.65Å; D77-K110 PolarHBondContact OD1-NZ 3.26Å; Q82-K110 VanDerWaalsContact NE2-NZ 3.19Å; G108-K110 PolarHBondContact O-N 3.04Å; K110-S112 PolarHBondContact O-N 3.18Å; K110-V113 HydrophobicContact CB-CG2 4.15Å; K110-V113 WeakPolarHBondContact O-CB 3.43Å; K110-V113 PolarHBondContact O-N 3.31Å; K110-L114 PolarHBondContact O-N 2.75Å; K110-L114 VanDerWaalsContact O-N 3.08Å
111	V	81.8	Confident	73.5	Confident	31 Å²	31	42.1 Å²	42.1	19%	0.188	22%	0.22	C	C	.	.	H	α-helix	trans	-52.1	-43.7	-179.7	170.4	0	0	0	0	111.9	L109 V113 L114 L115 I163 D173	L109-V111 PolarHBondContact O-N 3.39Å; V111-V113 VanDerWaalsContact C-N 3.27Å; V111-V113 PolarHBondContact O-N 3.31Å; V111-L114 PolarHBondContact O-N 3.07Å; V111-L115 HydrophobicContact CG1-CD1 3.91Å; V111-L115 HydrophobicContact CG1-CG 4.26Å; V111-L115 WeakPolarHBondContact O-CG 3.34Å; V111-L115 PolarHBondContact O-N 3.21Å; V111-I163 HydrophobicContact CG1-CD1 3.61Å; V111-I163 HydrophobicContact CG1-CG1 3.65Å; V111-D173 HydrophobicContact CG1-CB 3.87Å
112	S	77.1	Confident	73.3	Confident	63 Å²	63	42.3 Å²	42.3	44%	0.441	22%	0.22	S	C	.	.	H	α-helix	trans	-58.4	-37.2	177.8	57.6	0	0	0	0	113	K110 K116 D173	K110-S112 PolarHBondContact O-N 3.18Å; S112-K116 WeakPolarHBondContact O-CB 3.31Å; S112-K116 PolarHBondContact O-N 2.82Å; S112-D173 PolarHBondContact N-OD1 3Å
113	V	72.5	Confident	72.9	Confident	18 Å²	18	45 Å²	45	11%	0.109	23%	0.231	C	C	.	.	H	α-helix	trans	-73.5	-41.3	177.3	-175.1	0	0	0	0	110.6	L89 L109 K110 V111 L115 K116 L117	L89-V113 HydrophobicContact CD1-CG1 4.22Å; L109-V113 HydrophobicContact CD1-CB 4.05Å; L109-V113 HydrophobicContact CD1-CG1 3.9Å; L109-V113 HydrophobicContact CD2-CB 4.21Å; L109-V113 HydrophobicContact CD2-CG1 3.83Å; L109-V113 HydrophobicContact CG-CB 3.95Å; L109-V113 HydrophobicContact CG-CG1 4.01Å; K110-V113 HydrophobicContact CB-CG2 4.15Å; K110-V113 WeakPolarHBondContact O-CB 3.43Å; K110-V113 PolarHBondContact O-N 3.31Å; V111-V113 VanDerWaalsContact C-N 3.27Å; V111-V113 PolarHBondContact O-N 3.31Å; V113-L115 PolarHBondContact O-N 2.9Å; V113-K116 PolarHBondContact O-N 3.1Å; V113-L117 WeakPolarHBondContact O-CB 2.87Å; V113-L117 WeakPolarHBondContact O-CG 3.45Å; V113-L117 PolarHBondContact O-N 3.03Å
114	L	78	Confident	72.5	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-44.9	174.4	-71.5	165.8	0	0	0	111.8	F101 L104 R105 L109 K110 V111 K116 L117 A118 L159	F101-L114 HydrophobicContact CD2-CD2 4.36Å; F101-L114 HydrophobicContact CE2-CB 4.18Å; F101-L114 HydrophobicContact CE2-CD2 4.02Å; F101-L114 WeakPolarHBondContact CE2-O 3.17Å; F101-L114 HydrophobicContact CZ-CB 4.02Å; F101-L114 HydrophobicContact CZ-CD2 4.2Å; L104-L114 HydrophobicContact CB-CD2 4Å; R105-L114 HydrophobicContact CB-CD1 3.95Å; R105-L114 HydrophobicContact CB-CD2 4.31Å; R105-L114 HydrophobicContact CG-CD1 3.97Å; L109-L114 HydrophobicContact CB-CD1 4.46Å; L109-L114 HydrophobicContact CB-CD2 4.23Å; L109-L114 HydrophobicContact CB-CG 4.12Å; L109-L114 HydrophobicContact CD2-CD2 3.76Å; L109-L114 HydrophobicContact CD2-CG 3.98Å; L109-L114 HydrophobicContact CG-CD2 4.36Å; L109-L114 HydrophobicContact CG-CG 4.15Å; L109-L114 WeakPolarHBondContact O-CD1 3.3Å; K110-L114 PolarHBondContact O-N 2.75Å; K110-L114 VanDerWaalsContact O-N 3.08Å; V111-L114 PolarHBondContact O-N 3.07Å; L114-K116 VanDerWaalsContact C-N 3.35Å; L114-L117 WeakPolarHBondContact O-CB 3.42Å; L114-L117 PolarHBondContact O-N 3.43Å; L114-A118 WeakPolarHBondContact O-CB 3.38Å; L114-A118 PolarHBondContact O-N 2.92Å; L114-L159 HydrophobicContact CB-CD2 3.76Å; L114-L159 HydrophobicContact CD1-CD1 4.13Å; L114-L159 HydrophobicContact CD1-CD2 4.31Å
115	L	80.8	Confident	72.1	Confident	6 Å²	6	39.8 Å²	39.8	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-64.2	-41.2	176.8	-70.4	174.8	0	0	0	111.7	V111 V113 A118 N119 L156 L159 I163 D173 C177 L180	V111-L115 HydrophobicContact CG1-CD1 3.91Å; V111-L115 HydrophobicContact CG1-CG 4.26Å; V111-L115 WeakPolarHBondContact O-CG 3.34Å; V111-L115 PolarHBondContact O-N 3.21Å; V113-L115 PolarHBondContact O-N 2.9Å; L115-A118 PolarHBondContact O-N 3.4Å; L115-N119 WeakPolarHBondContact O-CB 3.49Å; L115-N119 PolarHBondContact O-N 3.47Å; L115-L156 HydrophobicContact CD2-CD1 4.47Å; L115-L159 HydrophobicContact CD2-CD2 4.17Å; L115-I163 HydrophobicContact CD1-CD1 3.95Å; L115-I163 HydrophobicContact CD2-CD1 3.88Å; L115-I163 HydrophobicContact CG-CD1 4.15Å; L115-D173 HydrophobicContact CD1-CB 4.09Å; L115-D173 WeakPolarHBondContact CD1-O 3Å; L115-C177 HydrophobicContact CD1-CB 4.36Å; L115-C177 HydrophobicContact CD2-CB 4.01Å; L115-L180 HydrophobicContact CD2-CD2 4.37Å
116	K	76.7	Confident	71.4	Confident	99 Å²	99	40.4 Å²	40.4	43%	0.43	23%	0.227	S	C	.	.	H	α-helix	trans	-62.1	-48.9	175.5	-174.2	171.8	177.9	-177.9	0	111	T86 S112 V113 L114 A118 N119 L120	T86-K116 HydrophobicContact CG2-CD 3.91Å; S112-K116 WeakPolarHBondContact O-CB 3.31Å; S112-K116 PolarHBondContact O-N 2.82Å; V113-K116 PolarHBondContact O-N 3.1Å; L114-K116 VanDerWaalsContact C-N 3.35Å; K116-A118 VanDerWaalsContact C-N 3.29Å; K116-A118 PolarHBondContact O-N 2.9Å; K116-N119 PolarHBondContact O-N 2.94Å; K116-L120 HydrophobicContact CG-CD1 3.75Å; K116-L120 HydrophobicContact CG-CG 4.41Å; K116-L120 VanDerWaalsContact O-CD1 3.3Å; K116-L120 WeakPolarHBondContact O-CD1 3.32Å; K116-L120 WeakPolarHBondContact O-CG 3.42Å; K116-L120 PolarHBondContact O-N 2.92Å
117	L	74.5	Confident	70.3	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-53.6	-47.2	174.3	-85.3	176	0	0	0	112.2	L89 L96 L104 L109 V113 L114 L120 K121	L89-L117 HydrophobicContact CB-CD2 3.62Å; L89-L117 HydrophobicContact CD1-CD1 3.68Å; L89-L117 HydrophobicContact CD1-CD2 3.59Å; L89-L117 HydrophobicContact CD1-CG 3.81Å; L89-L117 HydrophobicContact CD2-CD1 4.37Å; L89-L117 HydrophobicContact CD2-CD2 4.2Å; L89-L117 HydrophobicContact CG-CD2 4.02Å; L96-L117 HydrophobicContact CD2-CB 4.12Å; L104-L117 HydrophobicContact CD1-CD1 3.86Å; L109-L117 HydrophobicContact CD2-CD1 3.78Å; V113-L117 WeakPolarHBondContact O-CB 2.87Å; V113-L117 WeakPolarHBondContact O-CG 3.45Å; V113-L117 PolarHBondContact O-N 3.03Å; L114-L117 WeakPolarHBondContact O-CB 3.42Å; L114-L117 PolarHBondContact O-N 3.43Å; L117-L120 PolarHBondContact O-N 2.94Å; L117-K121 PolarHBondContact O-N 3.08Å
118	A	79.1	Confident	69	Low	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-41.9	-178.8	0	0	0	0	0	112.3	F101 L114 L115 K116 L120 K121 W122 F152 L156 L180	F101-A118 HydrophobicContact CE2-CB 3.87Å; F101-A118 HydrophobicContact CZ-CB 4.19Å; L114-A118 WeakPolarHBondContact O-CB 3.38Å; L114-A118 PolarHBondContact O-N 2.92Å; L115-A118 PolarHBondContact O-N 3.4Å; K116-A118 VanDerWaalsContact C-N 3.29Å; K116-A118 PolarHBondContact O-N 2.9Å; A118-L120 VanDerWaalsContact C-N 3.33Å; A118-L120 PolarHBondContact O-N 3.16Å; A118-K121 PolarHBondContact O-N 3.26Å; A118-W122 WeakPolarHBondContact O-CB 3.32Å; A118-W122 PolarHBondContact O-N 3.37Å; A118-F152 HydrophobicContact CB-CE1 4.44Å; A118-F152 HydrophobicContact CB-CE2 4.47Å; A118-F152 HydrophobicContact CB-CZ 3.62Å; A118-L156 HydrophobicContact CB-CD1 4.17Å; A118-L180 HydrophobicContact CB-CD2 3.46Å; A118-L180 VanDerWaalsContact CB-CD2 3.46Å
119	N	75.3	Confident	67.5	Low	48 Å²	48	38.1 Å²	38.1	26%	0.257	22%	0.216	S	C	.	.	H	α-helix	trans	-61.8	-41.3	173.7	-175.5	66.9	0	0	0	112.3	L115 K116 W122 Q123 L180	L115-N119 WeakPolarHBondContact O-CB 3.49Å; L115-N119 PolarHBondContact O-N 3.47Å; K116-N119 PolarHBondContact O-N 2.94Å; N119-W122 WeakPolarHBondContact O-CB 3.35Å; N119-W122 PolarHBondContact O-N 3.49Å; N119-Q123 PolarHBondContact ND2-NE2 3.35Å; N119-Q123 WeakPolarHBondContact O-CG 3.34Å; N119-Q123 PolarHBondContact O-N 2.77Å; N119-L180 HydrophobicContact CB-CD1 4.01Å
120	L	72.1	Confident	66.1	Low	26 Å²	26	41.1 Å²	41.1	14%	0.136	23%	0.227	C	C	.	.	H	α-helix	trans	-71	-39.7	180	-63.4	158	0	0	0	112.1	M90 I93 K116 L117 A118 W122 Q123 A124	M90-L120 HydrophobicContact CE-CB 4.49Å; M90-L120 HydrophobicContact CE-CD1 4.45Å; M90-L120 HydrophobicContact CE-CD2 3.87Å; M90-L120 HydrophobicContact CE-CG 4.48Å; M90-L120 HydrophobicContact SD-CB 4.14Å; M90-L120 HydrophobicContact SD-CD1 3.22Å; M90-L120 WeakPolarHBondContact SD-CD1 3.35Å; M90-L120 HydrophobicContact SD-CD2 3.66Å; M90-L120 HydrophobicContact SD-CG 3.84Å; I93-L120 HydrophobicContact CD1-CB 3.42Å; I93-L120 VanDerWaalsContact CD1-CB 3.42Å; I93-L120 HydrophobicContact CD1-CD1 4.37Å; I93-L120 HydrophobicContact CD1-CG 4.43Å; I93-L120 HydrophobicContact CG1-CB 4.39Å; K116-L120 HydrophobicContact CG-CD1 3.75Å; K116-L120 HydrophobicContact CG-CG 4.41Å; K116-L120 VanDerWaalsContact O-CD1 3.3Å; K116-L120 WeakPolarHBondContact O-CD1 3.32Å; K116-L120 WeakPolarHBondContact O-CG 3.42Å; K116-L120 PolarHBondContact O-N 2.92Å; L117-L120 PolarHBondContact O-N 2.94Å; A118-L120 VanDerWaalsContact C-N 3.33Å; A118-L120 PolarHBondContact O-N 3.16Å; L120-W122 PolarHBondContact O-N 3.39Å; L120-Q123 PolarHBondContact O-N 3.26Å; L120-A124 VanDerWaalsContact O-CB 3.27Å; L120-A124 WeakPolarHBondContact O-CB 3.42Å; L120-A124 PolarHBondContact O-N 3.01Å
121	K	70.2	Confident	64.2	Low	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55.9	-43.3	168.4	174.3	69.1	179.6	-161.7	0	111.1	I93 P94 L96 L117 A118 A124 C125 G147 F152	I93-K121 VanDerWaalsContact CG2-CA 3.48Å; I93-K121 HydrophobicContact CG2-CB 4.08Å; I93-K121 HydrophobicContact CG2-CD 4.05Å; I93-K121 WeakPolarHBondContact O-CD 3.49Å; I93-K121 PolarHBondContact O-NZ 3.03Å; P94-K121 PolarHBondContact O-NZ 3.03Å; L96-K121 HydrophobicContact CB-CD 4.21Å; L96-K121 HydrophobicContact CD2-CB 4.02Å; L96-K121 WeakPolarHBondContact O-CD 3.41Å; L96-K121 WeakPolarHBondContact O-CE 3.37Å; L96-K121 PolarHBondContact O-NZ 3.33Å; L96-K121 VanDerWaalsContact O-NZ 3.12Å; L117-K121 PolarHBondContact O-N 3.08Å; A118-K121 PolarHBondContact O-N 3.26Å; K121-A124 PolarHBondContact O-N 3.05Å; K121-C125 PolarHBondContact O-N 3.06Å; K121-C125 PolarHBondContact O-SG 3.34Å; K121-C125 VanDerWaalsContact O-SG 3.36Å; K121-G147 PolarHBondContact NZ-O 3.16Å; K121-F152 HydrophobicContact CB-CZ 4.43Å; K121-F152 HydrophobicContact CG-CE1 4.4Å; K121-F152 HydrophobicContact CG-CZ 4.34Å
122	W	68	Low	61.8	Low	4 Å²	4	49.2 Å²	49.2	2%	0.015	27%	0.271	C	S	.	.	H	α-helix	trans	-64.8	-45.3	178.9	-165.7	-115.2	0	0	0	113.5	A118 N119 L120 C125 N126 V148 L180 S183 L184 T187 M188	A118-W122 WeakPolarHBondContact O-CB 3.32Å; A118-W122 PolarHBondContact O-N 3.37Å; N119-W122 WeakPolarHBondContact O-CB 3.35Å; N119-W122 PolarHBondContact O-N 3.49Å; L120-W122 PolarHBondContact O-N 3.39Å; W122-C125 PolarHBondContact O-N 2.98Å; W122-N126 VanDerWaalsContact CD2-ND2 3.35Å; W122-N126 WeakPolarHBondContact CZ2-ND2 3.44Å; W122-N126 PolarHBondContact NE1-ND2 3.22Å; W122-N126 PolarHBondContact O-N 2.75Å; W122-N126 PolarHBondContact O-ND2 3.37Å; W122-V148 HydrophobicContact CE3-CG2 4.1Å; W122-V148 HydrophobicContact CH2-CG2 4.02Å; W122-V148 HydrophobicContact CZ3-CB 4.16Å; W122-V148 HydrophobicContact CZ3-CG1 3.83Å; W122-V148 HydrophobicContact CZ3-CG2 3.31Å; W122-L180 HydrophobicContact CB-CD1 4.3Å; W122-S183 PolarHBondContact NE1-O 3.46Å; W122-L184 HydrophobicContact CD2-CD2 3.29Å; W122-L184 HydrophobicContact CD2-CG 3.88Å; W122-L184 HydrophobicContact CE3-CD2 3.16Å; W122-L184 HydrophobicContact CE3-CG 4.22Å; W122-L184 HydrophobicContact CG-CD2 3.99Å; W122-L184 HydrophobicContact CG-CG 4.12Å; W122-L184 HydrophobicContact CH2-CD2 3.77Å; W122-L184 HydrophobicContact CZ2-CD2 3.84Å; W122-L184 HydrophobicContact CZ3-CD2 3.38Å; W122-T187 WeakPolarHBondContact CZ2-OG1 3.43Å; W122-T187 PolarHBondContact NE1-OG1 2.81Å; W122-M188 HydrophobicContact CH2-CE 4.33Å; W122-M188 HydrophobicContact CH2-CG 3.26Å; W122-M188 HydrophobicContact CH2-SD 3.81Å; W122-M188 HydrophobicContact CZ2-CG 3.66Å; W122-M188 HydrophobicContact CZ3-CG 4.28Å; W122-M188 HydrophobicContact CZ3-SD 4.3Å
123	Q	67.7	Low	59.8	Low	99 Å²	99	51.4 Å²	51.4	46%	0.463	28%	0.276	S	S	.	.	H	α-helix	trans	-64	-42.1	176.1	-72.9	177.6	-17.7	0	0	111.4	N119 L120 C125 N126 S127	N119-Q123 PolarHBondContact ND2-NE2 3.35Å; N119-Q123 WeakPolarHBondContact O-CG 3.34Å; N119-Q123 PolarHBondContact O-N 2.77Å; L120-Q123 PolarHBondContact O-N 3.26Å; Q123-C125 VanDerWaalsContact C-N 3.35Å; Q123-C125 PolarHBondContact O-N 3.16Å; Q123-N126 PolarHBondContact O-N 3.15Å; Q123-S127 WeakPolarHBondContact O-CB 3.49Å; Q123-S127 PolarHBondContact O-N 3.41Å; Q123-S127 PolarHBondContact O-OG 2.91Å
124	A	63.6	Low	58.1	Low	12 Å²	12	56 Å²	56	10%	0.099	29%	0.291	C	S	.	.	H	α-helix	trans	-60.6	-43	178	0	0	0	0	0	111.4	I93 L120 K121 N126 W130	I93-A124 HydrophobicContact CG2-CB 3.61Å; L120-A124 VanDerWaalsContact O-CB 3.27Å; L120-A124 WeakPolarHBondContact O-CB 3.42Å; L120-A124 PolarHBondContact O-N 3.01Å; K121-A124 PolarHBondContact O-N 3.05Å; A124-N126 PolarHBondContact O-N 2.8Å; A124-W130 VanDerWaalsContact O-CB 3.3Å; A124-W130 WeakPolarHBondContact O-CB 3.25Å
125	C	60.6	Low	55.7	Low	29 Å²	29	60.4 Å²	60.4	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-72.9	-20.7	-179.3	-67	0	0	0	0	115	K121 W122 Q123 V148	K121-C125 PolarHBondContact O-N 3.06Å; K121-C125 PolarHBondContact O-SG 3.34Å; K121-C125 VanDerWaalsContact O-SG 3.36Å; W122-C125 PolarHBondContact O-N 2.98Å; Q123-C125 VanDerWaalsContact C-N 3.35Å; Q123-C125 PolarHBondContact O-N 3.16Å; C125-V148 HydrophobicContact CB-CG2 4Å
126	N	55.3	Low	53.2	Low	80 Å²	80	67.6 Å²	67.6	43%	0.428	36%	0.358	S	S	.	.	H	α-helix	trans	-114.8	-5.3	-174.7	-67	-70.5	0	0	0	114.7	W122 Q123 A124	W122-N126 VanDerWaalsContact CD2-ND2 3.35Å; W122-N126 WeakPolarHBondContact CZ2-ND2 3.44Å; W122-N126 PolarHBondContact NE1-ND2 3.22Å; W122-N126 PolarHBondContact O-N 2.75Å; W122-N126 PolarHBondContact O-ND2 3.37Å; Q123-N126 PolarHBondContact O-N 3.15Å; A124-N126 PolarHBondContact O-N 2.8Å
127	S	50.2	Low	51	Low	38 Å²	38	66.6 Å²	66.6	27%	0.266	36%	0.36	S	S	.	.	S	Bend	trans	-93.5	150.9	178.1	58.9	0	0	0	0	111	Q123 S129 W130	Q123-S127 WeakPolarHBondContact O-CB 3.49Å; Q123-S127 PolarHBondContact O-N 3.41Å; Q123-S127 PolarHBondContact O-OG 2.91Å; S127-S129 WeakPolarHBondContact CB-OG 2.81Å; S127-S129 PolarHBondContact O-N 3.33Å; S127-S129 VanDerWaalsContact O-N 3.08Å; S127-S129 PolarHBondContact OG-OG 3.21Å; S127-W130 VanDerWaalsContact O-CB 3.26Å; S127-W130 WeakPolarHBondContact O-CB 3.26Å; S127-W130 PolarHBondContact O-N 2.62Å
128	S	38.5	Very low	48.8	Very low	95 Å²	95	74.7 Å²	74.7	66%	0.664	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.1	167.5	48	0	0	0	0	112.6	W130 L131 L132	S128-W130 PolarHBondContact O-N 2.81Å; S128-L131 WeakPolarHBondContact O-CB 3.31Å; S128-L131 PolarHBondContact O-N 3.48Å; S128-L132 PolarHBondContact O-N 2.89Å
129	S	36.6	Very low	46.5	Very low	53 Å²	53	77.2 Å²	77.2	37%	0.371	43%	0.43	S	S	.	.	H	α-helix	trans	-61.1	-20.6	170	16.7	0	0	0	0	114.2	S127 L131 L132 M133	S127-S129 WeakPolarHBondContact CB-OG 2.81Å; S127-S129 PolarHBondContact O-N 3.33Å; S127-S129 VanDerWaalsContact O-N 3.08Å; S127-S129 PolarHBondContact OG-OG 3.21Å; S129-L131 PolarHBondContact O-N 3.39Å; S129-L132 PolarHBondContact O-N 3.31Å; S129-L132 VanDerWaalsContact O-N 3.14Å; S129-M133 WeakPolarHBondContact O-CG 2.99Å; S129-M133 PolarHBondContact O-N 3Å
130	W	36.8	Very low	44.3	Very low	78 Å²	78	78.6 Å²	78.6	30%	0.295	43%	0.432	S	S	.	.	H	α-helix	trans	-53.5	-42.7	166.8	-178.1	-99.4	0	0	0	111.9	A124 S127 S128 P145	A124-W130 VanDerWaalsContact O-CB 3.3Å; A124-W130 WeakPolarHBondContact O-CB 3.25Å; S127-W130 VanDerWaalsContact O-CB 3.26Å; S127-W130 WeakPolarHBondContact O-CB 3.26Å; S127-W130 PolarHBondContact O-N 2.62Å; S128-W130 PolarHBondContact O-N 2.81Å; W130-P145 HydrophobicContact CH2-CB 4.06Å; W130-P145 HydrophobicContact CZ2-CB 4.43Å
131	L	31.6	Very low	42.5	Very low	131 Å²	131	83.3 Å²	83.3	69%	0.686	46%	0.462	S	S	*	.	H	α-helix	trans	-72.5	-33.3	178.1	-69.5	162.8	0	0	0	111.8	S128 S129 W134	S128-L131 WeakPolarHBondContact O-CB 3.31Å; S128-L131 PolarHBondContact O-N 3.48Å; S129-L131 PolarHBondContact O-N 3.39Å; L131-W134 PolarHBondContact O-N 3.36Å
132	L	32.8	Very low	40.8	Very low	148 Å²	148	88.8 Å²	88.8	78%	0.775	50%	0.495	S	S	*	.	H	α-helix	trans	-77.8	-22.6	-179.9	-68.3	169.6	0	0	0	113.4	S128 S129 W134	S128-L132 PolarHBondContact O-N 2.89Å; S129-L132 PolarHBondContact O-N 3.31Å; S129-L132 VanDerWaalsContact O-N 3.14Å; L132-W134 PolarHBondContact O-N 3.31Å
133	M	35.5	Very low	39.2	Very low	109 Å²	109	92.2 Å²	92.2	54%	0.537	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-4.1	172.5	-71.6	-173	74	0	0	113	S129	S129-M133 WeakPolarHBondContact O-CG 2.99Å; S129-M133 PolarHBondContact O-N 3Å
134	W	35.1	Very low	37.5	Very low	115 Å²	115	95.3 Å²	95.3	44%	0.436	53%	0.534	S	S	.	.			trans	-115.8	101.4	-178.5	-156.3	-76.6	0	0	0	111.7	L131 L132 P145	L131-W134 PolarHBondContact O-N 3.36Å; L132-W134 PolarHBondContact O-N 3.31Å; W134-P145 HydrophobicContact CH2-CG 3.68Å; W134-P145 HydrophobicContact CZ3-CG 3.53Å
135	P	29	Very low	36.3	Very low	95 Å²	95	96.3 Å²	96.3	62%	0.617	54%	0.54	S	S	*	.			trans	-71.1	136.6	149.5	4.1	12.4	0	0	0	107.9	V137	P135-V137 VanDerWaalsContact C-N 3.28Å; P135-V137 HydrophobicContact CB-CG2 4.18Å; P135-V137 PolarHBondContact O-N 3.27Å
136	N	27.4	Very low	35.3	Very low	156 Å²	156	97.6 Å²	97.6	83%	0.834	55%	0.547	S	S	*	.			trans	-50.7	86.6	167.6	-78.7	-26.4	0	0	0	111.3
137	V	30.2	Very low	34.9	Very low	78 Å²	78	95.8 Å²	95.8	47%	0.473	55%	0.547	S	S	.	.			trans	-114.2	94.2	172.6	-170.1	0	0	0	0	107.9	P135 G139	P135-V137 VanDerWaalsContact C-N 3.28Å; P135-V137 HydrophobicContact CB-CG2 4.18Å; P135-V137 PolarHBondContact O-N 3.27Å; V137-G139 PolarHBondContact O-N 3.29Å
138	D	29.3	Very low	34.8	Very low	174 Å²	174	96 Å²	96	93%	0.93	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	82	168.1	-70.7	-38.9	0	0	0	109.4
139	G	30.3	Very low	35.5	Very low	53 Å²	53	92 Å²	92	55%	0.546	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-166.5	-16.5	-177.4	0	0	0	0	0	116.6	V137 T141	V137-G139 PolarHBondContact O-N 3.29Å; G139-T141 PolarHBondContact O-N 3.36Å
140	Y	30.2	Very low	36.6	Very low	77 Å²	77	95.7 Å²	95.7	30%	0.302	53%	0.531	S	S	.	.			trans	-94.2	81.4	173.7	-74.1	-80.9	0	0	0	110.7	V56	V56-Y140 PolarHBondContact O-OH 3.35Å
141	T	34	Very low	38.1	Very low	125 Å²	125	94.4 Å²	94.4	77%	0.767	53%	0.529	S	S	*	.			trans	-116	20.4	-174.6	49.8	0	0	0	0	116.1	G139	G139-T141 PolarHBondContact O-N 3.36Å
142	T	33.8	Very low	40.2	Very low	115 Å²	115	88.1 Å²	88.1	71%	0.706	50%	0.497	S	S	*	.	S	Bend	trans	-122	-28.9	172.4	52	0	0	0	0	115.2
143	C	34.3	Very low	42.6	Very low	77 Å²	77	81.5 Å²	81.5	52%	0.52	46%	0.462	S	S	.	.	S	Bend	trans	-123.7	88.2	167.7	-66.4	0	0	0	0	107.5
144	E	31.7	Very low	44.9	Very low	163 Å²	163	80 Å²	80	76%	0.762	45%	0.453	S	S	*	.			trans	-49.9	141.9	164.7	-68.4	-177.4	167.7	0	0	108.1	T146	E144-T146 PolarHBondContact O-N 3.08Å
145	P	38.8	Very low	47.2	Very low	34 Å²	34	74.6 Å²	74.6	22%	0.221	43%	0.432	C	S	.	.			trans	-50.8	113.7	164.1	-13.4	23.2	0	0	0	106	W130 W134 G147	W130-P145 HydrophobicContact CH2-CB 4.06Å; W130-P145 HydrophobicContact CZ2-CB 4.43Å; W134-P145 HydrophobicContact CH2-CG 3.68Å; W134-P145 HydrophobicContact CZ3-CG 3.53Å; P145-G147 PolarHBondContact O-N 2.97Å
146	T	40	Very low	50.1	Low	56 Å²	56	70 Å²	70	34%	0.344	40%	0.403	S	S	.	.			trans	-55.1	133.6	162.3	56.1	0	0	0	0	103.8	E144 A149	E144-T146 PolarHBondContact O-N 3.08Å; T146-A149 HydrophobicContact CG2-CB 4.36Å
147	G	46.1	Very low	53.1	Low	42 Å²	42	62.6 Å²	62.6	43%	0.433	36%	0.363	S	S	.	.	S	Bend	trans	-58.9	-135.9	173.1	0	0	0	0	0	109.9	K121 P145 A149	K121-G147 PolarHBondContact NZ-O 3.16Å; P145-G147 PolarHBondContact O-N 2.97Å; G147-A149 PolarHBondContact O-N 3.31Å
148	V	49.4	Very low	56	Low	41 Å²	41	61.6 Å²	61.6	25%	0.248	36%	0.355	C	S	.	.	S	Bend	trans	-68	94.6	155.3	-176.2	0	0	0	0	105.1	W122 C125 E150 F152 P153	W122-V148 HydrophobicContact CE3-CG2 4.1Å; W122-V148 HydrophobicContact CH2-CG2 4.02Å; W122-V148 HydrophobicContact CZ3-CB 4.16Å; W122-V148 HydrophobicContact CZ3-CG1 3.83Å; W122-V148 HydrophobicContact CZ3-CG2 3.31Å; C125-V148 HydrophobicContact CB-CG2 4Å; V148-E150 PolarHBondContact O-N 3.01Å; V148-F152 HydrophobicContact CG1-CD1 4.47Å; V148-P153 HydrophobicContact CG1-CG 4.02Å
149	A	53.5	Low	58.9	Low	12 Å²	12	53.3 Å²	53.3	10%	0.099	31%	0.311	C	S	.	.			trans	-51.3	133	176	0	0	0	0	0	108	D97 T146 G147 D151 F152 P153	D97-A149 HydrophobicContact CB-CB 3.61Å; T146-A149 HydrophobicContact CG2-CB 4.36Å; G147-A149 PolarHBondContact O-N 3.31Å; A149-D151 WeakPolarHBondContact CB-OD1 3.11Å; A149-D151 PolarHBondContact O-N 3.47Å; A149-F152 WeakPolarHBondContact O-CB 3.29Å; A149-F152 PolarHBondContact O-N 3.13Å; A149-P153 WeakPolarHBondContact O-CD 3.46Å
150	E	58.5	Low	61.9	Low	131 Å²	131	50.8 Å²	50.8	61%	0.612	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-24	-172.4	-64.5	178.7	173.4	0	0	112.9	V148 K193	V148-E150 PolarHBondContact O-N 3.01Å; E150-K193 WeakPolarHBondContact OE1-CD 3.33Å; E150-K193 WeakPolarHBondContact OE1-CE 3.47Å; E150-K193 IonicContact OE1-NZ 2.75Å; E150-K193 PolarHBondContact OE1-NZ 3.18Å
151	D	68.4	Low	64.8	Low	50 Å²	50	50 Å²	50	27%	0.267	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-17.5	178.4	65.8	-19.5	0	0	0	113.8	G98 K99 A149 K154 A155	G98-D151 VanDerWaalsContact CA-CG 3.41Å; G98-D151 VanDerWaalsContact CA-OD2 3.29Å; G98-D151 WeakPolarHBondContact CA-OD2 3.42Å; G98-D151 VanDerWaalsContact N-CG 3.25Å; G98-D151 PolarHBondContact N-OD1 2.88Å; G98-D151 PolarHBondContact N-OD2 2.6Å; K99-D151 PolarHBondContact N-OD2 3.15Å; A149-D151 WeakPolarHBondContact CB-OD1 3.11Å; A149-D151 PolarHBondContact O-N 3.47Å; D151-K154 WeakPolarHBondContact O-CB 2.95Å; D151-K154 PolarHBondContact O-N 3.46Å; D151-A155 WeakPolarHBondContact O-CB 3.39Å; D151-A155 PolarHBondContact O-N 3.24Å
152	F	76.3	Confident	67.5	Low	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-49.7	-177.2	-179.3	-95.9	0	0	0	113.2	L96 F101 A118 K121 V148 A149 K154 A155 L156	L96-F152 HydrophobicContact CD2-CE2 4.1Å; L96-F152 HydrophobicContact CG-CE2 4.17Å; F101-F152 HydrophobicContact CB-CD2 4.2Å; F101-F152 HydrophobicContact CB-CE2 4.14Å; F101-F152 AromaticContact CD2-CE2 3.7Å; F101-F152 HydrophobicContact CD2-CE2 3.7Å; F101-F152 HydrophobicContact CD2-CZ 4.48Å; F101-F152 HydrophobicContact CE2-CE2 4.22Å; F101-F152 HydrophobicContact CG-CD2 4.39Å; F101-F152 AromaticContact CG-CE2 3.93Å; F101-F152 HydrophobicContact CG-CE2 3.93Å; A118-F152 HydrophobicContact CB-CE1 4.44Å; A118-F152 HydrophobicContact CB-CE2 4.47Å; A118-F152 HydrophobicContact CB-CZ 3.62Å; K121-F152 HydrophobicContact CB-CZ 4.43Å; K121-F152 HydrophobicContact CG-CE1 4.4Å; K121-F152 HydrophobicContact CG-CZ 4.34Å; V148-F152 HydrophobicContact CG1-CD1 4.47Å; A149-F152 WeakPolarHBondContact O-CB 3.29Å; A149-F152 PolarHBondContact O-N 3.13Å; F152-K154 PolarHBondContact O-N 2.99Å; F152-A155 PolarHBondContact O-N 3.06Å; F152-A155 VanDerWaalsContact O-N 3.15Å; F152-L156 PolarHBondContact O-N 2.9Å
153	P	82	Confident	70.1	Confident	8 Å²	8	43.2 Å²	43.2	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-57.5	-32.9	173.4	-25.1	35.5	0	0	0	112.7	V148 A149 L157 M188 F197	V148-P153 HydrophobicContact CG1-CG 4.02Å; A149-P153 WeakPolarHBondContact O-CD 3.46Å; P153-L157 WeakPolarHBondContact O-CB 3.35Å; P153-L157 PolarHBondContact O-N 2.98Å; P153-M188 HydrophobicContact CG-SD 4.43Å; P153-F197 HydrophobicContact CB-CD1 4.45Å; P153-F197 HydrophobicContact CB-CD2 4.34Å; P153-F197 HydrophobicContact CB-CE1 3.99Å; P153-F197 HydrophobicContact CB-CE2 3.87Å; P153-F197 HydrophobicContact CB-CZ 3.67Å
154	K	85.1	Confident	72.7	Confident	79 Å²	79	40.4 Å²	40.4	34%	0.343	22%	0.22	S	C	.	.	H	α-helix	trans	-68.4	-47.4	176	-174.9	61.7	179.4	177.6	0	111.8	D151 F152 L156 L157 D158 F197	D151-K154 WeakPolarHBondContact O-CB 2.95Å; D151-K154 PolarHBondContact O-N 3.46Å; F152-K154 PolarHBondContact O-N 2.99Å; K154-L156 VanDerWaalsContact C-N 3.29Å; K154-L156 PolarHBondContact O-N 3.36Å; K154-L157 WeakPolarHBondContact O-CB 3.41Å; K154-L157 PolarHBondContact O-N 3.39Å; K154-L157 VanDerWaalsContact O-N 3.15Å; K154-D158 VanDerWaalsContact O-CG 3.32Å; K154-D158 PolarHBondContact O-N 3.23Å; K154-F197 HydrophobicContact CB-CE2 4.1Å; K154-F197 HydrophobicContact CD-CE2 4.43Å
155	A	83.9	Confident	75.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-39	176.9	0	0	0	0	0	112.1	F101 N102 D151 F152 D158 L159	F101-A155 HydrophobicContact CB-CB 4.39Å; F101-A155 HydrophobicContact CD1-CB 3.81Å; N102-A155 WeakPolarHBondContact ND2-CB 3.23Å; D151-A155 WeakPolarHBondContact O-CB 3.39Å; D151-A155 PolarHBondContact O-N 3.24Å; F152-A155 PolarHBondContact O-N 3.06Å; F152-A155 VanDerWaalsContact O-N 3.15Å; A155-D158 PolarHBondContact O-N 2.86Å; A155-L159 PolarHBondContact O-N 3.43Å
156	L	88.1	Confident	77.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66	-40.8	173.8	178.4	62.7	0	0	0	112.2	F101 L115 A118 F152 K154 D158 L159 S160 L180 W181 L184	F101-L156 HydrophobicContact CZ-CD1 4.45Å; L115-L156 HydrophobicContact CD2-CD1 4.47Å; A118-L156 HydrophobicContact CB-CD1 4.17Å; F152-L156 PolarHBondContact O-N 2.9Å; K154-L156 VanDerWaalsContact C-N 3.29Å; K154-L156 PolarHBondContact O-N 3.36Å; L156-D158 VanDerWaalsContact C-N 3.31Å; L156-D158 PolarHBondContact O-N 3.46Å; L156-L159 HydrophobicContact CD1-CD2 4.47Å; L156-L159 PolarHBondContact O-N 3.1Å; L156-S160 WeakPolarHBondContact O-CB 3.43Å; L156-S160 PolarHBondContact O-N 2.91Å; L156-S160 PolarHBondContact O-OG 2.87Å; L156-L180 HydrophobicContact CD1-CD2 3.58Å; L156-L180 HydrophobicContact CD2-CD2 3.62Å; L156-L180 HydrophobicContact CD2-CG 3.88Å; L156-L180 HydrophobicContact CG-CD2 4.25Å; L156-W181 HydrophobicContact CD2-CZ2 4.2Å; L156-W181 HydrophobicContact CG-CZ2 4.1Å; L156-L184 HydrophobicContact CD2-CD1 3.12Å
157	L	90.6	Very high	79.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-43.2	175.7	-177.6	57.9	0	0	0	111.2	P153 K154 L159 S160 V161 W181 F197 T204 M205 L208	P153-L157 WeakPolarHBondContact O-CB 3.35Å; P153-L157 PolarHBondContact O-N 2.98Å; K154-L157 WeakPolarHBondContact O-CB 3.41Å; K154-L157 PolarHBondContact O-N 3.39Å; K154-L157 VanDerWaalsContact O-N 3.15Å; L157-L159 VanDerWaalsContact C-N 3.34Å; L157-L159 PolarHBondContact O-N 2.97Å; L157-S160 WeakPolarHBondContact O-CB 3.39Å; L157-S160 PolarHBondContact O-N 2.94Å; L157-S160 VanDerWaalsContact O-N 3.1Å; L157-V161 WeakPolarHBondContact O-CG2 3.4Å; L157-V161 PolarHBondContact O-N 3.21Å; L157-W181 HydrophobicContact CB-CH2 4.22Å; L157-W181 HydrophobicContact CB-CZ2 3.79Å; L157-W181 HydrophobicContact CD1-CZ2 3.99Å; L157-W181 HydrophobicContact CG-CZ2 4.47Å; L157-F197 HydrophobicContact CD2-CZ 4.29Å; L157-T204 HydrophobicContact CD1-CG2 4.03Å; L157-T204 HydrophobicContact CD2-CG2 3.85Å; L157-T204 HydrophobicContact CG-CG2 3.8Å; L157-M205 HydrophobicContact CD1-CE 3.99Å; L157-M205 HydrophobicContact CD1-SD 4.27Å; L157-L208 HydrophobicContact CD1-CD2 3.99Å
158	D	90.9	Very high	81.1	Confident	56 Å²	56	44.2 Å²	44.2	30%	0.299	25%	0.251	S	S	.	.	H	α-helix	trans	-63.6	-40.1	177	-62.9	-18.3	0	0	0	111.6	R105 K154 A155 L156 S160 H162	R105-D158 VanDerWaalsContact NH1-CB 3.29Å; K154-D158 VanDerWaalsContact O-CG 3.32Å; K154-D158 PolarHBondContact O-N 3.23Å; A155-D158 PolarHBondContact O-N 2.86Å; L156-D158 VanDerWaalsContact C-N 3.31Å; L156-D158 PolarHBondContact O-N 3.46Å; D158-S160 VanDerWaalsContact C-N 3.33Å; D158-H162 PolarHBondContact O-N 3.19Å; D158-H162 VanDerWaalsContact O-N 3.12Å
159	L	91	Very high	82.7	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-41.6	171.4	175.6	64.3	0	0	0	111.4	F101 L114 L115 A155 L156 L157 V161 H162 I163	F101-L159 HydrophobicContact CE1-CB 4.08Å; F101-L159 HydrophobicContact CE1-CD2 3.78Å; F101-L159 HydrophobicContact CZ-CD2 3.5Å; L114-L159 HydrophobicContact CB-CD2 3.76Å; L114-L159 HydrophobicContact CD1-CD1 4.13Å; L114-L159 HydrophobicContact CD1-CD2 4.31Å; L115-L159 HydrophobicContact CD2-CD2 4.17Å; A155-L159 PolarHBondContact O-N 3.43Å; L156-L159 HydrophobicContact CD1-CD2 4.47Å; L156-L159 PolarHBondContact O-N 3.1Å; L157-L159 VanDerWaalsContact C-N 3.34Å; L157-L159 PolarHBondContact O-N 2.97Å; L159-V161 VanDerWaalsContact C-N 3.34Å; L159-V161 PolarHBondContact O-N 3.45Å; L159-H162 WeakPolarHBondContact O-CB 3.35Å; L159-H162 PolarHBondContact O-N 2.97Å; L159-H162 VanDerWaalsContact O-N 3.13Å; L159-I163 HydrophobicContact CD1-CD1 4.24Å; L159-I163 HydrophobicContact CD1-CG1 4.26Å; L159-I163 HydrophobicContact CD2-CD1 4.39Å; L159-I163 HydrophobicContact CG-CD1 3.86Å; L159-I163 HydrophobicContact CG-CG1 4.33Å; L159-I163 VanDerWaalsContact O-CG1 3.29Å; L159-I163 WeakPolarHBondContact O-CG1 3.33Å; L159-I163 PolarHBondContact O-N 2.95Å
160	S	92.8	Very high	84.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-41.8	-178.8	-53.6	0	0	0	0	111.6	L156 L157 D158 H162 I163 S164 C177 W181 L208	L156-S160 WeakPolarHBondContact O-CB 3.43Å; L156-S160 PolarHBondContact O-N 2.91Å; L156-S160 PolarHBondContact O-OG 2.87Å; L157-S160 WeakPolarHBondContact O-CB 3.39Å; L157-S160 PolarHBondContact O-N 2.94Å; L157-S160 VanDerWaalsContact O-N 3.1Å; D158-S160 VanDerWaalsContact C-N 3.33Å; S160-H162 VanDerWaalsContact C-N 3.33Å; S160-H162 PolarHBondContact O-N 3.44Å; S160-I163 PolarHBondContact O-N 3.41Å; S160-S164 VanDerWaalsContact O-CB 3.31Å; S160-S164 WeakPolarHBondContact O-CB 3.38Å; S160-S164 PolarHBondContact O-N 3.34Å; S160-C177 WeakPolarHBondContact CB-SG 3.5Å; S160-C177 PolarHBondContact OG-SG 3.28Å; S160-W181 PolarHBondContact OG-NE1 2.78Å; S160-L208 WeakPolarHBondContact O-CD1 3.28Å
161	V	91.6	Very high	85.4	Confident	59 Å²	59	45.9 Å²	45.9	36%	0.358	26%	0.255	S	S	.	.	H	α-helix	trans	-61.4	-42.8	173.1	172.9	0	0	0	0	110.7	L157 L159 S164 A165 T204	L157-V161 WeakPolarHBondContact O-CG2 3.4Å; L157-V161 PolarHBondContact O-N 3.21Å; L159-V161 VanDerWaalsContact C-N 3.34Å; L159-V161 PolarHBondContact O-N 3.45Å; V161-S164 PolarHBondContact O-N 3.38Å; V161-A165 WeakPolarHBondContact O-CB 3.3Å; V161-A165 PolarHBondContact O-N 3.3Å; V161-T204 HydrophobicContact CG2-CG2 3.52Å
162	H	90.1	Very high	86.2	Confident	99 Å²	99	48 Å²	48	46%	0.458	27%	0.27	S	S	.	.	H	α-helix	trans	-61.8	-44.8	176	-178	73.5	0	0	0	112.3	D158 L159 S160 S164 A165 N166	D158-H162 PolarHBondContact O-N 3.19Å; D158-H162 VanDerWaalsContact O-N 3.12Å; L159-H162 WeakPolarHBondContact O-CB 3.35Å; L159-H162 PolarHBondContact O-N 2.97Å; L159-H162 VanDerWaalsContact O-N 3.13Å; S160-H162 VanDerWaalsContact C-N 3.33Å; S160-H162 PolarHBondContact O-N 3.44Å; H162-S164 VanDerWaalsContact C-N 3.29Å; H162-S164 PolarHBondContact O-N 2.83Å; H162-A165 PolarHBondContact O-N 3.15Å; H162-N166 WeakPolarHBondContact O-CB 3.29Å; H162-N166 PolarHBondContact O-N 3.23Å
163	I	89.9	Confident	86.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.3	-43.3	176.1	-67.6	166.4	0	0	0	110.8	V111 L115 L159 S160 S169 R174 C177	V111-I163 HydrophobicContact CG1-CD1 3.61Å; V111-I163 HydrophobicContact CG1-CG1 3.65Å; L115-I163 HydrophobicContact CD1-CD1 3.95Å; L115-I163 HydrophobicContact CD2-CD1 3.88Å; L115-I163 HydrophobicContact CG-CD1 4.15Å; L159-I163 HydrophobicContact CD1-CD1 4.24Å; L159-I163 HydrophobicContact CD1-CG1 4.26Å; L159-I163 HydrophobicContact CD2-CD1 4.39Å; L159-I163 HydrophobicContact CG-CD1 3.86Å; L159-I163 HydrophobicContact CG-CG1 4.33Å; L159-I163 VanDerWaalsContact O-CG1 3.29Å; L159-I163 WeakPolarHBondContact O-CG1 3.33Å; L159-I163 PolarHBondContact O-N 2.95Å; S160-I163 PolarHBondContact O-N 3.41Å; I163-S169 WeakPolarHBondContact CA-OG 3.09Å; I163-S169 WeakPolarHBondContact O-CB 3.45Å; I163-S169 PolarHBondContact O-OG 3.36Å; I163-R174 HydrophobicContact CG2-CG 3.81Å; I163-C177 HydrophobicContact CD1-CB 4.09Å
164	S	87.1	Confident	86.9	Confident	17 Å²	17	52 Å²	52	12%	0.119	29%	0.285	C	S	.	.	H	α-helix	trans	-68.4	-40.7	-178.1	-168.6	0	0	0	0	112.8	S160 V161 H162 T211	S160-S164 VanDerWaalsContact O-CB 3.31Å; S160-S164 WeakPolarHBondContact O-CB 3.38Å; S160-S164 PolarHBondContact O-N 3.34Å; V161-S164 PolarHBondContact O-N 3.38Å; H162-S164 VanDerWaalsContact C-N 3.29Å; H162-S164 PolarHBondContact O-N 2.83Å; S164-T211 VanDerWaalsContact OG-CB 3.28Å; S164-T211 WeakPolarHBondContact OG-CB 3.14Å; S164-T211 WeakPolarHBondContact OG-CG2 3.29Å
165	A	86.6	Confident	86.9	Confident	85 Å²	85	50.6 Å²	50.6	70%	0.702	28%	0.28	S	S	*	.	H	α-helix	trans	-76.4	-24.2	179	0	0	0	0	0	113.1	V161 H162 S167	V161-A165 WeakPolarHBondContact O-CB 3.3Å; V161-A165 PolarHBondContact O-N 3.3Å; H162-A165 PolarHBondContact O-N 3.15Å; A165-S167 PolarHBondContact O-N 2.82Å
166	N	85.6	Confident	87	Confident	49 Å²	49	52.9 Å²	52.9	26%	0.262	30%	0.297	S	S	.	.			trans	-83.1	113.6	-178.5	-177.1	2.4	0	0	0	111.2	H162 N168 S169 R174	H162-N166 WeakPolarHBondContact O-CB 3.29Å; H162-N166 PolarHBondContact O-N 3.23Å; N166-N168 PolarHBondContact O-N 2.94Å; N166-N168 WeakPolarHBondContact OD1-CA 3.21Å; N166-N168 VanDerWaalsContact OD1-CB 3.32Å; N166-N168 WeakPolarHBondContact OD1-CB 3.29Å; N166-N168 PolarHBondContact OD1-N 3.43Å; N166-S169 WeakPolarHBondContact CB-OG 3.05Å; N166-S169 WeakPolarHBondContact O-CB 3.26Å; N166-S169 PolarHBondContact O-N 3.39Å; N166-S169 PolarHBondContact O-OG 3.24Å; N166-R174 PolarHBondContact O-NH2 3.41Å
167	S	78.8	Confident	87.1	Confident	100 Å²	100	52.9 Å²	52.9	70%	0.699	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-23.4	175.7	53.4	0	0	0	0	113.2	A165	A165-S167 PolarHBondContact O-N 2.82Å
168	N	82.3	Confident	87	Confident	141 Å²	141	52.9 Å²	52.9	75%	0.754	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-7.3	178.4	-60.2	-31.6	0	0	0	113.4	N166 S170	N166-N168 PolarHBondContact O-N 2.94Å; N166-N168 WeakPolarHBondContact OD1-CA 3.21Å; N166-N168 VanDerWaalsContact OD1-CB 3.32Å; N166-N168 WeakPolarHBondContact OD1-CB 3.29Å; N166-N168 PolarHBondContact OD1-N 3.43Å; N168-S170 PolarHBondContact O-N 3.3Å
169	S	83.7	Confident	86.7	Confident	14 Å²	14	52.3 Å²	52.3	10%	0.098	30%	0.297	C	S	.	.	S	Bend	trans	-59.5	131.5	175.1	-65.3	0	0	0	0	110.2	I163 N166	I163-S169 WeakPolarHBondContact CA-OG 3.09Å; I163-S169 WeakPolarHBondContact O-CB 3.45Å; I163-S169 PolarHBondContact O-OG 3.36Å; N166-S169 WeakPolarHBondContact CB-OG 3.05Å; N166-S169 WeakPolarHBondContact O-CB 3.26Å; N166-S169 PolarHBondContact O-N 3.39Å; N166-S169 PolarHBondContact O-OG 3.24Å
170	S	84.2	Confident	86.5	Confident	49 Å²	49	52.3 Å²	52.3	34%	0.343	30%	0.297	S	S	.	.			trans	-66.2	154	179.8	78.7	0	0	0	0	111	N168 V172 D173 R174	N168-S170 PolarHBondContact O-N 3.3Å; S170-V172 PolarHBondContact O-N 3.27Å; S170-V172 PolarHBondContact OG-N 2.84Å; S170-D173 WeakPolarHBondContact CB-OD2 3.47Å; S170-D173 PolarHBondContact N-OD2 3.32Å; S170-D173 PolarHBondContact O-N 2.85Å; S170-D173 PolarHBondContact OG-N 3.3Å; S170-D173 PolarHBondContact OG-OD2 2.99Å; S170-R174 PolarHBondContact O-N 2.64Å
171	R	84.5	Confident	86.2	Confident	156 Å²	156	52.4 Å²	52.4	59%	0.589	30%	0.297	S	S	*	.	H	α-helix	trans	-55.4	-38.7	171.6	-178.7	-179.2	175	-169.2	-2.4	111.4	R174 M175 D217	R171-R174 PolarHBondContact O-N 3.02Å; R171-M175 HydrophobicContact CG-CG 4.47Å; R171-M175 HydrophobicContact CG-SD 4.03Å; R171-M175 WeakPolarHBondContact O-CG 3.46Å; R171-M175 PolarHBondContact O-N 3.21Å; R171-D217 IonicContact CZ-OD2 3.57Å; R171-D217 IonicContact NE-OD2 2.95Å; R171-D217 PolarHBondContact NE-OD2 3.42Å; R171-D217 IonicContact NH2-OD1 3.55Å; R171-D217 PolarHBondContact NH2-OD1 3.01Å; R171-D217 VanDerWaalsContact NH2-OD1 3.12Å; R171-D217 IonicContact NH2-OD2 3.27Å; R171-D217 PolarHBondContact NH2-OD2 2.84Å
172	V	84.4	Confident	85.8	Confident	96 Å²	96	51.7 Å²	51.7	58%	0.582	29%	0.291	S	S	*	.	H	α-helix	trans	-61.9	-45.6	178.5	179.9	0	0	0	0	110.6	S170 R174 M175 S176	S170-V172 PolarHBondContact O-N 3.27Å; S170-V172 PolarHBondContact OG-N 2.84Å; V172-R174 VanDerWaalsContact C-N 3.32Å; V172-R174 PolarHBondContact O-N 3.48Å; V172-M175 PolarHBondContact O-N 2.95Å; V172-S176 WeakPolarHBondContact O-CB 3.29Å; V172-S176 PolarHBondContact O-N 3.37Å; V172-S176 PolarHBondContact O-OG 3.15Å; V172-S176 VanDerWaalsContact O-OG 3.13Å
173	D	85.9	Confident	85.2	Confident	22 Å²	22	49 Å²	49	12%	0.118	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-41.6	178.3	-62.1	-47	0	0	0	111.8	V111 S112 L115 S170 S176 C177	V111-D173 HydrophobicContact CG1-CB 3.87Å; S112-D173 PolarHBondContact N-OD1 3Å; L115-D173 HydrophobicContact CD1-CB 4.09Å; L115-D173 WeakPolarHBondContact CD1-O 3Å; S170-D173 WeakPolarHBondContact CB-OD2 3.47Å; S170-D173 PolarHBondContact N-OD2 3.32Å; S170-D173 PolarHBondContact O-N 2.85Å; S170-D173 PolarHBondContact OG-N 3.3Å; S170-D173 PolarHBondContact OG-OD2 2.99Å; D173-S176 PolarHBondContact O-N 3.02Å; D173-C177 VanDerWaalsContact O-CB 3.23Å; D173-C177 WeakPolarHBondContact O-CB 3.42Å; D173-C177 PolarHBondContact O-N 2.95Å
174	R	88.5	Confident	84.6	Confident	68 Å²	68	49 Å²	49	26%	0.257	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-44.3	176.8	-66.3	178.3	-179.4	-177.7	3.2	111.8	I163 N166 S170 R171 V172 C177 L178 F212 M220	I163-R174 HydrophobicContact CG2-CG 3.81Å; N166-R174 PolarHBondContact O-NH2 3.41Å; S170-R174 PolarHBondContact O-N 2.64Å; R171-R174 PolarHBondContact O-N 3.02Å; V172-R174 VanDerWaalsContact C-N 3.32Å; V172-R174 PolarHBondContact O-N 3.48Å; R174-C177 WeakPolarHBondContact O-CB 3.39Å; R174-C177 PolarHBondContact O-N 3.46Å; R174-L178 WeakPolarHBondContact O-CG 3.4Å; R174-L178 PolarHBondContact O-N 2.94Å; R174-F212 HydrophobicContact CB-CE1 3.94Å; R174-F212 HydrophobicContact CG-CE1 4.01Å; R174-M220 HydrophobicContact CB-CE 3.86Å; R174-M220 HydrophobicContact CB-SD 4.36Å
175	M	85.4	Confident	84.1	Confident	50 Å²	50	48.2 Å²	48.2	25%	0.246	28%	0.278	C	S	.	.	H	α-helix	trans	-65.1	-43	176.4	-69.9	174	68.1	0	0	112.1	R171 V172 C177 L178 S179 Y219 M220	R171-M175 HydrophobicContact CG-CG 4.47Å; R171-M175 HydrophobicContact CG-SD 4.03Å; R171-M175 WeakPolarHBondContact O-CG 3.46Å; R171-M175 PolarHBondContact O-N 3.21Å; V172-M175 PolarHBondContact O-N 2.95Å; M175-C177 VanDerWaalsContact C-N 3.34Å; M175-L178 PolarHBondContact O-N 3.24Å; M175-S179 WeakPolarHBondContact O-CB 3.27Å; M175-S179 PolarHBondContact O-N 2.8Å; M175-S179 PolarHBondContact O-OG 3.37Å; M175-Y219 HydrophobicContact CB-CD1 4.2Å; M175-Y219 HydrophobicContact CB-CE1 4.05Å; M175-Y219 HydrophobicContact CE-CD1 3.42Å; M175-Y219 VanDerWaalsContact CE-CD1 3.42Å; M175-Y219 HydrophobicContact CE-CD2 4.42Å; M175-Y219 HydrophobicContact CE-CE1 3.87Å; M175-Y219 HydrophobicContact CE-CG 3.73Å; M175-Y219 HydrophobicContact CG-CD1 3.85Å; M175-Y219 HydrophobicContact CG-CE1 4.23Å; M175-Y219 HydrophobicContact SD-CD1 4.38Å; M175-M220 HydrophobicContact CG-CG 3.93Å
176	S	84.9	Confident	83.3	Confident	49 Å²	49	47.4 Å²	47.4	34%	0.343	27%	0.267	S	S	.	.	H	α-helix	trans	-64.1	-39.5	176.7	-67.3	0	0	0	0	111.8	V172 D173 S179 L180	V172-S176 WeakPolarHBondContact O-CB 3.29Å; V172-S176 PolarHBondContact O-N 3.37Å; V172-S176 PolarHBondContact O-OG 3.15Å; V172-S176 VanDerWaalsContact O-OG 3.13Å; D173-S176 PolarHBondContact O-N 3.02Å; S176-S179 PolarHBondContact O-N 3.38Å; S176-L180 WeakPolarHBondContact O-CB 3.35Å; S176-L180 PolarHBondContact O-N 3.31Å
177	C	89.7	Confident	82.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.7	-47.7	173.3	-178.3	0	0	0	0	111.8	L115 S160 I163 D173 R174 M175 L180 W181	L115-C177 HydrophobicContact CD1-CB 4.36Å; L115-C177 HydrophobicContact CD2-CB 4.01Å; S160-C177 WeakPolarHBondContact CB-SG 3.5Å; S160-C177 PolarHBondContact OG-SG 3.28Å; I163-C177 HydrophobicContact CD1-CB 4.09Å; D173-C177 VanDerWaalsContact O-CB 3.23Å; D173-C177 WeakPolarHBondContact O-CB 3.42Å; D173-C177 PolarHBondContact O-N 2.95Å; R174-C177 WeakPolarHBondContact O-CB 3.39Å; R174-C177 PolarHBondContact O-N 3.46Å; M175-C177 VanDerWaalsContact C-N 3.34Å; C177-L180 PolarHBondContact O-N 3.42Å; C177-W181 PolarHBondContact O-N 3.32Å
178	L	88.7	Confident	81.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.2	-43.1	176.3	-76	172.3	0	0	0	112.2	R174 M175 L180 W181 L182 M209 F212 M220 T223 S224 I227	R174-L178 WeakPolarHBondContact O-CG 3.4Å; R174-L178 PolarHBondContact O-N 2.94Å; M175-L178 PolarHBondContact O-N 3.24Å; L178-L180 VanDerWaalsContact C-N 3.29Å; L178-L180 PolarHBondContact O-N 3.42Å; L178-W181 PolarHBondContact O-N 2.92Å; L178-L182 PolarHBondContact O-N 3.04Å; L178-M209 HydrophobicContact CD2-CE 4.11Å; L178-M209 HydrophobicContact CD2-SD 4.38Å; L178-F212 HydrophobicContact CD1-CB 4.25Å; L178-F212 HydrophobicContact CD1-CD1 4.3Å; L178-F212 HydrophobicContact CD1-CD2 4.21Å; L178-F212 HydrophobicContact CD1-CG 4.01Å; L178-F212 HydrophobicContact CD2-CB 4.46Å; L178-F212 HydrophobicContact CD2-CD2 3.53Å; L178-F212 HydrophobicContact CD2-CE2 3.88Å; L178-F212 HydrophobicContact CD2-CG 4.12Å; L178-F212 HydrophobicContact CG-CD2 4.01Å; L178-F212 HydrophobicContact CG-CE2 4.09Å; L178-F212 HydrophobicContact CG-CG 4.33Å; L178-M220 HydrophobicContact CD1-CB 3.82Å; L178-M220 HydrophobicContact CD1-CE 4.34Å; L178-M220 HydrophobicContact CD1-CG 4Å; L178-T223 HydrophobicContact CB-CG2 3.7Å; L178-S224 VanDerWaalsContact CD2-OG 3.3Å; L178-S224 WeakPolarHBondContact CD2-OG 3.38Å; L178-I227 HydrophobicContact CB-CD1 4.44Å; L178-I227 HydrophobicContact CD2-CD1 3.67Å; L178-I227 WeakPolarHBondContact O-CD1 3.32Å
179	S	85.2	Confident	80.9	Confident	43 Å²	43	38.4 Å²	38.4	30%	0.301	21%	0.21	S	C	.	.	H	α-helix	trans	-58.4	-43.8	177.3	-55.8	0	0	0	0	111.6	M175 S176 L182 S183 Y219	M175-S179 WeakPolarHBondContact O-CB 3.27Å; M175-S179 PolarHBondContact O-N 2.8Å; M175-S179 PolarHBondContact O-OG 3.37Å; S176-S179 PolarHBondContact O-N 3.38Å; S179-L182 PolarHBondContact O-N 3.11Å; S179-S183 PolarHBondContact O-N 3.11Å; S179-Y219 PolarHBondContact OG-OH 2.91Å
180	L	85.4	Confident	79.8	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-45.7	177.9	177.7	57.2	0	0	0	111.4	L115 A118 N119 W122 L156 S176 C177 L178 L182 S183 L184	L115-L180 HydrophobicContact CD2-CD2 4.37Å; A118-L180 HydrophobicContact CB-CD2 3.46Å; A118-L180 VanDerWaalsContact CB-CD2 3.46Å; N119-L180 HydrophobicContact CB-CD1 4.01Å; W122-L180 HydrophobicContact CB-CD1 4.3Å; L156-L180 HydrophobicContact CD1-CD2 3.58Å; L156-L180 HydrophobicContact CD2-CD2 3.62Å; L156-L180 HydrophobicContact CD2-CG 3.88Å; L156-L180 HydrophobicContact CG-CD2 4.25Å; S176-L180 WeakPolarHBondContact O-CB 3.35Å; S176-L180 PolarHBondContact O-N 3.31Å; C177-L180 PolarHBondContact O-N 3.42Å; L178-L180 VanDerWaalsContact C-N 3.29Å; L178-L180 PolarHBondContact O-N 3.42Å; L180-L182 PolarHBondContact O-N 2.72Å; L180-S183 PolarHBondContact O-N 3.31Å; L180-L184 HydrophobicContact CD1-CD1 3.99Å; L180-L184 HydrophobicContact CD1-CG 4.32Å; L180-L184 HydrophobicContact CG-CD1 3.82Å; L180-L184 WeakPolarHBondContact O-CB 3.21Å; L180-L184 WeakPolarHBondContact O-CD1 3.45Å; L180-L184 WeakPolarHBondContact O-CG 3.11Å; L180-L184 PolarHBondContact O-N 3.3Å
181	W	86.9	Confident	78.9	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	25%	0.25	C	C	.	.	H	α-helix	trans	-61.2	-43.4	174.8	-86.6	110.4	0	0	0	112.7	L156 L157 S160 C177 L178 S183 L184 I185 W194 F197 M205 I227	L156-W181 HydrophobicContact CD2-CZ2 4.2Å; L156-W181 HydrophobicContact CG-CZ2 4.1Å; L157-W181 HydrophobicContact CB-CH2 4.22Å; L157-W181 HydrophobicContact CB-CZ2 3.79Å; L157-W181 HydrophobicContact CD1-CZ2 3.99Å; L157-W181 HydrophobicContact CG-CZ2 4.47Å; S160-W181 PolarHBondContact OG-NE1 2.78Å; C177-W181 PolarHBondContact O-N 3.32Å; L178-W181 PolarHBondContact O-N 2.92Å; W181-S183 VanDerWaalsContact C-N 3.3Å; W181-S183 PolarHBondContact O-N 3.14Å; W181-L184 HydrophobicContact CE3-CB 4.37Å; W181-L184 HydrophobicContact CE3-CD1 4.24Å; W181-L184 HydrophobicContact CZ3-CD1 4.43Å; W181-L184 WeakPolarHBondContact O-CB 3.49Å; W181-L184 PolarHBondContact O-N 2.78Å; W181-I185 HydrophobicContact CE3-CD1 4.28Å; W181-I185 HydrophobicContact CE3-CG1 4.22Å; W181-I185 WeakPolarHBondContact O-CB 3.43Å; W181-I185 WeakPolarHBondContact O-CD1 3.4Å; W181-I185 WeakPolarHBondContact O-CG1 3.49Å; W181-I185 PolarHBondContact O-N 3.38Å; W181-W194 HydrophobicContact CZ3-CH2 4.11Å; W181-W194 HydrophobicContact CZ3-CZ3 4.49Å; W181-F197 HydrophobicContact CH2-CE1 4.25Å; W181-F197 HydrophobicContact CH2-CZ 4.27Å; W181-F197 HydrophobicContact CZ3-CE1 4.45Å; W181-M205 HydrophobicContact CD2-CE 3.86Å; W181-M205 HydrophobicContact CD2-SD 4.39Å; W181-M205 HydrophobicContact CE3-CE 3.5Å; W181-M205 HydrophobicContact CE3-SD 4.44Å; W181-M205 HydrophobicContact CH2-CE 3.37Å; W181-M205 HydrophobicContact CZ2-CE 3.71Å; W181-M205 HydrophobicContact CZ3-CE 3.25Å; W181-I227 HydrophobicContact CB-CD1 3.69Å; W181-I227 HydrophobicContact CB-CG1 4.29Å
182	L	82.8	Confident	77.8	Confident	45 Å²	45	44.3 Å²	44.3	24%	0.236	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-45.2	176.1	-178.1	63.2	0	0	0	111	L178 S179 L180 L184 I185 S186 T223 Q226 I227	L178-L182 PolarHBondContact O-N 3.04Å; S179-L182 PolarHBondContact O-N 3.11Å; L180-L182 PolarHBondContact O-N 2.72Å; L182-L184 PolarHBondContact O-N 3.06Å; L182-I185 PolarHBondContact O-N 3.49Å; L182-S186 WeakPolarHBondContact O-CB 3.44Å; L182-S186 PolarHBondContact O-N 2.77Å; L182-S186 VanDerWaalsContact O-N 3.1Å; L182-S186 PolarHBondContact O-OG 2.73Å; L182-T223 HydrophobicContact CB-CG2 4.04Å; L182-T223 HydrophobicContact CD2-CG2 4.12Å; L182-Q226 HydrophobicContact CD1-CB 3.81Å; L182-I227 HydrophobicContact CB-CD1 4.46Å; L182-I227 HydrophobicContact CB-CG1 4.06Å; L182-I227 HydrophobicContact CD1-CG1 4.31Å
183	S	77.7	Confident	77	Confident	42 Å²	42	46 Å²	46	29%	0.294	26%	0.256	S	S	.	.	H	α-helix	trans	-64.3	-38.2	177.1	-173.1	0	0	0	0	112.9	W122 S179 L180 W181 S186 T187	W122-S183 PolarHBondContact NE1-O 3.46Å; S179-S183 PolarHBondContact O-N 3.11Å; L180-S183 PolarHBondContact O-N 3.31Å; W181-S183 VanDerWaalsContact C-N 3.3Å; W181-S183 PolarHBondContact O-N 3.14Å; S183-S186 PolarHBondContact O-OG 3.25Å; S183-T187 PolarHBondContact O-OG1 3.19Å
184	L	79	Confident	76.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-47.4	177.9	-89.3	159.6	0	0	0	111.8	W122 L156 L180 W181 L182 T187 M188	W122-L184 HydrophobicContact CD2-CD2 3.29Å; W122-L184 HydrophobicContact CD2-CG 3.88Å; W122-L184 HydrophobicContact CE3-CD2 3.16Å; W122-L184 HydrophobicContact CE3-CG 4.22Å; W122-L184 HydrophobicContact CG-CD2 3.99Å; W122-L184 HydrophobicContact CG-CG 4.12Å; W122-L184 HydrophobicContact CH2-CD2 3.77Å; W122-L184 HydrophobicContact CZ2-CD2 3.84Å; W122-L184 HydrophobicContact CZ3-CD2 3.38Å; L156-L184 HydrophobicContact CD2-CD1 3.12Å; L180-L184 HydrophobicContact CD1-CD1 3.99Å; L180-L184 HydrophobicContact CD1-CG 4.32Å; L180-L184 HydrophobicContact CG-CD1 3.82Å; L180-L184 WeakPolarHBondContact O-CB 3.21Å; L180-L184 WeakPolarHBondContact O-CD1 3.45Å; L180-L184 WeakPolarHBondContact O-CG 3.11Å; L180-L184 PolarHBondContact O-N 3.3Å; W181-L184 HydrophobicContact CE3-CB 4.37Å; W181-L184 HydrophobicContact CE3-CD1 4.24Å; W181-L184 HydrophobicContact CZ3-CD1 4.43Å; W181-L184 WeakPolarHBondContact O-CB 3.49Å; W181-L184 PolarHBondContact O-N 2.78Å; L182-L184 PolarHBondContact O-N 3.06Å; L184-T187 PolarHBondContact O-N 3.11Å; L184-T187 PolarHBondContact O-OG1 3.03Å; L184-M188 HydrophobicContact CB-CE 3.69Å; L184-M188 HydrophobicContact CD2-CE 3.53Å; L184-M188 HydrophobicContact CD2-SD 4.41Å; L184-M188 HydrophobicContact CG-CE 4.2Å; L184-M188 WeakPolarHBondContact O-CB 3.37Å; L184-M188 WeakPolarHBondContact O-CE 3.31Å; L184-M188 WeakPolarHBondContact O-CG 3.23Å; L184-M188 PolarHBondContact O-N 3.37Å
185	I	75.6	Confident	75.5	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-70.8	-39.9	-174.8	-61.7	168.3	0	0	0	110.4	W181 L182 T187 K189 W194 I227 C230 L231	W181-I185 HydrophobicContact CE3-CD1 4.28Å; W181-I185 HydrophobicContact CE3-CG1 4.22Å; W181-I185 WeakPolarHBondContact O-CB 3.43Å; W181-I185 WeakPolarHBondContact O-CD1 3.4Å; W181-I185 WeakPolarHBondContact O-CG1 3.49Å; W181-I185 PolarHBondContact O-N 3.38Å; L182-I185 PolarHBondContact O-N 3.49Å; I185-T187 PolarHBondContact O-N 2.99Å; I185-T187 VanDerWaalsContact O-N 3.14Å; I185-K189 WeakPolarHBondContact O-CG 3.48Å; I185-K189 PolarHBondContact O-N 3.44Å; I185-W194 HydrophobicContact CB-CZ2 4.14Å; I185-W194 HydrophobicContact CG1-CH2 3.87Å; I185-W194 HydrophobicContact CG1-CZ2 3.63Å; I185-W194 HydrophobicContact CG2-CZ2 4.05Å; I185-I227 HydrophobicContact CD1-CB 4.14Å; I185-I227 HydrophobicContact CD1-CG1 4.18Å; I185-I227 HydrophobicContact CD1-CG2 3.35Å; I185-C230 HydrophobicContact CB-CB 4.44Å; I185-C230 HydrophobicContact CG2-CB 3.33Å; I185-L231 HydrophobicContact CD1-CD1 4.44Å; I185-L231 HydrophobicContact CD1-CD2 3.82Å; I185-L231 HydrophobicContact CD1-CG 4.01Å; I185-L231 HydrophobicContact CG1-CD2 4.33Å
186	S	69.9	Low	75.1	Confident	68 Å²	68	44 Å²	44	48%	0.476	26%	0.257	S	S	.	.	H	α-helix	trans	-60.7	-25.6	179.8	67.3	0	0	0	0	113.4	L182 S183	L182-S186 WeakPolarHBondContact O-CB 3.44Å; L182-S186 PolarHBondContact O-N 2.77Å; L182-S186 VanDerWaalsContact O-N 3.1Å; L182-S186 PolarHBondContact O-OG 2.73Å; S183-S186 PolarHBondContact O-OG 3.25Å
187	T	67.5	Low	74.9	Confident	46 Å²	46	43.2 Å²	43.2	28%	0.282	25%	0.247	S	C	.	.	H	α-helix	trans	-104.2	-31.8	-174.4	35.9	0	0	0	0	112.4	W122 S183 L184 I185 K189	W122-T187 WeakPolarHBondContact CZ2-OG1 3.43Å; W122-T187 PolarHBondContact NE1-OG1 2.81Å; S183-T187 PolarHBondContact O-OG1 3.19Å; L184-T187 PolarHBondContact O-N 3.11Å; L184-T187 PolarHBondContact O-OG1 3.03Å; I185-T187 PolarHBondContact O-N 2.99Å; I185-T187 VanDerWaalsContact O-N 3.14Å; T187-K189 VanDerWaalsContact C-N 3.34Å; T187-K189 PolarHBondContact O-N 3.34Å
188	M	67.1	Low	74.5	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-77	-12.6	176.5	-73	-167.7	-75.8	0	0	115.1	W122 P153 L184 N190 L191 W194	W122-M188 HydrophobicContact CH2-CE 4.33Å; W122-M188 HydrophobicContact CH2-CG 3.26Å; W122-M188 HydrophobicContact CH2-SD 3.81Å; W122-M188 HydrophobicContact CZ2-CG 3.66Å; W122-M188 HydrophobicContact CZ3-CG 4.28Å; W122-M188 HydrophobicContact CZ3-SD 4.3Å; P153-M188 HydrophobicContact CG-SD 4.43Å; L184-M188 HydrophobicContact CB-CE 3.69Å; L184-M188 HydrophobicContact CD2-CE 3.53Å; L184-M188 HydrophobicContact CD2-SD 4.41Å; L184-M188 HydrophobicContact CG-CE 4.2Å; L184-M188 WeakPolarHBondContact O-CB 3.37Å; L184-M188 WeakPolarHBondContact O-CE 3.31Å; L184-M188 WeakPolarHBondContact O-CG 3.23Å; L184-M188 PolarHBondContact O-N 3.37Å; M188-N190 PolarHBondContact O-N 3.05Å; M188-L191 HydrophobicContact CB-CD1 4.45Å; M188-L191 HydrophobicContact CG-CD1 4.06Å; M188-L191 PolarHBondContact O-N 3.49Å; M188-W194 HydrophobicContact CB-CB 4.07Å; M188-W194 HydrophobicContact CB-CD2 3.49Å; M188-W194 VanDerWaalsContact CB-CD2 3.49Å; M188-W194 HydrophobicContact CB-CE3 3.82Å; M188-W194 HydrophobicContact CB-CG 3.62Å; M188-W194 HydrophobicContact CE-CD2 4.14Å; M188-W194 HydrophobicContact CE-CE3 3.4Å; M188-W194 HydrophobicContact CE-CH2 3.5Å; M188-W194 VanDerWaalsContact CE-CH2 3.5Å; M188-W194 HydrophobicContact CE-CZ2 4.21Å; M188-W194 HydrophobicContact CE-CZ3 3.03Å; M188-W194 HydrophobicContact CG-CD2 4.39Å; M188-W194 HydrophobicContact CG-CE3 4.24Å; M188-W194 VanDerWaalsContact O-CB 3.27Å; M188-W194 WeakPolarHBondContact O-CB 3.3Å; M188-W194 VanDerWaalsContact O-CD1 3.31Å; M188-W194 HydrophobicContact SD-CD2 4.12Å; M188-W194 HydrophobicContact SD-CE3 3.41Å; M188-W194 HydrophobicContact SD-CZ3 3.7Å
189	K	61.6	Low	74	Confident	49 Å²	49	46.1 Å²	46.1	21%	0.213	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-28	177.6	-85.3	178.7	179.6	-163.1	0	113.6	I185 T187 V234 E335	I185-K189 WeakPolarHBondContact O-CG 3.48Å; I185-K189 PolarHBondContact O-N 3.44Å; T187-K189 VanDerWaalsContact C-N 3.34Å; T187-K189 PolarHBondContact O-N 3.34Å; K189-V234 HydrophobicContact CG-CG2 4.36Å; K189-E335 IonicContact NZ-OE1 2.74Å; K189-E335 IonicContact NZ-OE2 3.31Å
190	N	60	Low	74	Confident	149 Å²	149	49.5 Å²	49.5	80%	0.797	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-2.9	-178.2	-61.9	-30.6	0	0	0	114.8	M188	M188-N190 PolarHBondContact O-N 3.05Å
191	L	65.9	Low	74.1	Confident	89 Å²	89	49.5 Å²	49.5	47%	0.466	28%	0.278	S	S	.	.			trans	-95.3	124.1	-177.5	-61	178.2	0	0	0	110.8	M188 K193 W194	M188-L191 HydrophobicContact CB-CD1 4.45Å; M188-L191 HydrophobicContact CG-CD1 4.06Å; M188-L191 PolarHBondContact O-N 3.49Å; L191-K193 PolarHBondContact O-N 2.93Å; L191-K193 VanDerWaalsContact O-N 3.1Å; L191-W194 HydrophobicContact CB-CB 4.17Å; L191-W194 WeakPolarHBondContact O-CB 3.44Å; L191-W194 PolarHBondContact O-N 3.48Å
192	S	62	Low	74.2	Confident	105 Å²	105	49.8 Å²	49.8	73%	0.734	28%	0.279	S	S	*	.	H	α-helix	trans	-55.8	-32.9	179.8	58.3	0	0	0	0	113.9
193	K	66.1	Low	74.6	Confident	131 Å²	131	51.2 Å²	51.2	57%	0.57	29%	0.291	S	S	*	.	H	α-helix	trans	-74.8	-22.5	179.3	-62.2	-175.3	177.2	-173.1	0	113.7	E150 L191 N195 S196 F197	E150-K193 WeakPolarHBondContact OE1-CD 3.33Å; E150-K193 WeakPolarHBondContact OE1-CE 3.47Å; E150-K193 IonicContact OE1-NZ 2.75Å; E150-K193 PolarHBondContact OE1-NZ 3.18Å; L191-K193 PolarHBondContact O-N 2.93Å; L191-K193 VanDerWaalsContact O-N 3.1Å; K193-N195 VanDerWaalsContact C-N 3.32Å; K193-N195 PolarHBondContact O-N 3.2Å; K193-S196 PolarHBondContact O-N 2.97Å; K193-F197 PolarHBondContact O-N 3.36Å; K193-F197 VanDerWaalsContact O-N 3.07Å
194	W	72	Confident	75.2	Confident	6 Å²	6	51.5 Å²	51.5	2%	0.023	29%	0.291	C	S	.	.	H	α-helix	trans	-60.3	-42.5	-180	174	-122.4	0	0	0	111.8	W181 I185 M188 L191 S196 F197 L198 L231	W181-W194 HydrophobicContact CZ3-CH2 4.11Å; W181-W194 HydrophobicContact CZ3-CZ3 4.49Å; I185-W194 HydrophobicContact CB-CZ2 4.14Å; I185-W194 HydrophobicContact CG1-CH2 3.87Å; I185-W194 HydrophobicContact CG1-CZ2 3.63Å; I185-W194 HydrophobicContact CG2-CZ2 4.05Å; M188-W194 HydrophobicContact CB-CB 4.07Å; M188-W194 HydrophobicContact CB-CD2 3.49Å; M188-W194 VanDerWaalsContact CB-CD2 3.49Å; M188-W194 HydrophobicContact CB-CE3 3.82Å; M188-W194 HydrophobicContact CB-CG 3.62Å; M188-W194 HydrophobicContact CE-CD2 4.14Å; M188-W194 HydrophobicContact CE-CE3 3.4Å; M188-W194 HydrophobicContact CE-CH2 3.5Å; M188-W194 VanDerWaalsContact CE-CH2 3.5Å; M188-W194 HydrophobicContact CE-CZ2 4.21Å; M188-W194 HydrophobicContact CE-CZ3 3.03Å; M188-W194 HydrophobicContact CG-CD2 4.39Å; M188-W194 HydrophobicContact CG-CE3 4.24Å; M188-W194 VanDerWaalsContact O-CB 3.27Å; M188-W194 WeakPolarHBondContact O-CB 3.3Å; M188-W194 VanDerWaalsContact O-CD1 3.31Å; M188-W194 HydrophobicContact SD-CD2 4.12Å; M188-W194 HydrophobicContact SD-CE3 3.41Å; M188-W194 HydrophobicContact SD-CZ3 3.7Å; L191-W194 HydrophobicContact CB-CB 4.17Å; L191-W194 WeakPolarHBondContact O-CB 3.44Å; L191-W194 PolarHBondContact O-N 3.48Å; W194-S196 VanDerWaalsContact C-N 3.29Å; W194-S196 PolarHBondContact O-N 2.67Å; W194-F197 AromaticContact CE3-CD1 3.77Å; W194-F197 HydrophobicContact CE3-CD1 3.77Å; W194-F197 HydrophobicContact CE3-CE1 4.47Å; W194-F197 HydrophobicContact CH2-CD1 4.27Å; W194-F197 HydrophobicContact CH2-CE1 4.28Å; W194-F197 AromaticContact CZ3-CD1 3.38Å; W194-F197 HydrophobicContact CZ3-CD1 3.38Å; W194-F197 AromaticContact CZ3-CE1 3.64Å; W194-F197 HydrophobicContact CZ3-CE1 3.64Å; W194-F197 PolarHBondContact O-N 2.63Å; W194-L198 HydrophobicContact CD2-CD1 4.07Å; W194-L198 HydrophobicContact CD2-CD2 4.44Å; W194-L198 HydrophobicContact CD2-CG 3.84Å; W194-L198 HydrophobicContact CE3-CD2 4.38Å; W194-L198 HydrophobicContact CE3-CG 4.13Å; W194-L198 HydrophobicContact CG-CD1 4.45Å; W194-L198 HydrophobicContact CG-CG 4.47Å; W194-L198 HydrophobicContact CH2-CD1 4.3Å; W194-L198 HydrophobicContact CH2-CD2 3.32Å; W194-L198 HydrophobicContact CH2-CG 3.83Å; W194-L198 HydrophobicContact CZ2-CD1 3.47Å; W194-L198 VanDerWaalsContact CZ2-CD1 3.47Å; W194-L198 HydrophobicContact CZ2-CD2 3.37Å; W194-L198 HydrophobicContact CZ2-CG 3.5Å; W194-L198 VanDerWaalsContact CZ2-CG 3.5Å; W194-L198 HydrophobicContact CZ3-CD2 3.86Å; W194-L198 HydrophobicContact CZ3-CG 4.12Å; W194-L198 VanDerWaalsContact NE1-CD1 3.32Å; W194-L198 WeakPolarHBondContact O-CB 3.19Å; W194-L198 WeakPolarHBondContact O-CG 3.4Å; W194-L198 PolarHBondContact O-N 3.14Å; W194-L231 HydrophobicContact CZ2-CD2 4.17Å
195	N	72.2	Confident	75.7	Confident	15 Å²	15	51.5 Å²	51.5	8%	0.08	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-38.1	179.5	-61.2	16.5	0	0	0	111.3	K193 R199 V234 D238 K242	K193-N195 VanDerWaalsContact C-N 3.32Å; K193-N195 PolarHBondContact O-N 3.2Å; N195-R199 WeakPolarHBondContact O-CG 3.31Å; N195-R199 PolarHBondContact O-N 3.26Å; N195-V234 HydrophobicContact CB-CG1 4.05Å; N195-V234 WeakPolarHBondContact OD1-CG1 3.34Å; N195-D238 PolarHBondContact ND2-OD1 2.82Å; N195-K242 PolarHBondContact ND2-NZ 2.89Å
196	S	75.7	Confident	76.4	Confident	77 Å²	77	52.9 Å²	52.9	54%	0.538	30%	0.296	S	S	.	.	H	α-helix	trans	-65.6	-49.3	175.7	178.5	0	0	0	0	111.7	K193 W194 L198 R199 T200	K193-S196 PolarHBondContact O-N 2.97Å; W194-S196 VanDerWaalsContact C-N 3.29Å; W194-S196 PolarHBondContact O-N 2.67Å; S196-L198 VanDerWaalsContact C-N 3.31Å; S196-L198 PolarHBondContact O-N 3Å; S196-R199 PolarHBondContact O-N 3.18Å; S196-T200 PolarHBondContact O-N 3.45Å; S196-T200 VanDerWaalsContact O-N 3.1Å; S196-T200 PolarHBondContact O-OG1 2.84Å
197	F	81	Confident	77.4	Confident	33 Å²	33	53 Å²	53	15%	0.145	30%	0.297	C	S	.	.	H	α-helix	trans	-56.7	-46.1	175.7	168.1	-96.1	0	0	0	111.7	P153 K154 L157 W181 K193 W194 R199 T200 S201	P153-F197 HydrophobicContact CB-CD1 4.45Å; P153-F197 HydrophobicContact CB-CD2 4.34Å; P153-F197 HydrophobicContact CB-CE1 3.99Å; P153-F197 HydrophobicContact CB-CE2 3.87Å; P153-F197 HydrophobicContact CB-CZ 3.67Å; K154-F197 HydrophobicContact CB-CE2 4.1Å; K154-F197 HydrophobicContact CD-CE2 4.43Å; L157-F197 HydrophobicContact CD2-CZ 4.29Å; W181-F197 HydrophobicContact CH2-CE1 4.25Å; W181-F197 HydrophobicContact CH2-CZ 4.27Å; W181-F197 HydrophobicContact CZ3-CE1 4.45Å; K193-F197 PolarHBondContact O-N 3.36Å; K193-F197 VanDerWaalsContact O-N 3.07Å; W194-F197 AromaticContact CE3-CD1 3.77Å; W194-F197 HydrophobicContact CE3-CD1 3.77Å; W194-F197 HydrophobicContact CE3-CE1 4.47Å; W194-F197 HydrophobicContact CH2-CD1 4.27Å; W194-F197 HydrophobicContact CH2-CE1 4.28Å; W194-F197 AromaticContact CZ3-CD1 3.38Å; W194-F197 HydrophobicContact CZ3-CD1 3.38Å; W194-F197 AromaticContact CZ3-CE1 3.64Å; W194-F197 HydrophobicContact CZ3-CE1 3.64Å; W194-F197 PolarHBondContact O-N 2.63Å; F197-R199 VanDerWaalsContact C-N 3.34Å; F197-R199 PolarHBondContact O-N 3.38Å; F197-T200 PolarHBondContact O-N 3.35Å; F197-S201 VanDerWaalsContact CE2-OG 3.31Å; F197-S201 WeakPolarHBondContact CE2-OG 3.31Å; F197-S201 VanDerWaalsContact O-CB 3.23Å; F197-S201 WeakPolarHBondContact O-CB 3.1Å; F197-S201 PolarHBondContact O-N 3.25Å; F197-S201 PolarHBondContact O-OG 2.92Å
198	L	81.3	Confident	78.4	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-42.2	-179.7	-80.7	-169.6	0	0	0	112.3	W194 S196 S201 W202 L231 V234 F235	W194-L198 HydrophobicContact CD2-CD1 4.07Å; W194-L198 HydrophobicContact CD2-CD2 4.44Å; W194-L198 HydrophobicContact CD2-CG 3.84Å; W194-L198 HydrophobicContact CE3-CD2 4.38Å; W194-L198 HydrophobicContact CE3-CG 4.13Å; W194-L198 HydrophobicContact CG-CD1 4.45Å; W194-L198 HydrophobicContact CG-CG 4.47Å; W194-L198 HydrophobicContact CH2-CD1 4.3Å; W194-L198 HydrophobicContact CH2-CD2 3.32Å; W194-L198 HydrophobicContact CH2-CG 3.83Å; W194-L198 HydrophobicContact CZ2-CD1 3.47Å; W194-L198 VanDerWaalsContact CZ2-CD1 3.47Å; W194-L198 HydrophobicContact CZ2-CD2 3.37Å; W194-L198 HydrophobicContact CZ2-CG 3.5Å; W194-L198 VanDerWaalsContact CZ2-CG 3.5Å; W194-L198 HydrophobicContact CZ3-CD2 3.86Å; W194-L198 HydrophobicContact CZ3-CG 4.12Å; W194-L198 VanDerWaalsContact NE1-CD1 3.32Å; W194-L198 WeakPolarHBondContact O-CB 3.19Å; W194-L198 WeakPolarHBondContact O-CG 3.4Å; W194-L198 PolarHBondContact O-N 3.14Å; S196-L198 VanDerWaalsContact C-N 3.31Å; S196-L198 PolarHBondContact O-N 3Å; L198-S201 CarbonylContact O-C 3.57Å; L198-S201 PolarHBondContact O-N 3.33Å; L198-W202 WeakPolarHBondContact O-CA 3.15Å; L198-W202 WeakPolarHBondContact O-CB 3.38Å; L198-W202 PolarHBondContact O-N 3.45Å; L198-L231 HydrophobicContact CD1-CD2 3.71Å; L198-L231 HydrophobicContact CD2-CD2 3.31Å; L198-L231 HydrophobicContact CG-CD2 4.15Å; L198-V234 HydrophobicContact CD1-CB 3.85Å; L198-V234 HydrophobicContact CD1-CG1 3.84Å; L198-V234 HydrophobicContact CD1-CG2 3.88Å; L198-F235 HydrophobicContact CB-CE1 4.26Å; L198-F235 HydrophobicContact CB-CZ 4.42Å
199	R	78.8	Confident	79.4	Confident	62 Å²	62	50.7 Å²	50.7	23%	0.234	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-49.5	176.8	-76.5	179	172.7	-100.9	-6.1	112	N195 S196 F197 S201 W202 F235 D238 E244	N195-R199 WeakPolarHBondContact O-CG 3.31Å; N195-R199 PolarHBondContact O-N 3.26Å; S196-R199 PolarHBondContact O-N 3.18Å; F197-R199 VanDerWaalsContact C-N 3.34Å; F197-R199 PolarHBondContact O-N 3.38Å; R199-S201 VanDerWaalsContact C-N 3.27Å; R199-S201 PolarHBondContact O-N 3.05Å; R199-W202 PolarHBondContact O-N 3.32Å; R199-F235 HydrophobicContact CG-CD1 4.36Å; R199-F235 HydrophobicContact CG-CE1 3.9Å; R199-D238 IonicContact CZ-OD2 2.67Å; R199-D238 IonicContact NE-OD2 3.25Å; R199-D238 PolarHBondContact NE-OD2 3.28Å; R199-D238 IonicContact NH2-OD2 3.22Å; R199-D238 PolarHBondContact NH2-OD2 3.44Å; R199-E244 IonicContact CZ-OE2 2.63Å; R199-E244 IonicContact NE-OE2 3.96Å; R199-E244 PolarHBondContact NE-OE2 3.35Å; R199-E244 IonicContact NH1-OE2 3.51Å; R199-E244 PolarHBondContact NH1-OE2 2.82Å; R199-E244 IonicContact NH2-OE2 2.7Å; R199-E244 PolarHBondContact NH2-OE2 2.95Å
200	T	84.5	Confident	80.6	Confident	113 Å²	113	49.3 Å²	49.3	69%	0.693	28%	0.278	S	S	*	.	H	α-helix	trans	-64.5	-34.7	-179.6	-55.6	0	0	0	0	112	S196 F197	S196-T200 PolarHBondContact O-N 3.45Å; S196-T200 VanDerWaalsContact O-N 3.1Å; S196-T200 PolarHBondContact O-OG1 2.84Å; F197-T200 PolarHBondContact O-N 3.35Å
201	S	87.7	Confident	81.9	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-97.9	1.8	-177.1	-58.7	0	0	0	0	113.8	F197 L198 R199 T204 M205	F197-S201 VanDerWaalsContact CE2-OG 3.31Å; F197-S201 WeakPolarHBondContact CE2-OG 3.31Å; F197-S201 VanDerWaalsContact O-CB 3.23Å; F197-S201 WeakPolarHBondContact O-CB 3.1Å; F197-S201 PolarHBondContact O-N 3.25Å; F197-S201 PolarHBondContact O-OG 2.92Å; L198-S201 CarbonylContact O-C 3.57Å; L198-S201 PolarHBondContact O-N 3.33Å; R199-S201 VanDerWaalsContact C-N 3.27Å; R199-S201 PolarHBondContact O-N 3.05Å; S201-T204 PolarHBondContact O-N 3.34Å; S201-T204 VanDerWaalsContact O-N 3.17Å; S201-M205 PolarHBondContact O-N 3.49Å
202	W	90.4	Very high	82.8	Confident	7 Å²	7	41.4 Å²	41.4	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-56.2	-47.7	-173	171.8	-126.7	0	0	0	113.4	L198 R199 T204 M205 R206 L228 L231 L232 F235 D250 V251 I256	L198-W202 WeakPolarHBondContact O-CA 3.15Å; L198-W202 WeakPolarHBondContact O-CB 3.38Å; L198-W202 PolarHBondContact O-N 3.45Å; R199-W202 PolarHBondContact O-N 3.32Å; W202-T204 PolarHBondContact O-N 3.19Å; W202-M205 HydrophobicContact CE3-CB 4.38Å; W202-M205 PolarHBondContact O-N 2.95Å; W202-R206 HydrophobicContact CD2-CB 4.1Å; W202-R206 HydrophobicContact CE3-CB 4.12Å; W202-R206 HydrophobicContact CH2-CB 4Å; W202-R206 HydrophobicContact CH2-CG 4.16Å; W202-R206 HydrophobicContact CZ2-CB 3.97Å; W202-R206 HydrophobicContact CZ2-CG 3.97Å; W202-R206 HydrophobicContact CZ3-CB 4.06Å; W202-R206 VanDerWaalsContact O-CB 3.23Å; W202-R206 WeakPolarHBondContact O-CB 3.29Å; W202-R206 PolarHBondContact O-N 3.31Å; W202-L228 HydrophobicContact CH2-CD1 3.81Å; W202-L228 HydrophobicContact CZ3-CD1 4.38Å; W202-L231 HydrophobicContact CZ3-CB 4.19Å; W202-L231 HydrophobicContact CZ3-CD1 4.1Å; W202-L232 HydrophobicContact CH2-CD2 4.02Å; W202-L232 HydrophobicContact CZ2-CD2 4.24Å; W202-F235 HydrophobicContact CB-CZ 3.86Å; W202-F235 AromaticContact CD2-CE2 3.46Å; W202-F235 HydrophobicContact CD2-CE2 3.46Å; W202-F235 VanDerWaalsContact CD2-CE2 3.46Å; W202-F235 AromaticContact CD2-CZ 3.68Å; W202-F235 HydrophobicContact CD2-CZ 3.68Å; W202-F235 AromaticContact CE2-CE2 3.79Å; W202-F235 AromaticContact CE3-CE2 3.48Å; W202-F235 HydrophobicContact CE3-CE2 3.48Å; W202-F235 VanDerWaalsContact CE3-CE2 3.48Å; W202-F235 AromaticContact CE3-CZ 3.76Å; W202-F235 HydrophobicContact CE3-CZ 3.76Å; W202-F235 AromaticContact CG-CE2 3.96Å; W202-F235 HydrophobicContact CG-CE2 3.96Å; W202-F235 AromaticContact CG-CZ 3.74Å; W202-F235 HydrophobicContact CG-CZ 3.74Å; W202-F235 HydrophobicContact CH2-CE2 4.12Å; W202-F235 HydrophobicContact CZ2-CE2 4.1Å; W202-F235 AromaticContact CZ3-CE2 3.83Å; W202-F235 HydrophobicContact CZ3-CE2 3.83Å; W202-D250 PolarHBondContact NE1-O 3.38Å; W202-V251 WeakPolarHBondContact CZ2-O 3.38Å; W202-V251 PolarHBondContact NE1-O 3.2Å; W202-V251 VanDerWaalsContact NE1-O 3.15Å; W202-I256 HydrophobicContact CH2-CD1 4.35Å; W202-I256 HydrophobicContact CZ2-CD1 4.1Å
203	P	90.4	Very high	83.7	Confident	74 Å²	74	36.5 Å²	36.5	48%	0.481	20%	0.204	S	C	.	.	H	α-helix	trans	-58	-39.2	-179.4	-25.6	35.8	0	0	0	112.7	S207	P203-S207 WeakPolarHBondContact O-CB 3.12Å; P203-S207 PolarHBondContact O-N 2.83Å
204	T	91.1	Very high	84.4	Confident	48 Å²	48	33.7 Å²	33.7	29%	0.294	20%	0.199	S	C	.	.	H	α-helix	trans	-71.7	-44.5	177.9	-52.1	0	0	0	0	111.5	L157 V161 S201 W202 S207 L208	L157-T204 HydrophobicContact CD1-CG2 4.03Å; L157-T204 HydrophobicContact CD2-CG2 3.85Å; L157-T204 HydrophobicContact CG-CG2 3.8Å; V161-T204 HydrophobicContact CG2-CG2 3.52Å; S201-T204 PolarHBondContact O-N 3.34Å; S201-T204 VanDerWaalsContact O-N 3.17Å; W202-T204 PolarHBondContact O-N 3.19Å; T204-S207 PolarHBondContact O-N 2.86Å; T204-L208 WeakPolarHBondContact O-CB 3.33Å; T204-L208 PolarHBondContact O-N 3.31Å
205	M	89.2	Confident	84.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.8	-42.9	177.8	-174.3	61.8	76.3	0	0	111.9	L157 W181 S201 W202 L208 M209 L231	L157-M205 HydrophobicContact CD1-CE 3.99Å; L157-M205 HydrophobicContact CD1-SD 4.27Å; W181-M205 HydrophobicContact CD2-CE 3.86Å; W181-M205 HydrophobicContact CD2-SD 4.39Å; W181-M205 HydrophobicContact CE3-CE 3.5Å; W181-M205 HydrophobicContact CE3-SD 4.44Å; W181-M205 HydrophobicContact CH2-CE 3.37Å; W181-M205 HydrophobicContact CZ2-CE 3.71Å; W181-M205 HydrophobicContact CZ3-CE 3.25Å; S201-M205 PolarHBondContact O-N 3.49Å; W202-M205 HydrophobicContact CE3-CB 4.38Å; W202-M205 PolarHBondContact O-N 2.95Å; M205-L208 WeakPolarHBondContact O-CB 3.12Å; M205-L208 PolarHBondContact O-N 3.01Å; M205-L208 HydrophobicContact SD-CD2 4.26Å; M205-M209 WeakPolarHBondContact O-CG 3.34Å; M205-M209 PolarHBondContact O-N 3.04Å; M205-M209 HydrophobicContact SD-CE 4.13Å; M205-L231 HydrophobicContact CG-CD1 3.27Å; M205-L231 HydrophobicContact CG-CD2 4.26Å; M205-L231 HydrophobicContact CG-CG 4.4Å; M205-L231 HydrophobicContact SD-CD1 4.09Å
206	R	90.3	Very high	84.6	Confident	29 Å²	29	40.7 Å²	40.7	11%	0.109	24%	0.239	C	C	.	.	H	α-helix	trans	-57	-54	173.1	-174.8	177.6	75.2	-152.5	3.7	109.8	W202 L208 M209 L210 D250 V251 Q255 I256	W202-R206 HydrophobicContact CD2-CB 4.1Å; W202-R206 HydrophobicContact CE3-CB 4.12Å; W202-R206 HydrophobicContact CH2-CB 4Å; W202-R206 HydrophobicContact CH2-CG 4.16Å; W202-R206 HydrophobicContact CZ2-CB 3.97Å; W202-R206 HydrophobicContact CZ2-CG 3.97Å; W202-R206 HydrophobicContact CZ3-CB 4.06Å; W202-R206 VanDerWaalsContact O-CB 3.23Å; W202-R206 WeakPolarHBondContact O-CB 3.29Å; W202-R206 PolarHBondContact O-N 3.31Å; R206-L208 VanDerWaalsContact C-N 3.29Å; R206-L208 PolarHBondContact O-N 3.23Å; R206-M209 PolarHBondContact O-N 3.3Å; R206-M209 VanDerWaalsContact O-N 3.14Å; R206-L210 HydrophobicContact CG-CD1 3.98Å; R206-L210 HydrophobicContact CG-CG 4.22Å; R206-L210 WeakPolarHBondContact O-CB 3.41Å; R206-L210 VanDerWaalsContact O-CG 3.24Å; R206-L210 WeakPolarHBondContact O-CG 3.29Å; R206-L210 PolarHBondContact O-N 3.36Å; R206-D250 PolarHBondContact NH1-O 3.3Å; R206-V251 VanDerWaalsContact CD-O 3.28Å; R206-V251 WeakPolarHBondContact CD-O 3.43Å; R206-V251 PolarHBondContact NH1-O 3.02Å; R206-Q255 VanDerWaalsContact CZ-OE1 3.29Å; R206-Q255 VanDerWaalsContact NE-OE1 3.08Å; R206-I256 HydrophobicContact CG-CD1 4.38Å; R206-I256 HydrophobicContact CG-CG1 4.34Å
207	S	89.9	Confident	84.6	Confident	71 Å²	71	37.8 Å²	37.8	50%	0.497	22%	0.217	S	C	.	.	H	α-helix	trans	-55	-43.5	177.6	-175.4	0	0	0	0	112.6	P203 T204 L210 T211	P203-S207 WeakPolarHBondContact O-CB 3.12Å; P203-S207 PolarHBondContact O-N 2.83Å; T204-S207 PolarHBondContact O-N 2.86Å; S207-L210 PolarHBondContact O-N 2.86Å; S207-T211 PolarHBondContact O-N 3.4Å; S207-T211 PolarHBondContact O-OG1 3.16Å
208	L	89.7	Confident	84.2	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-60	-49.5	176.1	-177.3	69.8	0	0	0	111.6	L157 S160 T204 M205 R206 L210 T211 F212	L157-L208 HydrophobicContact CD1-CD2 3.99Å; S160-L208 WeakPolarHBondContact O-CD1 3.28Å; T204-L208 WeakPolarHBondContact O-CB 3.33Å; T204-L208 PolarHBondContact O-N 3.31Å; M205-L208 WeakPolarHBondContact O-CB 3.12Å; M205-L208 PolarHBondContact O-N 3.01Å; M205-L208 HydrophobicContact SD-CD2 4.26Å; R206-L208 VanDerWaalsContact C-N 3.29Å; R206-L208 PolarHBondContact O-N 3.23Å; L208-L210 PolarHBondContact O-N 3.04Å; L208-T211 PolarHBondContact O-N 3.14Å; L208-F212 HydrophobicContact CD1-CD2 4.37Å; L208-F212 HydrophobicContact CD1-CE2 3.58Å; L208-F212 HydrophobicContact CD1-CZ 4.21Å; L208-F212 HydrophobicContact CG-CD2 4.31Å; L208-F212 HydrophobicContact CG-CE2 3.85Å; L208-F212 WeakPolarHBondContact O-CD2 3.14Å; L208-F212 PolarHBondContact O-N 2.82Å
209	M	88.5	Confident	83.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-44.4	179	-70.1	-51.9	106.8	0	0	111.9	L178 M205 R206 T211 F212 L213 I227 L231	L178-M209 HydrophobicContact CD2-CE 4.11Å; L178-M209 HydrophobicContact CD2-SD 4.38Å; M205-M209 WeakPolarHBondContact O-CG 3.34Å; M205-M209 PolarHBondContact O-N 3.04Å; M205-M209 HydrophobicContact SD-CE 4.13Å; R206-M209 PolarHBondContact O-N 3.3Å; R206-M209 VanDerWaalsContact O-N 3.14Å; M209-T211 PolarHBondContact O-N 3.14Å; M209-F212 PolarHBondContact O-N 3.17Å; M209-F212 VanDerWaalsContact O-N 3.09Å; M209-L213 WeakPolarHBondContact O-CG 3.41Å; M209-L213 PolarHBondContact O-N 3.1Å; M209-L213 VanDerWaalsContact O-N 3.16Å; M209-I227 HydrophobicContact CE-CD1 4.17Å; M209-I227 HydrophobicContact CE-CG2 3.88Å; M209-I227 HydrophobicContact CG-CG2 3.91Å; M209-I227 HydrophobicContact SD-CB 3.62Å; M209-I227 HydrophobicContact SD-CD1 3.95Å; M209-I227 HydrophobicContact SD-CG1 4.43Å; M209-I227 HydrophobicContact SD-CG2 3.22Å; M209-I227 WeakPolarHBondContact SD-CG2 3.44Å; M209-L231 HydrophobicContact CG-CD1 4.35Å
210	L	86.5	Confident	84	Confident	19 Å²	19	38 Å²	38	10%	0.099	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-26.3	178.2	-66.6	-171.6	0	0	0	112.8	R206 S207 L208 F212 L213 P214 Q255 I256 L259	R206-L210 HydrophobicContact CG-CD1 3.98Å; R206-L210 HydrophobicContact CG-CG 4.22Å; R206-L210 WeakPolarHBondContact O-CB 3.41Å; R206-L210 VanDerWaalsContact O-CG 3.24Å; R206-L210 WeakPolarHBondContact O-CG 3.29Å; R206-L210 PolarHBondContact O-N 3.36Å; S207-L210 PolarHBondContact O-N 2.86Å; L208-L210 PolarHBondContact O-N 3.04Å; L210-F212 VanDerWaalsContact C-N 3.35Å; L210-L213 HydrophobicContact CD2-CD1 3.65Å; L210-P214 WeakPolarHBondContact O-CD 3.43Å; L210-Q255 HydrophobicContact CD1-CB 3.9Å; L210-I256 HydrophobicContact CD2-CB 4.46Å; L210-I256 HydrophobicContact CD2-CG1 4.01Å; L210-L259 HydrophobicContact CB-CD1 3.61Å; L210-L259 HydrophobicContact CD1-CD1 3.99Å; L210-L259 HydrophobicContact CD2-CD1 3.65Å; L210-L259 HydrophobicContact CG-CD1 3.9Å
211	T	86.5	Confident	83.7	Confident	68 Å²	68	32.7 Å²	32.7	42%	0.417	19%	0.187	S	C	.	.	H	α-helix	trans	-72.7	-28.7	175.9	-52.7	0	0	0	0	112.6	S164 S207 L208 M209	S164-T211 VanDerWaalsContact OG-CB 3.28Å; S164-T211 WeakPolarHBondContact OG-CB 3.14Å; S164-T211 WeakPolarHBondContact OG-CG2 3.29Å; S207-T211 PolarHBondContact O-N 3.4Å; S207-T211 PolarHBondContact O-OG1 3.16Å; L208-T211 PolarHBondContact O-N 3.14Å; M209-T211 PolarHBondContact O-N 3.14Å
212	F	84	Confident	83.1	Confident	5 Å²	5	37 Å²	37	2%	0.022	20%	0.203	C	C	.	.	H	α-helix	trans	-91.2	-22.6	-178.9	-67.6	-55	0	0	0	114.1	R174 L178 L208 M209 L210 S215 M220 S224	R174-F212 HydrophobicContact CB-CE1 3.94Å; R174-F212 HydrophobicContact CG-CE1 4.01Å; L178-F212 HydrophobicContact CD1-CB 4.25Å; L178-F212 HydrophobicContact CD1-CD1 4.3Å; L178-F212 HydrophobicContact CD1-CD2 4.21Å; L178-F212 HydrophobicContact CD1-CG 4.01Å; L178-F212 HydrophobicContact CD2-CB 4.46Å; L178-F212 HydrophobicContact CD2-CD2 3.53Å; L178-F212 HydrophobicContact CD2-CE2 3.88Å; L178-F212 HydrophobicContact CD2-CG 4.12Å; L178-F212 HydrophobicContact CG-CD2 4.01Å; L178-F212 HydrophobicContact CG-CE2 4.09Å; L178-F212 HydrophobicContact CG-CG 4.33Å; L208-F212 HydrophobicContact CD1-CD2 4.37Å; L208-F212 HydrophobicContact CD1-CE2 3.58Å; L208-F212 HydrophobicContact CD1-CZ 4.21Å; L208-F212 HydrophobicContact CG-CD2 4.31Å; L208-F212 HydrophobicContact CG-CE2 3.85Å; L208-F212 WeakPolarHBondContact O-CD2 3.14Å; L208-F212 PolarHBondContact O-N 2.82Å; M209-F212 PolarHBondContact O-N 3.17Å; M209-F212 VanDerWaalsContact O-N 3.09Å; L210-F212 VanDerWaalsContact C-N 3.35Å; F212-S215 WeakPolarHBondContact O-CB 3.4Å; F212-S215 PolarHBondContact O-N 3.15Å; F212-M220 HydrophobicContact CB-CE 4.47Å; F212-M220 HydrophobicContact CD1-CE 3.24Å; F212-M220 HydrophobicContact CE1-CE 3.73Å; F212-M220 HydrophobicContact CG-CE 4.19Å; F212-S224 WeakPolarHBondContact CB-OG 3.17Å
213	L	82.4	Confident	82.6	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-40.5	176.7	-73.6	176.7	0	0	0	115.5	M209 L210 S215 V221 M225 W260 V263	M209-L213 WeakPolarHBondContact O-CG 3.41Å; M209-L213 PolarHBondContact O-N 3.1Å; M209-L213 VanDerWaalsContact O-N 3.16Å; L210-L213 HydrophobicContact CD2-CD1 3.65Å; L213-S215 PolarHBondContact O-N 2.96Å; L213-S215 VanDerWaalsContact O-N 3.17Å; L213-V221 HydrophobicContact CD2-CG1 4.23Å; L213-V221 WeakPolarHBondContact O-CG2 3.48Å; L213-M225 HydrophobicContact CD2-CG 3.89Å; L213-W260 HydrophobicContact CD1-CE3 4.04Å; L213-W260 HydrophobicContact CD1-CZ3 3.76Å; L213-W260 HydrophobicContact CD2-CH2 4.43Å; L213-W260 HydrophobicContact CD2-CZ3 3.82Å; L213-W260 HydrophobicContact CG-CZ3 4.48Å; L213-V263 HydrophobicContact CB-CG2 4.21Å
214	P	79.3	Confident	82.4	Confident	72 Å²	72	33.3 Å²	33.3	47%	0.468	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	12.2	177.8	31.8	-36.5	0	0	0	113.6	L210	L210-P214 WeakPolarHBondContact O-CD 3.43Å
215	S	77.3	Confident	82	Confident	27 Å²	27	31.1 Å²	31.1	19%	0.189	17%	0.166	C	C	.	.			trans	-67.1	144.2	178.5	-173.7	0	0	0	0	111.8	F212 L213 D217 V221 W274	F212-S215 WeakPolarHBondContact O-CB 3.4Å; F212-S215 PolarHBondContact O-N 3.15Å; L213-S215 PolarHBondContact O-N 2.96Å; L213-S215 VanDerWaalsContact O-N 3.17Å; S215-D217 PolarHBondContact O-N 3.43Å; S215-D217 WeakPolarHBondContact OG-CB 3.39Å; S215-D217 PolarHBondContact OG-N 2.64Å; S215-D217 VanDerWaalsContact OG-N 3.14Å; S215-V221 VanDerWaalsContact O-CG2 3.32Å; S215-V221 WeakPolarHBondContact O-CG2 3.34Å; S215-W274 WeakPolarHBondContact O-CZ2 3.43Å
216	N	72.1	Confident	81.6	Confident	141 Å²	141	33 Å²	33	75%	0.754	18%	0.175	S	C	*	.	S	Bend	trans	-76.1	0.1	168.9	-72.7	-38.3	0	0	0	112.9
217	D	76	Confident	81.3	Confident	17 Å²	17	31.7 Å²	31.7	9%	0.091	17%	0.17	C	C	.	.			trans	-96.3	109.3	179.5	-175.2	-10.3	0	0	0	111.3	R171 S215 Y219 M220 V221	R171-D217 IonicContact CZ-OD2 3.57Å; R171-D217 IonicContact NE-OD2 2.95Å; R171-D217 PolarHBondContact NE-OD2 3.42Å; R171-D217 IonicContact NH2-OD1 3.55Å; R171-D217 PolarHBondContact NH2-OD1 3.01Å; R171-D217 VanDerWaalsContact NH2-OD1 3.12Å; R171-D217 IonicContact NH2-OD2 3.27Å; R171-D217 PolarHBondContact NH2-OD2 2.84Å; S215-D217 PolarHBondContact O-N 3.43Å; S215-D217 WeakPolarHBondContact OG-CB 3.39Å; S215-D217 PolarHBondContact OG-N 2.64Å; S215-D217 VanDerWaalsContact OG-N 3.14Å; D217-Y219 PolarHBondContact O-N 2.86Å; D217-Y219 WeakPolarHBondContact OD1-CB 3.22Å; D217-Y219 PolarHBondContact OD1-N 3.48Å; D217-M220 HydrophobicContact CB-CB 4.06Å; D217-M220 HydrophobicContact CB-CG 3.89Å; D217-M220 HydrophobicContact CB-SD 3.89Å; D217-M220 PolarHBondContact O-N 3.01Å; D217-V221 WeakPolarHBondContact O-CG2 3.49Å; D217-V221 PolarHBondContact O-N 3.07Å
218	G	72.4	Confident	81.3	Confident	4 Å²	4	28.3 Å²	28.3	4%	0.041	15%	0.146	C	C	.	.	H	α-helix	trans	-54.8	-34.1	177.8	0	0	0	0	0	115.5	R222 R273 W274	G218-R222 WeakPolarHBondContact O-CB 3.35Å; G218-R222 PolarHBondContact O-N 3.28Å; G218-R273 PolarHBondContact N-O 3.09Å; G218-W274 CarbonylContact C-O 3.52Å; G218-W274 VanDerWaalsContact CA-CA 3.42Å; G218-W274 WeakPolarHBondContact CA-O 3.38Å
219	Y	75.1	Confident	81	Confident	89 Å²	89	28.5 Å²	28.5	35%	0.349	15%	0.148	S	C	.	.	H	α-helix	trans	-65.2	-49.6	175.7	179	-90.1	0	0	0	110.7	M175 S179 D217 V221 R222 T223	M175-Y219 HydrophobicContact CB-CD1 4.2Å; M175-Y219 HydrophobicContact CB-CE1 4.05Å; M175-Y219 HydrophobicContact CE-CD1 3.42Å; M175-Y219 VanDerWaalsContact CE-CD1 3.42Å; M175-Y219 HydrophobicContact CE-CD2 4.42Å; M175-Y219 HydrophobicContact CE-CE1 3.87Å; M175-Y219 HydrophobicContact CE-CG 3.73Å; M175-Y219 HydrophobicContact CG-CD1 3.85Å; M175-Y219 HydrophobicContact CG-CE1 4.23Å; M175-Y219 HydrophobicContact SD-CD1 4.38Å; S179-Y219 PolarHBondContact OG-OH 2.91Å; D217-Y219 PolarHBondContact O-N 2.86Å; D217-Y219 WeakPolarHBondContact OD1-CB 3.22Å; D217-Y219 PolarHBondContact OD1-N 3.48Å; Y219-V221 VanDerWaalsContact C-N 3.33Å; Y219-V221 PolarHBondContact O-N 2.74Å; Y219-R222 PolarHBondContact O-N 3.14Å; Y219-T223 WeakPolarHBondContact O-CB 3.24Å; Y219-T223 PolarHBondContact O-N 2.78Å; Y219-T223 PolarHBondContact O-OG1 3.35Å
220	M	80.7	Confident	80.6	Confident	7 Å²	7	29.5 Å²	29.5	3%	0.034	15%	0.154	C	C	.	.	H	α-helix	trans	-59.3	-47.1	-179.1	-68.7	179.3	59.7	0	0	110.9	R174 M175 L178 F212 D217 T223 S224	R174-M220 HydrophobicContact CB-CE 3.86Å; R174-M220 HydrophobicContact CB-SD 4.36Å; M175-M220 HydrophobicContact CG-CG 3.93Å; L178-M220 HydrophobicContact CD1-CB 3.82Å; L178-M220 HydrophobicContact CD1-CE 4.34Å; L178-M220 HydrophobicContact CD1-CG 4Å; F212-M220 HydrophobicContact CB-CE 4.47Å; F212-M220 HydrophobicContact CD1-CE 3.24Å; F212-M220 HydrophobicContact CE1-CE 3.73Å; F212-M220 HydrophobicContact CG-CE 4.19Å; D217-M220 HydrophobicContact CB-CB 4.06Å; D217-M220 HydrophobicContact CB-CG 3.89Å; D217-M220 HydrophobicContact CB-SD 3.89Å; D217-M220 PolarHBondContact O-N 3.01Å; M220-T223 PolarHBondContact O-N 3.03Å; M220-S224 WeakPolarHBondContact O-CB 3.15Å; M220-S224 PolarHBondContact O-N 2.7Å; M220-S224 PolarHBondContact O-OG 3.48Å
221	V	78.3	Confident	80.6	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-61.9	-52.8	179	-176.7	0	0	0	0	109.9	L213 S215 D217 Y219 T223 S224 M225 V263 W274	L213-V221 HydrophobicContact CD2-CG1 4.23Å; L213-V221 WeakPolarHBondContact O-CG2 3.48Å; S215-V221 VanDerWaalsContact O-CG2 3.32Å; S215-V221 WeakPolarHBondContact O-CG2 3.34Å; D217-V221 WeakPolarHBondContact O-CG2 3.49Å; D217-V221 PolarHBondContact O-N 3.07Å; Y219-V221 VanDerWaalsContact C-N 3.33Å; Y219-V221 PolarHBondContact O-N 2.74Å; V221-T223 VanDerWaalsContact C-N 3.29Å; V221-T223 PolarHBondContact O-N 3.25Å; V221-S224 CarbonylContact O-C 3.54Å; V221-S224 WeakPolarHBondContact O-CB 3.3Å; V221-S224 PolarHBondContact O-N 3.36Å; V221-M225 HydrophobicContact CG1-CG 4Å; V221-M225 HydrophobicContact CG1-SD 3.82Å; V221-M225 VanDerWaalsContact O-CG 3.24Å; V221-M225 WeakPolarHBondContact O-CG 3.29Å; V221-M225 PolarHBondContact O-N 3.27Å; V221-V263 HydrophobicContact CG1-CG1 4.42Å; V221-W274 HydrophobicContact CB-CE3 3.63Å; V221-W274 HydrophobicContact CB-CH2 4.38Å; V221-W274 HydrophobicContact CB-CZ3 3.57Å; V221-W274 HydrophobicContact CG1-CE3 3.4Å; V221-W274 HydrophobicContact CG1-CH2 4.11Å; V221-W274 HydrophobicContact CG1-CZ3 3.07Å; V221-W274 HydrophobicContact CG2-CD2 4.33Å; V221-W274 HydrophobicContact CG2-CE3 3.64Å; V221-W274 HydrophobicContact CG2-CH2 3.63Å; V221-W274 HydrophobicContact CG2-CZ2 4.32Å; V221-W274 HydrophobicContact CG2-CZ3 3.31Å
222	R	75.9	Confident	80.6	Confident	94 Å²	94	25.3 Å²	25.3	36%	0.355	13%	0.13	S	C	.	.	H	α-helix	trans	-54.3	-47.5	-179.3	179.9	-178.9	174.1	180	3.3	111.5	G218 Y219 M225 Q226 L290	G218-R222 WeakPolarHBondContact O-CB 3.35Å; G218-R222 PolarHBondContact O-N 3.28Å; Y219-R222 PolarHBondContact O-N 3.14Å; R222-M225 PolarHBondContact O-N 3.42Å; R222-Q226 WeakPolarHBondContact O-CG 3.5Å; R222-Q226 PolarHBondContact O-N 2.84Å; R222-L290 HydrophobicContact CG-CD1 4.19Å
223	T	79.8	Confident	80.3	Confident	3 Å²	3	25.1 Å²	25.1	2%	0.018	13%	0.129	C	C	.	.	H	α-helix	trans	-65.1	-40	179.2	-55.4	0	0	0	0	111.5	L178 L182 Y219 M220 V221 Q226 I227	L178-T223 HydrophobicContact CB-CG2 3.7Å; L182-T223 HydrophobicContact CB-CG2 4.04Å; L182-T223 HydrophobicContact CD2-CG2 4.12Å; Y219-T223 WeakPolarHBondContact O-CB 3.24Å; Y219-T223 PolarHBondContact O-N 2.78Å; Y219-T223 PolarHBondContact O-OG1 3.35Å; M220-T223 PolarHBondContact O-N 3.03Å; V221-T223 VanDerWaalsContact C-N 3.29Å; V221-T223 PolarHBondContact O-N 3.25Å; T223-Q226 PolarHBondContact O-N 2.82Å; T223-I227 HydrophobicContact CG2-CD1 4.01Å; T223-I227 WeakPolarHBondContact O-CB 3.23Å; T223-I227 WeakPolarHBondContact O-CD1 3.35Å; T223-I227 VanDerWaalsContact O-CG1 3.27Å; T223-I227 WeakPolarHBondContact O-CG1 3.43Å; T223-I227 PolarHBondContact O-N 2.84Å
224	S	85.8	Confident	80.1	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.7	-39.5	173.8	-63.7	0	0	0	0	113	L178 F212 M220 V221 I227 L228	L178-S224 VanDerWaalsContact CD2-OG 3.3Å; L178-S224 WeakPolarHBondContact CD2-OG 3.38Å; F212-S224 WeakPolarHBondContact CB-OG 3.17Å; M220-S224 WeakPolarHBondContact O-CB 3.15Å; M220-S224 PolarHBondContact O-N 2.7Å; M220-S224 PolarHBondContact O-OG 3.48Å; V221-S224 CarbonylContact O-C 3.54Å; V221-S224 WeakPolarHBondContact O-CB 3.3Å; V221-S224 PolarHBondContact O-N 3.36Å; S224-I227 PolarHBondContact O-N 3.13Å; S224-L228 VanDerWaalsContact O-CB 3.26Å; S224-L228 WeakPolarHBondContact O-CB 3.35Å; S224-L228 PolarHBondContact O-N 2.83Å
225	M	82	Confident	80.2	Confident	2 Å²	2	21.7 Å²	21.7	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-64.4	-41.7	174.5	-62.6	172.8	83.1	0	0	111.1	L213 V221 R222 L228 S229 W260 V263 L290 L291	L213-M225 HydrophobicContact CD2-CG 3.89Å; V221-M225 HydrophobicContact CG1-CG 4Å; V221-M225 HydrophobicContact CG1-SD 3.82Å; V221-M225 VanDerWaalsContact O-CG 3.24Å; V221-M225 WeakPolarHBondContact O-CG 3.29Å; V221-M225 PolarHBondContact O-N 3.27Å; R222-M225 PolarHBondContact O-N 3.42Å; M225-L228 PolarHBondContact O-N 3.22Å; M225-S229 WeakPolarHBondContact O-CB 3.48Å; M225-S229 PolarHBondContact O-N 2.75Å; M225-W260 HydrophobicContact CB-CH2 3.99Å; M225-W260 HydrophobicContact CE-CH2 3.67Å; M225-W260 HydrophobicContact CE-CZ2 3.35Å; M225-W260 HydrophobicContact CG-CH2 3.55Å; M225-W260 HydrophobicContact CG-CZ2 4.27Å; M225-W260 HydrophobicContact CG-CZ3 4.29Å; M225-W260 HydrophobicContact SD-CH2 4.43Å; M225-V263 HydrophobicContact CE-CG1 4.42Å; M225-L290 HydrophobicContact CB-CB 4.2Å; M225-L290 HydrophobicContact CB-CD1 4.03Å; M225-L290 HydrophobicContact CB-CD2 4.43Å; M225-L290 HydrophobicContact CB-CG 4.46Å; M225-L290 HydrophobicContact CE-CB 3.52Å; M225-L290 HydrophobicContact SD-CB 4.23Å; M225-L291 HydrophobicContact CE-CD2 4.02Å; M225-L291 HydrophobicContact CE-CG 3.99Å
226	Q	80.7	Confident	80.2	Confident	40 Å²	40	20.4 Å²	20.4	19%	0.187	10%	0.098	C	C	.	.	H	α-helix	trans	-64.5	-44.6	176.5	-73.6	175	-35.2	0	0	112	L182 R222 T223 S229 C230 L290	L182-Q226 HydrophobicContact CD1-CB 3.81Å; R222-Q226 WeakPolarHBondContact O-CG 3.5Å; R222-Q226 PolarHBondContact O-N 2.84Å; T223-Q226 PolarHBondContact O-N 2.82Å; Q226-S229 PolarHBondContact O-N 3.13Å; Q226-C230 PolarHBondContact O-N 2.99Å; Q226-C230 PolarHBondContact O-SG 3.16Å; Q226-L290 HydrophobicContact CG-CD1 3.84Å; Q226-L290 HydrophobicContact CG-CD2 4.14Å
227	I	84.6	Confident	80.2	Confident	0 Å²	0	16 Å²	16	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-59.5	-53	174.8	-72	162.2	0	0	0	109.7	L178 W181 L182 I185 M209 T223 S224 S229 C230 L231	L178-I227 HydrophobicContact CB-CD1 4.44Å; L178-I227 HydrophobicContact CD2-CD1 3.67Å; L178-I227 WeakPolarHBondContact O-CD1 3.32Å; W181-I227 HydrophobicContact CB-CD1 3.69Å; W181-I227 HydrophobicContact CB-CG1 4.29Å; L182-I227 HydrophobicContact CB-CD1 4.46Å; L182-I227 HydrophobicContact CB-CG1 4.06Å; L182-I227 HydrophobicContact CD1-CG1 4.31Å; I185-I227 HydrophobicContact CD1-CB 4.14Å; I185-I227 HydrophobicContact CD1-CG1 4.18Å; I185-I227 HydrophobicContact CD1-CG2 3.35Å; M209-I227 HydrophobicContact CE-CD1 4.17Å; M209-I227 HydrophobicContact CE-CG2 3.88Å; M209-I227 HydrophobicContact CG-CG2 3.91Å; M209-I227 HydrophobicContact SD-CB 3.62Å; M209-I227 HydrophobicContact SD-CD1 3.95Å; M209-I227 HydrophobicContact SD-CG1 4.43Å; M209-I227 HydrophobicContact SD-CG2 3.22Å; M209-I227 WeakPolarHBondContact SD-CG2 3.44Å; T223-I227 HydrophobicContact CG2-CD1 4.01Å; T223-I227 WeakPolarHBondContact O-CB 3.23Å; T223-I227 WeakPolarHBondContact O-CD1 3.35Å; T223-I227 VanDerWaalsContact O-CG1 3.27Å; T223-I227 WeakPolarHBondContact O-CG1 3.43Å; T223-I227 PolarHBondContact O-N 2.84Å; S224-I227 PolarHBondContact O-N 3.13Å; I227-S229 VanDerWaalsContact C-N 3.26Å; I227-S229 PolarHBondContact O-N 3.16Å; I227-C230 PolarHBondContact O-N 3.2Å; I227-C230 VanDerWaalsContact O-N 3.09Å; I227-L231 HydrophobicContact CG2-CD1 3.68Å; I227-L231 HydrophobicContact CG2-CG 4.18Å; I227-L231 VanDerWaalsContact O-CG 3.25Å; I227-L231 WeakPolarHBondContact O-CG 3.27Å; I227-L231 PolarHBondContact O-N 3.49Å
228	L	88.6	Confident	80	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-55.4	-44.3	179.6	-178.3	60.5	0	0	0	111	W202 S224 M225 C230 L231 L232 I256 W260 I294	W202-L228 HydrophobicContact CH2-CD1 3.81Å; W202-L228 HydrophobicContact CZ3-CD1 4.38Å; S224-L228 VanDerWaalsContact O-CB 3.26Å; S224-L228 WeakPolarHBondContact O-CB 3.35Å; S224-L228 PolarHBondContact O-N 2.83Å; M225-L228 PolarHBondContact O-N 3.22Å; L228-C230 PolarHBondContact O-N 2.72Å; L228-L231 PolarHBondContact O-N 3.12Å; L228-L232 HydrophobicContact CD1-CD1 4.4Å; L228-L232 HydrophobicContact CD1-CD2 4.49Å; L228-L232 HydrophobicContact CD1-CG 4.19Å; L228-L232 HydrophobicContact CG-CD1 4.23Å; L228-L232 HydrophobicContact CG-CG 4.39Å; L228-L232 WeakPolarHBondContact O-CG 3.14Å; L228-L232 PolarHBondContact O-N 3.42Å; L228-I256 HydrophobicContact CD1-CD1 4.42Å; L228-I256 HydrophobicContact CD2-CG2 3.96Å; L228-W260 HydrophobicContact CD2-CE3 4.38Å; L228-W260 HydrophobicContact CD2-CH2 4.25Å; L228-W260 HydrophobicContact CD2-CZ3 3.66Å; L228-I294 HydrophobicContact CB-CD1 4.25Å; L228-I294 HydrophobicContact CD2-CD1 4.35Å; L228-I294 HydrophobicContact CD2-CG1 4.3Å; L228-I294 HydrophobicContact CD2-CG2 3.81Å; L228-I294 HydrophobicContact CG-CD1 4.04Å; L228-I294 HydrophobicContact CG-CG2 4.39Å
229	S	84.1	Confident	79.8	Confident	8 Å²	8	17.5 Å²	17.5	6%	0.056	8%	0.081	C	C	.	.	H	α-helix	trans	-59.9	-46.2	177.4	176	0	0	0	0	112	M225 Q226 I227 L231 L232 S233 L293 I294 Q297	M225-S229 WeakPolarHBondContact O-CB 3.48Å; M225-S229 PolarHBondContact O-N 2.75Å; Q226-S229 PolarHBondContact O-N 3.13Å; I227-S229 VanDerWaalsContact C-N 3.26Å; I227-S229 PolarHBondContact O-N 3.16Å; S229-L231 VanDerWaalsContact C-N 3.29Å; S229-L231 PolarHBondContact O-N 2.97Å; S229-L232 PolarHBondContact O-N 3.38Å; S229-S233 WeakPolarHBondContact O-CB 3.44Å; S229-S233 PolarHBondContact O-N 3.49Å; S229-S233 PolarHBondContact O-OG 3.16Å; S229-L293 WeakPolarHBondContact OG-CD2 3.39Å; S229-I294 VanDerWaalsContact CB-CD1 3.44Å; S229-I294 VanDerWaalsContact N-CD1 3.29Å; S229-Q297 VanDerWaalsContact CA-OE1 3.32Å; S229-Q297 PolarHBondContact O-NE2 3.3Å; S229-Q297 PolarHBondContact OG-NE2 2.74Å; S229-Q297 PolarHBondContact OG-OE1 3.13Å
230	C	80.8	Confident	79.3	Confident	21 Å²	21	15.5 Å²	15.5	14%	0.142	8%	0.078	C	C	.	.	H	α-helix	trans	-64.3	-36.2	178.9	-67.7	0	0	0	0	112.2	I185 Q226 I227 L228 S233 V234	I185-C230 HydrophobicContact CB-CB 4.44Å; I185-C230 HydrophobicContact CG2-CB 3.33Å; Q226-C230 PolarHBondContact O-N 2.99Å; Q226-C230 PolarHBondContact O-SG 3.16Å; I227-C230 PolarHBondContact O-N 3.2Å; I227-C230 VanDerWaalsContact O-N 3.09Å; L228-C230 PolarHBondContact O-N 2.72Å; C230-S233 WeakPolarHBondContact O-CB 3.44Å; C230-S233 PolarHBondContact O-N 3.41Å; C230-V234 PolarHBondContact O-N 3.2Å
231	L	86	Confident	78.5	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-68.1	-47.9	176.5	-65.3	171.2	0	0	0	111.9	I185 W194 L198 W202 M205 M209 I227 L228 S229 S233 V234 F235	I185-L231 HydrophobicContact CD1-CD1 4.44Å; I185-L231 HydrophobicContact CD1-CD2 3.82Å; I185-L231 HydrophobicContact CD1-CG 4.01Å; I185-L231 HydrophobicContact CG1-CD2 4.33Å; W194-L231 HydrophobicContact CZ2-CD2 4.17Å; L198-L231 HydrophobicContact CD1-CD2 3.71Å; L198-L231 HydrophobicContact CD2-CD2 3.31Å; L198-L231 HydrophobicContact CG-CD2 4.15Å; W202-L231 HydrophobicContact CZ3-CB 4.19Å; W202-L231 HydrophobicContact CZ3-CD1 4.1Å; M205-L231 HydrophobicContact CG-CD1 3.27Å; M205-L231 HydrophobicContact CG-CD2 4.26Å; M205-L231 HydrophobicContact CG-CG 4.4Å; M205-L231 HydrophobicContact SD-CD1 4.09Å; M209-L231 HydrophobicContact CG-CD1 4.35Å; I227-L231 HydrophobicContact CG2-CD1 3.68Å; I227-L231 HydrophobicContact CG2-CG 4.18Å; I227-L231 VanDerWaalsContact O-CG 3.25Å; I227-L231 WeakPolarHBondContact O-CG 3.27Å; I227-L231 PolarHBondContact O-N 3.49Å; L228-L231 PolarHBondContact O-N 3.12Å; S229-L231 VanDerWaalsContact C-N 3.29Å; S229-L231 PolarHBondContact O-N 2.97Å; L231-S233 PolarHBondContact O-N 3.47Å; L231-V234 PolarHBondContact O-N 3.14Å; L231-V234 VanDerWaalsContact O-N 3.15Å; L231-F235 WeakPolarHBondContact O-CD2 3.35Å; L231-F235 PolarHBondContact O-N 2.82Å
232	L	86.4	Confident	77.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.7	-35.4	176.3	-65.9	-178	0	0	0	111.1	W202 L228 S229 V234 F235 I236 V251 I294 Q297 L298 L301	W202-L232 HydrophobicContact CH2-CD2 4.02Å; W202-L232 HydrophobicContact CZ2-CD2 4.24Å; L228-L232 HydrophobicContact CD1-CD1 4.4Å; L228-L232 HydrophobicContact CD1-CD2 4.49Å; L228-L232 HydrophobicContact CD1-CG 4.19Å; L228-L232 HydrophobicContact CG-CD1 4.23Å; L228-L232 HydrophobicContact CG-CG 4.39Å; L228-L232 WeakPolarHBondContact O-CG 3.14Å; L228-L232 PolarHBondContact O-N 3.42Å; S229-L232 PolarHBondContact O-N 3.38Å; L232-V234 VanDerWaalsContact C-N 3.34Å; L232-V234 PolarHBondContact O-N 2.79Å; L232-F235 HydrophobicContact CD2-CD2 4.38Å; L232-F235 PolarHBondContact O-N 3.43Å; L232-I236 VanDerWaalsContact O-CG1 3.31Å; L232-I236 WeakPolarHBondContact O-CG1 3.37Å; L232-I236 PolarHBondContact O-N 3.02Å; L232-V251 HydrophobicContact CD2-CG1 4.16Å; L232-I294 HydrophobicContact CD1-CD1 4.12Å; L232-I294 HydrophobicContact CD1-CG2 3.96Å; L232-Q297 HydrophobicContact CB-CB 3.97Å; L232-Q297 HydrophobicContact CD1-CB 3.9Å; L232-L298 HydrophobicContact CD1-CD2 3.96Å; L232-L298 HydrophobicContact CD1-CG 4.04Å; L232-L298 HydrophobicContact CD2-CD2 4.05Å; L232-L301 HydrophobicContact CB-CD1 4.43Å; L232-L301 HydrophobicContact CD2-CD1 3.8Å
233	S	78.7	Confident	76.8	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.007	14%	0.142	C	C	.	.	H	α-helix	trans	-57.7	-45.9	174.7	-55.9	0	0	0	0	112.5	S229 C230 L231 F235 I236 Q237 Q297 Y386	S229-S233 WeakPolarHBondContact O-CB 3.44Å; S229-S233 PolarHBondContact O-N 3.49Å; S229-S233 PolarHBondContact O-OG 3.16Å; C230-S233 WeakPolarHBondContact O-CB 3.44Å; C230-S233 PolarHBondContact O-N 3.41Å; L231-S233 PolarHBondContact O-N 3.47Å; S233-F235 VanDerWaalsContact C-N 3.31Å; S233-F235 PolarHBondContact O-N 3Å; S233-I236 PolarHBondContact O-N 3.37Å; S233-I236 VanDerWaalsContact O-N 3.13Å; S233-Q237 WeakPolarHBondContact O-CG 3.35Å; S233-Q237 PolarHBondContact O-N 3.06Å; S233-Q297 PolarHBondContact OG-NE2 3.3Å; S233-Q297 VanDerWaalsContact OG-NE2 3.1Å; S233-Y386 WeakPolarHBondContact CA-OH 3.43Å; S233-Y386 WeakPolarHBondContact CB-OH 3.33Å; S233-Y386 PolarHBondContact OG-OH 2.89Å
234	V	77.6	Confident	76.1	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-42.1	177.6	175.9	0	0	0	0	111.6	K189 N195 L198 C230 L231 L232 I236 Q237 D238	K189-V234 HydrophobicContact CG-CG2 4.36Å; N195-V234 HydrophobicContact CB-CG1 4.05Å; N195-V234 WeakPolarHBondContact OD1-CG1 3.34Å; L198-V234 HydrophobicContact CD1-CB 3.85Å; L198-V234 HydrophobicContact CD1-CG1 3.84Å; L198-V234 HydrophobicContact CD1-CG2 3.88Å; C230-V234 PolarHBondContact O-N 3.2Å; L231-V234 PolarHBondContact O-N 3.14Å; L231-V234 VanDerWaalsContact O-N 3.15Å; L232-V234 VanDerWaalsContact C-N 3.34Å; L232-V234 PolarHBondContact O-N 2.79Å; V234-I236 VanDerWaalsContact C-N 3.32Å; V234-I236 PolarHBondContact O-N 2.97Å; V234-Q237 PolarHBondContact O-N 2.94Å; V234-D238 PolarHBondContact O-N 2.75Å; V234-D238 VanDerWaalsContact O-N 3.08Å
235	F	81.7	Confident	75.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-36.8	177	-62.9	-41.9	0	0	0	112.7	L198 R199 W202 L231 L232 S233 D238 V239 M246 L301	L198-F235 HydrophobicContact CB-CE1 4.26Å; L198-F235 HydrophobicContact CB-CZ 4.42Å; R199-F235 HydrophobicContact CG-CD1 4.36Å; R199-F235 HydrophobicContact CG-CE1 3.9Å; W202-F235 HydrophobicContact CB-CZ 3.86Å; W202-F235 AromaticContact CD2-CE2 3.46Å; W202-F235 HydrophobicContact CD2-CE2 3.46Å; W202-F235 VanDerWaalsContact CD2-CE2 3.46Å; W202-F235 AromaticContact CD2-CZ 3.68Å; W202-F235 HydrophobicContact CD2-CZ 3.68Å; W202-F235 AromaticContact CE2-CE2 3.79Å; W202-F235 AromaticContact CE3-CE2 3.48Å; W202-F235 HydrophobicContact CE3-CE2 3.48Å; W202-F235 VanDerWaalsContact CE3-CE2 3.48Å; W202-F235 AromaticContact CE3-CZ 3.76Å; W202-F235 HydrophobicContact CE3-CZ 3.76Å; W202-F235 AromaticContact CG-CE2 3.96Å; W202-F235 HydrophobicContact CG-CE2 3.96Å; W202-F235 AromaticContact CG-CZ 3.74Å; W202-F235 HydrophobicContact CG-CZ 3.74Å; W202-F235 HydrophobicContact CH2-CE2 4.12Å; W202-F235 HydrophobicContact CZ2-CE2 4.1Å; W202-F235 AromaticContact CZ3-CE2 3.83Å; W202-F235 HydrophobicContact CZ3-CE2 3.83Å; L231-F235 WeakPolarHBondContact O-CD2 3.35Å; L231-F235 PolarHBondContact O-N 2.82Å; L232-F235 HydrophobicContact CD2-CD2 4.38Å; L232-F235 PolarHBondContact O-N 3.43Å; S233-F235 VanDerWaalsContact C-N 3.31Å; S233-F235 PolarHBondContact O-N 3Å; F235-D238 PolarHBondContact O-N 2.68Å; F235-V239 VanDerWaalsContact O-CG2 3.31Å; F235-V239 WeakPolarHBondContact O-CG2 3.5Å; F235-V239 PolarHBondContact O-N 3.12Å; F235-M246 HydrophobicContact CB-SD 3.69Å; F235-M246 HydrophobicContact CD1-CE 3.73Å; F235-M246 HydrophobicContact CD1-SD 3.87Å; F235-M246 HydrophobicContact CD2-CE 4.33Å; F235-M246 HydrophobicContact CD2-SD 4.26Å; F235-M246 HydrophobicContact CE1-CE 3.92Å; F235-M246 HydrophobicContact CE2-CE 4.49Å; F235-M246 HydrophobicContact CG-CE 3.97Å; F235-M246 HydrophobicContact CG-SD 3.68Å; F235-M246 HydrophobicContact CZ-CE 4.31Å; F235-L301 HydrophobicContact CB-CD1 4.15Å; F235-L301 HydrophobicContact CB-CD2 3.82Å
236	I	77	Confident	74.8	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-43.9	177.2	-68.8	168.1	0	0	0	110.3	L232 S233 V234 D238 V239 V240 Q297 T300 L301 Y386	L232-I236 VanDerWaalsContact O-CG1 3.31Å; L232-I236 WeakPolarHBondContact O-CG1 3.37Å; L232-I236 PolarHBondContact O-N 3.02Å; S233-I236 PolarHBondContact O-N 3.37Å; S233-I236 VanDerWaalsContact O-N 3.13Å; V234-I236 VanDerWaalsContact C-N 3.32Å; V234-I236 PolarHBondContact O-N 2.97Å; I236-D238 VanDerWaalsContact C-N 3.3Å; I236-D238 PolarHBondContact O-N 3.06Å; I236-V239 PolarHBondContact O-N 2.9Å; I236-V239 VanDerWaalsContact O-N 3.14Å; I236-V240 HydrophobicContact CG2-CG2 4.26Å; I236-V240 VanDerWaalsContact O-CG2 3.3Å; I236-V240 WeakPolarHBondContact O-CG2 3.3Å; I236-V240 PolarHBondContact O-N 3.32Å; I236-Q297 HydrophobicContact CD1-CB 3.64Å; I236-Q297 HydrophobicContact CD1-CG 3.78Å; I236-T300 HydrophobicContact CD1-CG2 4.09Å; I236-T300 HydrophobicContact CG1-CG2 4.09Å; I236-T300 HydrophobicContact CG2-CG2 3.8Å; I236-L301 HydrophobicContact CB-CD2 4.38Å; I236-L301 HydrophobicContact CD1-CG 4.23Å; I236-L301 HydrophobicContact CG1-CD1 4.2Å; I236-L301 HydrophobicContact CG1-CD2 3.49Å; I236-L301 VanDerWaalsContact CG1-CD2 3.49Å; I236-L301 HydrophobicContact CG1-CG 3.59Å; I236-Y386 HydrophobicContact CB-CE1 4.09Å; I236-Y386 HydrophobicContact CD1-CE1 3.49Å; I236-Y386 VanDerWaalsContact CD1-CE1 3.49Å; I236-Y386 HydrophobicContact CG1-CE1 4.36Å; I236-Y386 HydrophobicContact CG2-CD1 3.98Å; I236-Y386 HydrophobicContact CG2-CE1 3.65Å
237	Q	71.6	Confident	74.8	Confident	49 Å²	49	45.2 Å²	45.2	23%	0.229	22%	0.216	C	C	.	.	H	α-helix	trans	-57.5	-43	174.5	-63.3	-173.3	-40	0	0	111.7	S233 V234 V240 H241 D385	S233-Q237 WeakPolarHBondContact O-CG 3.35Å; S233-Q237 PolarHBondContact O-N 3.06Å; V234-Q237 PolarHBondContact O-N 2.94Å; Q237-V240 PolarHBondContact O-N 3.19Å; Q237-H241 WeakPolarHBondContact O-CB 3.41Å; Q237-H241 PolarHBondContact O-CD2 3.4Å; Q237-H241 VanDerWaalsContact O-CD2 3.31Å; Q237-H241 PolarHBondContact O-N 2.81Å; Q237-D385 HydrophobicContact CG-CB 4.41Å; Q237-D385 WeakPolarHBondContact CG-OD2 3.27Å; Q237-D385 PolarHBondContact NE2-OD2 3.05Å
238	D	71.1	Confident	74.6	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-41.4	175.7	-76.4	-15.5	0	0	0	112.4	N195 R199 V234 F235 I236 V240 K242	N195-D238 PolarHBondContact ND2-OD1 2.82Å; R199-D238 IonicContact CZ-OD2 2.67Å; R199-D238 IonicContact NE-OD2 3.25Å; R199-D238 PolarHBondContact NE-OD2 3.28Å; R199-D238 IonicContact NH2-OD2 3.22Å; R199-D238 PolarHBondContact NH2-OD2 3.44Å; V234-D238 PolarHBondContact O-N 2.75Å; V234-D238 VanDerWaalsContact O-N 3.08Å; F235-D238 PolarHBondContact O-N 2.68Å; I236-D238 VanDerWaalsContact C-N 3.3Å; I236-D238 PolarHBondContact O-N 3.06Å; D238-V240 VanDerWaalsContact C-N 3.34Å; D238-K242 WeakPolarHBondContact O-CA 3.38Å; D238-K242 WeakPolarHBondContact O-CB 3.39Å; D238-K242 PolarHBondContact O-N 2.89Å; D238-K242 WeakPolarHBondContact OD1-CD 3.29Å; D238-K242 WeakPolarHBondContact OD1-CE 3.33Å; D238-K242 IonicContact OD1-NZ 3.1Å; D238-K242 PolarHBondContact OD1-NZ 2.94Å
239	V	68.7	Low	74.5	Confident	50 Å²	50	54.6 Å²	54.6	30%	0.303	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-40.5	177.3	170.9	0	0	0	0	111	F235 I236 E244 L301	F235-V239 VanDerWaalsContact O-CG2 3.31Å; F235-V239 WeakPolarHBondContact O-CG2 3.5Å; F235-V239 PolarHBondContact O-N 3.12Å; I236-V239 PolarHBondContact O-N 2.9Å; I236-V239 VanDerWaalsContact O-N 3.14Å; V239-E244 WeakPolarHBondContact CA-O 3.47Å; V239-E244 WeakPolarHBondContact CG2-O 3.19Å; V239-L301 HydrophobicContact CG2-CD2 3.91Å
240	V	64.2	Low	74.4	Confident	47 Å²	47	57.6 Å²	57.6	29%	0.285	28%	0.279	S	S	.	.	H	α-helix	trans	-71.6	-45.8	-179.7	173.3	0	0	0	0	111.6	I236 Q237 D238 L389	I236-V240 HydrophobicContact CG2-CG2 4.26Å; I236-V240 VanDerWaalsContact O-CG2 3.3Å; I236-V240 WeakPolarHBondContact O-CG2 3.3Å; I236-V240 PolarHBondContact O-N 3.32Å; Q237-V240 PolarHBondContact O-N 3.19Å; D238-V240 VanDerWaalsContact C-N 3.34Å; V240-L389 HydrophobicContact CG2-CB 4.43Å; V240-L389 HydrophobicContact CG2-CD1 4.49Å; V240-L389 HydrophobicContact CG2-CD2 4Å
241	H	64.2	Low	74.7	Confident	95 Å²	95	56.6 Å²	56.6	44%	0.44	27%	0.272	S	S	.	.	H	α-helix	trans	-98	-35.8	-170.8	-67.8	-60	0	0	0	115.3	Q237 D385	Q237-H241 WeakPolarHBondContact O-CB 3.41Å; Q237-H241 PolarHBondContact O-CD2 3.4Å; Q237-H241 VanDerWaalsContact O-CD2 3.31Å; Q237-H241 PolarHBondContact O-N 2.81Å; H241-D385 IonicContact CD2-OD1 2.79Å; H241-D385 IonicContact CD2-OD2 3.18Å; H241-D385 PolarHBondContact CD2-OD2 2.92Å; H241-D385 IonicContact CE1-OD1 3.38Å; H241-D385 PolarHBondContact CE1-OD1 3.03Å; H241-D385 VanDerWaalsContact CE1-OD1 3.31Å; H241-D385 IonicContact NE2-OD1 2.94Å; H241-D385 PolarHBondContact NE2-OD1 3.43Å; H241-D385 IonicContact NE2-OD2 2.98Å; H241-D385 PolarHBondContact NE2-OD2 3.4Å
242	K	62	Low	74.7	Confident	103 Å²	103	56.8 Å²	56.8	45%	0.448	28%	0.275	S	S	.	.	S	Bend	trans	-105.5	4.6	-165	-59.6	-175.3	-170.9	158	0	114.6	N195 D238 E244	N195-K242 PolarHBondContact ND2-NZ 2.89Å; D238-K242 WeakPolarHBondContact O-CA 3.38Å; D238-K242 WeakPolarHBondContact O-CB 3.39Å; D238-K242 PolarHBondContact O-N 2.89Å; D238-K242 WeakPolarHBondContact OD1-CD 3.29Å; D238-K242 WeakPolarHBondContact OD1-CE 3.33Å; D238-K242 IonicContact OD1-NZ 3.1Å; D238-K242 PolarHBondContact OD1-NZ 2.94Å; K242-E244 HydrophobicContact CB-CG 4.49Å; K242-E244 PolarHBondContact O-N 2.96Å; K242-E244 VanDerWaalsContact O-N 3.1Å
243	K	56.9	Low	74.8	Confident	194 Å²	194	57.1 Å²	57.1	84%	0.843	28%	0.276	S	S	*	.			trans	57	17.5	-177.9	-61.6	-178.1	177.6	176	0	114.5
244	E	65.4	Low	75.2	Confident	81 Å²	81	61.9 Å²	61.9	38%	0.379	30%	0.298	S	S	.	.			trans	-80.7	127	173.3	-67.7	-174.2	146.5	0	0	108.9	R199 V239 K242	R199-E244 IonicContact CZ-OE2 2.63Å; R199-E244 IonicContact NE-OE2 3.96Å; R199-E244 PolarHBondContact NE-OE2 3.35Å; R199-E244 IonicContact NH1-OE2 3.51Å; R199-E244 PolarHBondContact NH1-OE2 2.82Å; R199-E244 IonicContact NH2-OE2 2.7Å; R199-E244 PolarHBondContact NH2-OE2 2.95Å; V239-E244 WeakPolarHBondContact CA-O 3.47Å; V239-E244 WeakPolarHBondContact CG2-O 3.19Å; K242-E244 HydrophobicContact CB-CG 4.49Å; K242-E244 PolarHBondContact O-N 2.96Å; K242-E244 VanDerWaalsContact O-N 3.1Å
245	K	66.1	Low	75.8	Confident	195 Å²	195	66.6 Å²	66.6	85%	0.848	32%	0.32	S	S	*	.			trans	-93.3	135	176.2	-65.6	-175.7	-179.8	-179.9	0	109.2
246	M	74.1	Confident	76.1	Confident	24 Å²	24	66.6 Å²	66.6	12%	0.118	32%	0.32	C	S	.	.			trans	-110.9	136.9	163.8	-70.1	-175.1	122.2	0	0	108.6	F235 D250 V251	F235-M246 HydrophobicContact CB-SD 3.69Å; F235-M246 HydrophobicContact CD1-CE 3.73Å; F235-M246 HydrophobicContact CD1-SD 3.87Å; F235-M246 HydrophobicContact CD2-CE 4.33Å; F235-M246 HydrophobicContact CD2-SD 4.26Å; F235-M246 HydrophobicContact CE1-CE 3.92Å; F235-M246 HydrophobicContact CE2-CE 4.49Å; F235-M246 HydrophobicContact CG-CE 3.97Å; F235-M246 HydrophobicContact CG-SD 3.68Å; F235-M246 HydrophobicContact CZ-CE 4.31Å; M246-D250 HydrophobicContact CB-CB 4.3Å; M246-V251 HydrophobicContact CB-CG2 3.83Å; M246-V251 HydrophobicContact SD-CG2 4.17Å
247	N	80.2	Confident	76.6	Confident	79 Å²	79	67 Å²	67	42%	0.422	32%	0.322	S	S	.	.			trans	-96.8	174.9	170.3	70.4	51.9	0	0	0	111	N249 D250 V251	N247-N249 VanDerWaalsContact C-N 3.27Å; N247-N249 PolarHBondContact O-N 3.46Å; N247-N249 WeakPolarHBondContact OD1-CA 3.42Å; N247-N249 VanDerWaalsContact OD1-CB 3.31Å; N247-N249 WeakPolarHBondContact OD1-CB 2.77Å; N247-N249 PolarHBondContact OD1-N 2.86Å; N247-D250 VanDerWaalsContact CG-CG 3.4Å; N247-D250 PolarHBondContact N-OD2 3.29Å; N247-D250 VanDerWaalsContact ND2-CG 3.31Å; N247-D250 PolarHBondContact ND2-OD1 2.99Å; N247-D250 PolarHBondContact ND2-OD2 3.37Å; N247-D250 PolarHBondContact O-N 3.31Å; N247-D250 VanDerWaalsContact OD1-CG 3.3Å; N247-D250 PolarHBondContact OD1-N 3.39Å; N247-D250 PolarHBondContact OD1-OD1 2.89Å; N247-D250 PolarHBondContact OD1-OD2 3.46Å; N247-V251 WeakPolarHBondContact O-CG2 3.48Å; N247-V251 PolarHBondContact O-N 3.3Å; N247-V251 VanDerWaalsContact O-N 3.11Å
248	E	82.1	Confident	77.2	Confident	78 Å²	78	67.7 Å²	67.7	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-58.3	-32.9	-179	62.1	-172.3	-165.9	0	0	114.6	G252 F253 K305	E248-G252 WeakPolarHBondContact O-CA 3.49Å; E248-G252 PolarHBondContact O-N 2.7Å; E248-F253 HydrophobicContact CB-CB 4.07Å; E248-F253 PolarHBondContact O-N 2.9Å; E248-K305 WeakPolarHBondContact OE2-CE 3.49Å; E248-K305 IonicContact OE2-NZ 2.93Å
249	N	85.1	Confident	77.9	Confident	119 Å²	119	70 Å²	70	64%	0.636	34%	0.344	S	S	*	.	H	α-helix	trans	-76.1	-39.6	178.3	-62.2	-44.5	0	0	0	111.2	N247 V251 G252	N247-N249 VanDerWaalsContact C-N 3.27Å; N247-N249 PolarHBondContact O-N 3.46Å; N247-N249 WeakPolarHBondContact OD1-CA 3.42Å; N247-N249 VanDerWaalsContact OD1-CB 3.31Å; N247-N249 WeakPolarHBondContact OD1-CB 2.77Å; N247-N249 PolarHBondContact OD1-N 2.86Å; N249-V251 VanDerWaalsContact C-N 3.33Å; N249-V251 PolarHBondContact O-N 3.1Å; N249-G252 PolarHBondContact O-N 2.69Å
250	D	83.1	Confident	78.6	Confident	71 Å²	71	67.6 Å²	67.6	38%	0.38	33%	0.33	S	S	.	.	H	α-helix	trans	-60	-47.4	177	-55.2	-28.2	0	0	0	109.8	W202 R206 M246 N247	W202-D250 PolarHBondContact NE1-O 3.38Å; R206-D250 PolarHBondContact NH1-O 3.3Å; M246-D250 HydrophobicContact CB-CB 4.3Å; N247-D250 VanDerWaalsContact CG-CG 3.4Å; N247-D250 PolarHBondContact N-OD2 3.29Å; N247-D250 VanDerWaalsContact ND2-CG 3.31Å; N247-D250 PolarHBondContact ND2-OD1 2.99Å; N247-D250 PolarHBondContact ND2-OD2 3.37Å; N247-D250 PolarHBondContact O-N 3.31Å; N247-D250 VanDerWaalsContact OD1-CG 3.3Å; N247-D250 PolarHBondContact OD1-N 3.39Å; N247-D250 PolarHBondContact OD1-OD1 2.89Å; N247-D250 PolarHBondContact OD1-OD2 3.46Å
251	V	85.5	Confident	79.3	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-71.6	-32.9	177.4	-175.3	0	0	0	0	110.9	W202 R206 L232 M246 N247 N249 L298 L301	W202-V251 WeakPolarHBondContact CZ2-O 3.38Å; W202-V251 PolarHBondContact NE1-O 3.2Å; W202-V251 VanDerWaalsContact NE1-O 3.15Å; R206-V251 VanDerWaalsContact CD-O 3.28Å; R206-V251 WeakPolarHBondContact CD-O 3.43Å; R206-V251 PolarHBondContact NH1-O 3.02Å; L232-V251 HydrophobicContact CD2-CG1 4.16Å; M246-V251 HydrophobicContact CB-CG2 3.83Å; M246-V251 HydrophobicContact SD-CG2 4.17Å; N247-V251 WeakPolarHBondContact O-CG2 3.48Å; N247-V251 PolarHBondContact O-N 3.3Å; N247-V251 VanDerWaalsContact O-N 3.11Å; N249-V251 VanDerWaalsContact C-N 3.33Å; N249-V251 PolarHBondContact O-N 3.1Å; V251-L298 HydrophobicContact CG1-CD2 3.41Å; V251-L298 VanDerWaalsContact CG1-CD2 3.41Å; V251-L301 HydrophobicContact CG1-CD1 3.88Å; V251-L301 HydrophobicContact CG2-CB 3.88Å; V251-L301 HydrophobicContact CG2-CD1 4.05Å; V251-L301 HydrophobicContact CG2-CG 4.49Å
252	G	85.9	Confident	80.1	Confident	5 Å²	5	67.7 Å²	67.7	5%	0.052	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	39.1	-172.8	0	0	0	0	0	111.8	E248 N249 E254 Q255 I256	E248-G252 WeakPolarHBondContact O-CA 3.49Å; E248-G252 PolarHBondContact O-N 2.7Å; N249-G252 PolarHBondContact O-N 2.69Å; G252-E254 PolarHBondContact O-N 3.18Å; G252-Q255 PolarHBondContact O-N 3.16Å; G252-Q255 VanDerWaalsContact O-N 3.15Å; G252-I256 WeakPolarHBondContact O-CG1 3.48Å; G252-I256 PolarHBondContact O-N 3.09Å
253	F	88.5	Confident	80.8	Confident	6 Å²	6	62.9 Å²	62.9	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-49	-54.6	-176	-177.9	-85.4	0	0	0	112.1	E248 Q255 I256 M257 L298 C302 K305 I309	E248-F253 HydrophobicContact CB-CB 4.07Å; E248-F253 PolarHBondContact O-N 2.9Å; F253-Q255 VanDerWaalsContact C-N 3.32Å; F253-Q255 PolarHBondContact O-N 3.4Å; F253-I256 PolarHBondContact O-N 3.39Å; F253-M257 HydrophobicContact CD1-CG 4.03Å; F253-M257 HydrophobicContact CD2-CG 4.44Å; F253-M257 HydrophobicContact CE1-CB 4.3Å; F253-M257 HydrophobicContact CE1-CG 3.57Å; F253-M257 HydrophobicContact CE2-CG 4.04Å; F253-M257 HydrophobicContact CG-CG 4.42Å; F253-M257 HydrophobicContact CZ-CG 3.55Å; F253-M257 HydrophobicContact CZ-SD 4.38Å; F253-M257 WeakPolarHBondContact O-CB 3.33Å; F253-M257 WeakPolarHBondContact O-CG 3.45Å; F253-M257 PolarHBondContact O-N 3.01Å; F253-L298 HydrophobicContact CD2-CB 3.87Å; F253-L298 HydrophobicContact CD2-CD1 4.42Å; F253-L298 HydrophobicContact CE2-CB 3.82Å; F253-C302 HydrophobicContact CD2-CB 3.87Å; F253-C302 HydrophobicContact CE2-CB 4.39Å; F253-K305 HydrophobicContact CD1-CB 4.31Å; F253-K305 HydrophobicContact CD1-CD 4.02Å; F253-K305 HydrophobicContact CD1-CG 3.9Å; F253-K305 HydrophobicContact CD2-CB 4.13Å; F253-K305 HydrophobicContact CD2-CG 4.19Å; F253-K305 HydrophobicContact CE1-CB 3.72Å; F253-K305 HydrophobicContact CE1-CD 3.74Å; F253-K305 HydrophobicContact CE1-CG 3.72Å; F253-K305 HydrophobicContact CE2-CB 3.48Å; F253-K305 VanDerWaalsContact CE2-CB 3.48Å; F253-K305 HydrophobicContact CE2-CG 4.01Å; F253-K305 HydrophobicContact CG-CG 4.16Å; F253-K305 HydrophobicContact CZ-CB 3.27Å; F253-K305 HydrophobicContact CZ-CD 4.23Å; F253-K305 HydrophobicContact CZ-CG 3.8Å; F253-I309 HydrophobicContact CE2-CD1 3.6Å; F253-I309 HydrophobicContact CE2-CG1 4.26Å; F253-I309 HydrophobicContact CZ-CD1 3.63Å; F253-I309 HydrophobicContact CZ-CG1 3.77Å
254	E	89	Confident	81.6	Confident	102 Å²	102	53.7 Å²	53.7	48%	0.477	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-37	-177.7	-61.3	-60.6	154	0	0	112.6	G252 S258 K305	G252-E254 PolarHBondContact O-N 3.18Å; E254-S258 WeakPolarHBondContact O-CB 3.4Å; E254-S258 PolarHBondContact O-N 3.23Å; E254-S258 PolarHBondContact O-OG 3.01Å; E254-K305 IonicContact OE1-NZ 3.05Å; E254-K305 PolarHBondContact OE1-NZ 2.97Å
255	Q	88.3	Confident	81.9	Confident	98 Å²	98	54.8 Å²	54.8	46%	0.458	28%	0.276	S	S	.	.	H	α-helix	trans	-68.5	-40.7	178.7	-65.3	179.6	-2.4	0	0	111.5	R206 L210 G252 F253 S258	R206-Q255 VanDerWaalsContact CZ-OE1 3.29Å; R206-Q255 VanDerWaalsContact NE-OE1 3.08Å; L210-Q255 HydrophobicContact CD1-CB 3.9Å; G252-Q255 PolarHBondContact O-N 3.16Å; G252-Q255 VanDerWaalsContact O-N 3.15Å; F253-Q255 VanDerWaalsContact C-N 3.32Å; F253-Q255 PolarHBondContact O-N 3.4Å; Q255-S258 PolarHBondContact O-OG 3.15Å; Q255-S258 VanDerWaalsContact O-OG 3.14Å
256	I	89.4	Confident	82.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-71.9	-47.7	178.3	-61.3	163.9	0	0	0	109.6	W202 R206 L210 L228 G252 F253 S258 L259 W260 I294 L298	W202-I256 HydrophobicContact CH2-CD1 4.35Å; W202-I256 HydrophobicContact CZ2-CD1 4.1Å; R206-I256 HydrophobicContact CG-CD1 4.38Å; R206-I256 HydrophobicContact CG-CG1 4.34Å; L210-I256 HydrophobicContact CD2-CB 4.46Å; L210-I256 HydrophobicContact CD2-CG1 4.01Å; L228-I256 HydrophobicContact CD1-CD1 4.42Å; L228-I256 HydrophobicContact CD2-CG2 3.96Å; G252-I256 WeakPolarHBondContact O-CG1 3.48Å; G252-I256 PolarHBondContact O-N 3.09Å; F253-I256 PolarHBondContact O-N 3.39Å; I256-S258 PolarHBondContact O-N 3.25Å; I256-L259 PolarHBondContact O-N 2.93Å; I256-W260 HydrophobicContact CG2-CE3 4.19Å; I256-W260 WeakPolarHBondContact O-CB 3.33Å; I256-W260 PolarHBondContact O-N 2.91Å; I256-I294 HydrophobicContact CG2-CG2 4.05Å; I256-L298 HydrophobicContact CB-CD1 3.99Å; I256-L298 HydrophobicContact CD1-CD2 3.83Å; I256-L298 HydrophobicContact CG2-CD1 3.69Å
257	M	86.8	Confident	81.8	Confident	9 Å²	9	47.8 Å²	47.8	4%	0.044	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-39.8	-176.1	-73.2	-53.8	-57.1	0	0	113.6	F253 L259 W260 E261 P295 L298 I309 L312 W314	F253-M257 HydrophobicContact CD1-CG 4.03Å; F253-M257 HydrophobicContact CD2-CG 4.44Å; F253-M257 HydrophobicContact CE1-CB 4.3Å; F253-M257 HydrophobicContact CE1-CG 3.57Å; F253-M257 HydrophobicContact CE2-CG 4.04Å; F253-M257 HydrophobicContact CG-CG 4.42Å; F253-M257 HydrophobicContact CZ-CG 3.55Å; F253-M257 HydrophobicContact CZ-SD 4.38Å; F253-M257 WeakPolarHBondContact O-CB 3.33Å; F253-M257 WeakPolarHBondContact O-CG 3.45Å; F253-M257 PolarHBondContact O-N 3.01Å; M257-L259 VanDerWaalsContact C-N 3.29Å; M257-L259 PolarHBondContact O-N 3.22Å; M257-W260 WeakPolarHBondContact O-CA 3.44Å; M257-W260 WeakPolarHBondContact O-CB 3.27Å; M257-W260 PolarHBondContact O-N 3.15Å; M257-W260 HydrophobicContact SD-CB 4.45Å; M257-E261 WeakPolarHBondContact O-CG 3.49Å; M257-E261 PolarHBondContact O-N 3.19Å; M257-P295 HydrophobicContact CE-CB 4.31Å; M257-P295 HydrophobicContact SD-CB 4.15Å; M257-P295 HydrophobicContact SD-CG 4.49Å; M257-L298 HydrophobicContact CG-CD1 3.96Å; M257-L298 HydrophobicContact SD-CD1 3.6Å; M257-L298 VanDerWaalsContact SD-CD1 3.6Å; M257-I309 HydrophobicContact CE-CG1 4Å; M257-I309 HydrophobicContact SD-CG1 4.31Å; M257-L312 HydrophobicContact CE-CD1 3.37Å; M257-W314 HydrophobicContact CE-CZ2 4.41Å
258	S	85.5	Confident	81	Confident	64 Å²	64	46.8 Å²	46.8	45%	0.448	24%	0.241	S	C	.	.	H	α-helix	trans	-60.6	-38.3	176	52.1	0	0	0	0	112.7	E254 Q255 I256	E254-S258 WeakPolarHBondContact O-CB 3.4Å; E254-S258 PolarHBondContact O-N 3.23Å; E254-S258 PolarHBondContact O-OG 3.01Å; Q255-S258 PolarHBondContact O-OG 3.15Å; Q255-S258 VanDerWaalsContact O-OG 3.14Å; I256-S258 PolarHBondContact O-N 3.25Å
259	L	84.6	Confident	80.2	Confident	50 Å²	50	49.1 Å²	49.1	26%	0.262	26%	0.256	S	S	.	.	H	α-helix	trans	-75.4	-31.7	172.4	-72.9	168.4	0	0	0	112.1	L210 I256 M257 V262 V263	L210-L259 HydrophobicContact CB-CD1 3.61Å; L210-L259 HydrophobicContact CD1-CD1 3.99Å; L210-L259 HydrophobicContact CD2-CD1 3.65Å; L210-L259 HydrophobicContact CG-CD1 3.9Å; I256-L259 PolarHBondContact O-N 2.93Å; M257-L259 VanDerWaalsContact C-N 3.29Å; M257-L259 PolarHBondContact O-N 3.22Å; L259-V262 PolarHBondContact O-N 2.85Å; L259-V263 WeakPolarHBondContact O-CG2 3.29Å; L259-V263 PolarHBondContact O-N 3.27Å
260	W	84.5	Confident	79.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-36.1	179.8	-143	-99.6	0	0	0	113	L213 M225 L228 I256 M257 V262 V263 G264 L291 I294 P295 W314	L213-W260 HydrophobicContact CD1-CE3 4.04Å; L213-W260 HydrophobicContact CD1-CZ3 3.76Å; L213-W260 HydrophobicContact CD2-CH2 4.43Å; L213-W260 HydrophobicContact CD2-CZ3 3.82Å; L213-W260 HydrophobicContact CG-CZ3 4.48Å; M225-W260 HydrophobicContact CB-CH2 3.99Å; M225-W260 HydrophobicContact CE-CH2 3.67Å; M225-W260 HydrophobicContact CE-CZ2 3.35Å; M225-W260 HydrophobicContact CG-CH2 3.55Å; M225-W260 HydrophobicContact CG-CZ2 4.27Å; M225-W260 HydrophobicContact CG-CZ3 4.29Å; M225-W260 HydrophobicContact SD-CH2 4.43Å; L228-W260 HydrophobicContact CD2-CE3 4.38Å; L228-W260 HydrophobicContact CD2-CH2 4.25Å; L228-W260 HydrophobicContact CD2-CZ3 3.66Å; I256-W260 HydrophobicContact CG2-CE3 4.19Å; I256-W260 WeakPolarHBondContact O-CB 3.33Å; I256-W260 PolarHBondContact O-N 2.91Å; M257-W260 WeakPolarHBondContact O-CA 3.44Å; M257-W260 WeakPolarHBondContact O-CB 3.27Å; M257-W260 PolarHBondContact O-N 3.15Å; M257-W260 HydrophobicContact SD-CB 4.45Å; W260-V262 VanDerWaalsContact C-N 3.34Å; W260-V263 PolarHBondContact O-N 3.11Å; W260-G264 PolarHBondContact O-N 3.21Å; W260-L291 PolarHBondContact NE1-O 2.9Å; W260-I294 HydrophobicContact CD2-CB 4.27Å; W260-I294 HydrophobicContact CD2-CG2 4.04Å; W260-I294 HydrophobicContact CE3-CG2 4.02Å; W260-I294 HydrophobicContact CH2-CB 3.67Å; W260-I294 HydrophobicContact CH2-CD1 4.45Å; W260-I294 HydrophobicContact CH2-CG1 3.21Å; W260-I294 HydrophobicContact CH2-CG2 3.9Å; W260-I294 HydrophobicContact CZ2-CB 3.35Å; W260-I294 HydrophobicContact CZ2-CG1 3.26Å; W260-I294 HydrophobicContact CZ2-CG2 3.92Å; W260-I294 HydrophobicContact CZ3-CB 4.25Å; W260-I294 HydrophobicContact CZ3-CG1 4.05Å; W260-I294 HydrophobicContact CZ3-CG2 3.95Å; W260-P295 HydrophobicContact CG-CG 4.5Å; W260-P295 VanDerWaalsContact NE1-CD 3.31Å; W260-W314 AromaticContact CD1-CH2 3.5Å; W260-W314 AromaticContact CD1-CZ2 3.8Å; W260-W314 AromaticContact NE1-CH2 3.99Å
261	E	78.5	Confident	77.8	Confident	78 Å²	78	43.8 Å²	43.8	36%	0.364	23%	0.233	S	C	.	.	H	α-helix	trans	-58.7	-47.2	171.9	-73.2	175.1	177.5	0	0	110.9	M257 V263 G264 E265 L312	M257-E261 WeakPolarHBondContact O-CG 3.49Å; M257-E261 PolarHBondContact O-N 3.19Å; E261-V263 PolarHBondContact O-N 3.21Å; E261-G264 PolarHBondContact O-N 3.01Å; E261-E265 WeakPolarHBondContact O-CG 3.21Å; E261-E265 PolarHBondContact O-N 3.01Å; E261-L312 HydrophobicContact CG-CD1 4.36Å; E261-L312 WeakPolarHBondContact OE1-CD2 3.23Å
262	V	79.7	Confident	76.1	Confident	66 Å²	66	46.2 Å²	46.2	40%	0.4	25%	0.25	S	C	.	.	H	α-helix	trans	-62.6	-42.6	176.7	178.3	0	0	0	0	111.5	L259 W260 N266	L259-V262 PolarHBondContact O-N 2.85Å; W260-V262 VanDerWaalsContact C-N 3.34Å; V262-N266 VanDerWaalsContact O-CB 3.27Å; V262-N266 WeakPolarHBondContact O-CB 3.34Å; V262-N266 PolarHBondContact O-N 2.87Å; V262-N266 PolarHBondContact O-ND2 3.27Å; V262-N266 VanDerWaalsContact O-ND2 3.15Å
263	V	77.6	Confident	74.3	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-43	176	168.9	0	0	0	0	111.1	L213 V221 M225 L259 W260 E261 N266 I267 W274 L291	L213-V263 HydrophobicContact CB-CG2 4.21Å; V221-V263 HydrophobicContact CG1-CG1 4.42Å; M225-V263 HydrophobicContact CE-CG1 4.42Å; L259-V263 WeakPolarHBondContact O-CG2 3.29Å; L259-V263 PolarHBondContact O-N 3.27Å; W260-V263 PolarHBondContact O-N 3.11Å; E261-V263 PolarHBondContact O-N 3.21Å; V263-N266 PolarHBondContact O-N 3.2Å; V263-I267 HydrophobicContact CG1-CD1 3.71Å; V263-I267 WeakPolarHBondContact O-CB 3.49Å; V263-I267 WeakPolarHBondContact O-CG1 3.27Å; V263-I267 PolarHBondContact O-N 3Å; V263-W274 HydrophobicContact CB-CZ3 4.39Å; V263-W274 HydrophobicContact CG1-CZ3 3.83Å; V263-W274 HydrophobicContact CG2-CH2 4.31Å; V263-W274 HydrophobicContact CG2-CZ3 4.17Å; V263-L291 HydrophobicContact CG1-CD2 3.93Å
264	G	73.3	Confident	72.2	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-50.3	176.6	0	0	0	0	0	112.5	W260 E261 N266 I267 E268	W260-G264 PolarHBondContact O-N 3.21Å; E261-G264 PolarHBondContact O-N 3.01Å; G264-N266 PolarHBondContact O-N 3.16Å; G264-I267 PolarHBondContact O-N 3.46Å; G264-E268 WeakPolarHBondContact O-CG 3.43Å; G264-E268 PolarHBondContact O-N 2.67Å
265	E	72.2	Confident	70.3	Confident	105 Å²	105	50.4 Å²	50.4	49%	0.491	26%	0.26	S	S	.	.	H	α-helix	trans	-62.3	-41.9	176.6	-71.6	-177.2	171.9	0	0	112.3	E261 E268 N269	E261-E265 WeakPolarHBondContact O-CG 3.21Å; E261-E265 PolarHBondContact O-N 3.01Å; E265-E268 PolarHBondContact O-N 3.31Å; E265-N269 WeakPolarHBondContact O-CB 3.4Å; E265-N269 PolarHBondContact O-N 2.87Å; E265-N269 PolarHBondContact O-ND2 3.29Å
266	N	70.6	Confident	68.1	Low	61 Å²	61	49.3 Å²	49.3	33%	0.326	28%	0.275	S	S	.	.	H	α-helix	trans	-65.3	-40.2	178.6	-78.2	-27.6	0	0	0	112.2	V262 V263 G264 N269 S270 W274	V262-N266 VanDerWaalsContact O-CB 3.27Å; V262-N266 WeakPolarHBondContact O-CB 3.34Å; V262-N266 PolarHBondContact O-N 2.87Å; V262-N266 PolarHBondContact O-ND2 3.27Å; V262-N266 VanDerWaalsContact O-ND2 3.15Å; V263-N266 PolarHBondContact O-N 3.2Å; G264-N266 PolarHBondContact O-N 3.16Å; N266-N269 PolarHBondContact O-N 3.49Å; N266-S270 WeakPolarHBondContact O-CA 3.42Å; N266-S270 WeakPolarHBondContact O-CB 3.47Å; N266-S270 PolarHBondContact O-N 3.33Å; N266-W274 HydrophobicContact CB-CH2 4.27Å; N266-W274 HydrophobicContact CB-CZ2 3.81Å
267	I	67	Low	65.5	Low	11 Å²	11	51.8 Å²	51.8	6%	0.056	30%	0.3	C	S	.	.	H	α-helix	trans	-67.4	-41.7	177.3	-77	169	0	0	0	111.1	V263 G264 N269 W274 F275 L291	V263-I267 HydrophobicContact CG1-CD1 3.71Å; V263-I267 WeakPolarHBondContact O-CB 3.49Å; V263-I267 WeakPolarHBondContact O-CG1 3.27Å; V263-I267 PolarHBondContact O-N 3Å; G264-I267 PolarHBondContact O-N 3.46Å; I267-N269 VanDerWaalsContact C-N 3.32Å; I267-N269 PolarHBondContact O-N 3.44Å; I267-W274 HydrophobicContact CD1-CE3 3.93Å; I267-W274 HydrophobicContact CD1-CZ3 4.44Å; I267-W274 HydrophobicContact CG1-CB 4.23Å; I267-W274 HydrophobicContact CG1-CD2 3.95Å; I267-W274 HydrophobicContact CG1-CE3 3.68Å; I267-W274 HydrophobicContact CG1-CG 4.13Å; I267-W274 HydrophobicContact CG1-CZ3 4.36Å; I267-F275 HydrophobicContact CG2-CE1 4.2Å; I267-F275 HydrophobicContact CG2-CZ 3.58Å; I267-L291 HydrophobicContact CB-CD1 3.89Å; I267-L291 HydrophobicContact CD1-CD1 3.68Å; I267-L291 HydrophobicContact CD1-CD2 3.83Å; I267-L291 HydrophobicContact CD1-CG 3.74Å; I267-L291 HydrophobicContact CG1-CD1 4.38Å; I267-L291 HydrophobicContact CG2-CD1 3.53Å
268	E	62.9	Low	63	Low	57 Å²	57	54.2 Å²	54.2	27%	0.266	31%	0.313	S	S	.	.	H	α-helix	trans	-61.4	-40.6	175.7	-76.4	-175.1	154.4	0	0	112	G264 E265 R317	G264-E268 WeakPolarHBondContact O-CG 3.43Å; G264-E268 PolarHBondContact O-N 2.67Å; E265-E268 PolarHBondContact O-N 3.31Å; E268-R317 IonicContact OE1-CZ 3.39Å; E268-R317 IonicContact OE1-NE 3.47Å; E268-R317 PolarHBondContact OE1-NE 3.43Å; E268-R317 IonicContact OE1-NH2 2.65Å; E268-R317 IonicContact OE2-CZ 2.78Å; E268-R317 IonicContact OE2-NE 3.53Å; E268-R317 PolarHBondContact OE2-NE 2.89Å; E268-R317 IonicContact OE2-NH2 3.69Å; E268-R317 PolarHBondContact OE2-NH2 3.45Å
269	N	65.4	Low	60.5	Low	128 Å²	128	62 Å²	62	68%	0.684	33%	0.332	S	S	*	.	H	α-helix	trans	-85.7	-24.3	-176.7	-69.4	-46.4	0	0	0	114.3	E265 N266 I267	E265-N269 WeakPolarHBondContact O-CB 3.4Å; E265-N269 PolarHBondContact O-N 2.87Å; E265-N269 PolarHBondContact O-ND2 3.29Å; N266-N269 PolarHBondContact O-N 3.49Å; I267-N269 VanDerWaalsContact C-N 3.32Å; I267-N269 PolarHBondContact O-N 3.44Å
270	S	63.2	Low	58.4	Low	38 Å²	38	61.2 Å²	61.2	27%	0.266	34%	0.336	S	S	.	.			trans	-137.1	55.2	-172.6	-69.5	0	0	0	0	113.7	N266 S272 R273	N266-S270 WeakPolarHBondContact O-CA 3.42Å; N266-S270 WeakPolarHBondContact O-CB 3.47Å; N266-S270 PolarHBondContact O-N 3.33Å; S270-S272 PolarHBondContact O-N 2.92Å; S270-R273 PolarHBondContact O-N 3.2Å
271	P	55.4	Low	56.2	Low	39 Å²	39	68.5 Å²	68.5	25%	0.253	38%	0.383	S	S	.	.	H	α-helix	trans	-56.1	-50.6	-173	20.9	-32.5	0	0	0	112.3	R273 W274 F275	P271-R273 PolarHBondContact O-N 2.98Å; P271-W274 PolarHBondContact O-N 3.24Å; P271-W274 VanDerWaalsContact O-N 3.13Å; P271-F275 HydrophobicContact CB-CD2 3.95Å; P271-F275 HydrophobicContact CB-CE2 3.41Å; P271-F275 VanDerWaalsContact CB-CE2 3.41Å; P271-F275 HydrophobicContact CB-CZ 4.38Å; P271-F275 WeakPolarHBondContact O-CD2 3.44Å; P271-F275 VanDerWaalsContact O-CE2 3.26Å; P271-F275 WeakPolarHBondContact O-CE2 3.26Å; P271-F275 VanDerWaalsContact O-CG 3.25Å; P271-F275 WeakPolarHBondContact O-CG 3.36Å; P271-F275 PolarHBondContact O-N 2.89Å
272	S	49.5	Very low	54.6	Low	51 Å²	51	66.6 Å²	66.6	36%	0.357	39%	0.385	S	S	.	.	H	α-helix	trans	-58.1	-25	-175.9	62.9	0	0	0	0	115.8	S270	S270-S272 PolarHBondContact O-N 2.92Å
273	R	48.2	Very low	53.2	Low	177 Å²	177	68.3 Å²	68.3	67%	0.668	39%	0.387	S	S	*	.	H	α-helix	trans	-81.5	-28	-177.8	-71.9	-175.2	177.9	179.8	0.6	112.9	G218 S270 P271	G218-R273 PolarHBondContact N-O 3.09Å; S270-R273 PolarHBondContact O-N 3.2Å; P271-R273 PolarHBondContact O-N 2.98Å
274	W	45.6	Very low	51.9	Low	12 Å²	12	69.4 Å²	69.4	5%	0.045	39%	0.393	C	S	.	.	H	α-helix	trans	-92.3	-14.7	-174.3	-70	62.6	0	0	0	112.3	S215 G218 V221 V263 N266 I267 P271	S215-W274 WeakPolarHBondContact O-CZ2 3.43Å; G218-W274 CarbonylContact C-O 3.52Å; G218-W274 VanDerWaalsContact CA-CA 3.42Å; G218-W274 WeakPolarHBondContact CA-O 3.38Å; V221-W274 HydrophobicContact CB-CE3 3.63Å; V221-W274 HydrophobicContact CB-CH2 4.38Å; V221-W274 HydrophobicContact CB-CZ3 3.57Å; V221-W274 HydrophobicContact CG1-CE3 3.4Å; V221-W274 HydrophobicContact CG1-CH2 4.11Å; V221-W274 HydrophobicContact CG1-CZ3 3.07Å; V221-W274 HydrophobicContact CG2-CD2 4.33Å; V221-W274 HydrophobicContact CG2-CE3 3.64Å; V221-W274 HydrophobicContact CG2-CH2 3.63Å; V221-W274 HydrophobicContact CG2-CZ2 4.32Å; V221-W274 HydrophobicContact CG2-CZ3 3.31Å; V263-W274 HydrophobicContact CB-CZ3 4.39Å; V263-W274 HydrophobicContact CG1-CZ3 3.83Å; V263-W274 HydrophobicContact CG2-CH2 4.31Å; V263-W274 HydrophobicContact CG2-CZ3 4.17Å; N266-W274 HydrophobicContact CB-CH2 4.27Å; N266-W274 HydrophobicContact CB-CZ2 3.81Å; I267-W274 HydrophobicContact CD1-CE3 3.93Å; I267-W274 HydrophobicContact CD1-CZ3 4.44Å; I267-W274 HydrophobicContact CG1-CB 4.23Å; I267-W274 HydrophobicContact CG1-CD2 3.95Å; I267-W274 HydrophobicContact CG1-CE3 3.68Å; I267-W274 HydrophobicContact CG1-CG 4.13Å; I267-W274 HydrophobicContact CG1-CZ3 4.36Å; P271-W274 PolarHBondContact O-N 3.24Å; P271-W274 VanDerWaalsContact O-N 3.13Å
275	F	48.5	Very low	50.9	Low	13 Å²	13	70.6 Å²	70.6	6%	0.057	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	35.1	-169	-51	-35.5	0	0	0	114.4	I267 P271 G277 I278 D284 S287	I267-F275 HydrophobicContact CG2-CE1 4.2Å; I267-F275 HydrophobicContact CG2-CZ 3.58Å; P271-F275 HydrophobicContact CB-CD2 3.95Å; P271-F275 HydrophobicContact CB-CE2 3.41Å; P271-F275 VanDerWaalsContact CB-CE2 3.41Å; P271-F275 HydrophobicContact CB-CZ 4.38Å; P271-F275 WeakPolarHBondContact O-CD2 3.44Å; P271-F275 VanDerWaalsContact O-CE2 3.26Å; P271-F275 WeakPolarHBondContact O-CE2 3.26Å; P271-F275 VanDerWaalsContact O-CG 3.25Å; P271-F275 WeakPolarHBondContact O-CG 3.36Å; P271-F275 PolarHBondContact O-N 2.89Å; F275-G277 PolarHBondContact O-N 2.98Å; F275-G277 VanDerWaalsContact O-N 3.14Å; F275-I278 PolarHBondContact O-N 3.32Å; F275-D284 HydrophobicContact CB-CB 4.1Å; F275-D284 HydrophobicContact CD1-CB 3.67Å; F275-D284 HydrophobicContact CD2-CB 3.51Å; F275-D284 HydrophobicContact CE1-CB 3.96Å; F275-D284 HydrophobicContact CE2-CB 3.73Å; F275-D284 HydrophobicContact CG-CB 3.47Å; F275-D284 VanDerWaalsContact CG-CB 3.47Å; F275-D284 HydrophobicContact CZ-CB 3.93Å; F275-S287 WeakPolarHBondContact CD1-OG 3.11Å; F275-S287 WeakPolarHBondContact CE1-OG 3.04Å
276	G	42.4	Very low	49.9	Very low	75 Å²	75	67.1 Å²	67.1	77%	0.773	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	22.7	176.4	0	0	0	0	0	114.3
277	G	34.7	Very low	49.2	Very low	51 Å²	51	64.3 Å²	64.3	53%	0.526	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	9.9	177.3	0	0	0	0	0	115.5	F275 R279	F275-G277 PolarHBondContact O-N 2.98Å; F275-G277 VanDerWaalsContact O-N 3.14Å; G277-R279 PolarHBondContact O-N 3.44Å
278	I	34.5	Very low	48.9	Very low	61 Å²	61	64.3 Å²	64.3	31%	0.313	37%	0.373	S	S	.	.			trans	-65.7	98.3	168.1	-56.2	174	0	0	0	107.7	F275 G280	F275-I278 PolarHBondContact O-N 3.32Å; I278-G280 PolarHBondContact O-N 3.43Å
279	R	32.3	Very low	48.7	Very low	227 Å²	227	62.4 Å²	62.4	86%	0.857	36%	0.364	S	S	*	.			trans	-76.8	101.2	171.5	-75.9	-174.7	178	-174	0.7	108.2	G277	G277-R279 PolarHBondContact O-N 3.44Å
280	G	39.8	Very low	48.6	Very low	34 Å²	34	56.5 Å²	56.5	35%	0.351	33%	0.332	S	S	.	.			trans	-147.2	150.7	167	0	0	0	0	0	110.7	I278 G282	I278-G280 PolarHBondContact O-N 3.43Å; G280-G282 PolarHBondContact O-N 3.15Å
281	P	39.2	Very low	48.9	Very low	152 Å²	152	54.7 Å²	54.7	99%	0.987	32%	0.32	S	S	*	.	S	Bend	trans	-69	-3.2	169.2	28.5	-33.4	0	0	0	113.2
282	G	44.2	Very low	49.7	Very low	39 Å²	39	53 Å²	53	40%	0.402	31%	0.309	S	S	.	.	S	Bend	trans	-85.5	141.2	176.8	0	0	0	0	0	112.1	G280 D284	G280-G282 PolarHBondContact O-N 3.15Å; G282-D284 PolarHBondContact O-N 3.48Å
283	K	49.9	Very low	50.9	Low	102 Å²	102	50.8 Å²	50.8	44%	0.443	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-64.1	128.2	167.3	-55.3	-177.1	179.4	-177.8	0	108.1	P285 V288 L318	K283-P285 WeakPolarHBondContact O-CD 3.3Å; K283-V288 HydrophobicContact CB-CG2 3.52Å; K283-V288 HydrophobicContact CD-CG2 3.92Å; K283-V288 HydrophobicContact CG-CG2 4.31Å; K283-L318 HydrophobicContact CD-CD2 4.33Å
284	D	52.2	Low	52.5	Low	25 Å²	25	42.4 Å²	42.4	13%	0.134	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-60.2	118	172.4	167.6	38.6	0	0	0	109.6	F275 G282 C286 S287 V288	F275-D284 HydrophobicContact CB-CB 4.1Å; F275-D284 HydrophobicContact CD1-CB 3.67Å; F275-D284 HydrophobicContact CD2-CB 3.51Å; F275-D284 HydrophobicContact CE1-CB 3.96Å; F275-D284 HydrophobicContact CE2-CB 3.73Å; F275-D284 HydrophobicContact CG-CB 3.47Å; F275-D284 VanDerWaalsContact CG-CB 3.47Å; F275-D284 HydrophobicContact CZ-CB 3.93Å; G282-D284 PolarHBondContact O-N 3.48Å; D284-C286 PolarHBondContact O-N 3.08Å; D284-C286 PolarHBondContact OD1-N 3.32Å; D284-S287 PolarHBondContact O-N 3.36Å; D284-S287 VanDerWaalsContact OD2-CB 3.31Å; D284-S287 WeakPolarHBondContact OD2-CB 3.13Å; D284-S287 PolarHBondContact OD2-N 3.36Å; D284-S287 VanDerWaalsContact OD2-N 3.15Å; D284-S287 PolarHBondContact OD2-OG 2.97Å; D284-V288 PolarHBondContact O-N 3.38Å
285	P	50.9	Low	54.1	Low	25 Å²	25	41.8 Å²	41.8	16%	0.162	26%	0.259	C	S	.	.	H	α-helix	trans	-56.3	-39.9	-178.9	-23.2	31.5	0	0	0	112.3	K283 S287 V288 R289 F433	K283-P285 WeakPolarHBondContact O-CD 3.3Å; P285-S287 PolarHBondContact O-N 3.31Å; P285-V288 PolarHBondContact O-N 2.89Å; P285-R289 WeakPolarHBondContact O-CB 3.46Å; P285-R289 PolarHBondContact O-N 3.45Å; P285-F433 HydrophobicContact CG-CD1 4.07Å; P285-F433 HydrophobicContact CG-CE1 3.31Å; P285-F433 HydrophobicContact CG-CZ 3.6Å
286	C	51.8	Low	55.4	Low	31 Å²	31	41.3 Å²	41.3	21%	0.209	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-33.4	179.8	-71.4	0	0	0	0	112.2	D284 R289 L290	D284-C286 PolarHBondContact O-N 3.08Å; D284-C286 PolarHBondContact OD1-N 3.32Å; C286-R289 WeakPolarHBondContact O-CB 3.33Å; C286-L290 VanDerWaalsContact O-CG 3.29Å; C286-L290 WeakPolarHBondContact O-CG 3.47Å; C286-L290 PolarHBondContact O-N 3.13Å
287	S	55.5	Low	57.3	Low	3 Å²	3	37.8 Å²	37.8	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-89	-36.1	-177.5	-62	0	0	0	0	113.3	F275 D284 P285 R289 L290 L291	F275-S287 WeakPolarHBondContact CD1-OG 3.11Å; F275-S287 WeakPolarHBondContact CE1-OG 3.04Å; D284-S287 PolarHBondContact O-N 3.36Å; D284-S287 VanDerWaalsContact OD2-CB 3.31Å; D284-S287 WeakPolarHBondContact OD2-CB 3.13Å; D284-S287 PolarHBondContact OD2-N 3.36Å; D284-S287 VanDerWaalsContact OD2-N 3.15Å; D284-S287 PolarHBondContact OD2-OG 2.97Å; P285-S287 PolarHBondContact O-N 3.31Å; S287-R289 PolarHBondContact O-N 3.19Å; S287-L290 PolarHBondContact O-N 3.32Å; S287-L291 WeakPolarHBondContact O-CB 3.31Å; S287-L291 VanDerWaalsContact O-CG 3.29Å; S287-L291 WeakPolarHBondContact O-CG 3.06Å; S287-L291 PolarHBondContact O-N 2.88Å
288	V	60.4	Low	59.7	Low	11 Å²	11	35.3 Å²	35.3	7%	0.067	20%	0.195	C	C	.	.	H	α-helix	trans	-56.7	-44.1	165.1	171.1	0	0	0	0	109.7	K283 D284 P285 L291 L292 L318	K283-V288 HydrophobicContact CB-CG2 3.52Å; K283-V288 HydrophobicContact CD-CG2 3.92Å; K283-V288 HydrophobicContact CG-CG2 4.31Å; D284-V288 PolarHBondContact O-N 3.38Å; P285-V288 PolarHBondContact O-N 2.89Å; V288-L291 PolarHBondContact O-N 2.96Å; V288-L292 HydrophobicContact CG1-CD1 3.96Å; V288-L292 WeakPolarHBondContact O-CB 3.24Å; V288-L292 VanDerWaalsContact O-CG 3.29Å; V288-L292 WeakPolarHBondContact O-CG 3.28Å; V288-L292 PolarHBondContact O-N 3.14Å; V288-L318 HydrophobicContact CG1-CD2 4.18Å; V288-L318 HydrophobicContact CG2-CD2 4.25Å
289	R	59.8	Low	61.9	Low	16 Å²	16	32.4 Å²	32.4	6%	0.06	18%	0.18	C	C	.	.	H	α-helix	trans	-57.7	-51.8	175.3	176.9	-174	100	141.2	3.7	111.8	P285 C286 S287 L292 L293 S329 F330 E333 Q336	P285-R289 WeakPolarHBondContact O-CB 3.46Å; P285-R289 PolarHBondContact O-N 3.45Å; C286-R289 WeakPolarHBondContact O-CB 3.33Å; S287-R289 PolarHBondContact O-N 3.19Å; R289-L292 PolarHBondContact O-N 2.83Å; R289-L293 WeakPolarHBondContact O-CB 3.16Å; R289-L293 PolarHBondContact O-N 2.79Å; R289-S329 WeakPolarHBondContact CD-O 3.34Å; R289-F330 HydrophobicContact CB-CE1 4.34Å; R289-F330 HydrophobicContact CG-CD1 3.97Å; R289-F330 HydrophobicContact CG-CE1 3.83Å; R289-E333 IonicContact CZ-OE1 3.09Å; R289-E333 IonicContact NH1-OE1 2.78Å; R289-E333 PolarHBondContact NH1-OE1 3.31Å; R289-E333 IonicContact NH2-OE1 3.56Å; R289-E333 PolarHBondContact NH2-OE1 2.96Å; R289-Q336 VanDerWaalsContact NH1-NE2 3.2Å; R289-Q336 VanDerWaalsContact NH1-OE1 3.09Å
290	L	63.4	Low	64	Low	4 Å²	4	22 Å²	22	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-67.3	-37.3	177.8	-71.9	168.3	0	0	0	112.8	R222 M225 Q226 C286 S287 L292 L293 I294	R222-L290 HydrophobicContact CG-CD1 4.19Å; M225-L290 HydrophobicContact CB-CB 4.2Å; M225-L290 HydrophobicContact CB-CD1 4.03Å; M225-L290 HydrophobicContact CB-CD2 4.43Å; M225-L290 HydrophobicContact CB-CG 4.46Å; M225-L290 HydrophobicContact CE-CB 3.52Å; M225-L290 HydrophobicContact SD-CB 4.23Å; Q226-L290 HydrophobicContact CG-CD1 3.84Å; Q226-L290 HydrophobicContact CG-CD2 4.14Å; C286-L290 VanDerWaalsContact O-CG 3.29Å; C286-L290 WeakPolarHBondContact O-CG 3.47Å; C286-L290 PolarHBondContact O-N 3.13Å; S287-L290 PolarHBondContact O-N 3.32Å; L290-L292 VanDerWaalsContact C-N 3.29Å; L290-L292 PolarHBondContact O-N 3.38Å; L290-L293 HydrophobicContact CD2-CD2 4.47Å; L290-L293 PolarHBondContact O-N 3.22Å; L290-I294 PolarHBondContact O-N 3.41Å
291	L	69.3	Low	66	Low	1 Å²	1	20.9 Å²	20.9	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-37.5	176.2	-86.6	176	0	0	0	112.5	M225 W260 V263 I267 S287 V288 P295 W314 L318	M225-L291 HydrophobicContact CE-CD2 4.02Å; M225-L291 HydrophobicContact CE-CG 3.99Å; W260-L291 PolarHBondContact NE1-O 2.9Å; V263-L291 HydrophobicContact CG1-CD2 3.93Å; I267-L291 HydrophobicContact CB-CD1 3.89Å; I267-L291 HydrophobicContact CD1-CD1 3.68Å; I267-L291 HydrophobicContact CD1-CD2 3.83Å; I267-L291 HydrophobicContact CD1-CG 3.74Å; I267-L291 HydrophobicContact CG1-CD1 4.38Å; I267-L291 HydrophobicContact CG2-CD1 3.53Å; S287-L291 WeakPolarHBondContact O-CB 3.31Å; S287-L291 VanDerWaalsContact O-CG 3.29Å; S287-L291 WeakPolarHBondContact O-CG 3.06Å; S287-L291 PolarHBondContact O-N 2.88Å; V288-L291 PolarHBondContact O-N 2.96Å; L291-P295 WeakPolarHBondContact O-CD 3.21Å; L291-P295 WeakPolarHBondContact O-CG 3.46Å; L291-W314 HydrophobicContact CB-CZ3 4.44Å; L291-L318 HydrophobicContact CB-CD1 3.96Å; L291-L318 HydrophobicContact CD1-CD1 4.2Å
292	L	71.8	Confident	68.1	Low	4 Å²	4	14 Å²	14	2%	0.021	8%	0.083	C	C	.	.	H	α-helix	trans	-75.5	-47.4	172.9	-70	172.7	0	0	0	110.5	V288 R289 L290 I294 P295 L296 F315 L318 V319 L326 F330	V288-L292 HydrophobicContact CG1-CD1 3.96Å; V288-L292 WeakPolarHBondContact O-CB 3.24Å; V288-L292 VanDerWaalsContact O-CG 3.29Å; V288-L292 WeakPolarHBondContact O-CG 3.28Å; V288-L292 PolarHBondContact O-N 3.14Å; R289-L292 PolarHBondContact O-N 2.83Å; L290-L292 VanDerWaalsContact C-N 3.29Å; L290-L292 PolarHBondContact O-N 3.38Å; L292-I294 PolarHBondContact O-N 3Å; L292-P295 VanDerWaalsContact O-CD 3.29Å; L292-P295 WeakPolarHBondContact O-CD 3.43Å; L292-L296 HydrophobicContact CB-CD1 4.14Å; L292-L296 WeakPolarHBondContact O-CB 3.46Å; L292-L296 VanDerWaalsContact O-CD1 3.26Å; L292-L296 WeakPolarHBondContact O-CD1 3.49Å; L292-L296 WeakPolarHBondContact O-CG 3.22Å; L292-L296 PolarHBondContact O-N 3.48Å; L292-F315 HydrophobicContact CD2-CD2 3.97Å; L292-F315 HydrophobicContact CD2-CE2 3.56Å; L292-F315 HydrophobicContact CD2-CZ 4.01Å; L292-L318 HydrophobicContact CD2-CB 3.76Å; L292-L318 HydrophobicContact CD2-CD1 4.14Å; L292-L318 HydrophobicContact CG-CB 4.31Å; L292-L318 HydrophobicContact CG-CD1 4.33Å; L292-V319 HydrophobicContact CD2-CG2 4.21Å; L292-L326 HydrophobicContact CD1-CD1 3.64Å; L292-F330 HydrophobicContact CB-CZ 4.42Å; L292-F330 HydrophobicContact CD1-CE2 4.42Å; L292-F330 HydrophobicContact CD1-CZ 4.08Å
293	L	74.7	Confident	69.5	Low	4 Å²	4	16 Å²	16	2%	0.021	8%	0.084	C	C	.	.	H	α-helix	trans	-58.4	-44.6	-168.4	-174.6	61.2	0	0	0	113.9	S229 R289 L290 L296 Q297 Q336 M339	S229-L293 WeakPolarHBondContact OG-CD2 3.39Å; R289-L293 WeakPolarHBondContact O-CB 3.16Å; R289-L293 PolarHBondContact O-N 2.79Å; L290-L293 HydrophobicContact CD2-CD2 4.47Å; L290-L293 PolarHBondContact O-N 3.22Å; L293-L296 PolarHBondContact O-N 3.01Å; L293-Q297 HydrophobicContact CD1-CG 4.25Å; L293-Q297 HydrophobicContact CG-CG 4.39Å; L293-Q297 WeakPolarHBondContact O-CB 3.45Å; L293-Q297 VanDerWaalsContact O-CG 3.3Å; L293-Q297 WeakPolarHBondContact O-CG 3.47Å; L293-Q297 PolarHBondContact O-N 3.5Å; L293-Q336 HydrophobicContact CD2-CG 4.29Å; L293-M339 HydrophobicContact CD1-CB 3.8Å; L293-M339 HydrophobicContact CD1-CG 3.58Å
294	I	81.2	Confident	70.9	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-65.3	-53.9	-177.2	-62.8	-50.4	0	0	0	113.1	L228 S229 L232 I256 W260 L290 L292 L296 Q297 L298	L228-I294 HydrophobicContact CB-CD1 4.25Å; L228-I294 HydrophobicContact CD2-CD1 4.35Å; L228-I294 HydrophobicContact CD2-CG1 4.3Å; L228-I294 HydrophobicContact CD2-CG2 3.81Å; L228-I294 HydrophobicContact CG-CD1 4.04Å; L228-I294 HydrophobicContact CG-CG2 4.39Å; S229-I294 VanDerWaalsContact CB-CD1 3.44Å; S229-I294 VanDerWaalsContact N-CD1 3.29Å; L232-I294 HydrophobicContact CD1-CD1 4.12Å; L232-I294 HydrophobicContact CD1-CG2 3.96Å; I256-I294 HydrophobicContact CG2-CG2 4.05Å; W260-I294 HydrophobicContact CD2-CB 4.27Å; W260-I294 HydrophobicContact CD2-CG2 4.04Å; W260-I294 HydrophobicContact CE3-CG2 4.02Å; W260-I294 HydrophobicContact CH2-CB 3.67Å; W260-I294 HydrophobicContact CH2-CD1 4.45Å; W260-I294 HydrophobicContact CH2-CG1 3.21Å; W260-I294 HydrophobicContact CH2-CG2 3.9Å; W260-I294 HydrophobicContact CZ2-CB 3.35Å; W260-I294 HydrophobicContact CZ2-CG1 3.26Å; W260-I294 HydrophobicContact CZ2-CG2 3.92Å; W260-I294 HydrophobicContact CZ3-CB 4.25Å; W260-I294 HydrophobicContact CZ3-CG1 4.05Å; W260-I294 HydrophobicContact CZ3-CG2 3.95Å; L290-I294 PolarHBondContact O-N 3.41Å; L292-I294 PolarHBondContact O-N 3Å; I294-L296 PolarHBondContact O-N 3.14Å; I294-L296 VanDerWaalsContact O-N 3.16Å; I294-Q297 VanDerWaalsContact CD1-OE1 3.26Å; I294-Q297 PolarHBondContact O-N 2.93Å; I294-Q297 VanDerWaalsContact O-N 3.14Å; I294-L298 HydrophobicContact CG2-CD1 4.15Å; I294-L298 HydrophobicContact CG2-CG 4.37Å; I294-L298 WeakPolarHBondContact O-CB 3.16Å; I294-L298 WeakPolarHBondContact O-CG 3.33Å; I294-L298 PolarHBondContact O-N 3.34Å
295	P	79.3	Confident	72.3	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-53.5	-37.8	174.7	-19.9	19.9	0	0	0	111.7	M257 W260 L291 L292 L298 S299 I309 W314 F315	M257-P295 HydrophobicContact CE-CB 4.31Å; M257-P295 HydrophobicContact SD-CB 4.15Å; M257-P295 HydrophobicContact SD-CG 4.49Å; W260-P295 HydrophobicContact CG-CG 4.5Å; W260-P295 VanDerWaalsContact NE1-CD 3.31Å; L291-P295 WeakPolarHBondContact O-CD 3.21Å; L291-P295 WeakPolarHBondContact O-CG 3.46Å; L292-P295 VanDerWaalsContact O-CD 3.29Å; L292-P295 WeakPolarHBondContact O-CD 3.43Å; P295-L298 WeakPolarHBondContact O-CB 3.3Å; P295-L298 PolarHBondContact O-N 3.04Å; P295-S299 WeakPolarHBondContact O-CB 3.49Å; P295-S299 PolarHBondContact O-N 2.87Å; P295-I309 HydrophobicContact CB-CD1 4.29Å; P295-I309 HydrophobicContact CB-CG1 4.38Å; P295-I309 HydrophobicContact CB-CG2 3.54Å; P295-I309 WeakPolarHBondContact O-CD1 3.48Å; P295-W314 HydrophobicContact CG-CH2 3.64Å; P295-W314 HydrophobicContact CG-CZ2 4.28Å; P295-F315 HydrophobicContact CB-CD2 4.4Å; P295-F315 HydrophobicContact CB-CE2 4.29Å; P295-F315 HydrophobicContact CG-CD2 4.43Å
296	L	76.1	Confident	73.5	Confident	3 Å²	3	15 Å²	15	2%	0.016	9%	0.093	C	C	.	.	H	α-helix	trans	-68.2	-46.2	-179.8	-63.7	172.2	0	0	0	111.7	L292 L293 I294 L298 S299 T300 F306 F315 M339 C343	L292-L296 HydrophobicContact CB-CD1 4.14Å; L292-L296 WeakPolarHBondContact O-CB 3.46Å; L292-L296 VanDerWaalsContact O-CD1 3.26Å; L292-L296 WeakPolarHBondContact O-CD1 3.49Å; L292-L296 WeakPolarHBondContact O-CG 3.22Å; L292-L296 PolarHBondContact O-N 3.48Å; L293-L296 PolarHBondContact O-N 3.01Å; I294-L296 PolarHBondContact O-N 3.14Å; I294-L296 VanDerWaalsContact O-N 3.16Å; L296-L298 VanDerWaalsContact C-N 3.29Å; L296-L298 PolarHBondContact O-N 2.76Å; L296-S299 WeakPolarHBondContact O-CB 3.44Å; L296-S299 PolarHBondContact O-N 2.87Å; L296-S299 VanDerWaalsContact O-N 3.07Å; L296-S299 PolarHBondContact O-OG 2.95Å; L296-T300 PolarHBondContact O-N 3.43Å; L296-T300 PolarHBondContact O-OG1 3.41Å; L296-T300 VanDerWaalsContact O-OG1 3.1Å; L296-F306 HydrophobicContact CD2-CE2 4.43Å; L296-F315 HydrophobicContact CD2-CE2 4.02Å; L296-F315 HydrophobicContact CD2-CZ 3.63Å; L296-F315 HydrophobicContact CG-CE2 4.17Å; L296-F315 HydrophobicContact CG-CZ 4.17Å; L296-M339 HydrophobicContact CB-CE 3.27Å; L296-M339 WeakPolarHBondContact O-CE 3.38Å; L296-C343 WeakPolarHBondContact CD1-SG 3.25Å; L296-C343 HydrophobicContact CD2-CB 4.28Å; L296-C343 WeakPolarHBondContact CD2-SG 3.39Å; L296-C343 WeakPolarHBondContact CG-SG 3.27Å
297	Q	82.8	Confident	74.4	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59.4	-41.8	173.6	-75.4	170.1	-28.3	0	0	111.3	S229 L232 S233 I236 L293 I294 S299 T300 L301 M339 Y386	S229-Q297 VanDerWaalsContact CA-OE1 3.32Å; S229-Q297 PolarHBondContact O-NE2 3.3Å; S229-Q297 PolarHBondContact OG-NE2 2.74Å; S229-Q297 PolarHBondContact OG-OE1 3.13Å; L232-Q297 HydrophobicContact CB-CB 3.97Å; L232-Q297 HydrophobicContact CD1-CB 3.9Å; S233-Q297 PolarHBondContact OG-NE2 3.3Å; S233-Q297 VanDerWaalsContact OG-NE2 3.1Å; I236-Q297 HydrophobicContact CD1-CB 3.64Å; I236-Q297 HydrophobicContact CD1-CG 3.78Å; L293-Q297 HydrophobicContact CD1-CG 4.25Å; L293-Q297 HydrophobicContact CG-CG 4.39Å; L293-Q297 WeakPolarHBondContact O-CB 3.45Å; L293-Q297 VanDerWaalsContact O-CG 3.3Å; L293-Q297 WeakPolarHBondContact O-CG 3.47Å; L293-Q297 PolarHBondContact O-N 3.5Å; I294-Q297 VanDerWaalsContact CD1-OE1 3.26Å; I294-Q297 PolarHBondContact O-N 2.93Å; I294-Q297 VanDerWaalsContact O-N 3.14Å; Q297-S299 VanDerWaalsContact C-N 3.31Å; Q297-S299 PolarHBondContact O-N 3.33Å; Q297-T300 WeakPolarHBondContact O-CB 3.08Å; Q297-T300 PolarHBondContact O-N 2.85Å; Q297-T300 VanDerWaalsContact O-N 3.15Å; Q297-L301 WeakPolarHBondContact O-CG 3.42Å; Q297-L301 PolarHBondContact O-N 3.26Å; Q297-M339 HydrophobicContact CG-CE 4.15Å; Q297-M339 HydrophobicContact CG-SD 4.39Å; Q297-M339 VanDerWaalsContact N-CE 3.29Å; Q297-Y386 HydrophobicContact CG-CE1 4.34Å; Q297-Y386 PolarHBondContact NE2-OH 2.91Å
298	L	85.5	Confident	75.4	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.2	-41	173.3	-71.3	177.3	0	0	0	111.9	L232 V251 F253 I256 M257 I294 P295 L296 T300 L301 C302	L232-L298 HydrophobicContact CD1-CD2 3.96Å; L232-L298 HydrophobicContact CD1-CG 4.04Å; L232-L298 HydrophobicContact CD2-CD2 4.05Å; V251-L298 HydrophobicContact CG1-CD2 3.41Å; V251-L298 VanDerWaalsContact CG1-CD2 3.41Å; F253-L298 HydrophobicContact CD2-CB 3.87Å; F253-L298 HydrophobicContact CD2-CD1 4.42Å; F253-L298 HydrophobicContact CE2-CB 3.82Å; I256-L298 HydrophobicContact CB-CD1 3.99Å; I256-L298 HydrophobicContact CD1-CD2 3.83Å; I256-L298 HydrophobicContact CG2-CD1 3.69Å; M257-L298 HydrophobicContact CG-CD1 3.96Å; M257-L298 HydrophobicContact SD-CD1 3.6Å; M257-L298 VanDerWaalsContact SD-CD1 3.6Å; I294-L298 HydrophobicContact CG2-CD1 4.15Å; I294-L298 HydrophobicContact CG2-CG 4.37Å; I294-L298 WeakPolarHBondContact O-CB 3.16Å; I294-L298 WeakPolarHBondContact O-CG 3.33Å; I294-L298 PolarHBondContact O-N 3.34Å; P295-L298 WeakPolarHBondContact O-CB 3.3Å; P295-L298 PolarHBondContact O-N 3.04Å; L296-L298 VanDerWaalsContact C-N 3.29Å; L296-L298 PolarHBondContact O-N 2.76Å; L298-T300 VanDerWaalsContact C-N 3.28Å; L298-T300 PolarHBondContact O-N 2.93Å; L298-L301 CarbonylContact O-C 3.56Å; L298-L301 PolarHBondContact O-N 3.13Å; L298-C302 WeakPolarHBondContact O-CA 3.49Å; L298-C302 VanDerWaalsContact O-CB 3.29Å; L298-C302 WeakPolarHBondContact O-CB 3.31Å; L298-C302 PolarHBondContact O-N 3.37Å
299	S	78.9	Confident	76.1	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.5	-31.3	176.6	84	0	0	0	0	112.8	P295 L296 Q297 C302 L303 F306	P295-S299 WeakPolarHBondContact O-CB 3.49Å; P295-S299 PolarHBondContact O-N 2.87Å; L296-S299 WeakPolarHBondContact O-CB 3.44Å; L296-S299 PolarHBondContact O-N 2.87Å; L296-S299 VanDerWaalsContact O-N 3.07Å; L296-S299 PolarHBondContact O-OG 2.95Å; Q297-S299 VanDerWaalsContact C-N 3.31Å; Q297-S299 PolarHBondContact O-N 3.33Å; S299-C302 CarbonylContact O-C 3.56Å; S299-C302 VanDerWaalsContact O-C 3.25Å; S299-C302 PolarHBondContact O-N 3.44Å; S299-L303 VanDerWaalsContact O-CA 3.3Å; S299-L303 WeakPolarHBondContact O-CA 3.33Å; S299-L303 WeakPolarHBondContact O-CD2 3.37Å; S299-L303 PolarHBondContact O-N 3.48Å; S299-F306 WeakPolarHBondContact OG-CD2 3.35Å
300	T	76.5	Confident	76.5	Confident	7 Å²	7	22.7 Å²	22.7	4%	0.043	14%	0.137	C	C	.	.	H	α-helix	trans	-70.2	-34.4	173.9	-57.5	0	0	0	0	111.8	I236 L296 Q297 L298 L303 F342 L389	I236-T300 HydrophobicContact CD1-CG2 4.09Å; I236-T300 HydrophobicContact CG1-CG2 4.09Å; I236-T300 HydrophobicContact CG2-CG2 3.8Å; L296-T300 PolarHBondContact O-N 3.43Å; L296-T300 PolarHBondContact O-OG1 3.41Å; L296-T300 VanDerWaalsContact O-OG1 3.1Å; Q297-T300 WeakPolarHBondContact O-CB 3.08Å; Q297-T300 PolarHBondContact O-N 2.85Å; Q297-T300 VanDerWaalsContact O-N 3.15Å; L298-T300 VanDerWaalsContact C-N 3.28Å; L298-T300 PolarHBondContact O-N 2.93Å; T300-L303 WeakPolarHBondContact O-CD2 3.2Å; T300-F342 HydrophobicContact CG2-CE2 4.38Å; T300-F342 HydrophobicContact CG2-CZ 4.34Å; T300-F342 WeakPolarHBondContact OG1-CE1 3.18Å; T300-L389 HydrophobicContact CG2-CD2 3.33Å
301	L	82	Confident	76.6	Confident	11 Å²	11	24 Å²	24	6%	0.058	15%	0.152	C	C	.	.	H	α-helix	trans	-79.1	-32.6	173.1	-65.1	170.1	0	0	0	112.3	L232 F235 I236 V239 V251 Q297 L298	L232-L301 HydrophobicContact CB-CD1 4.43Å; L232-L301 HydrophobicContact CD2-CD1 3.8Å; F235-L301 HydrophobicContact CB-CD1 4.15Å; F235-L301 HydrophobicContact CB-CD2 3.82Å; I236-L301 HydrophobicContact CB-CD2 4.38Å; I236-L301 HydrophobicContact CD1-CG 4.23Å; I236-L301 HydrophobicContact CG1-CD1 4.2Å; I236-L301 HydrophobicContact CG1-CD2 3.49Å; I236-L301 VanDerWaalsContact CG1-CD2 3.49Å; I236-L301 HydrophobicContact CG1-CG 3.59Å; V239-L301 HydrophobicContact CG2-CD2 3.91Å; V251-L301 HydrophobicContact CG1-CD1 3.88Å; V251-L301 HydrophobicContact CG2-CB 3.88Å; V251-L301 HydrophobicContact CG2-CD1 4.05Å; V251-L301 HydrophobicContact CG2-CG 4.49Å; Q297-L301 WeakPolarHBondContact O-CG 3.42Å; Q297-L301 PolarHBondContact O-N 3.26Å; L298-L301 CarbonylContact O-C 3.56Å; L298-L301 PolarHBondContact O-N 3.13Å
302	C	83.7	Confident	76.7	Confident	9 Å²	9	25.5 Å²	25.5	6%	0.061	16%	0.159	C	C	.	.			trans	-125.1	72.5	-173.3	-55.1	0	0	0	0	110.4	F253 L298 S299 A304 K305	F253-C302 HydrophobicContact CD2-CB 3.87Å; F253-C302 HydrophobicContact CE2-CB 4.39Å; L298-C302 WeakPolarHBondContact O-CA 3.49Å; L298-C302 VanDerWaalsContact O-CB 3.29Å; L298-C302 WeakPolarHBondContact O-CB 3.31Å; L298-C302 PolarHBondContact O-N 3.37Å; S299-C302 CarbonylContact O-C 3.56Å; S299-C302 VanDerWaalsContact O-C 3.25Å; S299-C302 PolarHBondContact O-N 3.44Å; C302-A304 PolarHBondContact O-N 2.96Å; C302-K305 HydrophobicContact CB-CB 4.38Å; C302-K305 HydrophobicContact CB-CG 4.25Å; C302-K305 PolarHBondContact O-N 2.74Å
303	L	73.7	Confident	76.7	Confident	81 Å²	81	32.2 Å²	32.2	42%	0.424	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-56	-29	-169.6	-56.1	-170.8	0	0	0	115.2	S299 T300 K305 R346 F393	S299-L303 VanDerWaalsContact O-CA 3.3Å; S299-L303 WeakPolarHBondContact O-CA 3.33Å; S299-L303 WeakPolarHBondContact O-CD2 3.37Å; S299-L303 PolarHBondContact O-N 3.48Å; T300-L303 WeakPolarHBondContact O-CD2 3.2Å; L303-K305 PolarHBondContact O-N 3.39Å; L303-R346 PolarHBondContact O-NH1 3.1Å; L303-F393 HydrophobicContact CD1-CZ 4.04Å
304	A	79.3	Confident	76.3	Confident	89 Å²	89	32.6 Å²	32.6	74%	0.736	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-71.9	-14.3	179	0	0	0	0	0	113.6	C302	C302-A304 PolarHBondContact O-N 2.96Å
305	K	81.5	Confident	75.6	Confident	39 Å²	39	32.7 Å²	32.7	17%	0.17	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-100.4	1.6	-177.4	-63.2	-73.4	-178.9	164.3	0	113.9	E248 F253 E254 C302 L303 D307 S308 I309	E248-K305 WeakPolarHBondContact OE2-CE 3.49Å; E248-K305 IonicContact OE2-NZ 2.93Å; F253-K305 HydrophobicContact CD1-CB 4.31Å; F253-K305 HydrophobicContact CD1-CD 4.02Å; F253-K305 HydrophobicContact CD1-CG 3.9Å; F253-K305 HydrophobicContact CD2-CB 4.13Å; F253-K305 HydrophobicContact CD2-CG 4.19Å; F253-K305 HydrophobicContact CE1-CB 3.72Å; F253-K305 HydrophobicContact CE1-CD 3.74Å; F253-K305 HydrophobicContact CE1-CG 3.72Å; F253-K305 HydrophobicContact CE2-CB 3.48Å; F253-K305 VanDerWaalsContact CE2-CB 3.48Å; F253-K305 HydrophobicContact CE2-CG 4.01Å; F253-K305 HydrophobicContact CG-CG 4.16Å; F253-K305 HydrophobicContact CZ-CB 3.27Å; F253-K305 HydrophobicContact CZ-CD 4.23Å; F253-K305 HydrophobicContact CZ-CG 3.8Å; E254-K305 IonicContact OE1-NZ 3.05Å; E254-K305 PolarHBondContact OE1-NZ 2.97Å; C302-K305 HydrophobicContact CB-CB 4.38Å; C302-K305 HydrophobicContact CB-CG 4.25Å; C302-K305 PolarHBondContact O-N 2.74Å; L303-K305 PolarHBondContact O-N 3.39Å; K305-D307 VanDerWaalsContact C-N 3.3Å; K305-D307 PolarHBondContact O-N 3.49Å; K305-S308 WeakPolarHBondContact O-CB 3.42Å; K305-S308 PolarHBondContact O-N 2.84Å; K305-S308 VanDerWaalsContact O-N 3.16Å; K305-I309 PolarHBondContact O-N 3.05Å; K305-I309 VanDerWaalsContact O-N 3.11Å
306	F	75.6	Confident	74.9	Confident	3 Å²	3	39.5 Å²	39.5	1%	0.013	22%	0.218	C	C	.	.	H	α-helix	trans	-54.7	-47.9	178.1	-173.2	-93.7	0	0	0	111.4	L296 S299 S308 I309 I310 R346 I347	L296-F306 HydrophobicContact CD2-CE2 4.43Å; S299-F306 WeakPolarHBondContact OG-CD2 3.35Å; F306-S308 VanDerWaalsContact C-N 3.28Å; F306-S308 PolarHBondContact O-N 3.23Å; F306-I309 PolarHBondContact O-N 2.61Å; F306-I309 VanDerWaalsContact O-N 3.11Å; F306-I310 HydrophobicContact CD1-CD1 4.09Å; F306-I310 HydrophobicContact CD1-CG2 4.02Å; F306-I310 HydrophobicContact CE1-CB 4.5Å; F306-I310 HydrophobicContact CE1-CD1 3.86Å; F306-I310 HydrophobicContact CE1-CG1 4.43Å; F306-I310 HydrophobicContact CE1-CG2 3.4Å; F306-I310 HydrophobicContact CE2-CG2 4.18Å; F306-I310 HydrophobicContact CZ-CG2 3.46Å; F306-I310 VanDerWaalsContact CZ-CG2 3.46Å; F306-I310 PolarHBondContact O-N 2.99Å; F306-R346 HydrophobicContact CD1-CB 3.77Å; F306-R346 HydrophobicContact CD2-CB 3.9Å; F306-R346 HydrophobicContact CD2-CG 4.06Å; F306-R346 HydrophobicContact CE1-CB 3.31Å; F306-R346 HydrophobicContact CE1-CG 4.41Å; F306-R346 HydrophobicContact CE2-CB 3.51Å; F306-R346 HydrophobicContact CE2-CG 3.99Å; F306-R346 HydrophobicContact CG-CB 4.06Å; F306-R346 HydrophobicContact CG-CG 4.37Å; F306-R346 HydrophobicContact CZ-CB 3.21Å; F306-R346 HydrophobicContact CZ-CG 4.19Å; F306-I347 HydrophobicContact CE1-CG1 3.68Å; F306-I347 HydrophobicContact CZ-CD1 4.19Å; F306-I347 HydrophobicContact CZ-CG1 3.58Å
307	D	71.5	Confident	74.3	Confident	117 Å²	117	44.5 Å²	44.5	63%	0.626	24%	0.237	S	C	*	.	H	α-helix	trans	-62.1	-35.4	-179.7	-64.7	-21.8	0	0	0	112.5	K305 I310 G311	K305-D307 VanDerWaalsContact C-N 3.3Å; K305-D307 PolarHBondContact O-N 3.49Å; D307-I310 VanDerWaalsContact O-CG1 3.31Å; D307-I310 WeakPolarHBondContact O-CG1 3.37Å; D307-G311 PolarHBondContact O-N 3.26Å
308	S	76.6	Confident	73.2	Confident	67 Å²	67	44.7 Å²	44.7	47%	0.469	24%	0.238	S	C	.	.	H	α-helix	trans	-64.5	-43	175	-51.5	0	0	0	0	111.5	K305 F306 G311 L312	K305-S308 WeakPolarHBondContact O-CB 3.42Å; K305-S308 PolarHBondContact O-N 2.84Å; K305-S308 VanDerWaalsContact O-N 3.16Å; F306-S308 VanDerWaalsContact C-N 3.28Å; F306-S308 PolarHBondContact O-N 3.23Å; S308-G311 PolarHBondContact O-N 3.41Å; S308-L312 WeakPolarHBondContact O-CG 3.28Å
309	I	74.9	Confident	71.8	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-67.4	-48	180	-69.9	160.4	0	0	0	111.3	F253 M257 P295 K305 F306 G311 L312 F315	F253-I309 HydrophobicContact CE2-CD1 3.6Å; F253-I309 HydrophobicContact CE2-CG1 4.26Å; F253-I309 HydrophobicContact CZ-CD1 3.63Å; F253-I309 HydrophobicContact CZ-CG1 3.77Å; M257-I309 HydrophobicContact CE-CG1 4Å; M257-I309 HydrophobicContact SD-CG1 4.31Å; P295-I309 HydrophobicContact CB-CD1 4.29Å; P295-I309 HydrophobicContact CB-CG1 4.38Å; P295-I309 HydrophobicContact CB-CG2 3.54Å; P295-I309 WeakPolarHBondContact O-CD1 3.48Å; K305-I309 PolarHBondContact O-N 3.05Å; K305-I309 VanDerWaalsContact O-N 3.11Å; F306-I309 PolarHBondContact O-N 2.61Å; F306-I309 VanDerWaalsContact O-N 3.11Å; I309-G311 PolarHBondContact O-N 3.39Å; I309-L312 WeakPolarHBondContact O-CB 3.02Å; I309-L312 WeakPolarHBondContact O-CG 3.46Å; I309-L312 PolarHBondContact O-N 3.1Å; I309-L312 VanDerWaalsContact O-N 3.08Å; I309-F315 HydrophobicContact CG2-CD1 4.39Å; I309-F315 HydrophobicContact CG2-CD2 3.9Å; I309-F315 HydrophobicContact CG2-CE1 4.43Å; I309-F315 HydrophobicContact CG2-CE2 3.96Å; I309-F315 HydrophobicContact CG2-CG 4.14Å; I309-F315 HydrophobicContact CG2-CZ 4.26Å
310	I	67.5	Low	70.6	Confident	36 Å²	36	50.1 Å²	50.1	19%	0.185	27%	0.268	C	S	.	.	H	α-helix	trans	-69.2	-17.7	178.6	67.3	174.3	0	0	0	112.5	F306 D307 L312 F315 R316 I347	F306-I310 HydrophobicContact CD1-CD1 4.09Å; F306-I310 HydrophobicContact CD1-CG2 4.02Å; F306-I310 HydrophobicContact CE1-CB 4.5Å; F306-I310 HydrophobicContact CE1-CD1 3.86Å; F306-I310 HydrophobicContact CE1-CG1 4.43Å; F306-I310 HydrophobicContact CE1-CG2 3.4Å; F306-I310 HydrophobicContact CE2-CG2 4.18Å; F306-I310 HydrophobicContact CZ-CG2 3.46Å; F306-I310 VanDerWaalsContact CZ-CG2 3.46Å; F306-I310 PolarHBondContact O-N 2.99Å; D307-I310 VanDerWaalsContact O-CG1 3.31Å; D307-I310 WeakPolarHBondContact O-CG1 3.37Å; I310-L312 VanDerWaalsContact C-N 3.29Å; I310-F315 HydrophobicContact CG2-CD1 4.45Å; I310-F315 HydrophobicContact CG2-CE1 4Å; I310-R316 WeakPolarHBondContact O-CG 3.36Å; I310-R316 PolarHBondContact O-NE 3.18Å; I310-I347 HydrophobicContact CG2-CD1 4.14Å; I310-I347 HydrophobicContact CG2-CG1 4.02Å
311	G	66.4	Low	69.4	Low	33 Å²	33	51.5 Å²	51.5	34%	0.34	28%	0.276	S	S	.	.	H	α-helix	trans	-71.1	-21.6	171.6	0	0	0	0	0	113.7	D307 S308 I309 Q313	D307-G311 PolarHBondContact O-N 3.26Å; S308-G311 PolarHBondContact O-N 3.41Å; I309-G311 PolarHBondContact O-N 3.39Å; G311-Q313 PolarHBondContact O-N 3.49Å
312	L	72.4	Confident	67.6	Low	31 Å²	31	53.5 Å²	53.5	16%	0.162	29%	0.291	C	S	.	.			trans	-68.2	130.5	-176	-58.8	176.5	0	0	0	111	M257 E261 S308 I309 I310 W314 F315 R316	M257-L312 HydrophobicContact CE-CD1 3.37Å; E261-L312 HydrophobicContact CG-CD1 4.36Å; E261-L312 WeakPolarHBondContact OE1-CD2 3.23Å; S308-L312 WeakPolarHBondContact O-CG 3.28Å; I309-L312 WeakPolarHBondContact O-CB 3.02Å; I309-L312 WeakPolarHBondContact O-CG 3.46Å; I309-L312 PolarHBondContact O-N 3.1Å; I309-L312 VanDerWaalsContact O-N 3.08Å; I310-L312 VanDerWaalsContact C-N 3.29Å; L312-W314 HydrophobicContact CD1-CZ2 3.89Å; L312-W314 PolarHBondContact O-N 3.4Å; L312-F315 HydrophobicContact CB-CB 3.91Å; L312-F315 PolarHBondContact O-N 3.38Å; L312-F315 VanDerWaalsContact O-N 3.16Å; L312-R316 WeakPolarHBondContact O-CG 3.31Å; L312-R316 PolarHBondContact O-N 2.92Å
313	Q	70.1	Confident	65.9	Low	146 Å²	146	54.8 Å²	54.8	68%	0.682	30%	0.298	S	S	*	.	H	α-helix	trans	-60.4	-44.6	-175.4	-67.2	-175.3	-0.3	0	0	112.5	G311 F315 R316 R317	G311-Q313 PolarHBondContact O-N 3.49Å; Q313-F315 VanDerWaalsContact C-N 3.33Å; Q313-F315 PolarHBondContact O-N 3.49Å; Q313-R316 PolarHBondContact O-N 3.14Å; Q313-R317 WeakPolarHBondContact O-CG 3.43Å; Q313-R317 PolarHBondContact O-N 2.83Å
314	W	66.1	Low	64.5	Low	11 Å²	11	53.6 Å²	53.6	4%	0.042	30%	0.3	C	S	.	.	H	α-helix	trans	-64.6	-38.9	177.8	68.6	-96.8	0	0	0	111.3	M257 W260 L291 P295 L312 R317 L318	M257-W314 HydrophobicContact CE-CZ2 4.41Å; W260-W314 AromaticContact CD1-CH2 3.5Å; W260-W314 AromaticContact CD1-CZ2 3.8Å; W260-W314 AromaticContact NE1-CH2 3.99Å; L291-W314 HydrophobicContact CB-CZ3 4.44Å; P295-W314 HydrophobicContact CG-CH2 3.64Å; P295-W314 HydrophobicContact CG-CZ2 4.28Å; L312-W314 HydrophobicContact CD1-CZ2 3.89Å; L312-W314 PolarHBondContact O-N 3.4Å; W314-R317 PolarHBondContact O-N 3.38Å; W314-L318 HydrophobicContact CE3-CD1 3.56Å; W314-L318 HydrophobicContact CE3-CG 4.4Å; W314-L318 HydrophobicContact CZ3-CD1 3.59Å; W314-L318 WeakPolarHBondContact O-CG 3.5Å; W314-L318 PolarHBondContact O-N 2.85Å
315	F	67.3	Low	62.9	Low	3 Å²	3	52.8 Å²	52.8	1%	0.013	28%	0.283	C	S	.	.	H	α-helix	trans	-64.7	-45.2	178.1	-172.9	-88.4	0	0	0	110.4	L292 P295 L296 I309 I310 L312 Q313 R317 L318 V319	L292-F315 HydrophobicContact CD2-CD2 3.97Å; L292-F315 HydrophobicContact CD2-CE2 3.56Å; L292-F315 HydrophobicContact CD2-CZ 4.01Å; P295-F315 HydrophobicContact CB-CD2 4.4Å; P295-F315 HydrophobicContact CB-CE2 4.29Å; P295-F315 HydrophobicContact CG-CD2 4.43Å; L296-F315 HydrophobicContact CD2-CE2 4.02Å; L296-F315 HydrophobicContact CD2-CZ 3.63Å; L296-F315 HydrophobicContact CG-CE2 4.17Å; L296-F315 HydrophobicContact CG-CZ 4.17Å; I309-F315 HydrophobicContact CG2-CD1 4.39Å; I309-F315 HydrophobicContact CG2-CD2 3.9Å; I309-F315 HydrophobicContact CG2-CE1 4.43Å; I309-F315 HydrophobicContact CG2-CE2 3.96Å; I309-F315 HydrophobicContact CG2-CG 4.14Å; I309-F315 HydrophobicContact CG2-CZ 4.26Å; I310-F315 HydrophobicContact CG2-CD1 4.45Å; I310-F315 HydrophobicContact CG2-CE1 4Å; L312-F315 HydrophobicContact CB-CB 3.91Å; L312-F315 PolarHBondContact O-N 3.38Å; L312-F315 VanDerWaalsContact O-N 3.16Å; Q313-F315 VanDerWaalsContact C-N 3.33Å; Q313-F315 PolarHBondContact O-N 3.49Å; F315-R317 PolarHBondContact O-N 2.62Å; F315-L318 PolarHBondContact O-N 3.32Å; F315-L318 VanDerWaalsContact O-N 3.16Å; F315-V319 HydrophobicContact CD1-CG2 3.89Å; F315-V319 HydrophobicContact CE1-CG2 3.45Å; F315-V319 VanDerWaalsContact CE1-CG2 3.45Å; F315-V319 HydrophobicContact CZ-CG2 3.89Å; F315-V319 WeakPolarHBondContact O-CG2 3.46Å; F315-V319 PolarHBondContact O-N 3.2Å
316	R	63.7	Low	61.4	Low	142 Å²	142	51.1 Å²	51.1	54%	0.536	28%	0.276	S	S	.	.	H	α-helix	trans	-56.3	-48.6	172.9	-70.3	-177.2	178.1	-169.7	-1.6	111.7	I310 L312 Q313 L318 V319 D320	I310-R316 WeakPolarHBondContact O-CG 3.36Å; I310-R316 PolarHBondContact O-NE 3.18Å; L312-R316 WeakPolarHBondContact O-CG 3.31Å; L312-R316 PolarHBondContact O-N 2.92Å; Q313-R316 PolarHBondContact O-N 3.14Å; R316-L318 PolarHBondContact O-N 3.06Å; R316-V319 CarbonylContact O-C 3.54Å; R316-V319 PolarHBondContact O-N 3.47Å; R316-V319 VanDerWaalsContact O-N 3.08Å; R316-D320 PolarHBondContact O-N 3.06Å
317	R	63.6	Low	60.1	Low	109 Å²	109	52.7 Å²	52.7	41%	0.411	29%	0.286	S	S	.	.	H	α-helix	trans	-59.8	-30.3	177.2	-73.2	-168.5	-66.6	-114.5	3.1	114.2	E268 Q313 W314 F315	E268-R317 IonicContact OE1-CZ 3.39Å; E268-R317 IonicContact OE1-NE 3.47Å; E268-R317 PolarHBondContact OE1-NE 3.43Å; E268-R317 IonicContact OE1-NH2 2.65Å; E268-R317 IonicContact OE2-CZ 2.78Å; E268-R317 IonicContact OE2-NE 3.53Å; E268-R317 PolarHBondContact OE2-NE 2.89Å; E268-R317 IonicContact OE2-NH2 3.69Å; E268-R317 PolarHBondContact OE2-NH2 3.45Å; Q313-R317 WeakPolarHBondContact O-CG 3.43Å; Q313-R317 PolarHBondContact O-N 2.83Å; W314-R317 PolarHBondContact O-N 3.38Å; F315-R317 PolarHBondContact O-N 2.62Å
318	L	60.1	Low	58.9	Low	3 Å²	3	48.2 Å²	48.2	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-78.7	-36.1	175.8	-69.5	178.3	0	0	0	111.9	K283 V288 L291 L292 W314 F315 R316 D320 V321	K283-L318 HydrophobicContact CD-CD2 4.33Å; V288-L318 HydrophobicContact CG1-CD2 4.18Å; V288-L318 HydrophobicContact CG2-CD2 4.25Å; L291-L318 HydrophobicContact CB-CD1 3.96Å; L291-L318 HydrophobicContact CD1-CD1 4.2Å; L292-L318 HydrophobicContact CD2-CB 3.76Å; L292-L318 HydrophobicContact CD2-CD1 4.14Å; L292-L318 HydrophobicContact CG-CB 4.31Å; L292-L318 HydrophobicContact CG-CD1 4.33Å; W314-L318 HydrophobicContact CE3-CD1 3.56Å; W314-L318 HydrophobicContact CE3-CG 4.4Å; W314-L318 HydrophobicContact CZ3-CD1 3.59Å; W314-L318 WeakPolarHBondContact O-CG 3.5Å; W314-L318 PolarHBondContact O-N 2.85Å; F315-L318 PolarHBondContact O-N 3.32Å; F315-L318 VanDerWaalsContact O-N 3.16Å; R316-L318 PolarHBondContact O-N 3.06Å; L318-D320 VanDerWaalsContact C-N 3.34Å; L318-V321 WeakPolarHBondContact O-CB 3.39Å; L318-V321 VanDerWaalsContact O-CG2 3.25Å; L318-V321 WeakPolarHBondContact O-CG2 3.33Å
319	V	56	Low	57.5	Low	26 Å²	26	46.4 Å²	46.4	16%	0.158	25%	0.253	C	S	.	.	H	α-helix	trans	-68.8	-34.4	173.2	173.7	0	0	0	0	110.3	L292 F315 R316 V321 L357	L292-V319 HydrophobicContact CD2-CG2 4.21Å; F315-V319 HydrophobicContact CD1-CG2 3.89Å; F315-V319 HydrophobicContact CE1-CG2 3.45Å; F315-V319 VanDerWaalsContact CE1-CG2 3.45Å; F315-V319 HydrophobicContact CZ-CG2 3.89Å; F315-V319 WeakPolarHBondContact O-CG2 3.46Å; F315-V319 PolarHBondContact O-N 3.2Å; R316-V319 CarbonylContact O-C 3.54Å; R316-V319 PolarHBondContact O-N 3.47Å; R316-V319 VanDerWaalsContact O-N 3.08Å; V319-V321 PolarHBondContact O-N 3.39Å; V319-L357 HydrophobicContact CB-CD1 4.35Å; V319-L357 HydrophobicContact CG1-CD1 3.21Å; V319-L357 WeakPolarHBondContact O-CD1 3.36Å
320	D	54.4	Low	56.3	Low	88 Å²	88	46.6 Å²	46.6	47%	0.471	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-3.4	177.1	-66.7	-27.8	0	0	0	115	R316 L318	R316-D320 PolarHBondContact O-N 3.06Å; L318-D320 VanDerWaalsContact C-N 3.34Å
321	V	51.5	Low	55.4	Low	36 Å²	36	47.8 Å²	47.8	22%	0.218	27%	0.265	C	S	.	.	S	Bend	trans	-68.5	134.8	171.8	177.8	0	0	0	0	110	L318 V319 T323 L325	L318-V321 WeakPolarHBondContact O-CB 3.39Å; L318-V321 VanDerWaalsContact O-CG2 3.25Å; L318-V321 WeakPolarHBondContact O-CG2 3.33Å; V319-V321 PolarHBondContact O-N 3.39Å; V321-T323 PolarHBondContact O-N 3.24Å; V321-L325 HydrophobicContact CG1-CB 3.55Å; V321-L325 HydrophobicContact CG1-CD1 4.03Å; V321-L325 HydrophobicContact CG1-CG 4.46Å
322	S	44.8	Very low	54.4	Low	53 Å²	53	53.9 Å²	53.9	37%	0.371	29%	0.285	S	S	.	.			trans	-50.1	137.8	-177.3	73	0	0	0	0	112.5	A324 L325 L326	S322-A324 PolarHBondContact O-N 2.77Å; S322-L325 WeakPolarHBondContact O-CB 3.47Å; S322-L325 PolarHBondContact O-N 2.96Å; S322-L325 WeakPolarHBondContact OG-CB 3.23Å; S322-L325 WeakPolarHBondContact OG-CD1 3.33Å; S322-L325 VanDerWaalsContact OG-CG 3.31Å; S322-L325 WeakPolarHBondContact OG-CG 3.2Å; S322-L326 PolarHBondContact O-N 2.9Å
323	T	46.2	Very low	53.3	Low	36 Å²	36	56.4 Å²	56.4	22%	0.221	30%	0.295	C	S	.	.	H	α-helix	trans	-41.3	-45.2	177.9	-79.1	0	0	0	0	113.6	V321 L325 L326 V327 S356 L357 L362	V321-T323 PolarHBondContact O-N 3.24Å; T323-L325 PolarHBondContact O-N 3.32Å; T323-L326 PolarHBondContact O-N 3.26Å; T323-V327 HydrophobicContact CG2-CG2 4.28Å; T323-V327 WeakPolarHBondContact O-CB 3.46Å; T323-V327 VanDerWaalsContact O-CG2 3.29Å; T323-V327 WeakPolarHBondContact O-CG2 3.38Å; T323-V327 PolarHBondContact O-N 2.95Å; T323-S356 PolarHBondContact OG1-O 3.07Å; T323-L357 VanDerWaalsContact OG1-CD2 3.3Å; T323-L357 WeakPolarHBondContact OG1-CD2 3.4Å; T323-L362 HydrophobicContact CG2-CD2 3.37Å
324	A	45.1	Very low	52.6	Low	56 Å²	56	54.2 Å²	54.2	46%	0.463	29%	0.288	S	S	.	.	H	α-helix	trans	-64.5	-40.3	-179.4	0	0	0	0	0	113.1	S322 A328	S322-A324 PolarHBondContact O-N 2.77Å; A324-A328 WeakPolarHBondContact O-CB 3.16Å; A324-A328 PolarHBondContact O-N 3.1Å
325	L	46	Very low	52.1	Low	73 Å²	73	56 Å²	56	38%	0.382	30%	0.297	S	S	.	.	H	α-helix	trans	-70.1	-38.2	176.6	-73.5	171	0	0	0	111.6	V321 S322 T323 S329 P454	V321-L325 HydrophobicContact CG1-CB 3.55Å; V321-L325 HydrophobicContact CG1-CD1 4.03Å; V321-L325 HydrophobicContact CG1-CG 4.46Å; S322-L325 WeakPolarHBondContact O-CB 3.47Å; S322-L325 PolarHBondContact O-N 2.96Å; S322-L325 WeakPolarHBondContact OG-CB 3.23Å; S322-L325 WeakPolarHBondContact OG-CD1 3.33Å; S322-L325 VanDerWaalsContact OG-CG 3.31Å; S322-L325 WeakPolarHBondContact OG-CG 3.2Å; T323-L325 PolarHBondContact O-N 3.32Å; L325-S329 PolarHBondContact O-N 3.36Å; L325-S329 PolarHBondContact O-OG 2.89Å; L325-P454 HydrophobicContact CD2-CB 4.48Å; L325-P454 HydrophobicContact CD2-CG 4.2Å
326	L	49.4	Very low	51.6	Low	4 Å²	4	56 Å²	56	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-67.9	-52.4	179.5	-168.2	63.9	0	0	0	110.7	L292 S322 T323 A328 S329 F330 L340 L357	L292-L326 HydrophobicContact CD1-CD1 3.64Å; S322-L326 PolarHBondContact O-N 2.9Å; T323-L326 PolarHBondContact O-N 3.26Å; L326-A328 VanDerWaalsContact C-N 3.31Å; L326-A328 PolarHBondContact O-N 3.29Å; L326-S329 WeakPolarHBondContact O-CA 3.48Å; L326-S329 WeakPolarHBondContact O-CB 3.44Å; L326-S329 PolarHBondContact O-N 2.85Å; L326-F330 HydrophobicContact CD1-CD2 4.42Å; L326-F330 HydrophobicContact CD1-CE2 3.65Å; L326-F330 HydrophobicContact CD1-CZ 4.5Å; L326-F330 HydrophobicContact CG-CD2 4.24Å; L326-F330 HydrophobicContact CG-CE2 3.81Å; L326-F330 WeakPolarHBondContact O-CD2 3.12Å; L326-F330 PolarHBondContact O-N 3.27Å; L326-L340 HydrophobicContact CD2-CD1 3.35Å; L326-L340 HydrophobicContact CD2-CD2 4.22Å; L326-L340 HydrophobicContact CD2-CG 4.43Å; L326-L340 HydrophobicContact CG-CD1 3.87Å; L326-L340 HydrophobicContact CG-CD2 4.08Å; L326-L357 HydrophobicContact CD2-CD2 4.13Å
327	V	48.5	Very low	51.5	Low	35 Å²	35	50.7 Å²	50.7	21%	0.212	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-40.1	175.3	174.3	0	0	0	0	111.3	T323 S329 F330 S331 L340 L362 M455	T323-V327 HydrophobicContact CG2-CG2 4.28Å; T323-V327 WeakPolarHBondContact O-CB 3.46Å; T323-V327 VanDerWaalsContact O-CG2 3.29Å; T323-V327 WeakPolarHBondContact O-CG2 3.38Å; T323-V327 PolarHBondContact O-N 2.95Å; V327-S329 PolarHBondContact O-N 3.21Å; V327-F330 PolarHBondContact O-N 3.31Å; V327-F330 VanDerWaalsContact O-N 3.08Å; V327-S331 PolarHBondContact O-N 3.42Å; V327-L340 HydrophobicContact CG2-CD2 3.87Å; V327-L362 HydrophobicContact CG2-CD2 4.11Å; V327-M455 HydrophobicContact CG1-CE 3.8Å
328	A	46.7	Very low	51.5	Low	23 Å²	23	45.6 Å²	45.6	19%	0.19	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-25.3	173.6	0	0	0	0	0	113.5	A324 L326 F330 S331 P454 M455	A324-A328 WeakPolarHBondContact O-CB 3.16Å; A324-A328 PolarHBondContact O-N 3.1Å; L326-A328 VanDerWaalsContact C-N 3.31Å; L326-A328 PolarHBondContact O-N 3.29Å; A328-F330 VanDerWaalsContact C-N 3.29Å; A328-S331 PolarHBondContact O-OG 2.84Å; A328-P454 HydrophobicContact CB-CB 4.47Å; A328-M455 HydrophobicContact CB-CB 4.16Å
329	S	47.5	Very low	51.6	Low	30 Å²	30	45.5 Å²	45.5	21%	0.21	26%	0.26	C	S	.	.	H	α-helix	trans	-79.4	-13.3	175.9	-56.2	0	0	0	0	113	R289 L325 L326 V327	R289-S329 WeakPolarHBondContact CD-O 3.34Å; L325-S329 PolarHBondContact O-N 3.36Å; L325-S329 PolarHBondContact O-OG 2.89Å; L326-S329 WeakPolarHBondContact O-CA 3.48Å; L326-S329 WeakPolarHBondContact O-CB 3.44Å; L326-S329 PolarHBondContact O-N 2.85Å; V327-S329 PolarHBondContact O-N 3.21Å
330	F	49.6	Very low	52	Low	4 Å²	4	44.8 Å²	44.8	2%	0.018	26%	0.255	C	S	.	.	S	Bend	trans	-110.3	0.9	-176	-71.7	-62.1	0	0	0	114.2	R289 L292 L326 V327 A328 E332 Q336 L340	R289-F330 HydrophobicContact CB-CE1 4.34Å; R289-F330 HydrophobicContact CG-CD1 3.97Å; R289-F330 HydrophobicContact CG-CE1 3.83Å; L292-F330 HydrophobicContact CB-CZ 4.42Å; L292-F330 HydrophobicContact CD1-CE2 4.42Å; L292-F330 HydrophobicContact CD1-CZ 4.08Å; L326-F330 HydrophobicContact CD1-CD2 4.42Å; L326-F330 HydrophobicContact CD1-CE2 3.65Å; L326-F330 HydrophobicContact CD1-CZ 4.5Å; L326-F330 HydrophobicContact CG-CD2 4.24Å; L326-F330 HydrophobicContact CG-CE2 3.81Å; L326-F330 WeakPolarHBondContact O-CD2 3.12Å; L326-F330 PolarHBondContact O-N 3.27Å; V327-F330 PolarHBondContact O-N 3.31Å; V327-F330 VanDerWaalsContact O-N 3.08Å; A328-F330 VanDerWaalsContact C-N 3.29Å; F330-E332 VanDerWaalsContact C-N 3.26Å; F330-E332 PolarHBondContact O-N 3.02Å; F330-Q336 HydrophobicContact CD1-CB 3.46Å; F330-Q336 VanDerWaalsContact CD1-CB 3.46Å; F330-Q336 HydrophobicContact CE1-CB 4.05Å; F330-Q336 HydrophobicContact CG-CB 4.42Å; F330-L340 HydrophobicContact CD2-CB 3.91Å; F330-L340 HydrophobicContact CD2-CD2 3.69Å; F330-L340 HydrophobicContact CD2-CG 4.24Å; F330-L340 HydrophobicContact CE2-CB 3.87Å; F330-L340 HydrophobicContact CE2-CD1 4.07Å; F330-L340 HydrophobicContact CE2-CD2 4.03Å; F330-L340 HydrophobicContact CE2-CG 4.19Å; F330-L340 HydrophobicContact CZ-CB 4.42Å
331	S	47.9	Very low	52.6	Low	61 Å²	61	40.9 Å²	40.9	43%	0.427	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-10	-168.8	60.3	0	0	0	0	116.2	V327 A328 M455	V327-S331 PolarHBondContact O-N 3.42Å; A328-S331 PolarHBondContact O-OG 2.84Å; S331-M455 WeakPolarHBondContact CB-SD 3.42Å
332	E	45	Very low	53.2	Low	162 Å²	162	39.2 Å²	39.2	76%	0.757	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-15.7	-175	-67.2	-173	168	0	0	114.2	F330	F330-E332 VanDerWaalsContact C-N 3.26Å; F330-E332 PolarHBondContact O-N 3.02Å
333	E	49	Very low	54.1	Low	83 Å²	83	37.1 Å²	37.1	39%	0.388	21%	0.209	S	C	.	.			trans	-143.8	120.8	-174.3	-65.6	173.2	-129.1	0	0	112.4	R289 E335 Q336 L337	R289-E333 IonicContact CZ-OE1 3.09Å; R289-E333 IonicContact NH1-OE1 2.78Å; R289-E333 PolarHBondContact NH1-OE1 3.31Å; R289-E333 IonicContact NH2-OE1 3.56Å; R289-E333 PolarHBondContact NH2-OE1 2.96Å; E333-E335 VanDerWaalsContact C-N 3.27Å; E333-E335 PolarHBondContact O-N 3.42Å; E333-Q336 HydrophobicContact CB-CG 3.84Å; E333-Q336 PolarHBondContact O-N 2.9Å; E333-Q336 PolarHBondContact OE1-NE2 3.28Å; E333-Q336 VanDerWaalsContact OE1-NE2 3.13Å; E333-Q336 PolarHBondContact OE2-NE2 2.94Å; E333-L337 PolarHBondContact O-N 3.41Å
334	D	55.6	Low	54.9	Low	100 Å²	100	35.6 Å²	35.6	54%	0.535	20%	0.201	S	C	.	.	H	α-helix	trans	-53	-37.8	-176.4	-70.3	-32.3	0	0	0	113.9	Q336 S338	D334-Q336 PolarHBondContact O-N 3.32Å; D334-S338 VanDerWaalsContact O-CB 3.31Å; D334-S338 WeakPolarHBondContact O-CB 3.38Å; D334-S338 PolarHBondContact O-N 3.5Å; D334-S338 PolarHBondContact O-OG 3.18Å
335	E	55.9	Low	55.7	Low	49 Å²	49	33.1 Å²	33.1	23%	0.229	18%	0.18	C	C	.	.	H	α-helix	trans	-60.1	-33.3	178.9	-62.6	-173.1	165.8	0	0	111.6	K189 E333 S338 M339 Y386	K189-E335 IonicContact NZ-OE1 2.74Å; K189-E335 IonicContact NZ-OE2 3.31Å; E333-E335 VanDerWaalsContact C-N 3.27Å; E333-E335 PolarHBondContact O-N 3.42Å; E335-S338 WeakPolarHBondContact O-CB 3.43Å; E335-M339 VanDerWaalsContact O-CG 3.29Å; E335-M339 WeakPolarHBondContact O-CG 3.4Å; E335-M339 PolarHBondContact O-N 3.37Å; E335-Y386 HydrophobicContact CB-CD2 3.7Å; E335-Y386 HydrophobicContact CB-CE2 3.87Å; E335-Y386 HydrophobicContact CG-CD2 3.75Å; E335-Y386 HydrophobicContact CG-CE2 3.87Å
336	Q	56.3	Low	56.4	Low	3 Å²	3	32.2 Å²	32.2	1%	0.014	17%	0.171	C	C	.	.	H	α-helix	trans	-88.3	-40	-168.4	-47.9	175.6	-9.1	0	0	112.3	R289 L293 F330 E333 D334 S338 M339 L340	R289-Q336 VanDerWaalsContact NH1-NE2 3.2Å; R289-Q336 VanDerWaalsContact NH1-OE1 3.09Å; L293-Q336 HydrophobicContact CD2-CG 4.29Å; F330-Q336 HydrophobicContact CD1-CB 3.46Å; F330-Q336 VanDerWaalsContact CD1-CB 3.46Å; F330-Q336 HydrophobicContact CE1-CB 4.05Å; F330-Q336 HydrophobicContact CG-CB 4.42Å; E333-Q336 HydrophobicContact CB-CG 3.84Å; E333-Q336 PolarHBondContact O-N 2.9Å; E333-Q336 PolarHBondContact OE1-NE2 3.28Å; E333-Q336 VanDerWaalsContact OE1-NE2 3.13Å; E333-Q336 PolarHBondContact OE2-NE2 2.94Å; D334-Q336 PolarHBondContact O-N 3.32Å; Q336-S338 PolarHBondContact O-N 2.91Å; Q336-M339 PolarHBondContact O-N 3.22Å; Q336-L340 PolarHBondContact O-N 3.26Å
337	L	63.1	Low	56.9	Low	31 Å²	31	33.4 Å²	33.4	16%	0.162	18%	0.177	C	C	.	.	H	α-helix	trans	-56.1	-41.9	166.9	177.1	59.7	0	0	0	110.2	E333 M339 L340 L341 F366	E333-L337 PolarHBondContact O-N 3.41Å; L337-M339 VanDerWaalsContact C-N 3.35Å; L337-M339 PolarHBondContact O-N 3.38Å; L337-L340 WeakPolarHBondContact O-CB 3.41Å; L337-L340 PolarHBondContact O-N 3.46Å; L337-L341 HydrophobicContact CD1-CD1 4.3Å; L337-L341 HydrophobicContact CD1-CG 4.32Å; L337-L341 HydrophobicContact CG-CD1 4.02Å; L337-L341 HydrophobicContact CG-CG 4.47Å; L337-L341 WeakPolarHBondContact O-CB 3.34Å; L337-L341 VanDerWaalsContact O-CG 3.23Å; L337-L341 WeakPolarHBondContact O-CG 3.5Å; L337-L341 PolarHBondContact O-N 3.32Å; L337-F366 HydrophobicContact CD2-CD2 3.64Å; L337-F366 HydrophobicContact CD2-CE2 3.57Å; L337-F366 HydrophobicContact CG-CD2 4.35Å; L337-F366 HydrophobicContact CG-CE2 4.46Å
338	S	62.9	Low	57.4	Low	2 Å²	2	32.6 Å²	32.6	1%	0.014	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-39.9	176.9	-60.8	0	0	0	0	113.3	D334 E335 Q336 L341 F342 S387 A390	D334-S338 VanDerWaalsContact O-CB 3.31Å; D334-S338 WeakPolarHBondContact O-CB 3.38Å; D334-S338 PolarHBondContact O-N 3.5Å; D334-S338 PolarHBondContact O-OG 3.18Å; E335-S338 WeakPolarHBondContact O-CB 3.43Å; Q336-S338 PolarHBondContact O-N 2.91Å; S338-L341 PolarHBondContact O-N 2.93Å; S338-F342 WeakPolarHBondContact O-CB 3.42Å; S338-F342 PolarHBondContact O-N 2.8Å; S338-S387 VanDerWaalsContact CB-N 3.33Å; S338-S387 VanDerWaalsContact OG-CA 3.28Å; S338-S387 WeakPolarHBondContact OG-CA 3.32Å; S338-S387 WeakPolarHBondContact OG-CB 3.49Å; S338-S387 PolarHBondContact OG-N 3.17Å; S338-S387 PolarHBondContact OG-OG 3.48Å; S338-A390 WeakPolarHBondContact O-CB 3.37Å
339	M	61.9	Low	57.9	Low	1 Å²	1	34 Å²	34	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-66	-41.2	174	-73.4	-57.5	-54.8	0	0	111.9	L293 L296 Q297 E335 Q336 L337 L341 F342 C343 Y386	L293-M339 HydrophobicContact CD1-CB 3.8Å; L293-M339 HydrophobicContact CD1-CG 3.58Å; L296-M339 HydrophobicContact CB-CE 3.27Å; L296-M339 WeakPolarHBondContact O-CE 3.38Å; Q297-M339 HydrophobicContact CG-CE 4.15Å; Q297-M339 HydrophobicContact CG-SD 4.39Å; Q297-M339 VanDerWaalsContact N-CE 3.29Å; E335-M339 VanDerWaalsContact O-CG 3.29Å; E335-M339 WeakPolarHBondContact O-CG 3.4Å; E335-M339 PolarHBondContact O-N 3.37Å; Q336-M339 PolarHBondContact O-N 3.22Å; L337-M339 VanDerWaalsContact C-N 3.35Å; L337-M339 PolarHBondContact O-N 3.38Å; M339-L341 VanDerWaalsContact C-N 3.33Å; M339-L341 PolarHBondContact O-N 3.35Å; M339-F342 HydrophobicContact CE-CD1 4.49Å; M339-F342 WeakPolarHBondContact O-CB 3.38Å; M339-F342 PolarHBondContact O-N 3.44Å; M339-C343 PolarHBondContact O-N 3.18Å; M339-C343 PolarHBondContact O-SG 3.22Å; M339-Y386 HydrophobicContact CG-CD1 3.92Å; M339-Y386 HydrophobicContact CG-CE1 4.05Å; M339-Y386 HydrophobicContact CG-CG 4.37Å; M339-Y386 HydrophobicContact SD-CD1 3.17Å; M339-Y386 WeakPolarHBondContact SD-CD1 3.48Å; M339-Y386 HydrophobicContact SD-CE1 3.35Å; M339-Y386 WeakPolarHBondContact SD-CE1 3.22Å; M339-Y386 HydrophobicContact SD-CG 4.11Å
340	L	65.2	Low	58.1	Low	11 Å²	11	33.6 Å²	33.6	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-58.8	-47.3	172.6	174.4	64.2	0	0	0	111.3	L326 V327 F330 Q336 L337 F342 C343 A344	L326-L340 HydrophobicContact CD2-CD1 3.35Å; L326-L340 HydrophobicContact CD2-CD2 4.22Å; L326-L340 HydrophobicContact CD2-CG 4.43Å; L326-L340 HydrophobicContact CG-CD1 3.87Å; L326-L340 HydrophobicContact CG-CD2 4.08Å; V327-L340 HydrophobicContact CG2-CD2 3.87Å; F330-L340 HydrophobicContact CD2-CB 3.91Å; F330-L340 HydrophobicContact CD2-CD2 3.69Å; F330-L340 HydrophobicContact CD2-CG 4.24Å; F330-L340 HydrophobicContact CE2-CB 3.87Å; F330-L340 HydrophobicContact CE2-CD1 4.07Å; F330-L340 HydrophobicContact CE2-CD2 4.03Å; F330-L340 HydrophobicContact CE2-CG 4.19Å; F330-L340 HydrophobicContact CZ-CB 4.42Å; Q336-L340 PolarHBondContact O-N 3.26Å; L337-L340 WeakPolarHBondContact O-CB 3.41Å; L337-L340 PolarHBondContact O-N 3.46Å; L340-F342 VanDerWaalsContact C-N 3.27Å; L340-F342 PolarHBondContact O-N 2.98Å; L340-C343 VanDerWaalsContact O-CB 3.29Å; L340-C343 WeakPolarHBondContact O-CB 3.31Å; L340-C343 PolarHBondContact O-N 3.18Å; L340-C343 VanDerWaalsContact O-N 3.1Å; L340-A344 PolarHBondContact O-N 2.94Å
341	L	66.6	Low	58.2	Low	5 Å²	5	41.6 Å²	41.6	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-34.1	178.1	-72.2	174.9	0	0	0	112	L337 S338 M339 A344 A345 W363 F366 A390	L337-L341 HydrophobicContact CD1-CD1 4.3Å; L337-L341 HydrophobicContact CD1-CG 4.32Å; L337-L341 HydrophobicContact CG-CD1 4.02Å; L337-L341 HydrophobicContact CG-CG 4.47Å; L337-L341 WeakPolarHBondContact O-CB 3.34Å; L337-L341 VanDerWaalsContact O-CG 3.23Å; L337-L341 WeakPolarHBondContact O-CG 3.5Å; L337-L341 PolarHBondContact O-N 3.32Å; S338-L341 PolarHBondContact O-N 2.93Å; M339-L341 VanDerWaalsContact C-N 3.33Å; M339-L341 PolarHBondContact O-N 3.35Å; L341-A344 WeakPolarHBondContact O-CB 3.37Å; L341-A344 PolarHBondContact O-N 2.86Å; L341-A345 WeakPolarHBondContact O-CB 3.4Å; L341-A345 PolarHBondContact O-N 2.93Å; L341-W363 HydrophobicContact CB-CD2 4.31Å; L341-W363 HydrophobicContact CB-CH2 3.85Å; L341-W363 HydrophobicContact CB-CZ2 3.48Å; L341-W363 VanDerWaalsContact CB-CZ2 3.48Å; L341-W363 HydrophobicContact CB-CZ3 4.4Å; L341-W363 HydrophobicContact CD1-CE3 4.16Å; L341-W363 HydrophobicContact CD1-CH2 4.02Å; L341-W363 HydrophobicContact CD1-CZ2 4.44Å; L341-W363 HydrophobicContact CD1-CZ3 3.87Å; L341-W363 HydrophobicContact CD2-CD2 3.77Å; L341-W363 HydrophobicContact CD2-CE3 4.06Å; L341-W363 HydrophobicContact CD2-CG 4Å; L341-W363 HydrophobicContact CD2-CZ2 4.5Å; L341-W363 HydrophobicContact CG-CD2 4.44Å; L341-W363 HydrophobicContact CG-CH2 4.43Å; L341-W363 HydrophobicContact CG-CZ2 4.35Å; L341-W363 PolarHBondContact O-NE1 3.21Å; L341-F366 HydrophobicContact CD1-CB 4.3Å; L341-F366 HydrophobicContact CD1-CD1 3.73Å; L341-F366 HydrophobicContact CD1-CD2 4.2Å; L341-F366 HydrophobicContact CD1-CE1 4.06Å; L341-F366 HydrophobicContact CD1-CE2 4.48Å; L341-F366 HydrophobicContact CD1-CG 3.8Å; L341-F366 HydrophobicContact CD1-CZ 4.42Å; L341-F366 HydrophobicContact CD2-CB 4.06Å; L341-F366 HydrophobicContact CD2-CG 4.44Å; L341-A390 HydrophobicContact CB-CB 4.36Å
342	F	64.6	Low	58.5	Low	2 Å²	2	40.6 Å²	40.6	1%	0.009	20%	0.203	C	C	.	.	H	α-helix	trans	-63.2	-42.6	171.7	-179.8	-90.9	0	0	0	111.5	T300 S338 M339 L340 A345 R346 L389 A390 F393	T300-F342 HydrophobicContact CG2-CE2 4.38Å; T300-F342 HydrophobicContact CG2-CZ 4.34Å; T300-F342 WeakPolarHBondContact OG1-CE1 3.18Å; S338-F342 WeakPolarHBondContact O-CB 3.42Å; S338-F342 PolarHBondContact O-N 2.8Å; M339-F342 HydrophobicContact CE-CD1 4.49Å; M339-F342 WeakPolarHBondContact O-CB 3.38Å; M339-F342 PolarHBondContact O-N 3.44Å; L340-F342 VanDerWaalsContact C-N 3.27Å; L340-F342 PolarHBondContact O-N 2.98Å; F342-A345 WeakPolarHBondContact O-CB 2.93Å; F342-A345 PolarHBondContact O-N 3.41Å; F342-R346 HydrophobicContact CD1-CG 4.18Å; F342-R346 HydrophobicContact CE1-CG 3.81Å; F342-R346 HydrophobicContact CZ-CG 4.03Å; F342-R346 WeakPolarHBondContact O-CB 3.46Å; F342-R346 WeakPolarHBondContact O-CG 3.21Å; F342-R346 PolarHBondContact O-N 2.99Å; F342-L389 HydrophobicContact CD2-CD2 4.49Å; F342-L389 HydrophobicContact CD2-CG 4.39Å; F342-L389 HydrophobicContact CE2-CD2 4.04Å; F342-L389 HydrophobicContact CE2-CG 4.11Å; F342-A390 HydrophobicContact CB-CB 3.71Å; F342-A390 HydrophobicContact CD2-CB 4.38Å; F342-F393 AromaticContact CD2-CD2 3.97Å; F342-F393 HydrophobicContact CD2-CD2 3.97Å; F342-F393 AromaticContact CE2-CD2 3.36Å; F342-F393 HydrophobicContact CE2-CD2 3.36Å; F342-F393 AromaticContact CE2-CE2 3.65Å; F342-F393 HydrophobicContact CE2-CE2 3.65Å; F342-F393 HydrophobicContact CE2-CG 4.09Å; F342-F393 HydrophobicContact CZ-CD2 4.27Å; F342-F393 HydrophobicContact CZ-CE2 4.31Å
343	C	62.1	Low	58.5	Low	8 Å²	8	38.3 Å²	38.3	5%	0.054	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-49.1	175.8	-51.8	0	0	0	0	111.1	L296 M339 L340 A345 R346 I347	L296-C343 WeakPolarHBondContact CD1-SG 3.25Å; L296-C343 HydrophobicContact CD2-CB 4.28Å; L296-C343 WeakPolarHBondContact CD2-SG 3.39Å; L296-C343 WeakPolarHBondContact CG-SG 3.27Å; M339-C343 PolarHBondContact O-N 3.18Å; M339-C343 PolarHBondContact O-SG 3.22Å; L340-C343 VanDerWaalsContact O-CB 3.29Å; L340-C343 WeakPolarHBondContact O-CB 3.31Å; L340-C343 PolarHBondContact O-N 3.18Å; L340-C343 VanDerWaalsContact O-N 3.1Å; C343-A345 VanDerWaalsContact C-N 3.28Å; C343-A345 PolarHBondContact O-N 2.92Å; C343-R346 CarbonylContact O-C 3.53Å; C343-R346 PolarHBondContact O-N 2.9Å; C343-I347 HydrophobicContact CB-CD1 4.13Å; C343-I347 WeakPolarHBondContact O-CB 3.33Å; C343-I347 VanDerWaalsContact O-CG1 3.25Å; C343-I347 WeakPolarHBondContact O-CG1 3.42Å; C343-I347 PolarHBondContact O-N 3.48Å
344	A	64.2	Low	58.3	Low	5 Å²	5	36 Å²	36	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-52.1	-54.6	176.1	0	0	0	0	0	108.8	L340 L341 R346 I347 F348 P359 L362	L340-A344 PolarHBondContact O-N 2.94Å; L341-A344 WeakPolarHBondContact O-CB 3.37Å; L341-A344 PolarHBondContact O-N 2.86Å; A344-R346 PolarHBondContact O-N 2.88Å; A344-R346 VanDerWaalsContact O-N 3.07Å; A344-I347 CarbonylContact O-C 3.5Å; A344-I347 PolarHBondContact O-N 3.18Å; A344-F348 PolarHBondContact O-N 3.31Å; A344-P359 HydrophobicContact CB-CB 3.97Å; A344-P359 WeakPolarHBondContact O-CB 3.38Å; A344-P359 VanDerWaalsContact O-CG 3.29Å; A344-P359 WeakPolarHBondContact O-CG 3.45Å; A344-L362 HydrophobicContact CB-CB 4.27Å; A344-L362 HydrophobicContact CB-CD1 3.69Å
345	A	61	Low	57.7	Low	3 Å²	3	37.4 Å²	37.4	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-53.4	-34.7	178.8	0	0	0	0	0	114.1	L341 F342 C343 F393 F394 A397	L341-A345 WeakPolarHBondContact O-CB 3.4Å; L341-A345 PolarHBondContact O-N 2.93Å; F342-A345 WeakPolarHBondContact O-CB 2.93Å; F342-A345 PolarHBondContact O-N 3.41Å; C343-A345 VanDerWaalsContact C-N 3.28Å; C343-A345 PolarHBondContact O-N 2.92Å; A345-F393 HydrophobicContact CB-CB 3.91Å; A345-F394 HydrophobicContact CB-CB 3.83Å; A345-A397 VanDerWaalsContact O-CB 3.29Å; A345-A397 WeakPolarHBondContact O-CB 3.46Å
346	R	61.2	Low	57.1	Low	54 Å²	54	37.7 Å²	37.7	20%	0.204	21%	0.209	C	C	.	.	H	α-helix	trans	-86	-33.2	-179.9	-74.5	-71.8	-171.4	125.1	0.6	114.5	L303 F306 F342 C343 A344 F348 F393	L303-R346 PolarHBondContact O-NH1 3.1Å; F306-R346 HydrophobicContact CD1-CB 3.77Å; F306-R346 HydrophobicContact CD2-CB 3.9Å; F306-R346 HydrophobicContact CD2-CG 4.06Å; F306-R346 HydrophobicContact CE1-CB 3.31Å; F306-R346 HydrophobicContact CE1-CG 4.41Å; F306-R346 HydrophobicContact CE2-CB 3.51Å; F306-R346 HydrophobicContact CE2-CG 3.99Å; F306-R346 HydrophobicContact CG-CB 4.06Å; F306-R346 HydrophobicContact CG-CG 4.37Å; F306-R346 HydrophobicContact CZ-CB 3.21Å; F306-R346 HydrophobicContact CZ-CG 4.19Å; F342-R346 HydrophobicContact CD1-CG 4.18Å; F342-R346 HydrophobicContact CE1-CG 3.81Å; F342-R346 HydrophobicContact CZ-CG 4.03Å; F342-R346 WeakPolarHBondContact O-CB 3.46Å; F342-R346 WeakPolarHBondContact O-CG 3.21Å; F342-R346 PolarHBondContact O-N 2.99Å; C343-R346 CarbonylContact O-C 3.53Å; C343-R346 PolarHBondContact O-N 2.9Å; A344-R346 PolarHBondContact O-N 2.88Å; A344-R346 VanDerWaalsContact O-N 3.07Å; R346-F348 PolarHBondContact O-N 2.68Å; R346-F393 VanDerWaalsContact CZ-CE1 3.49Å; R346-F393 VanDerWaalsContact NE-CD1 3.32Å
347	I	61	Low	56.7	Low	29 Å²	29	38.1 Å²	38.1	15%	0.149	21%	0.211	C	C	.	.	S	Bend	trans	-83	18.1	174	-53.3	161.1	0	0	0	109.7	F306 I310 C343 A344 S349 P359	F306-I347 HydrophobicContact CE1-CG1 3.68Å; F306-I347 HydrophobicContact CZ-CD1 4.19Å; F306-I347 HydrophobicContact CZ-CG1 3.58Å; I310-I347 HydrophobicContact CG2-CD1 4.14Å; I310-I347 HydrophobicContact CG2-CG1 4.02Å; C343-I347 HydrophobicContact CB-CD1 4.13Å; C343-I347 WeakPolarHBondContact O-CB 3.33Å; C343-I347 VanDerWaalsContact O-CG1 3.25Å; C343-I347 WeakPolarHBondContact O-CG1 3.42Å; C343-I347 PolarHBondContact O-N 3.48Å; A344-I347 CarbonylContact O-C 3.5Å; A344-I347 PolarHBondContact O-N 3.18Å; I347-S349 PolarHBondContact O-N 2.79Å; I347-P359 WeakPolarHBondContact O-CG 3.31Å
348	F	58.6	Low	56.7	Low	19 Å²	19	37.5 Å²	37.5	8%	0.083	21%	0.208	C	C	.	.			trans	-64.6	79.2	171	-156.9	-54.7	0	0	0	109.4	A344 R346 P359 V360 A397 L398 Q401 F405	A344-F348 PolarHBondContact O-N 3.31Å; R346-F348 PolarHBondContact O-N 2.68Å; F348-P359 HydrophobicContact CD2-CB 4.34Å; F348-V360 HydrophobicContact CD2-CG2 3.82Å; F348-V360 HydrophobicContact CE2-CG2 3.01Å; F348-V360 HydrophobicContact CZ-CG2 3.5Å; F348-V360 VanDerWaalsContact CZ-CG2 3.5Å; F348-A397 HydrophobicContact CB-CB 3.8Å; F348-A397 HydrophobicContact CD2-CB 3.92Å; F348-A397 HydrophobicContact CG-CB 4.02Å; F348-L398 HydrophobicContact CE2-CB 4.16Å; F348-L398 HydrophobicContact CE2-CD1 3.91Å; F348-L398 HydrophobicContact CZ-CD1 4.04Å; F348-Q401 HydrophobicContact CD1-CB 3.57Å; F348-Q401 HydrophobicContact CD1-CG 3.56Å; F348-Q401 HydrophobicContact CE1-CB 3.15Å; F348-Q401 HydrophobicContact CE1-CG 3.74Å; F348-Q401 HydrophobicContact CG-CG 4.38Å; F348-Q401 HydrophobicContact CZ-CB 3.8Å; F348-F405 HydrophobicContact CZ-CB 4.18Å; F348-F405 HydrophobicContact CZ-CD2 4.39Å
349	S	57.1	Low	56.8	Low	52 Å²	52	37.5 Å²	37.5	36%	0.364	21%	0.208	S	C	.	.			trans	-118.9	113.1	167	177.8	0	0	0	0	105.7	I347 E351 N352	I347-S349 PolarHBondContact O-N 2.79Å; S349-E351 PolarHBondContact O-N 3.1Å; S349-E351 PolarHBondContact OG-N 3.26Å; S349-N352 WeakPolarHBondContact O-CB 3.27Å; S349-N352 PolarHBondContact O-N 3.47Å; S349-N352 VanDerWaalsContact O-N 3.09Å
350	P	51.2	Low	57.5	Low	22 Å²	22	37.5 Å²	37.5	14%	0.143	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.5	172.3	25	-30.5	0	0	0	111.3	N352 M404 R411	P350-N352 VanDerWaalsContact C-N 3.25Å; P350-N352 PolarHBondContact O-N 2.84Å; P350-M404 HydrophobicContact CB-CB 4.25Å; P350-M404 HydrophobicContact CG-CB 4.02Å; P350-M404 HydrophobicContact CG-CE 4.31Å; P350-M404 HydrophobicContact CG-CG 4.42Å; P350-M404 HydrophobicContact CG-SD 3.63Å; P350-R411 PolarHBondContact O-NH1 2.79Å
351	E	52.5	Low	57.9	Low	171 Å²	171	37.5 Å²	37.5	80%	0.799	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	1.5	175.1	-63.2	-172.8	172.9	0	0	113.8	S349 P353	S349-E351 PolarHBondContact O-N 3.1Å; S349-E351 PolarHBondContact OG-N 3.26Å; E351-P353 WeakPolarHBondContact O-CD 3.38Å; E351-P353 VanDerWaalsContact O-N 3.09Å
352	N	53.7	Low	58.2	Low	40 Å²	40	37.7 Å²	37.7	21%	0.214	21%	0.211	C	C	.	.			trans	-61.8	116.4	175.1	-167.7	-3	0	0	0	109.1	S349 P350 V354	S349-N352 WeakPolarHBondContact O-CB 3.27Å; S349-N352 PolarHBondContact O-N 3.47Å; S349-N352 VanDerWaalsContact O-N 3.09Å; P350-N352 VanDerWaalsContact C-N 3.25Å; P350-N352 PolarHBondContact O-N 2.84Å; N352-V354 PolarHBondContact O-N 3.15Å; N352-V354 VanDerWaalsContact O-N 3.08Å; N352-V354 WeakPolarHBondContact OD1-CG2 3.2Å; N352-V354 PolarHBondContact OD1-N 2.88Å
353	P	45.8	Very low	58.9	Low	114 Å²	114	37.6 Å²	37.6	74%	0.74	21%	0.21	S	C	*	.			trans	-70	-3.9	-177.6	29.6	-36.9	0	0	0	113	E351 D355	E351-P353 WeakPolarHBondContact O-CD 3.38Å; E351-P353 VanDerWaalsContact O-N 3.09Å; P353-D355 PolarHBondContact O-N 2.95Å
354	V	44.1	Very low	60	Low	34 Å²	34	37.2 Å²	37.2	21%	0.206	21%	0.208	C	C	.	.			trans	-86	89.9	-176.4	-175.8	0	0	0	0	109.5	N352 S356 L357	N352-V354 PolarHBondContact O-N 3.15Å; N352-V354 VanDerWaalsContact O-N 3.08Å; N352-V354 WeakPolarHBondContact OD1-CG2 3.2Å; N352-V354 PolarHBondContact OD1-N 2.88Å; V354-S356 WeakPolarHBondContact CG1-OG 3.29Å; V354-S356 PolarHBondContact O-N 3.29Å; V354-L357 HydrophobicContact CG1-CB 4.25Å; V354-L357 HydrophobicContact CG1-CD1 4.46Å; V354-L357 PolarHBondContact O-N 3.07Å
355	D	42.7	Very low	60.6	Low	131 Å²	131	38.5 Å²	38.5	70%	0.701	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-51.9	-26	174.1	-71.8	-31.3	0	0	0	113	P353 L357	P353-D355 PolarHBondContact O-N 2.95Å; D355-L357 PolarHBondContact O-N 3.38Å
356	S	44.1	Very low	61.4	Low	55 Å²	55	39.1 Å²	39.1	39%	0.385	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-78.5	-14.4	-173.6	63.9	0	0	0	0	114.7	T323 V354	T323-S356 PolarHBondContact OG1-O 3.07Å; V354-S356 WeakPolarHBondContact CG1-OG 3.29Å; V354-S356 PolarHBondContact O-N 3.29Å
357	L	48.2	Very low	62.5	Low	11 Å²	11	36.5 Å²	36.5	6%	0.058	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-135.5	44.9	-173.4	-76.2	172.9	0	0	0	112.6	V319 T323 L326 V354 D355 P359 L362	V319-L357 HydrophobicContact CB-CD1 4.35Å; V319-L357 HydrophobicContact CG1-CD1 3.21Å; V319-L357 WeakPolarHBondContact O-CD1 3.36Å; T323-L357 VanDerWaalsContact OG1-CD2 3.3Å; T323-L357 WeakPolarHBondContact OG1-CD2 3.4Å; L326-L357 HydrophobicContact CD2-CD2 4.13Å; V354-L357 HydrophobicContact CG1-CB 4.25Å; V354-L357 HydrophobicContact CG1-CD1 4.46Å; V354-L357 PolarHBondContact O-N 3.07Å; D355-L357 PolarHBondContact O-N 3.38Å; L357-P359 WeakPolarHBondContact O-CD 3.43Å; L357-L362 HydrophobicContact CD2-CD1 3.81Å; L357-L362 HydrophobicContact CD2-CD2 4.28Å; L357-L362 HydrophobicContact CD2-CG 4.4Å
358	H	61.9	Low	63.4	Low	18 Å²	18	35.4 Å²	35.4	8%	0.083	20%	0.199	C	C	.	.			trans	-57.8	116.3	170.3	-169	-77.7	0	0	0	108.7	V360 A361 L362 F405 R411	H358-V360 PolarHBondContact ND1-N 3.21Å; H358-V360 PolarHBondContact O-N 3.36Å; H358-A361 HydrophobicContact CB-CB 4.01Å; H358-A361 WeakPolarHBondContact O-CA 3.23Å; H358-A361 WeakPolarHBondContact O-CB 3.1Å; H358-A361 PolarHBondContact O-N 3.07Å; H358-L362 PolarHBondContact O-N 3.12Å; H358-F405 AromaticContact CE1-CD2 3.8Å; H358-R411 WeakPolarHBondContact CB-O 3.35Å
359	P	65.6	Low	63.9	Low	3 Å²	3	36.8 Å²	36.8	2%	0.019	21%	0.211	C	C	.	.	H	α-helix	trans	-53.2	-36.6	-172.3	-40.9	46.4	0	0	0	116	A344 I347 F348 L357 L362 W363	A344-P359 HydrophobicContact CB-CB 3.97Å; A344-P359 WeakPolarHBondContact O-CB 3.38Å; A344-P359 VanDerWaalsContact O-CG 3.29Å; A344-P359 WeakPolarHBondContact O-CG 3.45Å; I347-P359 WeakPolarHBondContact O-CG 3.31Å; F348-P359 HydrophobicContact CD2-CB 4.34Å; L357-P359 WeakPolarHBondContact O-CD 3.43Å; P359-L362 PolarHBondContact O-N 3.45Å; P359-W363 PolarHBondContact O-N 3.46Å
360	V	75.5	Confident	64.9	Low	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-70.6	-36.4	177.3	-173.5	0	0	0	0	111.4	F348 H358 L362 W363 L364 F394 L398 F405	F348-V360 HydrophobicContact CD2-CG2 3.82Å; F348-V360 HydrophobicContact CE2-CG2 3.01Å; F348-V360 HydrophobicContact CZ-CG2 3.5Å; F348-V360 VanDerWaalsContact CZ-CG2 3.5Å; H358-V360 PolarHBondContact ND1-N 3.21Å; H358-V360 PolarHBondContact O-N 3.36Å; V360-L362 PolarHBondContact O-N 2.93Å; V360-W363 PolarHBondContact O-N 2.98Å; V360-L364 HydrophobicContact CG1-CD1 3.66Å; V360-L364 HydrophobicContact CG1-CG 3.9Å; V360-L364 WeakPolarHBondContact O-CB 3.4Å; V360-L364 WeakPolarHBondContact O-CG 3.39Å; V360-L364 PolarHBondContact O-N 2.87Å; V360-F394 HydrophobicContact CG1-CE2 4.21Å; V360-F394 HydrophobicContact CG2-CE2 4.31Å; V360-L398 HydrophobicContact CG1-CD1 4.41Å; V360-L398 HydrophobicContact CG2-CD1 3.99Å; V360-F405 HydrophobicContact CB-CD2 4.11Å; V360-F405 HydrophobicContact CB-CE2 3.5Å; V360-F405 VanDerWaalsContact CB-CE2 3.5Å; V360-F405 HydrophobicContact CB-CZ 4.27Å; V360-F405 HydrophobicContact CG1-CD2 4.21Å; V360-F405 HydrophobicContact CG1-CE2 3.28Å; V360-F405 HydrophobicContact CG1-CZ 3.53Å; V360-F405 HydrophobicContact CG2-CD2 3.79Å; V360-F405 HydrophobicContact CG2-CE2 3.68Å
361	A	74	Confident	66.4	Low	12 Å²	12	41.9 Å²	41.9	10%	0.099	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-35.2	177.8	0	0	0	0	0	111	H358 L364 Q365 I412	H358-A361 HydrophobicContact CB-CB 4.01Å; H358-A361 WeakPolarHBondContact O-CA 3.23Å; H358-A361 WeakPolarHBondContact O-CB 3.1Å; H358-A361 PolarHBondContact O-N 3.07Å; A361-L364 PolarHBondContact O-N 2.87Å; A361-Q365 WeakPolarHBondContact O-CB 3.15Å; A361-Q365 PolarHBondContact O-N 3.13Å; A361-I412 HydrophobicContact CB-CG2 4.4Å
362	L	72.3	Confident	67.9	Low	9 Å²	9	34.5 Å²	34.5	5%	0.047	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-49.5	173.2	-74.3	169.3	0	0	0	112.6	T323 V327 A344 L357 H358 P359 V360 L364 Q365 F366	T323-L362 HydrophobicContact CG2-CD2 3.37Å; V327-L362 HydrophobicContact CG2-CD2 4.11Å; A344-L362 HydrophobicContact CB-CB 4.27Å; A344-L362 HydrophobicContact CB-CD1 3.69Å; L357-L362 HydrophobicContact CD2-CD1 3.81Å; L357-L362 HydrophobicContact CD2-CD2 4.28Å; L357-L362 HydrophobicContact CD2-CG 4.4Å; H358-L362 PolarHBondContact O-N 3.12Å; P359-L362 PolarHBondContact O-N 3.45Å; V360-L362 PolarHBondContact O-N 2.93Å; L362-L364 VanDerWaalsContact C-N 3.32Å; L362-L364 PolarHBondContact O-N 3.25Å; L362-Q365 PolarHBondContact O-N 3.1Å; L362-F366 WeakPolarHBondContact O-CB 3.26Å; L362-F366 PolarHBondContact O-N 2.62Å
363	W	80.8	Confident	69.5	Low	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.2	-41.9	176.8	-86.5	97.4	0	0	0	112.4	L341 P359 V360 F366 F367 A390 F391 F394	L341-W363 HydrophobicContact CB-CD2 4.31Å; L341-W363 HydrophobicContact CB-CH2 3.85Å; L341-W363 HydrophobicContact CB-CZ2 3.48Å; L341-W363 VanDerWaalsContact CB-CZ2 3.48Å; L341-W363 HydrophobicContact CB-CZ3 4.4Å; L341-W363 HydrophobicContact CD1-CE3 4.16Å; L341-W363 HydrophobicContact CD1-CH2 4.02Å; L341-W363 HydrophobicContact CD1-CZ2 4.44Å; L341-W363 HydrophobicContact CD1-CZ3 3.87Å; L341-W363 HydrophobicContact CD2-CD2 3.77Å; L341-W363 HydrophobicContact CD2-CE3 4.06Å; L341-W363 HydrophobicContact CD2-CG 4Å; L341-W363 HydrophobicContact CD2-CZ2 4.5Å; L341-W363 HydrophobicContact CG-CD2 4.44Å; L341-W363 HydrophobicContact CG-CH2 4.43Å; L341-W363 HydrophobicContact CG-CZ2 4.35Å; L341-W363 PolarHBondContact O-NE1 3.21Å; P359-W363 PolarHBondContact O-N 3.46Å; V360-W363 PolarHBondContact O-N 2.98Å; W363-F366 HydrophobicContact CE3-CD1 4.04Å; W363-F366 HydrophobicContact CZ3-CD1 4.16Å; W363-F366 HydrophobicContact CZ3-CE1 4.27Å; W363-F366 WeakPolarHBondContact O-CB 3.41Å; W363-F366 PolarHBondContact O-N 3.08Å; W363-F367 HydrophobicContact CB-CE2 4.38Å; W363-F367 HydrophobicContact CB-CZ 4.4Å; W363-F367 HydrophobicContact CD2-CZ 4.42Å; W363-F367 AromaticContact CE3-CE1 3.64Å; W363-F367 HydrophobicContact CE3-CE1 3.64Å; W363-F367 AromaticContact CE3-CZ 3.55Å; W363-F367 HydrophobicContact CE3-CZ 3.55Å; W363-F367 HydrophobicContact CZ3-CE1 4.06Å; W363-F367 HydrophobicContact CZ3-CZ 4.23Å; W363-F367 WeakPolarHBondContact O-CD1 3.3Å; W363-F367 VanDerWaalsContact O-CD2 3.32Å; W363-F367 WeakPolarHBondContact O-CD2 3.15Å; W363-F367 WeakPolarHBondContact O-CG 3.22Å; W363-F367 PolarHBondContact O-N 2.65Å; W363-A390 HydrophobicContact CH2-CB 3.9Å; W363-A390 HydrophobicContact CZ2-CB 3.7Å; W363-A390 WeakPolarHBondContact CZ2-O 3.27Å; W363-F391 HydrophobicContact CE3-CD2 4.31Å; W363-F391 VanDerWaalsContact CH2-CA 3.45Å; W363-F391 HydrophobicContact CH2-CB 3.73Å; W363-F391 HydrophobicContact CH2-CD2 4.09Å; W363-F391 HydrophobicContact CH2-CG 4.43Å; W363-F391 HydrophobicContact CZ3-CB 4.19Å; W363-F391 AromaticContact CZ3-CD2 3.77Å; W363-F391 HydrophobicContact CZ3-CD2 3.77Å; W363-F391 HydrophobicContact CZ3-CG 4.47Å; W363-F394 HydrophobicContact CB-CD2 4Å; W363-F394 HydrophobicContact CB-CE1 4.38Å; W363-F394 HydrophobicContact CB-CE2 3.67Å; W363-F394 HydrophobicContact CB-CG 4.48Å; W363-F394 HydrophobicContact CB-CZ 3.87Å; W363-F394 AromaticContact CD1-CD2 3.28Å; W363-F394 AromaticContact CD1-CE2 3.82Å; W363-F394 AromaticContact CD1-CG 3.74Å; W363-F394 HydrophobicContact CD2-CB 4.05Å; W363-F394 HydrophobicContact CD2-CD1 4.01Å; W363-F394 HydrophobicContact CD2-CD2 4.01Å; W363-F394 HydrophobicContact CD2-CE1 4.49Å; W363-F394 HydrophobicContact CD2-CE2 4.49Å; W363-F394 AromaticContact CD2-CG 3.74Å; W363-F394 HydrophobicContact CD2-CG 3.74Å; W363-F394 VanDerWaalsContact CE2-CB 3.45Å; W363-F394 AromaticContact CE2-CG 3.68Å; W363-F394 HydrophobicContact CE3-CD1 4.34Å; W363-F394 HydrophobicContact CE3-CG 4.48Å; W363-F394 HydrophobicContact CG-CB 4.36Å; W363-F394 HydrophobicContact CG-CD1 4.19Å; W363-F394 AromaticContact CG-CD2 3.47Å; W363-F394 HydrophobicContact CG-CD2 3.47Å; W363-F394 VanDerWaalsContact CG-CD2 3.47Å; W363-F394 HydrophobicContact CG-CE1 4.38Å; W363-F394 AromaticContact CG-CE2 3.69Å; W363-F394 HydrophobicContact CG-CE2 3.69Å; W363-F394 AromaticContact CG-CG 3.73Å; W363-F394 HydrophobicContact CG-CG 3.73Å; W363-F394 HydrophobicContact CG-CZ 4.14Å; W363-F394 HydrophobicContact CZ2-CB 3.7Å; W363-F394 HydrophobicContact CZ2-CG 4.3Å; W363-F394 AromaticContact NE1-CD2 3.68Å; W363-F394 AromaticContact NE1-CG 3.72Å
364	L	83.9	Confident	71.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-70.8	-35.7	178.4	-65.2	177.9	0	0	0	112.3	V360 A361 L362 F366 F367 E368 F372 I412 V414 L477 L481	V360-L364 HydrophobicContact CG1-CD1 3.66Å; V360-L364 HydrophobicContact CG1-CG 3.9Å; V360-L364 WeakPolarHBondContact O-CB 3.4Å; V360-L364 WeakPolarHBondContact O-CG 3.39Å; V360-L364 PolarHBondContact O-N 2.87Å; A361-L364 PolarHBondContact O-N 2.87Å; L362-L364 VanDerWaalsContact C-N 3.32Å; L362-L364 PolarHBondContact O-N 3.25Å; L364-F366 VanDerWaalsContact C-N 3.32Å; L364-F367 HydrophobicContact CD2-CD2 3.91Å; L364-F367 HydrophobicContact CD2-CE2 4.26Å; L364-F367 PolarHBondContact O-N 3.37Å; L364-E368 WeakPolarHBondContact O-CB 3.11Å; L364-E368 PolarHBondContact O-N 2.96Å; L364-F372 HydrophobicContact CD2-CE1 4.34Å; L364-F372 HydrophobicContact CD2-CZ 4.45Å; L364-I412 HydrophobicContact CD1-CG2 4.05Å; L364-V414 HydrophobicContact CB-CG1 4.5Å; L364-V414 HydrophobicContact CB-CG2 3.49Å; L364-V414 VanDerWaalsContact CB-CG2 3.49Å; L364-V414 HydrophobicContact CD1-CG2 4.25Å; L364-L477 HydrophobicContact CB-CD1 4.21Å; L364-L477 HydrophobicContact CD1-CD1 4.08Å; L364-L477 HydrophobicContact CD1-CD2 3.54Å; L364-L477 HydrophobicContact CD1-CG 3.78Å; L364-L477 HydrophobicContact CD2-CD1 4.46Å; L364-L477 HydrophobicContact CG-CD1 4.49Å; L364-L481 HydrophobicContact CD2-CB 4.41Å; L364-L481 HydrophobicContact CD2-CD1 3.97Å; L364-L481 HydrophobicContact CD2-CD2 4.3Å; L364-L481 HydrophobicContact CD2-CG 4.45Å
365	Q	76.6	Confident	73.7	Confident	32 Å²	32	35.6 Å²	35.6	15%	0.15	18%	0.184	C	C	.	.	H	α-helix	trans	-67	-34.9	172.4	-171.1	65.4	63.6	0	0	111.6	A361 L362 E368 S369 Y415	A361-Q365 WeakPolarHBondContact O-CB 3.15Å; A361-Q365 PolarHBondContact O-N 3.13Å; L362-Q365 PolarHBondContact O-N 3.1Å; Q365-E368 PolarHBondContact O-N 2.95Å; Q365-S369 PolarHBondContact O-N 3.33Å; Q365-Y415 PolarHBondContact NE2-O 3.29Å
366	F	78.7	Confident	75.7	Confident	15 Å²	15	31 Å²	31	7%	0.066	16%	0.162	C	C	.	.	H	α-helix	trans	-63.3	-47.7	170.3	166.1	-112.9	0	0	0	111.3	L337 L341 L362 W363 L364 E368 S369 L370 V380	L337-F366 HydrophobicContact CD2-CD2 3.64Å; L337-F366 HydrophobicContact CD2-CE2 3.57Å; L337-F366 HydrophobicContact CG-CD2 4.35Å; L337-F366 HydrophobicContact CG-CE2 4.46Å; L341-F366 HydrophobicContact CD1-CB 4.3Å; L341-F366 HydrophobicContact CD1-CD1 3.73Å; L341-F366 HydrophobicContact CD1-CD2 4.2Å; L341-F366 HydrophobicContact CD1-CE1 4.06Å; L341-F366 HydrophobicContact CD1-CE2 4.48Å; L341-F366 HydrophobicContact CD1-CG 3.8Å; L341-F366 HydrophobicContact CD1-CZ 4.42Å; L341-F366 HydrophobicContact CD2-CB 4.06Å; L341-F366 HydrophobicContact CD2-CG 4.44Å; L362-F366 WeakPolarHBondContact O-CB 3.26Å; L362-F366 PolarHBondContact O-N 2.62Å; W363-F366 HydrophobicContact CE3-CD1 4.04Å; W363-F366 HydrophobicContact CZ3-CD1 4.16Å; W363-F366 HydrophobicContact CZ3-CE1 4.27Å; W363-F366 WeakPolarHBondContact O-CB 3.41Å; W363-F366 PolarHBondContact O-N 3.08Å; L364-F366 VanDerWaalsContact C-N 3.32Å; F366-E368 VanDerWaalsContact C-N 3.31Å; F366-E368 PolarHBondContact O-N 3.03Å; F366-S369 WeakPolarHBondContact O-CB 3.47Å; F366-S369 PolarHBondContact O-N 3.44Å; F366-S369 VanDerWaalsContact O-N 3.11Å; F366-S369 PolarHBondContact O-OG 3.05Å; F366-L370 HydrophobicContact CE1-CD1 4.4Å; F366-L370 HydrophobicContact CE2-CD1 3.74Å; F366-L370 HydrophobicContact CE2-CG 4.44Å; F366-L370 HydrophobicContact CZ-CD1 3.66Å; F366-L370 PolarHBondContact O-N 3.41Å; F366-V380 HydrophobicContact CE2-CG1 4.47Å; F366-V380 HydrophobicContact CZ-CB 4.47Å; F366-V380 HydrophobicContact CZ-CG1 3.92Å
367	F	84.2	Confident	77.6	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.6	-42.2	175.4	-57.6	-28.6	0	0	0	111.8	W363 L364 S369 L370 H371 F372 I377 F391 F394 L481 L484	W363-F367 HydrophobicContact CB-CE2 4.38Å; W363-F367 HydrophobicContact CB-CZ 4.4Å; W363-F367 HydrophobicContact CD2-CZ 4.42Å; W363-F367 AromaticContact CE3-CE1 3.64Å; W363-F367 HydrophobicContact CE3-CE1 3.64Å; W363-F367 AromaticContact CE3-CZ 3.55Å; W363-F367 HydrophobicContact CE3-CZ 3.55Å; W363-F367 HydrophobicContact CZ3-CE1 4.06Å; W363-F367 HydrophobicContact CZ3-CZ 4.23Å; W363-F367 WeakPolarHBondContact O-CD1 3.3Å; W363-F367 VanDerWaalsContact O-CD2 3.32Å; W363-F367 WeakPolarHBondContact O-CD2 3.15Å; W363-F367 WeakPolarHBondContact O-CG 3.22Å; W363-F367 PolarHBondContact O-N 2.65Å; L364-F367 HydrophobicContact CD2-CD2 3.91Å; L364-F367 HydrophobicContact CD2-CE2 4.26Å; L364-F367 PolarHBondContact O-N 3.37Å; F367-S369 VanDerWaalsContact C-N 3.3Å; F367-S369 PolarHBondContact O-N 3.43Å; F367-L370 CarbonylContact O-C 3.59Å; F367-L370 VanDerWaalsContact O-C 3.28Å; F367-L370 WeakPolarHBondContact O-CA 3.44Å; F367-L370 PolarHBondContact O-N 3.33Å; F367-H371 PolarHBondContact O-N 2.88Å; F367-H371 VanDerWaalsContact O-N 3.15Å; F367-F372 HydrophobicContact CB-CD1 3.81Å; F367-F372 HydrophobicContact CB-CD2 4.46Å; F367-F372 HydrophobicContact CB-CE1 3.67Å; F367-F372 HydrophobicContact CB-CE2 4.36Å; F367-F372 HydrophobicContact CB-CG 4.2Å; F367-F372 HydrophobicContact CB-CZ 3.96Å; F367-F372 HydrophobicContact CD2-CE1 4.15Å; F367-F372 HydrophobicContact CG-CE1 4.41Å; F367-F372 PolarHBondContact O-N 2.95Å; F367-I377 HydrophobicContact CB-CD1 4.01Å; F367-I377 HydrophobicContact CD1-CD1 3.7Å; F367-I377 HydrophobicContact CD1-CG1 4.17Å; F367-I377 HydrophobicContact CD1-CG2 4.23Å; F367-I377 HydrophobicContact CE1-CG2 4.13Å; F367-I377 HydrophobicContact CG-CD1 4.09Å; F367-F391 HydrophobicContact CE1-CE2 4.42Å; F367-F391 HydrophobicContact CZ-CD2 4.32Å; F367-F391 AromaticContact CZ-CE2 3.9Å; F367-F391 HydrophobicContact CZ-CE2 3.9Å; F367-F394 HydrophobicContact CE2-CE1 4.15Å; F367-F394 HydrophobicContact CE2-CZ 4.43Å; F367-F394 HydrophobicContact CZ-CE1 4.11Å; F367-L481 HydrophobicContact CE2-CD1 4.24Å; F367-L484 HydrophobicContact CB-CD2 3.91Å; F367-L484 HydrophobicContact CD1-CD2 4.06Å; F367-L484 HydrophobicContact CD2-CD2 3.45Å; F367-L484 VanDerWaalsContact CD2-CD2 3.45Å; F367-L484 HydrophobicContact CE1-CD2 4.48Å; F367-L484 HydrophobicContact CE2-CD2 3.96Å; F367-L484 HydrophobicContact CG-CD2 3.54Å; F367-L484 HydrophobicContact CZ-CD2 4.45Å
368	E	79	Confident	79.5	Confident	5 Å²	5	28.6 Å²	28.6	2%	0.023	14%	0.144	C	C	.	.	H	α-helix	trans	-62.3	-35.7	175	-175.5	51.4	-139.1	0	0	112.2	L364 Q365 F366 L370 H371 F372 V414 Y415 E416 I472 K480	L364-E368 WeakPolarHBondContact O-CB 3.11Å; L364-E368 PolarHBondContact O-N 2.96Å; Q365-E368 PolarHBondContact O-N 2.95Å; F366-E368 VanDerWaalsContact C-N 3.31Å; F366-E368 PolarHBondContact O-N 3.03Å; E368-L370 PolarHBondContact O-N 3.39Å; E368-L370 VanDerWaalsContact O-N 3.17Å; E368-H371 WeakPolarHBondContact O-CA 3.33Å; E368-H371 PolarHBondContact O-N 2.82Å; E368-F372 HydrophobicContact CB-CD2 4.25Å; E368-F372 HydrophobicContact CB-CE2 3.7Å; E368-F372 HydrophobicContact CG-CE2 4.41Å; E368-F372 VanDerWaalsContact OE2-CD2 3.23Å; E368-F372 WeakPolarHBondContact OE2-CD2 3.43Å; E368-F372 WeakPolarHBondContact OE2-CE2 3.46Å; E368-V414 HydrophobicContact CB-CG1 3.96Å; E368-V414 HydrophobicContact CG-CG1 4.27Å; E368-Y415 WeakPolarHBondContact CG-O 3.23Å; E368-E416 WeakPolarHBondContact OE1-CG 3.26Å; E368-I472 HydrophobicContact CG-CD1 4.08Å; E368-I472 WeakPolarHBondContact OE2-CD1 3.14Å; E368-K480 IonicContact OE2-NZ 2.92Å; E368-K480 PolarHBondContact OE2-NZ 3.35Å
369	S	70.9	Confident	80.4	Confident	49 Å²	49	31.3 Å²	31.3	34%	0.343	16%	0.159	S	C	.	.	H	α-helix	trans	-62.3	-23.1	175	80.5	0	0	0	0	113.4	Q365 F366 F367	Q365-S369 PolarHBondContact O-N 3.33Å; F366-S369 WeakPolarHBondContact O-CB 3.47Å; F366-S369 PolarHBondContact O-N 3.44Å; F366-S369 VanDerWaalsContact O-N 3.11Å; F366-S369 PolarHBondContact O-OG 3.05Å; F367-S369 VanDerWaalsContact C-N 3.3Å; F367-S369 PolarHBondContact O-N 3.43Å
370	L	77.8	Confident	81	Confident	44 Å²	44	32.6 Å²	32.6	23%	0.23	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	18.4	173.2	-61	176.4	0	0	0	112	F366 F367 E368 F372 K373 I377 V380	F366-L370 HydrophobicContact CE1-CD1 4.4Å; F366-L370 HydrophobicContact CE2-CD1 3.74Å; F366-L370 HydrophobicContact CE2-CG 4.44Å; F366-L370 HydrophobicContact CZ-CD1 3.66Å; F366-L370 PolarHBondContact O-N 3.41Å; F367-L370 CarbonylContact O-C 3.59Å; F367-L370 VanDerWaalsContact O-C 3.28Å; F367-L370 WeakPolarHBondContact O-CA 3.44Å; F367-L370 PolarHBondContact O-N 3.33Å; E368-L370 PolarHBondContact O-N 3.39Å; E368-L370 VanDerWaalsContact O-N 3.17Å; L370-F372 PolarHBondContact O-N 3.31Å; L370-F372 VanDerWaalsContact O-N 3.16Å; L370-K373 WeakPolarHBondContact O-CB 3.39Å; L370-K373 PolarHBondContact O-N 3.43Å; L370-I377 HydrophobicContact CB-CG1 4.01Å; L370-I377 HydrophobicContact CD1-CB 4.45Å; L370-I377 HydrophobicContact CD1-CG1 3.62Å; L370-I377 HydrophobicContact CG-CG1 4.46Å; L370-V380 HydrophobicContact CD1-CG2 4.22Å
371	H	81.9	Confident	81.3	Confident	136 Å²	136	32.6 Å²	32.6	63%	0.63	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	30.7	-179.9	-57.2	-66.9	0	0	0	114.6	F367 E368 K373	F367-H371 PolarHBondContact O-N 2.88Å; F367-H371 VanDerWaalsContact O-N 3.15Å; E368-H371 WeakPolarHBondContact O-CA 3.33Å; E368-H371 PolarHBondContact O-N 2.82Å; H371-K373 PolarHBondContact O-N 3.44Å
372	F	85.1	Confident	81.4	Confident	17 Å²	17	34.6 Å²	34.6	8%	0.075	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	23.9	-173.4	-75.2	-96.6	0	0	0	113.5	L364 F367 E368 L370 A374 L477 K480 L484	L364-F372 HydrophobicContact CD2-CE1 4.34Å; L364-F372 HydrophobicContact CD2-CZ 4.45Å; F367-F372 HydrophobicContact CB-CD1 3.81Å; F367-F372 HydrophobicContact CB-CD2 4.46Å; F367-F372 HydrophobicContact CB-CE1 3.67Å; F367-F372 HydrophobicContact CB-CE2 4.36Å; F367-F372 HydrophobicContact CB-CG 4.2Å; F367-F372 HydrophobicContact CB-CZ 3.96Å; F367-F372 HydrophobicContact CD2-CE1 4.15Å; F367-F372 HydrophobicContact CG-CE1 4.41Å; F367-F372 PolarHBondContact O-N 2.95Å; E368-F372 HydrophobicContact CB-CD2 4.25Å; E368-F372 HydrophobicContact CB-CE2 3.7Å; E368-F372 HydrophobicContact CG-CE2 4.41Å; E368-F372 VanDerWaalsContact OE2-CD2 3.23Å; E368-F372 WeakPolarHBondContact OE2-CD2 3.43Å; E368-F372 WeakPolarHBondContact OE2-CE2 3.46Å; L370-F372 PolarHBondContact O-N 3.31Å; L370-F372 VanDerWaalsContact O-N 3.16Å; F372-A374 PolarHBondContact O-N 3.39Å; F372-L477 HydrophobicContact CE2-CD1 4.43Å; F372-L477 HydrophobicContact CZ-CD1 3.76Å; F372-K480 HydrophobicContact CD1-CB 3.86Å; F372-K480 HydrophobicContact CD2-CB 4.33Å; F372-K480 HydrophobicContact CD2-CD 3.66Å; F372-K480 HydrophobicContact CE1-CB 3.93Å; F372-K480 HydrophobicContact CE2-CB 4.35Å; F372-K480 HydrophobicContact CE2-CD 3.76Å; F372-K480 HydrophobicContact CG-CB 4.08Å; F372-K480 HydrophobicContact CG-CD 4.16Å; F372-K480 HydrophobicContact CZ-CB 4.19Å; F372-K480 HydrophobicContact CZ-CD 4.37Å; F372-L484 HydrophobicContact CD1-CB 4.13Å; F372-L484 HydrophobicContact CD1-CD2 3.7Å; F372-L484 HydrophobicContact CD1-CG 4.48Å; F372-L484 HydrophobicContact CE1-CD2 4.2Å
373	K	86.2	Confident	81.2	Confident	123 Å²	123	37.2 Å²	37.2	54%	0.535	20%	0.204	S	C	.	.			trans	-76.7	108.1	178.4	-175.9	176.5	171.8	-169.8	0	110.2	L370 H371 Q375 S376 I377	L370-K373 WeakPolarHBondContact O-CB 3.39Å; L370-K373 PolarHBondContact O-N 3.43Å; H371-K373 PolarHBondContact O-N 3.44Å; K373-Q375 VanDerWaalsContact C-N 3.32Å; K373-Q375 PolarHBondContact O-N 3.4Å; K373-S376 WeakPolarHBondContact CD-OG 3.34Å; K373-S376 PolarHBondContact O-N 2.84Å; K373-S376 VanDerWaalsContact O-N 3.14Å; K373-I377 PolarHBondContact O-N 3.3Å
374	A	91.2	Very high	80.5	Confident	2 Å²	2	37.5 Å²	37.5	2%	0.017	21%	0.207	C	C	.	.	H	α-helix	trans	-56.1	-42	-175.8	0	0	0	0	0	113.6	F372 S376 I377 F378 L484 E487 L488	F372-A374 PolarHBondContact O-N 3.39Å; A374-S376 PolarHBondContact O-N 2.93Å; A374-I377 PolarHBondContact O-N 3.03Å; A374-F378 VanDerWaalsContact O-CB 3.23Å; A374-F378 WeakPolarHBondContact O-CB 3.36Å; A374-F378 PolarHBondContact O-N 2.88Å; A374-L484 HydrophobicContact CB-CD1 3.91Å; A374-E487 HydrophobicContact CB-CB 3.32Å; A374-E487 HydrophobicContact CB-CG 4.41Å; A374-E487 WeakPolarHBondContact CB-OE2 3.36Å; A374-L488 HydrophobicContact CB-CD2 4.19Å; A374-L488 HydrophobicContact CB-CG 4.13Å; A374-L488 VanDerWaalsContact O-CD2 3.3Å; A374-L488 WeakPolarHBondContact O-CD2 3.37Å
375	Q	88.1	Confident	79.5	Confident	86 Å²	86	38.7 Å²	38.7	40%	0.402	21%	0.213	S	C	.	.	H	α-helix	trans	-62.4	-43.4	179.2	-173.4	61	40.1	0	0	112.2	K373 F378 D379	K373-Q375 VanDerWaalsContact C-N 3.32Å; K373-Q375 PolarHBondContact O-N 3.4Å; Q375-F378 WeakPolarHBondContact O-CB 3.48Å; Q375-F378 PolarHBondContact O-N 3.48Å; Q375-D379 PolarHBondContact NE2-OD1 2.92Å; Q375-D379 WeakPolarHBondContact O-CB 3.44Å; Q375-D379 PolarHBondContact O-N 3.26Å
376	S	83.1	Confident	78.9	Confident	34 Å²	34	37.3 Å²	37.3	24%	0.238	21%	0.207	C	C	.	.	H	α-helix	trans	-68.4	-38.8	179.7	-67.1	0	0	0	0	111.8	K373 A374 D379 V380	K373-S376 WeakPolarHBondContact CD-OG 3.34Å; K373-S376 PolarHBondContact O-N 2.84Å; K373-S376 VanDerWaalsContact O-N 3.14Å; A374-S376 PolarHBondContact O-N 2.93Å; S376-D379 PolarHBondContact O-N 3.25Å; S376-V380 WeakPolarHBondContact O-CG2 3.3Å; S376-V380 PolarHBondContact O-N 3.37Å; S376-V380 VanDerWaalsContact O-N 3.11Å
377	I	85.3	Confident	78.6	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-45.9	172.9	-67.9	159.7	0	0	0	109.8	F367 L370 K373 A374 D379 V380 L381 L484 L488	F367-I377 HydrophobicContact CB-CD1 4.01Å; F367-I377 HydrophobicContact CD1-CD1 3.7Å; F367-I377 HydrophobicContact CD1-CG1 4.17Å; F367-I377 HydrophobicContact CD1-CG2 4.23Å; F367-I377 HydrophobicContact CE1-CG2 4.13Å; F367-I377 HydrophobicContact CG-CD1 4.09Å; L370-I377 HydrophobicContact CB-CG1 4.01Å; L370-I377 HydrophobicContact CD1-CB 4.45Å; L370-I377 HydrophobicContact CD1-CG1 3.62Å; L370-I377 HydrophobicContact CG-CG1 4.46Å; K373-I377 PolarHBondContact O-N 3.3Å; A374-I377 PolarHBondContact O-N 3.03Å; I377-D379 VanDerWaalsContact C-N 3.34Å; I377-D379 PolarHBondContact O-N 3.24Å; I377-V380 PolarHBondContact O-N 3.36Å; I377-L381 HydrophobicContact CG2-CD1 3.78Å; I377-L381 HydrophobicContact CG2-CG 4.06Å; I377-L381 WeakPolarHBondContact O-CB 3.38Å; I377-L381 WeakPolarHBondContact O-CG 3.5Å; I377-L381 PolarHBondContact O-N 3.47Å; I377-L484 HydrophobicContact CD1-CD1 3.46Å; I377-L484 VanDerWaalsContact CD1-CD1 3.46Å; I377-L484 HydrophobicContact CD1-CD2 3.82Å; I377-L484 HydrophobicContact CD1-CG 4.3Å; I377-L488 HydrophobicContact CB-CD2 4.24Å; I377-L488 HydrophobicContact CG2-CD1 4.15Å; I377-L488 HydrophobicContact CG2-CD2 4.02Å
378	F	86.7	Confident	78.3	Confident	16 Å²	16	37.5 Å²	37.5	7%	0.07	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-45.5	176.3	176.4	-103.6	0	0	0	111.8	A374 Q375 V380 L381 I382 L488 C491 F492	A374-F378 VanDerWaalsContact O-CB 3.23Å; A374-F378 WeakPolarHBondContact O-CB 3.36Å; A374-F378 PolarHBondContact O-N 2.88Å; Q375-F378 WeakPolarHBondContact O-CB 3.48Å; Q375-F378 PolarHBondContact O-N 3.48Å; F378-V380 VanDerWaalsContact C-N 3.33Å; F378-V380 PolarHBondContact O-N 3.38Å; F378-L381 PolarHBondContact O-N 2.81Å; F378-L381 VanDerWaalsContact O-N 3.12Å; F378-I382 HydrophobicContact CD1-CD1 3.89Å; F378-I382 HydrophobicContact CD1-CG2 4.37Å; F378-I382 HydrophobicContact CD2-CG2 3.91Å; F378-I382 HydrophobicContact CE1-CD1 3.54Å; F378-I382 HydrophobicContact CE1-CG2 4.04Å; F378-I382 HydrophobicContact CE2-CG2 3.51Å; F378-I382 HydrophobicContact CG-CG2 4.33Å; F378-I382 HydrophobicContact CZ-CD1 4.08Å; F378-I382 HydrophobicContact CZ-CG2 3.6Å; F378-I382 WeakPolarHBondContact O-CG1 3.48Å; F378-I382 WeakPolarHBondContact O-CG2 3.42Å; F378-I382 PolarHBondContact O-N 3.08Å; F378-L488 HydrophobicContact CB-CD2 3.99Å; F378-C491 HydrophobicContact CB-CB 3.91Å; F378-C491 HydrophobicContact CD1-CB 4.01Å; F378-C491 HydrophobicContact CD2-CB 3.59Å; F378-C491 HydrophobicContact CE1-CB 4.39Å; F378-C491 HydrophobicContact CE2-CB 4.04Å; F378-C491 HydrophobicContact CG-CB 3.57Å; F378-C491 HydrophobicContact CZ-CB 4.41Å; F378-C491 WeakPolarHBondContact CZ-O 3.48Å; F378-F492 AromaticContact CD2-CD1 3.94Å; F378-F492 HydrophobicContact CD2-CD1 3.94Å; F378-F492 AromaticContact CD2-CE1 3.85Å; F378-F492 HydrophobicContact CD2-CE1 3.85Å; F378-F492 HydrophobicContact CD2-CE2 4.48Å; F378-F492 HydrophobicContact CD2-CG 4.3Å; F378-F492 HydrophobicContact CD2-CZ 4.13Å; F378-F492 AromaticContact CE2-CD1 3.55Å; F378-F492 HydrophobicContact CE2-CD1 3.55Å; F378-F492 AromaticContact CE2-CE1 3.8Å; F378-F492 HydrophobicContact CE2-CE1 3.8Å; F378-F492 HydrophobicContact CE2-CG 4.1Å
379	D	82.3	Confident	78.1	Confident	75 Å²	75	39 Å²	39	40%	0.401	22%	0.217	S	C	.	.	H	α-helix	trans	-60.3	-41.1	177.9	-65.1	-23	0	0	0	111.7	Q375 S376 I377 I382 G383	Q375-D379 PolarHBondContact NE2-OD1 2.92Å; Q375-D379 WeakPolarHBondContact O-CB 3.44Å; Q375-D379 PolarHBondContact O-N 3.26Å; S376-D379 PolarHBondContact O-N 3.25Å; I377-D379 VanDerWaalsContact C-N 3.34Å; I377-D379 PolarHBondContact O-N 3.24Å; D379-I382 WeakPolarHBondContact O-CG1 3.47Å; D379-G383 WeakPolarHBondContact O-CA 3.39Å; D379-G383 PolarHBondContact O-N 2.98Å
380	V	77.4	Confident	78.4	Confident	29 Å²	29	36.7 Å²	36.7	18%	0.176	20%	0.2	C	C	.	.	H	α-helix	trans	-67.5	-40.1	173.5	174.2	0	0	0	0	111.7	F366 L370 S376 I377 F378 G383 G384 S387	F366-V380 HydrophobicContact CE2-CG1 4.47Å; F366-V380 HydrophobicContact CZ-CB 4.47Å; F366-V380 HydrophobicContact CZ-CG1 3.92Å; L370-V380 HydrophobicContact CD1-CG2 4.22Å; S376-V380 WeakPolarHBondContact O-CG2 3.3Å; S376-V380 PolarHBondContact O-N 3.37Å; S376-V380 VanDerWaalsContact O-N 3.11Å; I377-V380 PolarHBondContact O-N 3.36Å; F378-V380 VanDerWaalsContact C-N 3.33Å; F378-V380 PolarHBondContact O-N 3.38Å; V380-G383 PolarHBondContact O-N 3.5Å; V380-G384 PolarHBondContact O-N 3.42Å; V380-G384 VanDerWaalsContact O-N 3.16Å; V380-S387 VanDerWaalsContact O-CB 3.27Å; V380-S387 WeakPolarHBondContact O-CB 3.41Å; V380-S387 PolarHBondContact O-OG 3.02Å
381	L	81.4	Confident	78.8	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-66.2	-43.5	179.9	-70.7	179.5	0	0	0	112	I377 F378 S387 L388 F391 F492	I377-L381 HydrophobicContact CG2-CD1 3.78Å; I377-L381 HydrophobicContact CG2-CG 4.06Å; I377-L381 WeakPolarHBondContact O-CB 3.38Å; I377-L381 WeakPolarHBondContact O-CG 3.5Å; I377-L381 PolarHBondContact O-N 3.47Å; F378-L381 PolarHBondContact O-N 2.81Å; F378-L381 VanDerWaalsContact O-N 3.12Å; L381-S387 VanDerWaalsContact CD2-O 3.31Å; L381-S387 WeakPolarHBondContact CD2-O 3.45Å; L381-L388 WeakPolarHBondContact O-CB 3.32Å; L381-L388 PolarHBondContact O-N 2.95Å; L381-F391 HydrophobicContact CD1-CB 4.28Å; L381-F391 HydrophobicContact CD1-CD1 3.63Å; L381-F391 HydrophobicContact CD1-CD2 4.15Å; L381-F391 HydrophobicContact CD1-CE1 3.88Å; L381-F391 HydrophobicContact CD1-CE2 4.4Å; L381-F391 HydrophobicContact CD1-CG 3.76Å; L381-F391 HydrophobicContact CD1-CZ 4.27Å; L381-F391 HydrophobicContact CD2-CB 3.58Å; L381-F391 HydrophobicContact CD2-CD1 4.47Å; L381-F391 HydrophobicContact CD2-CD2 4.4Å; L381-F391 HydrophobicContact CD2-CG 3.93Å; L381-F492 HydrophobicContact CD1-CE2 4.43Å; L381-F492 HydrophobicContact CD1-CZ 3.91Å
382	I	76.3	Confident	78.9	Confident	54 Å²	54	29.6 Å²	29.6	28%	0.277	17%	0.168	S	C	.	.	H	α-helix	trans	-79.9	-26.3	177.2	70.5	-176.3	0	0	0	112.5	F378 D379 G384 I498	F378-I382 HydrophobicContact CD1-CD1 3.89Å; F378-I382 HydrophobicContact CD1-CG2 4.37Å; F378-I382 HydrophobicContact CD2-CG2 3.91Å; F378-I382 HydrophobicContact CE1-CD1 3.54Å; F378-I382 HydrophobicContact CE1-CG2 4.04Å; F378-I382 HydrophobicContact CE2-CG2 3.51Å; F378-I382 HydrophobicContact CG-CG2 4.33Å; F378-I382 HydrophobicContact CZ-CD1 4.08Å; F378-I382 HydrophobicContact CZ-CG2 3.6Å; F378-I382 WeakPolarHBondContact O-CG1 3.48Å; F378-I382 WeakPolarHBondContact O-CG2 3.42Å; F378-I382 PolarHBondContact O-N 3.08Å; D379-I382 WeakPolarHBondContact O-CG1 3.47Å; I382-G384 VanDerWaalsContact C-N 3.33Å; I382-I498 HydrophobicContact CB-CD1 4.44Å
383	G	68.5	Low	78.7	Confident	63 Å²	63	30.6 Å²	30.6	65%	0.649	17%	0.173	S	C	*	.	H	α-helix	trans	-73.5	-25	179.7	0	0	0	0	0	113	D379 V380	D379-G383 WeakPolarHBondContact O-CA 3.39Å; D379-G383 PolarHBondContact O-N 2.98Å; V380-G383 PolarHBondContact O-N 3.5Å
384	G	66.4	Low	78.7	Confident	6 Å²	6	24.8 Å²	24.8	6%	0.062	15%	0.147	C	C	.	.			trans	-125.1	120.6	177.1	0	0	0	0	0	112.7	V380 I382 Y386 S387 L388	V380-G384 PolarHBondContact O-N 3.42Å; V380-G384 VanDerWaalsContact O-N 3.16Å; I382-G384 VanDerWaalsContact C-N 3.33Å; G384-Y386 PolarHBondContact O-N 3.15Å; G384-S387 WeakPolarHBondContact CA-OG 3.12Å; G384-S387 WeakPolarHBondContact O-CA 3.35Å; G384-S387 WeakPolarHBondContact O-CB 3.41Å; G384-S387 PolarHBondContact O-N 3.18Å; G384-S387 PolarHBondContact O-OG 3.26Å; G384-L388 PolarHBondContact O-N 2.93Å; G384-L388 VanDerWaalsContact O-N 3.16Å
385	D	62.4	Low	78.6	Confident	25 Å²	25	24.7 Å²	24.7	13%	0.134	15%	0.147	C	C	.	.	H	α-helix	trans	-58.6	-35.6	178.3	-62.2	-25.5	0	0	0	112.4	Q237 H241 L389	Q237-D385 HydrophobicContact CG-CB 4.41Å; Q237-D385 WeakPolarHBondContact CG-OD2 3.27Å; Q237-D385 PolarHBondContact NE2-OD2 3.05Å; H241-D385 IonicContact CD2-OD1 2.79Å; H241-D385 IonicContact CD2-OD2 3.18Å; H241-D385 PolarHBondContact CD2-OD2 2.92Å; H241-D385 IonicContact CE1-OD1 3.38Å; H241-D385 PolarHBondContact CE1-OD1 3.03Å; H241-D385 VanDerWaalsContact CE1-OD1 3.31Å; H241-D385 IonicContact NE2-OD1 2.94Å; H241-D385 PolarHBondContact NE2-OD1 3.43Å; H241-D385 IonicContact NE2-OD2 2.98Å; H241-D385 PolarHBondContact NE2-OD2 3.4Å; D385-L389 WeakPolarHBondContact O-CB 3.4Å; D385-L389 PolarHBondContact O-N 3.38Å; D385-L389 VanDerWaalsContact O-N 3.14Å
386	Y	64.2	Low	78.5	Confident	4 Å²	4	25.3 Å²	25.3	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-61.6	-44.3	171.6	-66.5	-72.8	0	0	0	112.5	S233 I236 Q297 E335 M339 G384 L388 L389 A390	S233-Y386 WeakPolarHBondContact CA-OH 3.43Å; S233-Y386 WeakPolarHBondContact CB-OH 3.33Å; S233-Y386 PolarHBondContact OG-OH 2.89Å; I236-Y386 HydrophobicContact CB-CE1 4.09Å; I236-Y386 HydrophobicContact CD1-CE1 3.49Å; I236-Y386 VanDerWaalsContact CD1-CE1 3.49Å; I236-Y386 HydrophobicContact CG1-CE1 4.36Å; I236-Y386 HydrophobicContact CG2-CD1 3.98Å; I236-Y386 HydrophobicContact CG2-CE1 3.65Å; Q297-Y386 HydrophobicContact CG-CE1 4.34Å; Q297-Y386 PolarHBondContact NE2-OH 2.91Å; E335-Y386 HydrophobicContact CB-CD2 3.7Å; E335-Y386 HydrophobicContact CB-CE2 3.87Å; E335-Y386 HydrophobicContact CG-CD2 3.75Å; E335-Y386 HydrophobicContact CG-CE2 3.87Å; M339-Y386 HydrophobicContact CG-CD1 3.92Å; M339-Y386 HydrophobicContact CG-CE1 4.05Å; M339-Y386 HydrophobicContact CG-CG 4.37Å; M339-Y386 HydrophobicContact SD-CD1 3.17Å; M339-Y386 WeakPolarHBondContact SD-CD1 3.48Å; M339-Y386 HydrophobicContact SD-CE1 3.35Å; M339-Y386 WeakPolarHBondContact SD-CE1 3.22Å; M339-Y386 HydrophobicContact SD-CG 4.11Å; G384-Y386 PolarHBondContact O-N 3.15Å; Y386-L388 VanDerWaalsContact C-N 3.32Å; Y386-L388 PolarHBondContact O-N 2.91Å; Y386-L389 PolarHBondContact O-N 3.2Å; Y386-A390 WeakPolarHBondContact O-CB 3.41Å; Y386-A390 PolarHBondContact O-N 3.33Å
387	S	72.7	Confident	78.4	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.014	14%	0.141	C	C	.	.	H	α-helix	trans	-59.1	-48.2	-177.6	-40.6	0	0	0	0	109.5	S338 V380 L381 G384 F391	S338-S387 VanDerWaalsContact CB-N 3.33Å; S338-S387 VanDerWaalsContact OG-CA 3.28Å; S338-S387 WeakPolarHBondContact OG-CA 3.32Å; S338-S387 WeakPolarHBondContact OG-CB 3.49Å; S338-S387 PolarHBondContact OG-N 3.17Å; S338-S387 PolarHBondContact OG-OG 3.48Å; V380-S387 VanDerWaalsContact O-CB 3.27Å; V380-S387 WeakPolarHBondContact O-CB 3.41Å; V380-S387 PolarHBondContact O-OG 3.02Å; L381-S387 VanDerWaalsContact CD2-O 3.31Å; L381-S387 WeakPolarHBondContact CD2-O 3.45Å; G384-S387 WeakPolarHBondContact CA-OG 3.12Å; G384-S387 WeakPolarHBondContact O-CA 3.35Å; G384-S387 WeakPolarHBondContact O-CB 3.41Å; G384-S387 PolarHBondContact O-N 3.18Å; G384-S387 PolarHBondContact O-OG 3.26Å; S387-F391 VanDerWaalsContact O-CB 3.29Å; S387-F391 WeakPolarHBondContact O-CB 3.39Å; S387-F391 PolarHBondContact O-N 3.14Å
388	L	77.5	Confident	78.5	Confident	17 Å²	17	24.2 Å²	24.2	9%	0.089	14%	0.141	C	C	.	.	H	α-helix	trans	-64.6	-46.5	179.9	-173.1	58.6	0	0	0	112.1	L381 G384 Y386 F391 V392 F492 I498 P500	L381-L388 WeakPolarHBondContact O-CB 3.32Å; L381-L388 PolarHBondContact O-N 2.95Å; G384-L388 PolarHBondContact O-N 2.93Å; G384-L388 VanDerWaalsContact O-N 3.16Å; Y386-L388 VanDerWaalsContact C-N 3.32Å; Y386-L388 PolarHBondContact O-N 2.91Å; L388-F391 PolarHBondContact O-N 3.38Å; L388-V392 WeakPolarHBondContact O-CG2 3.34Å; L388-V392 PolarHBondContact O-N 3.36Å; L388-F492 HydrophobicContact CD1-CE1 3.84Å; L388-F492 HydrophobicContact CD1-CZ 4.08Å; L388-I498 HydrophobicContact CD2-CG2 4.01Å; L388-P500 HydrophobicContact CD1-CB 4.4Å; L388-P500 HydrophobicContact CD1-CG 4.04Å; L388-P500 HydrophobicContact CD2-CB 4.31Å; L388-P500 HydrophobicContact CD2-CG 4.35Å
389	L	74.6	Confident	78.5	Confident	36 Å²	36	23.8 Å²	23.8	19%	0.188	14%	0.14	C	C	.	.	H	α-helix	trans	-62.7	-47.2	179.4	-174.5	66	0	0	0	111.2	V240 T300 F342 D385 Y386 F391 V392 F393	V240-L389 HydrophobicContact CG2-CB 4.43Å; V240-L389 HydrophobicContact CG2-CD1 4.49Å; V240-L389 HydrophobicContact CG2-CD2 4Å; T300-L389 HydrophobicContact CG2-CD2 3.33Å; F342-L389 HydrophobicContact CD2-CD2 4.49Å; F342-L389 HydrophobicContact CD2-CG 4.39Å; F342-L389 HydrophobicContact CE2-CD2 4.04Å; F342-L389 HydrophobicContact CE2-CG 4.11Å; D385-L389 WeakPolarHBondContact O-CB 3.4Å; D385-L389 PolarHBondContact O-N 3.38Å; D385-L389 VanDerWaalsContact O-N 3.14Å; Y386-L389 PolarHBondContact O-N 3.2Å; L389-F391 PolarHBondContact O-N 2.95Å; L389-V392 PolarHBondContact O-N 2.89Å; L389-F393 HydrophobicContact CD1-CD2 4.04Å; L389-F393 HydrophobicContact CD1-CE2 3.65Å; L389-F393 HydrophobicContact CD2-CE2 4.49Å; L389-F393 HydrophobicContact CG-CD2 3.98Å; L389-F393 HydrophobicContact CG-CE2 3.91Å; L389-F393 VanDerWaalsContact O-CD2 3.29Å; L389-F393 WeakPolarHBondContact O-CD2 3.16Å; L389-F393 PolarHBondContact O-N 3.1Å
390	A	77.8	Confident	78.6	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-53.6	-45.2	174.6	0	0	0	0	0	111	S338 L341 F342 W363 Y386 F393 F394	S338-A390 WeakPolarHBondContact O-CB 3.37Å; L341-A390 HydrophobicContact CB-CB 4.36Å; F342-A390 HydrophobicContact CB-CB 3.71Å; F342-A390 HydrophobicContact CD2-CB 4.38Å; W363-A390 HydrophobicContact CH2-CB 3.9Å; W363-A390 HydrophobicContact CZ2-CB 3.7Å; W363-A390 WeakPolarHBondContact CZ2-O 3.27Å; Y386-A390 WeakPolarHBondContact O-CB 3.41Å; Y386-A390 PolarHBondContact O-N 3.33Å; A390-F393 PolarHBondContact O-N 2.81Å; A390-F394 WeakPolarHBondContact O-CB 3.19Å; A390-F394 PolarHBondContact O-N 3.38Å
391	F	85.8	Confident	78.9	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.5	-42.1	179.8	-174.8	-114.7	0	0	0	112.6	W363 F367 L381 S387 L388 L389 F393 F394 L395 L488 F492 I507	W363-F391 HydrophobicContact CE3-CD2 4.31Å; W363-F391 VanDerWaalsContact CH2-CA 3.45Å; W363-F391 HydrophobicContact CH2-CB 3.73Å; W363-F391 HydrophobicContact CH2-CD2 4.09Å; W363-F391 HydrophobicContact CH2-CG 4.43Å; W363-F391 HydrophobicContact CZ3-CB 4.19Å; W363-F391 AromaticContact CZ3-CD2 3.77Å; W363-F391 HydrophobicContact CZ3-CD2 3.77Å; W363-F391 HydrophobicContact CZ3-CG 4.47Å; F367-F391 HydrophobicContact CE1-CE2 4.42Å; F367-F391 HydrophobicContact CZ-CD2 4.32Å; F367-F391 AromaticContact CZ-CE2 3.9Å; F367-F391 HydrophobicContact CZ-CE2 3.9Å; L381-F391 HydrophobicContact CD1-CB 4.28Å; L381-F391 HydrophobicContact CD1-CD1 3.63Å; L381-F391 HydrophobicContact CD1-CD2 4.15Å; L381-F391 HydrophobicContact CD1-CE1 3.88Å; L381-F391 HydrophobicContact CD1-CE2 4.4Å; L381-F391 HydrophobicContact CD1-CG 3.76Å; L381-F391 HydrophobicContact CD1-CZ 4.27Å; L381-F391 HydrophobicContact CD2-CB 3.58Å; L381-F391 HydrophobicContact CD2-CD1 4.47Å; L381-F391 HydrophobicContact CD2-CD2 4.4Å; L381-F391 HydrophobicContact CD2-CG 3.93Å; S387-F391 VanDerWaalsContact O-CB 3.29Å; S387-F391 WeakPolarHBondContact O-CB 3.39Å; S387-F391 PolarHBondContact O-N 3.14Å; L388-F391 PolarHBondContact O-N 3.38Å; L389-F391 PolarHBondContact O-N 2.95Å; F391-F393 VanDerWaalsContact C-N 3.32Å; F391-F393 PolarHBondContact O-N 3.4Å; F391-F394 AromaticContact CD2-CD1 3.97Å; F391-F394 HydrophobicContact CD2-CD1 3.97Å; F391-F394 HydrophobicContact CE2-CD1 4.08Å; F391-F394 HydrophobicContact CE2-CE1 4.35Å; F391-F394 WeakPolarHBondContact O-CB 3.5Å; F391-F394 PolarHBondContact O-N 3.12Å; F391-L395 HydrophobicContact CD1-CD1 3.85Å; F391-L395 HydrophobicContact CD1-CG 4.33Å; F391-L395 HydrophobicContact CD2-CG 4.45Å; F391-L395 HydrophobicContact CE1-CD1 3.47Å; F391-L395 VanDerWaalsContact CE1-CD1 3.47Å; F391-L395 HydrophobicContact CE1-CD2 4.33Å; F391-L395 HydrophobicContact CE1-CG 4.05Å; F391-L395 HydrophobicContact CE2-CD1 4.47Å; F391-L395 HydrophobicContact CE2-CD2 4.01Å; F391-L395 HydrophobicContact CE2-CG 4.16Å; F391-L395 HydrophobicContact CZ-CD1 3.82Å; F391-L395 HydrophobicContact CZ-CD2 3.79Å; F391-L395 HydrophobicContact CZ-CG 3.96Å; F391-L395 VanDerWaalsContact O-CG 3.3Å; F391-L395 WeakPolarHBondContact O-CG 3.49Å; F391-L395 PolarHBondContact O-N 3.46Å; F391-L488 HydrophobicContact CE2-CD1 4.39Å; F391-L488 HydrophobicContact CZ-CD1 3.79Å; F391-F492 HydrophobicContact CD1-CE2 4.42Å; F391-F492 HydrophobicContact CD1-CZ 4.29Å; F391-F492 AromaticContact CE1-CE2 3.83Å; F391-F492 HydrophobicContact CE1-CE2 3.83Å; F391-F492 HydrophobicContact CE1-CZ 4.14Å; F391-I507 HydrophobicContact CE1-CD1 4.37Å
392	V	84.3	Confident	79.1	Confident	31 Å²	31	27.4 Å²	27.4	19%	0.188	15%	0.152	C	C	.	.	H	α-helix	trans	-58.3	-45.5	173.4	171.3	0	0	0	0	111.1	L388 L389 L395 K396 C503 L506	L388-V392 WeakPolarHBondContact O-CG2 3.34Å; L388-V392 PolarHBondContact O-N 3.36Å; L389-V392 PolarHBondContact O-N 2.89Å; V392-L395 PolarHBondContact O-N 3.3Å; V392-K396 WeakPolarHBondContact O-CB 3.11Å; V392-K396 PolarHBondContact O-N 2.91Å; V392-C503 WeakPolarHBondContact CG2-SG 3.31Å; V392-L506 HydrophobicContact CG1-CD1 4.02Å
393	F	80.4	Confident	79.5	Confident	39 Å²	39	31.8 Å²	31.8	17%	0.171	17%	0.171	C	C	.	.	H	α-helix	trans	-63.8	-42.2	176.7	-85.7	-74.1	0	0	0	112	L303 F342 A345 R346 L389 A390 F391 K396 A397	L303-F393 HydrophobicContact CD1-CZ 4.04Å; F342-F393 AromaticContact CD2-CD2 3.97Å; F342-F393 HydrophobicContact CD2-CD2 3.97Å; F342-F393 AromaticContact CE2-CD2 3.36Å; F342-F393 HydrophobicContact CE2-CD2 3.36Å; F342-F393 AromaticContact CE2-CE2 3.65Å; F342-F393 HydrophobicContact CE2-CE2 3.65Å; F342-F393 HydrophobicContact CE2-CG 4.09Å; F342-F393 HydrophobicContact CZ-CD2 4.27Å; F342-F393 HydrophobicContact CZ-CE2 4.31Å; A345-F393 HydrophobicContact CB-CB 3.91Å; R346-F393 VanDerWaalsContact CZ-CE1 3.49Å; R346-F393 VanDerWaalsContact NE-CD1 3.32Å; L389-F393 HydrophobicContact CD1-CD2 4.04Å; L389-F393 HydrophobicContact CD1-CE2 3.65Å; L389-F393 HydrophobicContact CD2-CE2 4.49Å; L389-F393 HydrophobicContact CG-CD2 3.98Å; L389-F393 HydrophobicContact CG-CE2 3.91Å; L389-F393 VanDerWaalsContact O-CD2 3.29Å; L389-F393 WeakPolarHBondContact O-CD2 3.16Å; L389-F393 PolarHBondContact O-N 3.1Å; A390-F393 PolarHBondContact O-N 2.81Å; F391-F393 VanDerWaalsContact C-N 3.32Å; F391-F393 PolarHBondContact O-N 3.4Å; F393-K396 PolarHBondContact O-N 3.41Å; F393-A397 VanDerWaalsContact O-CB 3.31Å; F393-A397 WeakPolarHBondContact O-CB 3.44Å; F393-A397 PolarHBondContact O-N 3.23Å
394	F	86.6	Confident	80	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.8	-51	176.8	163.1	-109.3	0	0	0	111.1	A345 V360 W363 F367 A390 F391 K396 A397 L398	A345-F394 HydrophobicContact CB-CB 3.83Å; V360-F394 HydrophobicContact CG1-CE2 4.21Å; V360-F394 HydrophobicContact CG2-CE2 4.31Å; W363-F394 HydrophobicContact CB-CD2 4Å; W363-F394 HydrophobicContact CB-CE1 4.38Å; W363-F394 HydrophobicContact CB-CE2 3.67Å; W363-F394 HydrophobicContact CB-CG 4.48Å; W363-F394 HydrophobicContact CB-CZ 3.87Å; W363-F394 AromaticContact CD1-CD2 3.28Å; W363-F394 AromaticContact CD1-CE2 3.82Å; W363-F394 AromaticContact CD1-CG 3.74Å; W363-F394 HydrophobicContact CD2-CB 4.05Å; W363-F394 HydrophobicContact CD2-CD1 4.01Å; W363-F394 HydrophobicContact CD2-CD2 4.01Å; W363-F394 HydrophobicContact CD2-CE1 4.49Å; W363-F394 HydrophobicContact CD2-CE2 4.49Å; W363-F394 AromaticContact CD2-CG 3.74Å; W363-F394 HydrophobicContact CD2-CG 3.74Å; W363-F394 VanDerWaalsContact CE2-CB 3.45Å; W363-F394 AromaticContact CE2-CG 3.68Å; W363-F394 HydrophobicContact CE3-CD1 4.34Å; W363-F394 HydrophobicContact CE3-CG 4.48Å; W363-F394 HydrophobicContact CG-CB 4.36Å; W363-F394 HydrophobicContact CG-CD1 4.19Å; W363-F394 AromaticContact CG-CD2 3.47Å; W363-F394 HydrophobicContact CG-CD2 3.47Å; W363-F394 VanDerWaalsContact CG-CD2 3.47Å; W363-F394 HydrophobicContact CG-CE1 4.38Å; W363-F394 AromaticContact CG-CE2 3.69Å; W363-F394 HydrophobicContact CG-CE2 3.69Å; W363-F394 AromaticContact CG-CG 3.73Å; W363-F394 HydrophobicContact CG-CG 3.73Å; W363-F394 HydrophobicContact CG-CZ 4.14Å; W363-F394 HydrophobicContact CZ2-CB 3.7Å; W363-F394 HydrophobicContact CZ2-CG 4.3Å; W363-F394 AromaticContact NE1-CD2 3.68Å; W363-F394 AromaticContact NE1-CG 3.72Å; F367-F394 HydrophobicContact CE2-CE1 4.15Å; F367-F394 HydrophobicContact CE2-CZ 4.43Å; F367-F394 HydrophobicContact CZ-CE1 4.11Å; A390-F394 WeakPolarHBondContact O-CB 3.19Å; A390-F394 PolarHBondContact O-N 3.38Å; F391-F394 AromaticContact CD2-CD1 3.97Å; F391-F394 HydrophobicContact CD2-CD1 3.97Å; F391-F394 HydrophobicContact CE2-CD1 4.08Å; F391-F394 HydrophobicContact CE2-CE1 4.35Å; F391-F394 WeakPolarHBondContact O-CB 3.5Å; F391-F394 PolarHBondContact O-N 3.12Å; F394-K396 VanDerWaalsContact C-N 3.3Å; F394-K396 PolarHBondContact O-N 3.08Å; F394-A397 PolarHBondContact O-N 3.4Å; F394-L398 HydrophobicContact CE1-CD2 4.27Å; F394-L398 HydrophobicContact CE2-CB 4.4Å; F394-L398 HydrophobicContact CE2-CD2 4.2Å; F394-L398 HydrophobicContact CZ-CD2 3.74Å; F394-L398 VanDerWaalsContact O-CB 3.25Å; F394-L398 WeakPolarHBondContact O-CB 3.01Å; F394-L398 PolarHBondContact O-N 3.38Å
395	L	89.7	Confident	80.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.2	-43.2	179	-65.6	173.1	0	0	0	111	F391 V392 T399 L485 L506 I507 L510	F391-L395 HydrophobicContact CD1-CD1 3.85Å; F391-L395 HydrophobicContact CD1-CG 4.33Å; F391-L395 HydrophobicContact CD2-CG 4.45Å; F391-L395 HydrophobicContact CE1-CD1 3.47Å; F391-L395 VanDerWaalsContact CE1-CD1 3.47Å; F391-L395 HydrophobicContact CE1-CD2 4.33Å; F391-L395 HydrophobicContact CE1-CG 4.05Å; F391-L395 HydrophobicContact CE2-CD1 4.47Å; F391-L395 HydrophobicContact CE2-CD2 4.01Å; F391-L395 HydrophobicContact CE2-CG 4.16Å; F391-L395 HydrophobicContact CZ-CD1 3.82Å; F391-L395 HydrophobicContact CZ-CD2 3.79Å; F391-L395 HydrophobicContact CZ-CG 3.96Å; F391-L395 VanDerWaalsContact O-CG 3.3Å; F391-L395 WeakPolarHBondContact O-CG 3.49Å; F391-L395 PolarHBondContact O-N 3.46Å; V392-L395 PolarHBondContact O-N 3.3Å; L395-T399 VanDerWaalsContact O-CB 3.24Å; L395-T399 WeakPolarHBondContact O-CB 3.24Å; L395-T399 PolarHBondContact O-N 3.23Å; L395-T399 PolarHBondContact O-OG1 2.69Å; L395-L485 HydrophobicContact CD2-CD2 3.87Å; L395-L506 HydrophobicContact CB-CB 3.81Å; L395-L506 HydrophobicContact CB-CD1 4.05Å; L395-L506 HydrophobicContact CB-CG 4.48Å; L395-L506 HydrophobicContact CD1-CB 4.04Å; L395-I507 HydrophobicContact CD1-CD1 4.47Å; L395-I507 HydrophobicContact CD1-CG1 3.81Å; L395-I507 HydrophobicContact CD2-CG1 4.27Å; L395-L510 HydrophobicContact CB-CD1 3.98Å; L395-L510 HydrophobicContact CD2-CD1 3.39Å; L395-L510 HydrophobicContact CG-CD1 4.28Å
396	K	85.1	Confident	81.6	Confident	99 Å²	99	32.5 Å²	32.5	43%	0.43	16%	0.157	S	C	.	.	H	α-helix	trans	-62.6	-46.8	177.7	-175.5	-179.2	177.4	-175.4	0	111.9	V392 F393 F394 T399 Q400 L506	V392-K396 WeakPolarHBondContact O-CB 3.11Å; V392-K396 PolarHBondContact O-N 2.91Å; F393-K396 PolarHBondContact O-N 3.41Å; F394-K396 VanDerWaalsContact C-N 3.3Å; F394-K396 PolarHBondContact O-N 3.08Å; K396-T399 WeakPolarHBondContact O-CB 3.42Å; K396-T399 PolarHBondContact O-N 3.49Å; K396-Q400 WeakPolarHBondContact O-CB 3.38Å; K396-Q400 VanDerWaalsContact O-CG 3.3Å; K396-Q400 WeakPolarHBondContact O-CG 3.26Å; K396-Q400 PolarHBondContact O-N 2.89Å; K396-L506 HydrophobicContact CB-CD1 4.18Å; K396-L506 HydrophobicContact CB-CD2 4.28Å
397	A	81.6	Confident	82.3	Confident	12 Å²	12	37 Å²	37	10%	0.099	18%	0.182	C	C	.	.	H	α-helix	trans	-64.4	-48.9	179.3	0	0	0	0	0	111	A345 F348 F393 F394 T399 Q400 Q401	A345-A397 VanDerWaalsContact O-CB 3.29Å; A345-A397 WeakPolarHBondContact O-CB 3.46Å; F348-A397 HydrophobicContact CB-CB 3.8Å; F348-A397 HydrophobicContact CD2-CB 3.92Å; F348-A397 HydrophobicContact CG-CB 4.02Å; F393-A397 VanDerWaalsContact O-CB 3.31Å; F393-A397 WeakPolarHBondContact O-CB 3.44Å; F393-A397 PolarHBondContact O-N 3.23Å; F394-A397 PolarHBondContact O-N 3.4Å; A397-T399 VanDerWaalsContact C-N 3.26Å; A397-T399 PolarHBondContact O-N 3.35Å; A397-Q400 PolarHBondContact O-N 3.47Å; A397-Q400 VanDerWaalsContact O-N 3.1Å; A397-Q401 WeakPolarHBondContact O-CB 3.5Å; A397-Q401 VanDerWaalsContact O-CG 3.3Å; A397-Q401 WeakPolarHBondContact O-CG 3.02Å; A397-Q401 PolarHBondContact O-N 3.3Å
398	L	87.4	Confident	82.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-41.2	176.3	-176.1	64.3	0	0	0	111.4	F348 V360 F394 Q401 W402 F405 L481 L510	F348-L398 HydrophobicContact CE2-CB 4.16Å; F348-L398 HydrophobicContact CE2-CD1 3.91Å; F348-L398 HydrophobicContact CZ-CD1 4.04Å; V360-L398 HydrophobicContact CG1-CD1 4.41Å; V360-L398 HydrophobicContact CG2-CD1 3.99Å; F394-L398 HydrophobicContact CE1-CD2 4.27Å; F394-L398 HydrophobicContact CE2-CB 4.4Å; F394-L398 HydrophobicContact CE2-CD2 4.2Å; F394-L398 HydrophobicContact CZ-CD2 3.74Å; F394-L398 VanDerWaalsContact O-CB 3.25Å; F394-L398 WeakPolarHBondContact O-CB 3.01Å; F394-L398 PolarHBondContact O-N 3.38Å; L398-Q401 PolarHBondContact O-N 3.05Å; L398-W402 HydrophobicContact CD1-CE3 4.15Å; L398-W402 HydrophobicContact CD1-CZ3 4.29Å; L398-W402 HydrophobicContact CD2-CZ3 4.47Å; L398-W402 HydrophobicContact CG-CE3 4.14Å; L398-W402 HydrophobicContact CG-CZ3 4.32Å; L398-W402 VanDerWaalsContact O-CA 3.23Å; L398-W402 WeakPolarHBondContact O-CA 2.98Å; L398-W402 WeakPolarHBondContact O-CB 3.4Å; L398-W402 PolarHBondContact O-N 3.48Å; L398-F405 HydrophobicContact CD1-CB 4.47Å; L398-F405 HydrophobicContact CD1-CD1 3.82Å; L398-F405 HydrophobicContact CD1-CD2 4.28Å; L398-F405 HydrophobicContact CD1-CE1 4.08Å; L398-F405 HydrophobicContact CD1-CE2 4.48Å; L398-F405 HydrophobicContact CD1-CG 3.93Å; L398-F405 HydrophobicContact CD1-CZ 4.4Å; L398-L481 HydrophobicContact CD2-CD2 4.48Å; L398-L510 HydrophobicContact CB-CD2 4.16Å; L398-L510 HydrophobicContact CD2-CD1 4.04Å; L398-L510 HydrophobicContact CD2-CD2 3.81Å; L398-L510 HydrophobicContact CG-CD2 3.67Å
399	T	87	Confident	82.5	Confident	6 Å²	6	39.1 Å²	39.1	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-44.4	176.4	-61.8	0	0	0	0	111.9	L395 K396 A397 Q401 K509 L510 Q513	L395-T399 VanDerWaalsContact O-CB 3.24Å; L395-T399 WeakPolarHBondContact O-CB 3.24Å; L395-T399 PolarHBondContact O-N 3.23Å; L395-T399 PolarHBondContact O-OG1 2.69Å; K396-T399 WeakPolarHBondContact O-CB 3.42Å; K396-T399 PolarHBondContact O-N 3.49Å; A397-T399 VanDerWaalsContact C-N 3.26Å; A397-T399 PolarHBondContact O-N 3.35Å; T399-Q401 VanDerWaalsContact C-N 3.34Å; T399-K509 HydrophobicContact CG2-CB 4.44Å; T399-K509 HydrophobicContact CG2-CD 3.41Å; T399-K509 VanDerWaalsContact CG2-CD 3.41Å; T399-K509 HydrophobicContact CG2-CG 3.71Å; T399-L510 WeakPolarHBondContact OG1-CG 3.42Å; T399-Q513 PolarHBondContact O-NE2 2.84Å
400	Q	84.5	Confident	82.4	Confident	124 Å²	124	42.8 Å²	42.8	58%	0.579	21%	0.213	S	C	*	.	H	α-helix	trans	-71.5	-31.4	-177.5	-76.1	177.7	-28.5	0	0	112.3	K396 A397	K396-Q400 WeakPolarHBondContact O-CB 3.38Å; K396-Q400 VanDerWaalsContact O-CG 3.3Å; K396-Q400 WeakPolarHBondContact O-CG 3.26Å; K396-Q400 PolarHBondContact O-N 2.89Å; A397-Q400 PolarHBondContact O-N 3.47Å; A397-Q400 VanDerWaalsContact O-N 3.1Å
401	Q	83.3	Confident	82	Confident	49 Å²	49	47 Å²	47	23%	0.229	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	14.6	-172.8	-56.9	-73.3	-53.7	0	0	112	F348 A397 L398 T399 E403 M404 F405	F348-Q401 HydrophobicContact CD1-CB 3.57Å; F348-Q401 HydrophobicContact CD1-CG 3.56Å; F348-Q401 HydrophobicContact CE1-CB 3.15Å; F348-Q401 HydrophobicContact CE1-CG 3.74Å; F348-Q401 HydrophobicContact CG-CG 4.38Å; F348-Q401 HydrophobicContact CZ-CB 3.8Å; A397-Q401 WeakPolarHBondContact O-CB 3.5Å; A397-Q401 VanDerWaalsContact O-CG 3.3Å; A397-Q401 WeakPolarHBondContact O-CG 3.02Å; A397-Q401 PolarHBondContact O-N 3.3Å; L398-Q401 PolarHBondContact O-N 3.05Å; T399-Q401 VanDerWaalsContact C-N 3.34Å; Q401-E403 PolarHBondContact O-N 2.92Å; Q401-M404 HydrophobicContact CB-CE 4.35Å; Q401-M404 VanDerWaalsContact CD-CE 3.44Å; Q401-M404 HydrophobicContact CG-CE 4.5Å; Q401-M404 PolarHBondContact O-N 3.12Å; Q401-F405 WeakPolarHBondContact O-CB 3.26Å; Q401-F405 PolarHBondContact O-N 2.98Å
402	W	85.7	Confident	81.3	Confident	8 Å²	8	47.2 Å²	47.2	3%	0.03	23%	0.23	C	C	.	.	H	α-helix	trans	-53.8	-50.7	-170.8	178.6	-104.5	0	0	0	113	L398 M404 F405 I406 M478 L510 Q513 I514 T517	L398-W402 HydrophobicContact CD1-CE3 4.15Å; L398-W402 HydrophobicContact CD1-CZ3 4.29Å; L398-W402 HydrophobicContact CD2-CZ3 4.47Å; L398-W402 HydrophobicContact CG-CE3 4.14Å; L398-W402 HydrophobicContact CG-CZ3 4.32Å; L398-W402 VanDerWaalsContact O-CA 3.23Å; L398-W402 WeakPolarHBondContact O-CA 2.98Å; L398-W402 WeakPolarHBondContact O-CB 3.4Å; L398-W402 PolarHBondContact O-N 3.48Å; W402-M404 VanDerWaalsContact C-N 3.33Å; W402-M404 PolarHBondContact O-N 3.43Å; W402-F405 HydrophobicContact CE3-CD1 4.09Å; W402-F405 AromaticContact CZ3-CD1 3.95Å; W402-F405 HydrophobicContact CZ3-CD1 3.95Å; W402-F405 HydrophobicContact CZ3-CE1 4.06Å; W402-F405 WeakPolarHBondContact O-CB 3.49Å; W402-F405 PolarHBondContact O-N 3.03Å; W402-I406 HydrophobicContact CD2-CG2 4.02Å; W402-I406 VanDerWaalsContact CE2-CG2 3.5Å; W402-I406 HydrophobicContact CE3-CG2 4.45Å; W402-I406 HydrophobicContact CH2-CG2 4Å; W402-I406 HydrophobicContact CZ2-CG2 3.5Å; W402-I406 VanDerWaalsContact CZ2-CG2 3.5Å; W402-I406 HydrophobicContact CZ3-CG2 4.45Å; W402-I406 WeakPolarHBondContact O-CG1 3.49Å; W402-I406 PolarHBondContact O-N 2.77Å; W402-M478 HydrophobicContact CH2-CE 3.43Å; W402-M478 VanDerWaalsContact CH2-CE 3.43Å; W402-M478 HydrophobicContact CZ2-CE 4.33Å; W402-M478 HydrophobicContact CZ3-CE 4.16Å; W402-L510 HydrophobicContact CE3-CD2 4.01Å; W402-L510 HydrophobicContact CZ3-CD2 4.32Å; W402-Q513 HydrophobicContact CD2-CB 4Å; W402-Q513 HydrophobicContact CG-CB 3.93Å; W402-Q513 HydrophobicContact CG-CG 4.31Å; W402-Q513 PolarHBondContact NE1-O 2.84Å; W402-I514 HydrophobicContact CH2-CB 4.41Å; W402-I514 HydrophobicContact CH2-CD1 4.32Å; W402-I514 HydrophobicContact CH2-CG1 3.34Å; W402-I514 HydrophobicContact CZ2-CB 4.36Å; W402-I514 HydrophobicContact CZ2-CG1 3.73Å; W402-I514 HydrophobicContact CZ3-CG1 4.18Å; W402-T517 PolarHBondContact NE1-OG1 2.83Å
403	E	84	Confident	80.7	Confident	146 Å²	146	48 Å²	48	68%	0.682	24%	0.236	S	C	*	.	H	α-helix	trans	-62.3	-39.7	-177.7	-67.3	-179.6	175.1	0	0	112.1	Q401 I406 N407	Q401-E403 PolarHBondContact O-N 2.92Å; E403-I406 VanDerWaalsContact O-CG1 3.27Å; E403-I406 WeakPolarHBondContact O-CG1 3.29Å; E403-N407 WeakPolarHBondContact O-CB 3.37Å; E403-N407 PolarHBondContact O-N 3.22Å; E403-N407 PolarHBondContact O-ND2 3.46Å
404	M	78.6	Confident	80.4	Confident	85 Å²	85	46.1 Å²	46.1	42%	0.419	23%	0.228	S	C	.	.	H	α-helix	trans	-69	-37.9	176.7	-72.1	178.7	-78.7	0	0	111.7	P350 Q401 W402 N407 S408	P350-M404 HydrophobicContact CB-CB 4.25Å; P350-M404 HydrophobicContact CG-CB 4.02Å; P350-M404 HydrophobicContact CG-CE 4.31Å; P350-M404 HydrophobicContact CG-CG 4.42Å; P350-M404 HydrophobicContact CG-SD 3.63Å; Q401-M404 HydrophobicContact CB-CE 4.35Å; Q401-M404 VanDerWaalsContact CD-CE 3.44Å; Q401-M404 HydrophobicContact CG-CE 4.5Å; Q401-M404 PolarHBondContact O-N 3.12Å; W402-M404 VanDerWaalsContact C-N 3.33Å; W402-M404 PolarHBondContact O-N 3.43Å; M404-N407 PolarHBondContact O-N 3.4Å; M404-S408 PolarHBondContact O-N 3.48Å; M404-S408 PolarHBondContact O-OG 2.98Å
405	F	78.7	Confident	79.7	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-50.8	177.4	170.2	-104.8	0	0	0	112.7	F348 H358 V360 L398 Q401 W402 N407 S408 I412 F474 M478	F348-F405 HydrophobicContact CZ-CB 4.18Å; F348-F405 HydrophobicContact CZ-CD2 4.39Å; H358-F405 AromaticContact CE1-CD2 3.8Å; V360-F405 HydrophobicContact CB-CD2 4.11Å; V360-F405 HydrophobicContact CB-CE2 3.5Å; V360-F405 VanDerWaalsContact CB-CE2 3.5Å; V360-F405 HydrophobicContact CB-CZ 4.27Å; V360-F405 HydrophobicContact CG1-CD2 4.21Å; V360-F405 HydrophobicContact CG1-CE2 3.28Å; V360-F405 HydrophobicContact CG1-CZ 3.53Å; V360-F405 HydrophobicContact CG2-CD2 3.79Å; V360-F405 HydrophobicContact CG2-CE2 3.68Å; L398-F405 HydrophobicContact CD1-CB 4.47Å; L398-F405 HydrophobicContact CD1-CD1 3.82Å; L398-F405 HydrophobicContact CD1-CD2 4.28Å; L398-F405 HydrophobicContact CD1-CE1 4.08Å; L398-F405 HydrophobicContact CD1-CE2 4.48Å; L398-F405 HydrophobicContact CD1-CG 3.93Å; L398-F405 HydrophobicContact CD1-CZ 4.4Å; Q401-F405 WeakPolarHBondContact O-CB 3.26Å; Q401-F405 PolarHBondContact O-N 2.98Å; W402-F405 HydrophobicContact CE3-CD1 4.09Å; W402-F405 AromaticContact CZ3-CD1 3.95Å; W402-F405 HydrophobicContact CZ3-CD1 3.95Å; W402-F405 HydrophobicContact CZ3-CE1 4.06Å; W402-F405 WeakPolarHBondContact O-CB 3.49Å; W402-F405 PolarHBondContact O-N 3.03Å; F405-N407 PolarHBondContact O-N 3.44Å; F405-S408 PolarHBondContact O-N 2.92Å; F405-I412 HydrophobicContact CD2-CD1 3.72Å; F405-I412 HydrophobicContact CD2-CG1 4.43Å; F405-I412 HydrophobicContact CE1-CD1 4.34Å; F405-I412 HydrophobicContact CE2-CD1 3.04Å; F405-I412 HydrophobicContact CE2-CG1 3.75Å; F405-I412 HydrophobicContact CZ-CD1 3.41Å; F405-I412 VanDerWaalsContact CZ-CD1 3.41Å; F405-I412 HydrophobicContact CZ-CG1 4.43Å; F405-F474 HydrophobicContact CE1-CE2 4.34Å; F405-F474 HydrophobicContact CE1-CZ 4.41Å; F405-F474 HydrophobicContact CZ-CE2 4.16Å; F405-M478 HydrophobicContact CE1-CE 4.34Å; F405-M478 HydrophobicContact CE1-SD 3.97Å; F405-M478 HydrophobicContact CZ-SD 4.35Å
406	I	83.8	Confident	78.7	Confident	22 Å²	22	54.2 Å²	54.2	11%	0.113	26%	0.262	C	S	.	.	H	α-helix	trans	-68.4	-17.7	-179.3	62.9	172	0	0	0	113.6	W402 E403 T517	W402-I406 HydrophobicContact CD2-CG2 4.02Å; W402-I406 VanDerWaalsContact CE2-CG2 3.5Å; W402-I406 HydrophobicContact CE3-CG2 4.45Å; W402-I406 HydrophobicContact CH2-CG2 4Å; W402-I406 HydrophobicContact CZ2-CG2 3.5Å; W402-I406 VanDerWaalsContact CZ2-CG2 3.5Å; W402-I406 HydrophobicContact CZ3-CG2 4.45Å; W402-I406 WeakPolarHBondContact O-CG1 3.49Å; W402-I406 PolarHBondContact O-N 2.77Å; E403-I406 VanDerWaalsContact O-CG1 3.27Å; E403-I406 WeakPolarHBondContact O-CG1 3.29Å; I406-T517 HydrophobicContact CB-CG2 4.38Å; I406-T517 HydrophobicContact CD1-CG2 3.57Å; I406-T517 HydrophobicContact CG2-CG2 4.3Å
407	N	80.3	Confident	77.6	Confident	100 Å²	100	52.5 Å²	52.5	54%	0.535	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-7.2	179.5	-73.8	-28.4	0	0	0	113.7	E403 M404 F405 R521	E403-N407 WeakPolarHBondContact O-CB 3.37Å; E403-N407 PolarHBondContact O-N 3.22Å; E403-N407 PolarHBondContact O-ND2 3.46Å; M404-N407 PolarHBondContact O-N 3.4Å; F405-N407 PolarHBondContact O-N 3.44Å; N407-R521 PolarHBondContact OD1-NH2 3.12Å
408	S	77.4	Confident	76.6	Confident	26 Å²	26	54 Å²	54	18%	0.182	27%	0.265	C	S	.	.			trans	-126.2	52.1	177.7	-46	0	0	0	0	112.7	M404 F405 E410 R411	M404-S408 PolarHBondContact O-N 3.48Å; M404-S408 PolarHBondContact O-OG 2.98Å; F405-S408 PolarHBondContact O-N 2.92Å; S408-E410 WeakPolarHBondContact CA-OE1 3.28Å; S408-E410 WeakPolarHBondContact CA-OE2 3.43Å; S408-E410 WeakPolarHBondContact CB-OE1 3.45Å; S408-E410 PolarHBondContact O-N 2.98Å; S408-E410 VanDerWaalsContact O-N 3.17Å; S408-R411 PolarHBondContact O-N 2.67Å
409	P	75.7	Confident	75.2	Confident	36 Å²	36	56.8 Å²	56.8	23%	0.234	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-61.8	-25.8	-173.5	28.1	-36.8	0	0	0	113.6	R411 I412 F474	P409-R411 PolarHBondContact O-N 3.31Å; P409-I412 PolarHBondContact O-N 3.31Å; P409-I412 VanDerWaalsContact O-N 3.14Å; P409-F474 HydrophobicContact CB-CB 4.22Å; P409-F474 HydrophobicContact CB-CD1 3.7Å; P409-F474 HydrophobicContact CB-CD2 3.99Å; P409-F474 HydrophobicContact CB-CE1 4Å; P409-F474 HydrophobicContact CB-CE2 4.29Å; P409-F474 HydrophobicContact CB-CG 3.68Å; P409-F474 HydrophobicContact CB-CZ 4.28Å
410	E	72.7	Confident	73.5	Confident	114 Å²	114	60.7 Å²	60.7	53%	0.533	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-60.1	-29.8	178.9	67.6	-70.5	163.2	0	0	113.1	S408 I412	S408-E410 WeakPolarHBondContact CA-OE1 3.28Å; S408-E410 WeakPolarHBondContact CA-OE2 3.43Å; S408-E410 WeakPolarHBondContact CB-OE1 3.45Å; S408-E410 PolarHBondContact O-N 2.98Å; S408-E410 VanDerWaalsContact O-N 3.17Å; E410-I412 PolarHBondContact O-N 2.87Å
411	R	68.5	Low	72.1	Confident	88 Å²	88	62.8 Å²	62.8	33%	0.332	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-76.4	-9.5	-179.9	-58.8	-172.2	-178.6	-155.9	1.7	113.5	P350 H358 S408 P409	P350-R411 PolarHBondContact O-NH1 2.79Å; H358-R411 WeakPolarHBondContact CB-O 3.35Å; S408-R411 PolarHBondContact O-N 2.67Å; P409-R411 PolarHBondContact O-N 3.31Å
412	I	72.9	Confident	70.3	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.021	34%	0.34	C	S	.	.			trans	-99.3	110.1	-176.7	-55.3	159.6	0	0	0	108.3	A361 L364 F405 P409 E410 V414 K471 F474 L477	A361-I412 HydrophobicContact CB-CG2 4.4Å; L364-I412 HydrophobicContact CD1-CG2 4.05Å; F405-I412 HydrophobicContact CD2-CD1 3.72Å; F405-I412 HydrophobicContact CD2-CG1 4.43Å; F405-I412 HydrophobicContact CE1-CD1 4.34Å; F405-I412 HydrophobicContact CE2-CD1 3.04Å; F405-I412 HydrophobicContact CE2-CG1 3.75Å; F405-I412 HydrophobicContact CZ-CD1 3.41Å; F405-I412 VanDerWaalsContact CZ-CD1 3.41Å; F405-I412 HydrophobicContact CZ-CG1 4.43Å; P409-I412 PolarHBondContact O-N 3.31Å; P409-I412 VanDerWaalsContact O-N 3.14Å; E410-I412 PolarHBondContact O-N 2.87Å; I412-V414 HydrophobicContact CG2-CG2 4.27Å; I412-K471 WeakPolarHBondContact O-CE 3.46Å; I412-K471 PolarHBondContact O-NZ 3.14Å; I412-F474 HydrophobicContact CD1-CD2 3.8Å; I412-F474 HydrophobicContact CD1-CE2 3.33Å; I412-F474 HydrophobicContact CD1-CZ 4.3Å; I412-L477 HydrophobicContact CG2-CD2 3.61Å
413	C	71.4	Confident	68.3	Low	47 Å²	47	72.4 Å²	72.4	32%	0.318	38%	0.375	S	S	.	.			trans	-119.3	109	176.4	-67.2	0	0	0	0	109.7	Y415 K471	C413-Y415 HydrophobicContact CB-CE2 3.93Å; C413-K471 PolarHBondContact SG-NZ 2.96Å
414	V	72.6	Confident	66.3	Low	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.369	C	S	.	.			trans	-121.1	133.2	173.3	-176.6	0	0	0	0	107.5	L364 E368 I412 K471 I472 L477	L364-V414 HydrophobicContact CB-CG1 4.5Å; L364-V414 HydrophobicContact CB-CG2 3.49Å; L364-V414 VanDerWaalsContact CB-CG2 3.49Å; L364-V414 HydrophobicContact CD1-CG2 4.25Å; E368-V414 HydrophobicContact CB-CG1 3.96Å; E368-V414 HydrophobicContact CG-CG1 4.27Å; I412-V414 HydrophobicContact CG2-CG2 4.27Å; V414-K471 WeakPolarHBondContact O-CA 3.35Å; V414-I472 HydrophobicContact CB-CD1 4.42Å; V414-I472 HydrophobicContact CG1-CD1 3.83Å; V414-I472 PolarHBondContact O-N 3.05Å; V414-L477 HydrophobicContact CB-CD1 4.08Å; V414-L477 HydrophobicContact CB-CD2 4.15Å; V414-L477 HydrophobicContact CG1-CD1 4.17Å; V414-L477 HydrophobicContact CG2-CD1 4.01Å; V414-L477 HydrophobicContact CG2-CD2 3.66Å; V414-L477 HydrophobicContact CG2-CG 4.48Å
415	Y	72.8	Confident	64.7	Low	94 Å²	94	74.4 Å²	74.4	37%	0.369	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.6	-177.1	-62.6	-88.7	0	0	0	110.5	Q365 E368 C413 S470 K471	Q365-Y415 PolarHBondContact NE2-O 3.29Å; E368-Y415 WeakPolarHBondContact CG-O 3.23Å; C413-Y415 HydrophobicContact CB-CE2 3.93Å; Y415-S470 CarbonylContact C-O 3.57Å; Y415-S470 VanDerWaalsContact CA-O 3.26Å; Y415-S470 WeakPolarHBondContact CA-O 3.37Å; Y415-K471 HydrophobicContact CD1-CB 4.2Å; Y415-K471 HydrophobicContact CE1-CB 3.95Å
416	E	69.2	Low	63.3	Low	76 Å²	76	77.9 Å²	77.9	36%	0.355	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	139.5	169.7	-178.9	164.7	-121.4	0	0	109.1	E368 T469 S470 I472 K480	E368-E416 WeakPolarHBondContact OE1-CG 3.26Å; E416-T469 WeakPolarHBondContact O-CA 3.48Å; E416-S470 PolarHBondContact N-O 2.87Å; E416-S470 PolarHBondContact O-N 2.74Å; E416-S470 VanDerWaalsContact O-N 3.09Å; E416-I472 HydrophobicContact CB-CD1 4Å; E416-I472 HydrophobicContact CB-CG1 3.8Å; E416-K480 IonicContact OE1-NZ 3Å; E416-K480 PolarHBondContact OE1-NZ 2.94Å
417	W	60.8	Low	61.6	Low	64 Å²	64	81.8 Å²	81.8	24%	0.242	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	112	-178.3	-61.1	78.3	0	0	0	109	A456 T469	W417-A456 HydrophobicContact CH2-CB 3.46Å; W417-A456 VanDerWaalsContact CH2-CB 3.46Å; W417-A456 HydrophobicContact CZ2-CB 4.28Å; W417-A456 HydrophobicContact CZ3-CB 4.19Å; W417-T469 HydrophobicContact CD2-CG2 3.66Å; W417-T469 HydrophobicContact CE3-CG2 3.45Å; W417-T469 VanDerWaalsContact CE3-CG2 3.45Å; W417-T469 HydrophobicContact CG-CG2 4.49Å; W417-T469 HydrophobicContact CH2-CG2 3.42Å; W417-T469 VanDerWaalsContact CH2-CG2 3.42Å; W417-T469 HydrophobicContact CZ2-CG2 3.66Å; W417-T469 HydrophobicContact CZ3-CG2 3.34Å
418	A	60.7	Low	60.3	Low	43 Å²	43	82.8 Å²	82.8	36%	0.355	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	139.3	174.1	0	0	0	0	0	110.3	R420 Y467 S468	A418-R420 PolarHBondContact O-N 3.36Å; A418-Y467 CarbonylContact O-C 3.45Å; A418-Y467 VanDerWaalsContact O-CA 3.29Å; A418-Y467 WeakPolarHBondContact O-CA 3.4Å; A418-S468 PolarHBondContact N-O 3.36Å; A418-S468 PolarHBondContact O-N 3.32Å; A418-S468 PolarHBondContact O-OG 3.39Å
419	A	57.5	Low	59.1	Low	58 Å²	58	82.6 Å²	82.6	48%	0.479	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	129.5	165.6	0	0	0	0	0	108.4	V465 Y467	A419-V465 HydrophobicContact CB-CG1 3.82Å; A419-Y467 HydrophobicContact CB-CE1 4.32Å
420	R	52.3	Low	57.8	Low	88 Å²	88	89.7 Å²	89.7	33%	0.332	48%	0.475	S	S	.	.			trans	-83.6	138.5	173.3	-61.3	178.7	-175.8	-153.5	-7.6	109.5	A418 Q422 P466 S468	A418-R420 PolarHBondContact O-N 3.36Å; R420-Q422 PolarHBondContact O-N 2.88Å; R420-P466 HydrophobicContact CB-CG 4.32Å; R420-P466 WeakPolarHBondContact CB-O 3.4Å; R420-P466 WeakPolarHBondContact CG-O 3.5Å; R420-P466 PolarHBondContact N-O 3.11Å; R420-S468 VanDerWaalsContact NE-CB 3.32Å
421	D	55	Low	56.6	Low	169 Å²	169	86.7 Å²	86.7	90%	0.904	47%	0.466	S	S	*	.	S	Bend	trans	-71.5	-11.4	173.5	-64	-35.5	0	0	0	113.4
422	Q	45.1	Very low	55.6	Low	147 Å²	147	84.7 Å²	84.7	69%	0.687	47%	0.468	S	S	*	.	S	Bend	trans	-134.3	129.1	-173.1	-64.4	-177.9	7.3	0	0	112.7	R420 I424	R420-Q422 PolarHBondContact O-N 2.88Å; Q422-I424 PolarHBondContact O-N 3.36Å
423	S	44.4	Very low	54.5	Low	112 Å²	112	87.3 Å²	87.3	78%	0.783	48%	0.479	S	S	*	.			trans	-71.8	112.5	168.5	57.1	0	0	0	0	110.1
424	I	41.8	Very low	53.3	Low	106 Å²	106	88.5 Å²	88.5	54%	0.544	49%	0.485	S	S	.	.			trans	-99.2	142.9	166	-63.4	172	0	0	0	107	Q422 I426	Q422-I424 PolarHBondContact O-N 3.36Å; I424-I426 HydrophobicContact CB-CG1 4.44Å; I424-I426 HydrophobicContact CG2-CG1 4.43Å; I424-I426 PolarHBondContact O-N 3.12Å
425	D	44.9	Very low	51.9	Low	167 Å²	167	91.3 Å²	91.3	89%	0.893	50%	0.5	S	S	*	.			trans	-62.9	74.4	168.9	-75	-35.4	0	0	0	110.4
426	I	48.9	Very low	50.9	Low	74 Å²	74	89.7 Å²	89.7	38%	0.379	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-76.6	129.6	167.9	-57.9	175.1	0	0	0	105.9	I424	I424-I426 HydrophobicContact CB-CG1 4.44Å; I424-I426 HydrophobicContact CG2-CG1 4.43Å; I424-I426 PolarHBondContact O-N 3.12Å
427	P	49	Very low	49.7	Very low	104 Å²	104	89 Å²	89	68%	0.675	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-54.2	140.8	175.5	20.7	-31	0	0	0	109.6	A429	P427-A429 PolarHBondContact O-N 2.91Å
428	P	53.4	Low	49.3	Very low	121 Å²	121	91.3 Å²	91.3	79%	0.786	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-52.4	131.2	-170.9	19.8	-31.8	0	0	0	110	K430	P428-K430 PolarHBondContact O-N 3.38Å
429	A	50.8	Low	48.5	Very low	23 Å²	23	91.7 Å²	91.7	19%	0.19	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-47.4	127.6	175.8	0	0	0	0	0	108.6	P427 P431 F453 Y457	P427-A429 PolarHBondContact O-N 2.91Å; A429-P431 WeakPolarHBondContact O-CD 3.17Å; A429-F453 HydrophobicContact CB-CD1 3.77Å; A429-F453 HydrophobicContact CB-CE1 3.99Å; A429-F453 WeakPolarHBondContact O-CE1 3.48Å; A429-Y457 HydrophobicContact CB-CD1 3.39Å; A429-Y457 HydrophobicContact CB-CE1 4.04Å; A429-Y457 HydrophobicContact CB-CG 3.91Å
430	K	49.4	Very low	48.2	Very low	184 Å²	184	94.4 Å²	94.4	80%	0.8	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-70.7	125.8	170.8	-73.6	-174.7	-179.1	178.4	0	106.7	P428 A432	P428-K430 PolarHBondContact O-N 3.38Å; K430-A432 PolarHBondContact O-N 3.34Å
431	P	47	Very low	48.2	Very low	52 Å²	52	95.2 Å²	95.2	34%	0.338	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-54.8	142.8	171.9	20.3	-29.3	0	0	0	109.6	A429 F433 T434 P451 V452 F453	A429-P431 WeakPolarHBondContact O-CD 3.17Å; P431-F433 PolarHBondContact O-N 2.97Å; P431-T434 HydrophobicContact CG-CG2 4.45Å; P431-P451 HydrophobicContact CB-CB 3.65Å; P431-P451 HydrophobicContact CG-CB 4.02Å; P431-V452 CarbonylContact C-O 3.56Å; P431-F453 HydrophobicContact CB-CD1 4.41Å; P431-F453 HydrophobicContact CB-CE1 4.23Å
432	A	48.7	Very low	48.1	Very low	46 Å²	46	94.7 Å²	94.7	38%	0.38	52%	0.519	S	S	.	.	S	Bend	trans	-58.5	-39.1	169.7	0	0	0	0	0	109.8	K430 V452 P454	K430-A432 PolarHBondContact O-N 3.34Å; A432-V452 WeakPolarHBondContact CB-O 3.28Å; A432-V452 PolarHBondContact N-O 3.18Å; A432-P454 HydrophobicContact CB-CG 4Å
433	F	48.3	Very low	48.4	Very low	59 Å²	59	91.2 Å²	91.2	26%	0.259	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	167.3	173.4	56.9	-82.5	0	0	0	109.6	P285 P431 L435 V452	P285-F433 HydrophobicContact CG-CD1 4.07Å; P285-F433 HydrophobicContact CG-CE1 3.31Å; P285-F433 HydrophobicContact CG-CZ 3.6Å; P431-F433 PolarHBondContact O-N 2.97Å; F433-L435 HydrophobicContact CE2-CB 4.25Å; F433-L435 HydrophobicContact CE2-CD1 4.11Å; F433-V452 HydrophobicContact CD1-CB 4.4Å; F433-V452 HydrophobicContact CD2-CB 4.18Å; F433-V452 HydrophobicContact CD2-CG2 4.26Å; F433-V452 HydrophobicContact CE1-CB 3.89Å; F433-V452 HydrophobicContact CE1-CG1 3.79Å; F433-V452 HydrophobicContact CE2-CB 3.68Å; F433-V452 HydrophobicContact CE2-CG1 4.18Å; F433-V452 HydrophobicContact CE2-CG2 3.58Å; F433-V452 HydrophobicContact CZ-CB 3.52Å; F433-V452 HydrophobicContact CZ-CG1 3.5Å; F433-V452 HydrophobicContact CZ-CG2 3.8Å; F433-V452 PolarHBondContact N-O 2.98Å; F433-V452 PolarHBondContact O-N 2.94Å
434	T	47.6	Very low	48.3	Very low	72 Å²	72	94 Å²	94	44%	0.442	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.5	171	45.3	0	0	0	0	109.4	P431 R450 P451	P431-T434 HydrophobicContact CG-CG2 4.45Å; T434-R450 CarbonylContact C-O 3.37Å; T434-R450 WeakPolarHBondContact CA-O 3.33Å; T434-P451 HydrophobicContact CG2-CB 4.5Å
435	L	43.1	Very low	49.3	Very low	59 Å²	59	93.2 Å²	93.2	31%	0.309	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	118.8	176.7	-158.4	150	0	0	0	108.6	F433 M437 R450 V452	F433-L435 HydrophobicContact CE2-CB 4.25Å; F433-L435 HydrophobicContact CE2-CD1 4.11Å; L435-M437 HydrophobicContact CD2-CB 4.41Å; L435-M437 HydrophobicContact CD2-CG 3.17Å; L435-M437 HydrophobicContact CD2-SD 4.08Å; L435-M437 PolarHBondContact O-N 3.18Å; L435-R450 PolarHBondContact N-O 3.33Å; L435-R450 PolarHBondContact O-N 3.14Å; L435-V452 HydrophobicContact CB-CG2 3.94Å; L435-V452 HydrophobicContact CD1-CG2 4.31Å
436	D	50.5	Low	50.2	Low	60 Å²	60	88 Å²	88	32%	0.321	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	108.1	170.4	-77.9	-24.1	0	0	0	107.9	V447 S448 R449	D436-V447 HydrophobicContact CB-CG1 3.68Å; D436-S448 CarbonylContact C-O 3.39Å; D436-R449 WeakPolarHBondContact OD1-CG 3.33Å; D436-R449 IonicContact OD1-NE 3Å; D436-R449 PolarHBondContact OD1-NE 2.97Å; D436-R449 VanDerWaalsContact OD1-NE 3.09Å
437	M	43.9	Very low	50.8	Low	60 Å²	60	89 Å²	89	30%	0.296	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.2	174.6	-73.1	-155.3	-60.1	0	0	111.1	L435 E439 V447 S448 R450	L435-M437 HydrophobicContact CD2-CB 4.41Å; L435-M437 HydrophobicContact CD2-CG 3.17Å; L435-M437 HydrophobicContact CD2-SD 4.08Å; L435-M437 PolarHBondContact O-N 3.18Å; M437-E439 PolarHBondContact O-N 3.2Å; M437-V447 CarbonylContact O-C 3.58Å; M437-V447 VanDerWaalsContact O-CA 3.31Å; M437-V447 WeakPolarHBondContact O-CA 3.32Å; M437-S448 PolarHBondContact N-O 3.24Å; M437-S448 PolarHBondContact O-N 3.07Å; M437-R450 HydrophobicContact CE-CB 4.29Å; M437-R450 HydrophobicContact CE-CG 3.59Å
438	L	52.2	Low	51.3	Low	114 Å²	114	85.1 Å²	85.1	60%	0.597	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	108.3	169.1	-170.2	72.4	0	0	0	108.8	I440 S446 V447	L438-I440 HydrophobicContact CD2-CD1 4.37Å; L438-I440 HydrophobicContact CD2-CG1 4.49Å; L438-I440 HydrophobicContact CG-CG1 4.38Å; L438-S446 CarbonylContact C-O 3.56Å; L438-S446 WeakPolarHBondContact CA-O 3.3Å; L438-V447 HydrophobicContact CD1-CG2 4.03Å
439	E	44.8	Very low	51.5	Low	51 Å²	51	88.3 Å²	88.3	24%	0.238	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	122.6	171.6	-73.3	178.8	-169.8	0	0	109.2	M437 S446 S448 R450	M437-E439 PolarHBondContact O-N 3.2Å; E439-S446 PolarHBondContact N-O 3.27Å; E439-S446 PolarHBondContact O-N 3Å; E439-S446 PolarHBondContact O-OG 3.46Å; E439-S448 WeakPolarHBondContact OE1-CB 3.1Å; E439-S448 PolarHBondContact OE1-OG 3.31Å; E439-R450 IonicContact OE1-CZ 3.44Å; E439-R450 IonicContact OE1-NE 3.82Å; E439-R450 PolarHBondContact OE1-NE 3.07Å; E439-R450 IonicContact OE1-NH2 2.67Å; E439-R450 PolarHBondContact OE1-NH2 3.33Å
440	I	51.7	Low	51.7	Low	114 Å²	114	93.6 Å²	93.6	59%	0.585	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108	104.4	174.6	-56.4	175.5	0	0	0	107	L438 K444	L438-I440 HydrophobicContact CD2-CD1 4.37Å; L438-I440 HydrophobicContact CD2-CG1 4.49Å; L438-I440 HydrophobicContact CG-CG1 4.38Å; I440-K444 WeakPolarHBondContact CA-O 3.43Å
441	I	51.2	Low	51.8	Low	105 Å²	105	87.9 Å²	87.9	54%	0.538	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	127	176.2	-55.9	176.2	0	0	0	107	G443 K444	I441-G443 PolarHBondContact O-N 3.43Å; I441-G443 VanDerWaalsContact O-N 3.16Å; I441-K444 PolarHBondContact N-O 2.86Å; I441-K444 VanDerWaalsContact N-O 3.13Å; I441-K444 PolarHBondContact O-N 3.39Å
442	D	54.2	Low	51.7	Low	159 Å²	159	87.7 Å²	87.7	85%	0.85	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	40.2	179.8	-56.7	-29.9	0	0	0	114.2	K444	D442-K444 PolarHBondContact O-N 2.84Å
443	G	49.8	Very low	51.6	Low	74 Å²	74	87.7 Å²	87.7	76%	0.763	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	1	178.4	0	0	0	0	0	115.2	I441	I441-G443 PolarHBondContact O-N 3.43Å; I441-G443 VanDerWaalsContact O-N 3.16Å
444	K	42.9	Very low	51.4	Low	170 Å²	170	85.7 Å²	85.7	74%	0.739	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	126.9	171.5	-69.3	-178.3	-179.2	175	0	109.8	I440 I441 D442	I440-K444 WeakPolarHBondContact CA-O 3.43Å; I441-K444 PolarHBondContact N-O 2.86Å; I441-K444 VanDerWaalsContact N-O 3.13Å; I441-K444 PolarHBondContact O-N 3.39Å; D442-K444 PolarHBondContact O-N 2.84Å
445	S	63.3	Low	51	Low	89 Å²	89	85.3 Å²	85.3	62%	0.622	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	132.7	171.1	52.2	0	0	0	0	110.5
446	S	62.8	Low	50.9	Low	59 Å²	59	83.7 Å²	83.7	41%	0.413	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.8	168	65.6	0	0	0	0	108.7	L438 E439	L438-S446 CarbonylContact C-O 3.56Å; L438-S446 WeakPolarHBondContact CA-O 3.3Å; E439-S446 PolarHBondContact N-O 3.27Å; E439-S446 PolarHBondContact O-N 3Å; E439-S446 PolarHBondContact O-OG 3.46Å
447	V	62.2	Low	50.4	Low	93 Å²	93	85.6 Å²	85.6	56%	0.564	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	108.8	172.4	179.3	0	0	0	0	107.1	D436 M437 L438	D436-V447 HydrophobicContact CB-CG1 3.68Å; M437-V447 CarbonylContact O-C 3.58Å; M437-V447 VanDerWaalsContact O-CA 3.31Å; M437-V447 WeakPolarHBondContact O-CA 3.32Å; L438-V447 HydrophobicContact CD1-CG2 4.03Å
448	S	59.7	Low	50.2	Low	24 Å²	24	84 Å²	84	17%	0.168	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	132.5	173.5	75.5	0	0	0	0	109.8	D436 M437 E439	D436-S448 CarbonylContact C-O 3.39Å; M437-S448 PolarHBondContact N-O 3.24Å; M437-S448 PolarHBondContact O-N 3.07Å; E439-S448 WeakPolarHBondContact OE1-CB 3.1Å; E439-S448 PolarHBondContact OE1-OG 3.31Å
449	R	57.6	Low	49.5	Very low	188 Å²	188	82.9 Å²	82.9	71%	0.709	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	108.8	173.8	-86.6	173.7	-177.6	174	5.8	109.1	D436	D436-R449 WeakPolarHBondContact OD1-CG 3.33Å; D436-R449 IonicContact OD1-NE 3Å; D436-R449 PolarHBondContact OD1-NE 2.97Å; D436-R449 VanDerWaalsContact OD1-NE 3.09Å
450	R	54.7	Low	49.3	Very low	133 Å²	133	83 Å²	83	50%	0.502	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	120.4	174.3	-66.4	-148.7	-167.4	164.8	5.3	111.2	T434 L435 M437 E439 V452	T434-R450 CarbonylContact C-O 3.37Å; T434-R450 WeakPolarHBondContact CA-O 3.33Å; L435-R450 PolarHBondContact N-O 3.33Å; L435-R450 PolarHBondContact O-N 3.14Å; M437-R450 HydrophobicContact CE-CB 4.29Å; M437-R450 HydrophobicContact CE-CG 3.59Å; E439-R450 IonicContact OE1-CZ 3.44Å; E439-R450 IonicContact OE1-NE 3.82Å; E439-R450 PolarHBondContact OE1-NE 3.07Å; E439-R450 IonicContact OE1-NH2 2.67Å; E439-R450 PolarHBondContact OE1-NH2 3.33Å; R450-V452 PolarHBondContact O-N 2.73Å
451	P	51.7	Low	48.7	Very low	64 Å²	64	80.3 Å²	80.3	42%	0.416	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	126.4	170.4	26.5	-30.5	0	0	0	109.7	P431 T434 F453	P431-P451 HydrophobicContact CB-CB 3.65Å; P431-P451 HydrophobicContact CG-CB 4.02Å; T434-P451 HydrophobicContact CG2-CB 4.5Å; P451-F453 HydrophobicContact CB-CE1 4.39Å; P451-F453 HydrophobicContact CB-CE2 3.75Å; P451-F453 HydrophobicContact CB-CZ 3.64Å; P451-F453 HydrophobicContact CG-CE2 3.76Å; P451-F453 HydrophobicContact CG-CZ 3.81Å
452	V	44.9	Very low	48.2	Very low	49 Å²	49	81.6 Å²	81.6	30%	0.297	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	122.1	171.3	-179.1	0	0	0	0	107.9	P431 A432 F433 L435 R450	P431-V452 CarbonylContact C-O 3.56Å; A432-V452 WeakPolarHBondContact CB-O 3.28Å; A432-V452 PolarHBondContact N-O 3.18Å; F433-V452 HydrophobicContact CD1-CB 4.4Å; F433-V452 HydrophobicContact CD2-CB 4.18Å; F433-V452 HydrophobicContact CD2-CG2 4.26Å; F433-V452 HydrophobicContact CE1-CB 3.89Å; F433-V452 HydrophobicContact CE1-CG1 3.79Å; F433-V452 HydrophobicContact CE2-CB 3.68Å; F433-V452 HydrophobicContact CE2-CG1 4.18Å; F433-V452 HydrophobicContact CE2-CG2 3.58Å; F433-V452 HydrophobicContact CZ-CB 3.52Å; F433-V452 HydrophobicContact CZ-CG1 3.5Å; F433-V452 HydrophobicContact CZ-CG2 3.8Å; F433-V452 PolarHBondContact N-O 2.98Å; F433-V452 PolarHBondContact O-N 2.94Å; L435-V452 HydrophobicContact CB-CG2 3.94Å; L435-V452 HydrophobicContact CD1-CG2 4.31Å; R450-V452 PolarHBondContact O-N 2.73Å
453	F	46.5	Very low	47.2	Very low	46 Å²	46	76.5 Å²	76.5	20%	0.202	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-98.1	144.3	-179.1	-58.2	-85.6	0	0	0	109.5	A429 P431 P451 T461	A429-F453 HydrophobicContact CB-CD1 3.77Å; A429-F453 HydrophobicContact CB-CE1 3.99Å; A429-F453 WeakPolarHBondContact O-CE1 3.48Å; P431-F453 HydrophobicContact CB-CD1 4.41Å; P431-F453 HydrophobicContact CB-CE1 4.23Å; P451-F453 HydrophobicContact CB-CE1 4.39Å; P451-F453 HydrophobicContact CB-CE2 3.75Å; P451-F453 HydrophobicContact CB-CZ 3.64Å; P451-F453 HydrophobicContact CG-CE2 3.76Å; P451-F453 HydrophobicContact CG-CZ 3.81Å; F453-T461 HydrophobicContact CB-CG2 4.34Å; F453-T461 HydrophobicContact CD1-CG2 3.76Å; F453-T461 HydrophobicContact CD2-CG2 3.54Å; F453-T461 VanDerWaalsContact CD2-OG1 3.3Å; F453-T461 WeakPolarHBondContact CD2-OG1 3.49Å; F453-T461 HydrophobicContact CE1-CG2 3.86Å; F453-T461 HydrophobicContact CE2-CG2 3.64Å; F453-T461 HydrophobicContact CG-CG2 3.6Å; F453-T461 HydrophobicContact CZ-CG2 3.8Å
454	P	45	Very low	46.7	Very low	16 Å²	16	82.7 Å²	82.7	10%	0.104	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-53.2	149.4	170.1	-18.9	28	0	0	0	110	L325 A328 A432 A456 Y457 S458	L325-P454 HydrophobicContact CD2-CB 4.48Å; L325-P454 HydrophobicContact CD2-CG 4.2Å; A328-P454 HydrophobicContact CB-CB 4.47Å; A432-P454 HydrophobicContact CB-CG 4Å; P454-A456 PolarHBondContact O-N 3.37Å; P454-Y457 HydrophobicContact CB-CD2 4.01Å; P454-Y457 HydrophobicContact CG-CD2 3.71Å; P454-Y457 HydrophobicContact CG-CE2 4.35Å; P454-Y457 CarbonylContact O-C 3.25Å; P454-Y457 VanDerWaalsContact O-CA 3.3Å; P454-Y457 WeakPolarHBondContact O-CA 3.42Å; P454-Y457 WeakPolarHBondContact O-CB 3.5Å; P454-Y457 PolarHBondContact O-N 2.85Å; P454-S458 PolarHBondContact O-N 2.98Å
455	M	38.4	Very low	46.6	Very low	65 Å²	65	77.5 Å²	77.5	32%	0.32	40%	0.401	S	S	.	.	H	α-helix	trans	-49.5	-34.9	179.9	-98.2	-155	-57	0	0	114.3	V327 A328 S331 Y457 S458 R459	V327-M455 HydrophobicContact CG1-CE 3.8Å; A328-M455 HydrophobicContact CB-CB 4.16Å; S331-M455 WeakPolarHBondContact CB-SD 3.42Å; M455-Y457 PolarHBondContact O-N 2.87Å; M455-S458 WeakPolarHBondContact CA-OG 3.37Å; M455-S458 PolarHBondContact O-N 3.18Å; M455-S458 PolarHBondContact O-OG 3.07Å; M455-R459 PolarHBondContact O-N 3.19Å
456	A	41.3	Very low	45.6	Very low	24 Å²	24	74.5 Å²	74.5	20%	0.198	38%	0.379	C	S	.	.	H	α-helix	trans	-53.5	-34.8	172.2	0	0	0	0	0	113.5	W417 P454	W417-A456 HydrophobicContact CH2-CB 3.46Å; W417-A456 VanDerWaalsContact CH2-CB 3.46Å; W417-A456 HydrophobicContact CZ2-CB 4.28Å; W417-A456 HydrophobicContact CZ3-CB 4.19Å; P454-A456 PolarHBondContact O-N 3.37Å
457	Y	40.1	Very low	45.1	Very low	100 Å²	100	74.1 Å²	74.1	39%	0.392	37%	0.369	S	S	.	.	H	α-helix	trans	-103.8	-22.2	178.2	-65.8	-80	0	0	0	113	A429 P454 M455 R459 Q460 T461	A429-Y457 HydrophobicContact CB-CD1 3.39Å; A429-Y457 HydrophobicContact CB-CE1 4.04Å; A429-Y457 HydrophobicContact CB-CG 3.91Å; P454-Y457 HydrophobicContact CB-CD2 4.01Å; P454-Y457 HydrophobicContact CG-CD2 3.71Å; P454-Y457 HydrophobicContact CG-CE2 4.35Å; P454-Y457 CarbonylContact O-C 3.25Å; P454-Y457 VanDerWaalsContact O-CA 3.3Å; P454-Y457 WeakPolarHBondContact O-CA 3.42Å; P454-Y457 WeakPolarHBondContact O-CB 3.5Å; P454-Y457 PolarHBondContact O-N 2.85Å; M455-Y457 PolarHBondContact O-N 2.87Å; Y457-R459 PolarHBondContact O-N 3.43Å; Y457-Q460 CarbonylContact O-C 3.4Å; Y457-Q460 VanDerWaalsContact O-CA 3.27Å; Y457-Q460 WeakPolarHBondContact O-CA 3.46Å; Y457-Q460 VanDerWaalsContact O-CB 3.29Å; Y457-Q460 WeakPolarHBondContact O-CB 3.47Å; Y457-Q460 PolarHBondContact O-N 2.79Å; Y457-T461 WeakPolarHBondContact O-CG2 3.44Å; Y457-T461 PolarHBondContact O-N 3.35Å; Y457-T461 PolarHBondContact O-OG1 3.45Å
458	S	38.5	Very low	44.8	Very low	28 Å²	28	71.3 Å²	71.3	20%	0.196	35%	0.354	C	S	.	.	H	α-helix	trans	-63.3	-35.8	173.9	83	0	0	0	0	110.3	P454 M455 Q460 T461 D462	P454-S458 PolarHBondContact O-N 2.98Å; M455-S458 WeakPolarHBondContact CA-OG 3.37Å; M455-S458 PolarHBondContact O-N 3.18Å; M455-S458 PolarHBondContact O-OG 3.07Å; S458-Q460 PolarHBondContact O-N 3.33Å; S458-T461 WeakPolarHBondContact CA-OG1 3.35Å; S458-T461 PolarHBondContact O-N 2.96Å; S458-T461 VanDerWaalsContact O-N 3.17Å; S458-T461 PolarHBondContact O-OG1 3.01Å; S458-D462 VanDerWaalsContact O-CB 3.28Å; S458-D462 WeakPolarHBondContact O-CB 3.33Å; S458-D462 PolarHBondContact O-N 2.74Å
459	R	38.4	Very low	44.9	Very low	89 Å²	89	73.6 Å²	73.6	34%	0.336	37%	0.367	S	S	.	.	H	α-helix	trans	-64.5	-22.2	167.8	-68.9	-171.5	179.5	-173.9	-1.4	113.5	M455 Y457 C463 Y467	M455-R459 PolarHBondContact O-N 3.19Å; Y457-R459 PolarHBondContact O-N 3.43Å; R459-C463 WeakPolarHBondContact O-CB 3.18Å; R459-Y467 HydrophobicContact CB-CD2 3.85Å; R459-Y467 HydrophobicContact CB-CE2 3.84Å; R459-Y467 WeakPolarHBondContact O-CD2 3.27Å; R459-Y467 VanDerWaalsContact O-CE2 3.27Å; R459-Y467 WeakPolarHBondContact O-CE2 3.25Å
460	Q	40.1	Very low	45.6	Very low	55 Å²	55	67.2 Å²	67.2	26%	0.257	35%	0.351	S	S	.	.	H	α-helix	trans	-88.1	-22.4	172.7	-63.1	-177.3	-9.5	0	0	113.3	Y457 S458 C463	Y457-Q460 CarbonylContact O-C 3.4Å; Y457-Q460 VanDerWaalsContact O-CA 3.27Å; Y457-Q460 WeakPolarHBondContact O-CA 3.46Å; Y457-Q460 VanDerWaalsContact O-CB 3.29Å; Y457-Q460 WeakPolarHBondContact O-CB 3.47Å; Y457-Q460 PolarHBondContact O-N 2.79Å; S458-Q460 PolarHBondContact O-N 3.33Å; Q460-C463 CarbonylContact C-O 3.54Å; Q460-C463 VanDerWaalsContact O-O 3.13Å
461	T	39	Very low	46.6	Very low	57 Å²	57	65.6 Å²	65.6	35%	0.35	35%	0.348	S	S	.	.	H	α-helix	trans	-100.3	-33.6	-177.7	59.3	0	0	0	0	113.7	F453 Y457 S458	F453-T461 HydrophobicContact CB-CG2 4.34Å; F453-T461 HydrophobicContact CD1-CG2 3.76Å; F453-T461 HydrophobicContact CD2-CG2 3.54Å; F453-T461 VanDerWaalsContact CD2-OG1 3.3Å; F453-T461 WeakPolarHBondContact CD2-OG1 3.49Å; F453-T461 HydrophobicContact CE1-CG2 3.86Å; F453-T461 HydrophobicContact CE2-CG2 3.64Å; F453-T461 HydrophobicContact CG-CG2 3.6Å; F453-T461 HydrophobicContact CZ-CG2 3.8Å; Y457-T461 WeakPolarHBondContact O-CG2 3.44Å; Y457-T461 PolarHBondContact O-N 3.35Å; Y457-T461 PolarHBondContact O-OG1 3.45Å; S458-T461 WeakPolarHBondContact CA-OG1 3.35Å; S458-T461 PolarHBondContact O-N 2.96Å; S458-T461 VanDerWaalsContact O-N 3.17Å; S458-T461 PolarHBondContact O-OG1 3.01Å
462	D	40	Very low	47.9	Very low	132 Å²	132	62.8 Å²	62.8	71%	0.706	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-25.5	177	-64.2	-21.1	0	0	0	111.6	S458	S458-D462 VanDerWaalsContact O-CB 3.28Å; S458-D462 WeakPolarHBondContact O-CB 3.33Å; S458-D462 PolarHBondContact O-N 2.74Å
463	C	33.6	Very low	49.9	Very low	51 Å²	51	64.3 Å²	64.3	35%	0.345	34%	0.34	S	S	.	.	S	Bend	trans	-113.6	126.1	173	-55.3	0	0	0	0	108.6	R459 Q460 V465 Y467	R459-C463 WeakPolarHBondContact O-CB 3.18Å; Q460-C463 CarbonylContact C-O 3.54Å; Q460-C463 VanDerWaalsContact O-O 3.13Å; C463-V465 HydrophobicContact CB-CB 4.5Å; C463-V465 PolarHBondContact O-N 3.21Å; C463-Y467 HydrophobicContact CB-CE2 4.36Å
464	Q	39	Very low	51.8	Low	204 Å²	204	64.6 Å²	64.6	95%	0.953	34%	0.341	S	S	*	.	S	Bend	trans	-63.9	18	170	-67.3	-174.6	-15.5	0	0	113.5
465	V	41.4	Very low	53.8	Low	61 Å²	61	67 Å²	67	37%	0.37	36%	0.362	S	S	.	.	S	Bend	trans	-110.7	109.1	-177.9	-172.5	0	0	0	0	107.8	A419 C463 Y467	A419-V465 HydrophobicContact CB-CG1 3.82Å; C463-V465 HydrophobicContact CB-CB 4.5Å; C463-V465 PolarHBondContact O-N 3.21Å; V465-Y467 VanDerWaalsContact O-CD2 3.22Å; V465-Y467 WeakPolarHBondContact O-CD2 3.43Å; V465-Y467 WeakPolarHBondContact O-CE2 3.25Å; V465-Y467 PolarHBondContact O-N 3.22Å
466	P	43.1	Very low	56.2	Low	26 Å²	26	67 Å²	67	17%	0.169	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-67.4	123.2	177.1	23.4	-26.6	0	0	0	109.3	R420	R420-P466 HydrophobicContact CB-CG 4.32Å; R420-P466 WeakPolarHBondContact CB-O 3.4Å; R420-P466 WeakPolarHBondContact CG-O 3.5Å; R420-P466 PolarHBondContact N-O 3.11Å
467	Y	51.3	Low	58.5	Low	52 Å²	52	65.9 Å²	65.9	20%	0.204	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	140.5	174	-71.3	-92.1	0	0	0	110.8	A418 A419 R459 C463 V465	A418-Y467 CarbonylContact O-C 3.45Å; A418-Y467 VanDerWaalsContact O-CA 3.29Å; A418-Y467 WeakPolarHBondContact O-CA 3.4Å; A419-Y467 HydrophobicContact CB-CE1 4.32Å; R459-Y467 HydrophobicContact CB-CD2 3.85Å; R459-Y467 HydrophobicContact CB-CE2 3.84Å; R459-Y467 WeakPolarHBondContact O-CD2 3.27Å; R459-Y467 VanDerWaalsContact O-CE2 3.27Å; R459-Y467 WeakPolarHBondContact O-CE2 3.25Å; C463-Y467 HydrophobicContact CB-CE2 4.36Å; V465-Y467 VanDerWaalsContact O-CD2 3.22Å; V465-Y467 WeakPolarHBondContact O-CD2 3.43Å; V465-Y467 WeakPolarHBondContact O-CE2 3.25Å; V465-Y467 PolarHBondContact O-N 3.22Å
468	S	56.6	Low	60.8	Low	34 Å²	34	62.1 Å²	62.1	24%	0.238	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	143.8	162	43.9	0	0	0	0	110.1	A418 R420	A418-S468 PolarHBondContact N-O 3.36Å; A418-S468 PolarHBondContact O-N 3.32Å; A418-S468 PolarHBondContact O-OG 3.39Å; R420-S468 VanDerWaalsContact NE-CB 3.32Å
469	T	61	Low	63.3	Low	71 Å²	71	65.1 Å²	65.1	44%	0.436	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.3	165.5	49.9	0	0	0	0	109.8	E416 W417	E416-T469 WeakPolarHBondContact O-CA 3.48Å; W417-T469 HydrophobicContact CD2-CG2 3.66Å; W417-T469 HydrophobicContact CE3-CG2 3.45Å; W417-T469 VanDerWaalsContact CE3-CG2 3.45Å; W417-T469 HydrophobicContact CG-CG2 4.49Å; W417-T469 HydrophobicContact CH2-CG2 3.42Å; W417-T469 VanDerWaalsContact CH2-CG2 3.42Å; W417-T469 HydrophobicContact CZ2-CG2 3.66Å; W417-T469 HydrophobicContact CZ3-CG2 3.34Å
470	S	72.8	Confident	65.9	Low	55 Å²	55	63.2 Å²	63.2	39%	0.385	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.4	170.1	53.4	0	0	0	0	109.1	Y415 E416 I472	Y415-S470 CarbonylContact C-O 3.57Å; Y415-S470 VanDerWaalsContact CA-O 3.26Å; Y415-S470 WeakPolarHBondContact CA-O 3.37Å; E416-S470 PolarHBondContact N-O 2.87Å; E416-S470 PolarHBondContact O-N 2.74Å; E416-S470 VanDerWaalsContact O-N 3.09Å; S470-I472 PolarHBondContact O-N 3.41Å
471	K	75.9	Confident	68.4	Low	98 Å²	98	60.6 Å²	60.6	43%	0.426	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	123.3	174	-177.9	176.3	175.9	170.6	0	108.5	I412 C413 V414 Y415 P473	I412-K471 WeakPolarHBondContact O-CE 3.46Å; I412-K471 PolarHBondContact O-NZ 3.14Å; C413-K471 PolarHBondContact SG-NZ 2.96Å; V414-K471 WeakPolarHBondContact O-CA 3.35Å; Y415-K471 HydrophobicContact CD1-CB 4.2Å; Y415-K471 HydrophobicContact CE1-CB 3.95Å; K471-P473 WeakPolarHBondContact O-CD 3.18Å
472	I	79.5	Confident	71	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.031	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-67.9	125.8	174.4	-55.1	179.6	0	0	0	108.1	E368 V414 E416 S470 F474 V476 L477	E368-I472 HydrophobicContact CG-CD1 4.08Å; E368-I472 WeakPolarHBondContact OE2-CD1 3.14Å; V414-I472 HydrophobicContact CB-CD1 4.42Å; V414-I472 HydrophobicContact CG1-CD1 3.83Å; V414-I472 PolarHBondContact O-N 3.05Å; E416-I472 HydrophobicContact CB-CD1 4Å; E416-I472 HydrophobicContact CB-CG1 3.8Å; S470-I472 PolarHBondContact O-N 3.41Å; I472-F474 PolarHBondContact O-N 2.73Å; I472-V476 HydrophobicContact CG2-CB 4.04Å; I472-V476 HydrophobicContact CG2-CG1 3.99Å; I472-L477 HydrophobicContact CD1-CD1 4.45Å; I472-L477 HydrophobicContact CG2-CB 3.99Å; I472-L477 HydrophobicContact CG2-CD1 4.42Å
473	P	86.6	Confident	73.6	Confident	80 Å²	80	60 Å²	60	52%	0.519	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-58	139.1	173.1	-23.2	33.5	0	0	0	111	K471 A475 V476 L477	K471-P473 WeakPolarHBondContact O-CD 3.18Å; P473-A475 VanDerWaalsContact C-N 3.27Å; P473-A475 PolarHBondContact O-N 3.19Å; P473-V476 HydrophobicContact CB-CB 4.5Å; P473-V476 HydrophobicContact CB-CG2 4.15Å; P473-V476 HydrophobicContact CG-CG2 4.26Å; P473-V476 PolarHBondContact O-N 2.94Å; P473-L477 PolarHBondContact O-N 3.4Å
474	F	85.3	Confident	76.5	Confident	52 Å²	52	57.7 Å²	57.7	23%	0.228	31%	0.313	C	S	.	.	H	α-helix	trans	-55.2	-40.2	-175.5	178.8	-105.3	0	0	0	113.1	F405 P409 I412 I472 V476 L477 M478	F405-F474 HydrophobicContact CE1-CE2 4.34Å; F405-F474 HydrophobicContact CE1-CZ 4.41Å; F405-F474 HydrophobicContact CZ-CE2 4.16Å; P409-F474 HydrophobicContact CB-CB 4.22Å; P409-F474 HydrophobicContact CB-CD1 3.7Å; P409-F474 HydrophobicContact CB-CD2 3.99Å; P409-F474 HydrophobicContact CB-CE1 4Å; P409-F474 HydrophobicContact CB-CE2 4.29Å; P409-F474 HydrophobicContact CB-CG 3.68Å; P409-F474 HydrophobicContact CB-CZ 4.28Å; I412-F474 HydrophobicContact CD1-CD2 3.8Å; I412-F474 HydrophobicContact CD1-CE2 3.33Å; I412-F474 HydrophobicContact CD1-CZ 4.3Å; I472-F474 PolarHBondContact O-N 2.73Å; F474-V476 PolarHBondContact O-N 3.41Å; F474-L477 WeakPolarHBondContact O-CB 3.37Å; F474-L477 PolarHBondContact O-N 3.11Å; F474-M478 HydrophobicContact CD1-CG 4.14Å; F474-M478 HydrophobicContact CD2-CG 4.35Å; F474-M478 HydrophobicContact CD2-SD 4.41Å; F474-M478 HydrophobicContact CE1-CG 3.69Å; F474-M478 HydrophobicContact CE1-SD 4.28Å; F474-M478 HydrophobicContact CE2-CG 3.89Å; F474-M478 HydrophobicContact CE2-SD 3.58Å; F474-M478 VanDerWaalsContact CE2-SD 3.58Å; F474-M478 HydrophobicContact CG-CG 4.46Å; F474-M478 HydrophobicContact CZ-CG 3.56Å; F474-M478 HydrophobicContact CZ-SD 3.52Å; F474-M478 VanDerWaalsContact CZ-SD 3.52Å; F474-M478 VanDerWaalsContact O-CG 3.32Å; F474-M478 WeakPolarHBondContact O-CG 3.27Å; F474-M478 PolarHBondContact O-N 3.23Å
475	A	87.8	Confident	79.2	Confident	66 Å²	66	48 Å²	48	55%	0.545	27%	0.268	S	S	.	.	H	α-helix	trans	-58.9	-48.4	176.3	0	0	0	0	0	112.5	P473 L477 M478 D479	P473-A475 VanDerWaalsContact C-N 3.27Å; P473-A475 PolarHBondContact O-N 3.19Å; A475-L477 VanDerWaalsContact C-N 3.27Å; A475-L477 PolarHBondContact O-N 2.87Å; A475-M478 PolarHBondContact O-N 3.49Å; A475-M478 VanDerWaalsContact O-N 3.15Å; A475-D479 PolarHBondContact O-N 2.85Å
476	V	89.6	Confident	81.8	Confident	66 Å²	66	47.4 Å²	47.4	40%	0.4	27%	0.27	S	S	.	.	H	α-helix	trans	-62	-38.4	176.8	179	0	0	0	0	110.9	I472 P473 F474 M478 D479 K480	I472-V476 HydrophobicContact CG2-CB 4.04Å; I472-V476 HydrophobicContact CG2-CG1 3.99Å; P473-V476 HydrophobicContact CB-CB 4.5Å; P473-V476 HydrophobicContact CB-CG2 4.15Å; P473-V476 HydrophobicContact CG-CG2 4.26Å; P473-V476 PolarHBondContact O-N 2.94Å; F474-V476 PolarHBondContact O-N 3.41Å; V476-M478 VanDerWaalsContact C-N 3.33Å; V476-D479 PolarHBondContact O-N 3.4Å; V476-K480 WeakPolarHBondContact O-CG 3.35Å; V476-K480 PolarHBondContact O-N 2.93Å
477	L	87.9	Confident	84.2	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-39.1	177.2	-173.7	62.5	0	0	0	112	L364 F372 I412 V414 I472 P473 F474 A475 L481	L364-L477 HydrophobicContact CB-CD1 4.21Å; L364-L477 HydrophobicContact CD1-CD1 4.08Å; L364-L477 HydrophobicContact CD1-CD2 3.54Å; L364-L477 HydrophobicContact CD1-CG 3.78Å; L364-L477 HydrophobicContact CD2-CD1 4.46Å; L364-L477 HydrophobicContact CG-CD1 4.49Å; F372-L477 HydrophobicContact CE2-CD1 4.43Å; F372-L477 HydrophobicContact CZ-CD1 3.76Å; I412-L477 HydrophobicContact CG2-CD2 3.61Å; V414-L477 HydrophobicContact CB-CD1 4.08Å; V414-L477 HydrophobicContact CB-CD2 4.15Å; V414-L477 HydrophobicContact CG1-CD1 4.17Å; V414-L477 HydrophobicContact CG2-CD1 4.01Å; V414-L477 HydrophobicContact CG2-CD2 3.66Å; V414-L477 HydrophobicContact CG2-CG 4.48Å; I472-L477 HydrophobicContact CD1-CD1 4.45Å; I472-L477 HydrophobicContact CG2-CB 3.99Å; I472-L477 HydrophobicContact CG2-CD1 4.42Å; P473-L477 PolarHBondContact O-N 3.4Å; F474-L477 WeakPolarHBondContact O-CB 3.37Å; F474-L477 PolarHBondContact O-N 3.11Å; A475-L477 VanDerWaalsContact C-N 3.27Å; A475-L477 PolarHBondContact O-N 2.87Å; L477-L481 WeakPolarHBondContact O-CB 3.46Å; L477-L481 PolarHBondContact O-N 3.3Å
478	M	89.2	Confident	86.2	Confident	21 Å²	21	47.6 Å²	47.6	10%	0.103	27%	0.27	C	S	.	.	H	α-helix	trans	-67.4	-39.8	175.1	-67.8	-45.7	-55	0	0	112.1	W402 F405 F474 A475 V476 L481 K482 I514	W402-M478 HydrophobicContact CH2-CE 3.43Å; W402-M478 VanDerWaalsContact CH2-CE 3.43Å; W402-M478 HydrophobicContact CZ2-CE 4.33Å; W402-M478 HydrophobicContact CZ3-CE 4.16Å; F405-M478 HydrophobicContact CE1-CE 4.34Å; F405-M478 HydrophobicContact CE1-SD 3.97Å; F405-M478 HydrophobicContact CZ-SD 4.35Å; F474-M478 HydrophobicContact CD1-CG 4.14Å; F474-M478 HydrophobicContact CD2-CG 4.35Å; F474-M478 HydrophobicContact CD2-SD 4.41Å; F474-M478 HydrophobicContact CE1-CG 3.69Å; F474-M478 HydrophobicContact CE1-SD 4.28Å; F474-M478 HydrophobicContact CE2-CG 3.89Å; F474-M478 HydrophobicContact CE2-SD 3.58Å; F474-M478 VanDerWaalsContact CE2-SD 3.58Å; F474-M478 HydrophobicContact CG-CG 4.46Å; F474-M478 HydrophobicContact CZ-CG 3.56Å; F474-M478 HydrophobicContact CZ-SD 3.52Å; F474-M478 VanDerWaalsContact CZ-SD 3.52Å; F474-M478 VanDerWaalsContact O-CG 3.32Å; F474-M478 WeakPolarHBondContact O-CG 3.27Å; F474-M478 PolarHBondContact O-N 3.23Å; A475-M478 PolarHBondContact O-N 3.49Å; A475-M478 VanDerWaalsContact O-N 3.15Å; V476-M478 VanDerWaalsContact C-N 3.33Å; M478-L481 HydrophobicContact CE-CD2 4Å; M478-L481 PolarHBondContact O-N 2.82Å; M478-K482 WeakPolarHBondContact O-CB 3.06Å; M478-K482 PolarHBondContact O-N 3.17Å; M478-I514 HydrophobicContact CE-CG1 4.33Å
479	D	91.2	Very high	88	Confident	90 Å²	90	49.2 Å²	49.2	48%	0.481	27%	0.273	S	S	.	.	H	α-helix	trans	-63.7	-45.9	174.1	-69.8	-29	0	0	0	111.6	A475 V476 L481 K482 L483	A475-D479 PolarHBondContact O-N 2.85Å; V476-D479 PolarHBondContact O-N 3.4Å; D479-L481 VanDerWaalsContact C-N 3.33Å; D479-L481 PolarHBondContact O-N 3.02Å; D479-K482 PolarHBondContact O-N 3.43Å; D479-L483 PolarHBondContact O-N 3.43Å
480	K	92.5	Very high	89.5	Confident	50 Å²	50	52.2 Å²	52.2	22%	0.217	28%	0.282	C	S	.	.	H	α-helix	trans	-58.2	-44.6	174	-75.6	-168.9	179.4	-170.5	0	110.9	E368 F372 E416 V476 L484	E368-K480 IonicContact OE2-NZ 2.92Å; E368-K480 PolarHBondContact OE2-NZ 3.35Å; F372-K480 HydrophobicContact CD1-CB 3.86Å; F372-K480 HydrophobicContact CD2-CB 4.33Å; F372-K480 HydrophobicContact CD2-CD 3.66Å; F372-K480 HydrophobicContact CE1-CB 3.93Å; F372-K480 HydrophobicContact CE2-CB 4.35Å; F372-K480 HydrophobicContact CE2-CD 3.76Å; F372-K480 HydrophobicContact CG-CB 4.08Å; F372-K480 HydrophobicContact CG-CD 4.16Å; F372-K480 HydrophobicContact CZ-CB 4.19Å; F372-K480 HydrophobicContact CZ-CD 4.37Å; E416-K480 IonicContact OE1-NZ 3Å; E416-K480 PolarHBondContact OE1-NZ 2.94Å; V476-K480 WeakPolarHBondContact O-CG 3.35Å; V476-K480 PolarHBondContact O-N 2.93Å; K480-L484 VanDerWaalsContact O-CB 3.24Å; K480-L484 WeakPolarHBondContact O-CB 3.46Å; K480-L484 PolarHBondContact O-N 3.47Å
481	L	92.1	Very high	90.3	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-44.2	177.6	179	62.5	0	0	0	112	L364 F367 L398 L477 M478 D479 L484 L485	L364-L481 HydrophobicContact CD2-CB 4.41Å; L364-L481 HydrophobicContact CD2-CD1 3.97Å; L364-L481 HydrophobicContact CD2-CD2 4.3Å; L364-L481 HydrophobicContact CD2-CG 4.45Å; F367-L481 HydrophobicContact CE2-CD1 4.24Å; L398-L481 HydrophobicContact CD2-CD2 4.48Å; L477-L481 WeakPolarHBondContact O-CB 3.46Å; L477-L481 PolarHBondContact O-N 3.3Å; M478-L481 HydrophobicContact CE-CD2 4Å; M478-L481 PolarHBondContact O-N 2.82Å; D479-L481 VanDerWaalsContact C-N 3.33Å; D479-L481 PolarHBondContact O-N 3.02Å; L481-L484 PolarHBondContact O-N 3.26Å; L481-L485 HydrophobicContact CD1-CD1 4.03Å; L481-L485 HydrophobicContact CD1-CD2 4.47Å; L481-L485 HydrophobicContact CD1-CG 3.97Å; L481-L485 HydrophobicContact CG-CD1 3.96Å; L481-L485 HydrophobicContact CG-CG 4.32Å; L481-L485 WeakPolarHBondContact O-CB 3.37Å; L481-L485 VanDerWaalsContact O-CG 3.24Å; L481-L485 WeakPolarHBondContact O-CG 3.38Å; L481-L485 PolarHBondContact O-N 3.36Å
482	K	94.1	Very high	90.9	Very high	70 Å²	70	45.4 Å²	45.4	30%	0.304	25%	0.246	S	C	.	.	H	α-helix	trans	-59	-48.7	178.1	-176.7	-175.7	-173.3	173.8	0	111.4	M478 D479 L485 A486 L511 I514 E518	M478-K482 WeakPolarHBondContact O-CB 3.06Å; M478-K482 PolarHBondContact O-N 3.17Å; D479-K482 PolarHBondContact O-N 3.43Å; K482-L485 PolarHBondContact O-N 3.02Å; K482-A486 PolarHBondContact O-N 3.34Å; K482-A486 VanDerWaalsContact O-N 3.15Å; K482-L511 HydrophobicContact CG-CD2 4.3Å; K482-I514 HydrophobicContact CB-CD1 4.45Å; K482-I514 HydrophobicContact CB-CG2 4.21Å; K482-I514 HydrophobicContact CD-CG2 3.97Å; K482-I514 HydrophobicContact CG-CG2 4.07Å; K482-E518 IonicContact NZ-OE1 2.75Å; K482-E518 PolarHBondContact NZ-OE1 2.81Å; K482-E518 IonicContact NZ-OE2 2.97Å; K482-E518 PolarHBondContact NZ-OE2 2.98Å
483	L	94.8	Very high	91.3	Very high	107 Å²	107	48.9 Å²	48.9	56%	0.56	27%	0.268	S	S	*	.	H	α-helix	trans	-62	-48.9	177.7	-175.9	67	0	0	0	111	D479 L485 A486 E487	D479-L483 PolarHBondContact O-N 3.43Å; L483-L485 VanDerWaalsContact C-N 3.34Å; L483-L485 PolarHBondContact O-N 2.87Å; L483-A486 PolarHBondContact O-N 3.47Å; L483-E487 WeakPolarHBondContact O-CG 3.44Å; L483-E487 PolarHBondContact O-N 2.85Å
484	L	95.1	Very high	91.2	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-55.8	-47	177.8	171.1	63.8	0	0	0	112.1	F367 F372 A374 I377 K480 L481 A486 E487 L488	F367-L484 HydrophobicContact CB-CD2 3.91Å; F367-L484 HydrophobicContact CD1-CD2 4.06Å; F367-L484 HydrophobicContact CD2-CD2 3.45Å; F367-L484 VanDerWaalsContact CD2-CD2 3.45Å; F367-L484 HydrophobicContact CE1-CD2 4.48Å; F367-L484 HydrophobicContact CE2-CD2 3.96Å; F367-L484 HydrophobicContact CG-CD2 3.54Å; F367-L484 HydrophobicContact CZ-CD2 4.45Å; F372-L484 HydrophobicContact CD1-CB 4.13Å; F372-L484 HydrophobicContact CD1-CD2 3.7Å; F372-L484 HydrophobicContact CD1-CG 4.48Å; F372-L484 HydrophobicContact CE1-CD2 4.2Å; A374-L484 HydrophobicContact CB-CD1 3.91Å; I377-L484 HydrophobicContact CD1-CD1 3.46Å; I377-L484 VanDerWaalsContact CD1-CD1 3.46Å; I377-L484 HydrophobicContact CD1-CD2 3.82Å; I377-L484 HydrophobicContact CD1-CG 4.3Å; K480-L484 VanDerWaalsContact O-CB 3.24Å; K480-L484 WeakPolarHBondContact O-CB 3.46Å; K480-L484 PolarHBondContact O-N 3.47Å; L481-L484 PolarHBondContact O-N 3.26Å; L484-A486 PolarHBondContact O-N 3.03Å; L484-E487 PolarHBondContact O-N 3.34Å; L484-L488 HydrophobicContact CD1-CD1 3.76Å; L484-L488 HydrophobicContact CD1-CG 3.78Å; L484-L488 HydrophobicContact CD2-CD1 4.39Å; L484-L488 HydrophobicContact CG-CD1 3.82Å; L484-L488 HydrophobicContact CG-CG 4.25Å; L484-L488 WeakPolarHBondContact O-CB 3.47Å; L484-L488 WeakPolarHBondContact O-CG 3.35Å; L484-L488 PolarHBondContact O-N 3.43Å
485	L	95.1	Very high	90.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.5	-41.1	-179.4	-74.5	175.6	0	0	0	111.7	L395 L481 K482 L483 K489 I507 L510 L511 I514	L395-L485 HydrophobicContact CD2-CD2 3.87Å; L481-L485 HydrophobicContact CD1-CD1 4.03Å; L481-L485 HydrophobicContact CD1-CD2 4.47Å; L481-L485 HydrophobicContact CD1-CG 3.97Å; L481-L485 HydrophobicContact CG-CD1 3.96Å; L481-L485 HydrophobicContact CG-CG 4.32Å; L481-L485 WeakPolarHBondContact O-CB 3.37Å; L481-L485 VanDerWaalsContact O-CG 3.24Å; L481-L485 WeakPolarHBondContact O-CG 3.38Å; L481-L485 PolarHBondContact O-N 3.36Å; K482-L485 PolarHBondContact O-N 3.02Å; L483-L485 VanDerWaalsContact C-N 3.34Å; L483-L485 PolarHBondContact O-N 2.87Å; L485-K489 WeakPolarHBondContact O-CB 3.48Å; L485-K489 PolarHBondContact O-N 2.85Å; L485-I507 HydrophobicContact CB-CG2 4.08Å; L485-I507 HydrophobicContact CD2-CG1 4.16Å; L485-I507 HydrophobicContact CD2-CG2 4.49Å; L485-I507 WeakPolarHBondContact O-CG2 3.28Å; L485-L510 HydrophobicContact CD1-CB 4.2Å; L485-L511 HydrophobicContact CB-CD2 3.82Å; L485-L511 HydrophobicContact CB-CG 4.21Å; L485-I514 HydrophobicContact CD1-CD1 3.82Å
486	A	95.3	Very high	89.4	Confident	49 Å²	49	53 Å²	53	41%	0.405	28%	0.277	S	S	.	.	H	α-helix	trans	-63.7	-42	176.2	0	0	0	0	0	112.2	K482 L483 L484 K489 H490	K482-A486 PolarHBondContact O-N 3.34Å; K482-A486 VanDerWaalsContact O-N 3.15Å; L483-A486 PolarHBondContact O-N 3.47Å; L484-A486 PolarHBondContact O-N 3.03Å; A486-K489 WeakPolarHBondContact O-CB 3.22Å; A486-H490 PolarHBondContact O-N 2.82Å
487	E	95.2	Very high	87.7	Confident	83 Å²	83	57.2 Å²	57.2	39%	0.388	30%	0.298	S	S	.	.	H	α-helix	trans	-70.1	-42.7	176.8	-69.8	-177.8	-178.9	0	0	112.3	A374 L483 L484 K489 H490 C491	A374-E487 HydrophobicContact CB-CB 3.32Å; A374-E487 HydrophobicContact CB-CG 4.41Å; A374-E487 WeakPolarHBondContact CB-OE2 3.36Å; L483-E487 WeakPolarHBondContact O-CG 3.44Å; L483-E487 PolarHBondContact O-N 2.85Å; L484-E487 PolarHBondContact O-N 3.34Å; E487-K489 VanDerWaalsContact C-N 3.29Å; E487-K489 PolarHBondContact O-N 3.39Å; E487-H490 WeakPolarHBondContact O-CA 3.32Å; E487-H490 WeakPolarHBondContact O-CB 3.18Å; E487-H490 PolarHBondContact O-N 3.41Å; E487-C491 PolarHBondContact O-N 2.98Å; E487-C491 PolarHBondContact O-SG 2.94Å
488	L	93.2	Very high	86.1	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.9	-40.2	175.2	-80.3	176.2	0	0	0	111.5	A374 I377 F378 F391 L484 H490 C491 F492 I507	A374-L488 HydrophobicContact CB-CD2 4.19Å; A374-L488 HydrophobicContact CB-CG 4.13Å; A374-L488 VanDerWaalsContact O-CD2 3.3Å; A374-L488 WeakPolarHBondContact O-CD2 3.37Å; I377-L488 HydrophobicContact CB-CD2 4.24Å; I377-L488 HydrophobicContact CG2-CD1 4.15Å; I377-L488 HydrophobicContact CG2-CD2 4.02Å; F378-L488 HydrophobicContact CB-CD2 3.99Å; F391-L488 HydrophobicContact CE2-CD1 4.39Å; F391-L488 HydrophobicContact CZ-CD1 3.79Å; L484-L488 HydrophobicContact CD1-CD1 3.76Å; L484-L488 HydrophobicContact CD1-CG 3.78Å; L484-L488 HydrophobicContact CD2-CD1 4.39Å; L484-L488 HydrophobicContact CG-CD1 3.82Å; L484-L488 HydrophobicContact CG-CG 4.25Å; L484-L488 WeakPolarHBondContact O-CB 3.47Å; L484-L488 WeakPolarHBondContact O-CG 3.35Å; L484-L488 PolarHBondContact O-N 3.43Å; L488-H490 VanDerWaalsContact C-N 3.26Å; L488-H490 PolarHBondContact O-N 2.86Å; L488-C491 WeakPolarHBondContact O-CB 3.41Å; L488-C491 PolarHBondContact O-N 3.08Å; L488-C491 VanDerWaalsContact O-N 3.16Å; L488-F492 HydrophobicContact CB-CD2 4.43Å; L488-F492 HydrophobicContact CB-CE2 4.31Å; L488-F492 WeakPolarHBondContact O-CD2 3.29Å; L488-F492 PolarHBondContact O-N 3.42Å; L488-I507 HydrophobicContact CB-CD1 4.36Å
489	K	93.3	Very high	84.6	Confident	68 Å²	68	67 Å²	67	30%	0.296	34%	0.337	S	S	.	.	H	α-helix	trans	-54.1	-46.1	172.6	-179.9	-176.5	174.6	179.3	0	110.9	L485 A486 E487 F492 V493 V504 I507 D508	L485-K489 WeakPolarHBondContact O-CB 3.48Å; L485-K489 PolarHBondContact O-N 2.85Å; A486-K489 WeakPolarHBondContact O-CB 3.22Å; E487-K489 VanDerWaalsContact C-N 3.29Å; E487-K489 PolarHBondContact O-N 3.39Å; K489-F492 PolarHBondContact O-N 3.06Å; K489-V493 HydrophobicContact CG-CG2 4.5Å; K489-V493 VanDerWaalsContact O-CG2 3.29Å; K489-V493 WeakPolarHBondContact O-CG2 3.34Å; K489-V493 PolarHBondContact O-N 3.31Å; K489-V504 HydrophobicContact CG-CG1 4.34Å; K489-I507 HydrophobicContact CB-CG2 3.97Å; K489-D508 WeakPolarHBondContact CD-OD1 3.47Å; K489-D508 WeakPolarHBondContact CE-OD1 3.44Å; K489-D508 IonicContact NZ-OD1 3.4Å; K489-D508 PolarHBondContact NZ-OD1 3.41Å; K489-D508 IonicContact NZ-OD2 3.49Å
490	H	92	Very high	83.5	Confident	133 Å²	133	63.8 Å²	63.8	62%	0.616	32%	0.321	S	S	*	.	H	α-helix	trans	-62.8	-43.4	177.4	-179.6	-84.8	0	0	0	111.9	A486 E487 L488 F492 V493 S494	A486-H490 PolarHBondContact O-N 2.82Å; E487-H490 WeakPolarHBondContact O-CA 3.32Å; E487-H490 WeakPolarHBondContact O-CB 3.18Å; E487-H490 PolarHBondContact O-N 3.41Å; L488-H490 VanDerWaalsContact C-N 3.26Å; L488-H490 PolarHBondContact O-N 2.86Å; H490-F492 PolarHBondContact O-N 3.39Å; H490-V493 PolarHBondContact O-N 2.82Å; H490-S494 WeakPolarHBondContact O-CB 3.48Å; H490-S494 PolarHBondContact O-N 3.41Å; H490-S494 PolarHBondContact O-OG 3.18Å
491	C	91	Very high	83	Confident	9 Å²	9	66.4 Å²	66.4	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-58.8	-46.3	174.5	-64.4	0	0	0	0	112.1	F378 E487 L488 V493 S494 G495	F378-C491 HydrophobicContact CB-CB 3.91Å; F378-C491 HydrophobicContact CD1-CB 4.01Å; F378-C491 HydrophobicContact CD2-CB 3.59Å; F378-C491 HydrophobicContact CE1-CB 4.39Å; F378-C491 HydrophobicContact CE2-CB 4.04Å; F378-C491 HydrophobicContact CG-CB 3.57Å; F378-C491 HydrophobicContact CZ-CB 4.41Å; F378-C491 WeakPolarHBondContact CZ-O 3.48Å; E487-C491 PolarHBondContact O-N 2.98Å; E487-C491 PolarHBondContact O-SG 2.94Å; L488-C491 WeakPolarHBondContact O-CB 3.41Å; L488-C491 PolarHBondContact O-N 3.08Å; L488-C491 VanDerWaalsContact O-N 3.16Å; C491-V493 PolarHBondContact O-N 2.95Å; C491-S494 PolarHBondContact O-N 3.46Å; C491-S494 PolarHBondContact O-OG 3.42Å; C491-S494 VanDerWaalsContact O-OG 3.13Å; C491-G495 PolarHBondContact O-N 2.9Å
492	F	88.7	Confident	82.5	Confident	1 Å²	1	68.8 Å²	68.8	0%	0.004	36%	0.357	C	S	.	.	H	α-helix	trans	-65.2	-38.1	178.5	-76.3	-62.8	0	0	0	113.6	F378 L381 L388 F391 L488 K489 H490 P500 C503 V504 I507	F378-F492 AromaticContact CD2-CD1 3.94Å; F378-F492 HydrophobicContact CD2-CD1 3.94Å; F378-F492 AromaticContact CD2-CE1 3.85Å; F378-F492 HydrophobicContact CD2-CE1 3.85Å; F378-F492 HydrophobicContact CD2-CE2 4.48Å; F378-F492 HydrophobicContact CD2-CG 4.3Å; F378-F492 HydrophobicContact CD2-CZ 4.13Å; F378-F492 AromaticContact CE2-CD1 3.55Å; F378-F492 HydrophobicContact CE2-CD1 3.55Å; F378-F492 AromaticContact CE2-CE1 3.8Å; F378-F492 HydrophobicContact CE2-CE1 3.8Å; F378-F492 HydrophobicContact CE2-CG 4.1Å; L381-F492 HydrophobicContact CD1-CE2 4.43Å; L381-F492 HydrophobicContact CD1-CZ 3.91Å; L388-F492 HydrophobicContact CD1-CE1 3.84Å; L388-F492 HydrophobicContact CD1-CZ 4.08Å; F391-F492 HydrophobicContact CD1-CE2 4.42Å; F391-F492 HydrophobicContact CD1-CZ 4.29Å; F391-F492 AromaticContact CE1-CE2 3.83Å; F391-F492 HydrophobicContact CE1-CE2 3.83Å; F391-F492 HydrophobicContact CE1-CZ 4.14Å; L488-F492 HydrophobicContact CB-CD2 4.43Å; L488-F492 HydrophobicContact CB-CE2 4.31Å; L488-F492 WeakPolarHBondContact O-CD2 3.29Å; L488-F492 PolarHBondContact O-N 3.42Å; K489-F492 PolarHBondContact O-N 3.06Å; H490-F492 PolarHBondContact O-N 3.39Å; F492-P500 HydrophobicContact CD1-CG 3.39Å; F492-P500 HydrophobicContact CE1-CG 3.59Å; F492-P500 HydrophobicContact CG-CG 4.27Å; F492-C503 HydrophobicContact CD2-CB 4.25Å; F492-C503 HydrophobicContact CE2-CB 4.22Å; F492-C503 HydrophobicContact CG-CB 4.45Å; F492-C503 HydrophobicContact CZ-CB 4.37Å; F492-V504 HydrophobicContact CB-CG2 3.88Å; F492-I507 HydrophobicContact CD2-CD1 3.91Å; F492-I507 HydrophobicContact CE2-CD1 4.11Å
493	V	87.7	Confident	82.1	Confident	79 Å²	79	65.5 Å²	65.5	48%	0.479	34%	0.343	S	S	.	.	H	α-helix	trans	-71.4	-37.7	178.4	171.5	0	0	0	0	111.6	K489 H490 C491 V504	K489-V493 HydrophobicContact CG-CG2 4.5Å; K489-V493 VanDerWaalsContact O-CG2 3.29Å; K489-V493 WeakPolarHBondContact O-CG2 3.34Å; K489-V493 PolarHBondContact O-N 3.31Å; H490-V493 PolarHBondContact O-N 2.82Å; C491-V493 PolarHBondContact O-N 2.95Å; V493-V504 HydrophobicContact CG2-CG1 4.26Å; V493-V504 HydrophobicContact CG2-CG2 4.13Å
494	S	84.3	Confident	81.9	Confident	72 Å²	72	61.5 Å²	61.5	50%	0.503	32%	0.323	S	S	.	.	H	α-helix	trans	-79.5	-14.3	179.8	60.4	0	0	0	0	114	H490 C491 K496	H490-S494 WeakPolarHBondContact O-CB 3.48Å; H490-S494 PolarHBondContact O-N 3.41Å; H490-S494 PolarHBondContact O-OG 3.18Å; C491-S494 PolarHBondContact O-N 3.46Å; C491-S494 PolarHBondContact O-OG 3.42Å; C491-S494 VanDerWaalsContact O-OG 3.13Å; S494-K496 PolarHBondContact O-N 3.04Å
495	G	73.8	Confident	81.6	Confident	12 Å²	12	68.6 Å²	68.6	12%	0.124	35%	0.354	C	S	.	.			trans	-59.3	129.4	177	0	0	0	0	0	113.5	C491	C491-G495 PolarHBondContact O-N 2.9Å
496	K	60.4	Low	81.5	Confident	200 Å²	200	70.1 Å²	70.1	87%	0.87	36%	0.362	S	S	*	.	S	Bend	trans	-81.3	-29.8	-178.3	-70.2	-177.5	178.9	178.1	0	114.1	S494	S494-K496 PolarHBondContact O-N 3.04Å
497	N	53.9	Low	81.5	Confident	156 Å²	156	67.8 Å²	67.8	83%	0.834	34%	0.343	S	S	*	.	S	Bend	trans	-115.8	-21.2	-164.8	-64.7	-15.4	0	0	0	114.9
498	I	55	Low	81.4	Confident	56 Å²	56	66.5 Å²	66.5	29%	0.287	34%	0.338	S	S	.	.			trans	-139.6	107.9	179.4	-54.4	174.9	0	0	0	106.6	I382 L388 P500	I382-I498 HydrophobicContact CB-CD1 4.44Å; L388-I498 HydrophobicContact CD2-CG2 4.01Å; I498-P500 VanDerWaalsContact O-CD 3.27Å; I498-P500 WeakPolarHBondContact O-CD 3.37Å
499	R	57	Low	81.5	Confident	172 Å²	172	71.6 Å²	71.6	65%	0.649	36%	0.361	S	S	*	.			trans	-109	88.3	170.6	-72.6	-175.4	179.8	178.1	-1.6	108.6	D501	R499-D501 PolarHBondContact O-N 3.29Å
500	P	69.9	Low	81.5	Confident	21 Å²	21	68.4 Å²	68.4	14%	0.136	35%	0.346	C	S	.	.			trans	-74.2	85.2	172.8	30.1	-28.9	0	0	0	107.7	L388 F492 I498 A502 C503 V504	L388-P500 HydrophobicContact CD1-CB 4.4Å; L388-P500 HydrophobicContact CD1-CG 4.04Å; L388-P500 HydrophobicContact CD2-CB 4.31Å; L388-P500 HydrophobicContact CD2-CG 4.35Å; F492-P500 HydrophobicContact CD1-CG 3.39Å; F492-P500 HydrophobicContact CE1-CG 3.59Å; F492-P500 HydrophobicContact CG-CG 4.27Å; I498-P500 VanDerWaalsContact O-CD 3.27Å; I498-P500 WeakPolarHBondContact O-CD 3.37Å; P500-A502 PolarHBondContact O-N 2.84Å; P500-C503 HydrophobicContact CB-CB 4.08Å; P500-C503 HydrophobicContact CG-CB 3.88Å; P500-C503 WeakPolarHBondContact O-CA 3.17Å; P500-C503 WeakPolarHBondContact O-CB 3.25Å; P500-C503 PolarHBondContact O-N 2.93Å; P500-V504 PolarHBondContact O-N 3.04Å
501	D	80.7	Confident	81.6	Confident	105 Å²	105	63.8 Å²	63.8	56%	0.561	33%	0.326	S	S	*	.	H	α-helix	trans	-50.3	-29.5	175.1	-73.2	-16.7	0	0	0	111.6	R499 K505	R499-D501 PolarHBondContact O-N 3.29Å; D501-K505 WeakPolarHBondContact O-CB 3.48Å; D501-K505 VanDerWaalsContact O-CG 3.27Å; D501-K505 WeakPolarHBondContact O-CG 3.39Å; D501-K505 PolarHBondContact O-N 3.22Å
502	A	81.6	Confident	81.7	Confident	51 Å²	51	69.5 Å²	69.5	42%	0.421	36%	0.355	S	S	.	.	H	α-helix	trans	-61	-44.1	172.5	0	0	0	0	0	113.1	P500 L506	P500-A502 PolarHBondContact O-N 2.84Å; A502-L506 WeakPolarHBondContact O-CB 3.23Å; A502-L506 WeakPolarHBondContact O-CD1 3.18Å; A502-L506 VanDerWaalsContact O-CG 3.23Å; A502-L506 WeakPolarHBondContact O-CG 3.46Å; A502-L506 PolarHBondContact O-N 2.95Å
503	C	87.1	Confident	81.9	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-62.9	-49.6	176.4	-71.6	0	0	0	0	110.5	V392 F492 P500 K505 L506 I507	V392-C503 WeakPolarHBondContact CG2-SG 3.31Å; F492-C503 HydrophobicContact CD2-CB 4.25Å; F492-C503 HydrophobicContact CE2-CB 4.22Å; F492-C503 HydrophobicContact CG-CB 4.45Å; F492-C503 HydrophobicContact CZ-CB 4.37Å; P500-C503 HydrophobicContact CB-CB 4.08Å; P500-C503 HydrophobicContact CG-CB 3.88Å; P500-C503 WeakPolarHBondContact O-CA 3.17Å; P500-C503 WeakPolarHBondContact O-CB 3.25Å; P500-C503 PolarHBondContact O-N 2.93Å; C503-K505 VanDerWaalsContact C-N 3.34Å; C503-K505 PolarHBondContact O-N 3.47Å; C503-L506 PolarHBondContact O-N 3.25Å; C503-I507 WeakPolarHBondContact O-CB 3.33Å; C503-I507 WeakPolarHBondContact O-CG1 2.88Å; C503-I507 PolarHBondContact O-N 3.34Å
504	V	89.7	Confident	81.9	Confident	24 Å²	24	67.7 Å²	67.7	15%	0.145	34%	0.342	C	S	.	.	H	α-helix	trans	-57.8	-47.7	-178.7	179.1	0	0	0	0	110.8	K489 F492 V493 P500 L506 I507 D508	K489-V504 HydrophobicContact CG-CG1 4.34Å; F492-V504 HydrophobicContact CB-CG2 3.88Å; V493-V504 HydrophobicContact CG2-CG1 4.26Å; V493-V504 HydrophobicContact CG2-CG2 4.13Å; P500-V504 PolarHBondContact O-N 3.04Å; V504-L506 PolarHBondContact O-N 3.07Å; V504-I507 PolarHBondContact O-N 3Å; V504-D508 PolarHBondContact O-N 3.25Å
505	K	90	Very high	82.1	Confident	150 Å²	150	66.7 Å²	66.7	65%	0.652	34%	0.338	S	S	*	.	H	α-helix	trans	-62.2	-40.4	177.8	-72.9	175.1	-176.6	178.3	0	113.3	D501 C503 K509	D501-K505 WeakPolarHBondContact O-CB 3.48Å; D501-K505 VanDerWaalsContact O-CG 3.27Å; D501-K505 WeakPolarHBondContact O-CG 3.39Å; D501-K505 PolarHBondContact O-N 3.22Å; C503-K505 VanDerWaalsContact C-N 3.34Å; C503-K505 PolarHBondContact O-N 3.47Å; K505-K509 PolarHBondContact O-N 3.47Å; K505-K509 VanDerWaalsContact O-N 3.15Å
506	L	92.4	Very high	82.6	Confident	32 Å²	32	70 Å²	70	17%	0.168	36%	0.36	C	S	.	.	H	α-helix	trans	-72	-38.4	179.1	-72.5	170	0	0	0	111.9	V392 L395 K396 A502 C503 V504 K509 L510	V392-L506 HydrophobicContact CG1-CD1 4.02Å; L395-L506 HydrophobicContact CB-CB 3.81Å; L395-L506 HydrophobicContact CB-CD1 4.05Å; L395-L506 HydrophobicContact CB-CG 4.48Å; L395-L506 HydrophobicContact CD1-CB 4.04Å; K396-L506 HydrophobicContact CB-CD1 4.18Å; K396-L506 HydrophobicContact CB-CD2 4.28Å; A502-L506 WeakPolarHBondContact O-CB 3.23Å; A502-L506 WeakPolarHBondContact O-CD1 3.18Å; A502-L506 VanDerWaalsContact O-CG 3.23Å; A502-L506 WeakPolarHBondContact O-CG 3.46Å; A502-L506 PolarHBondContact O-N 2.95Å; C503-L506 PolarHBondContact O-N 3.25Å; V504-L506 PolarHBondContact O-N 3.07Å; L506-K509 PolarHBondContact O-N 3.34Å; L506-L510 PolarHBondContact O-N 3.37Å
507	I	94.4	Very high	83.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.3	-47	173.5	-70.1	168.2	0	0	0	110.2	F391 L395 L485 L488 K489 F492 C503 V504 K509 L510 L511	F391-I507 HydrophobicContact CE1-CD1 4.37Å; L395-I507 HydrophobicContact CD1-CD1 4.47Å; L395-I507 HydrophobicContact CD1-CG1 3.81Å; L395-I507 HydrophobicContact CD2-CG1 4.27Å; L485-I507 HydrophobicContact CB-CG2 4.08Å; L485-I507 HydrophobicContact CD2-CG1 4.16Å; L485-I507 HydrophobicContact CD2-CG2 4.49Å; L485-I507 WeakPolarHBondContact O-CG2 3.28Å; L488-I507 HydrophobicContact CB-CD1 4.36Å; K489-I507 HydrophobicContact CB-CG2 3.97Å; F492-I507 HydrophobicContact CD2-CD1 3.91Å; F492-I507 HydrophobicContact CE2-CD1 4.11Å; C503-I507 WeakPolarHBondContact O-CB 3.33Å; C503-I507 WeakPolarHBondContact O-CG1 2.88Å; C503-I507 PolarHBondContact O-N 3.34Å; V504-I507 PolarHBondContact O-N 3Å; I507-K509 VanDerWaalsContact C-N 3.27Å; I507-K509 PolarHBondContact O-N 3.29Å; I507-L510 PolarHBondContact O-N 3.26Å; I507-L511 HydrophobicContact CG2-CD1 3.79Å; I507-L511 HydrophobicContact CG2-CG 4.19Å; I507-L511 WeakPolarHBondContact O-CB 3.21Å; I507-L511 WeakPolarHBondContact O-CG 3.14Å; I507-L511 PolarHBondContact O-N 3.42Å
508	D	94.3	Very high	83.8	Confident	55 Å²	55	59.7 Å²	59.7	29%	0.294	31%	0.312	S	S	.	.	H	α-helix	trans	-57.2	-43.1	176.5	-80.4	-26.9	0	0	0	111.9	K489 V504 L511 L512	K489-D508 WeakPolarHBondContact CD-OD1 3.47Å; K489-D508 WeakPolarHBondContact CE-OD1 3.44Å; K489-D508 IonicContact NZ-OD1 3.4Å; K489-D508 PolarHBondContact NZ-OD1 3.41Å; K489-D508 IonicContact NZ-OD2 3.49Å; V504-D508 PolarHBondContact O-N 3.25Å; D508-L511 PolarHBondContact O-N 3.19Å; D508-L512 VanDerWaalsContact O-CG 3.31Å; D508-L512 WeakPolarHBondContact O-CG 3.4Å; D508-L512 PolarHBondContact O-N 3.15Å; D508-L512 VanDerWaalsContact O-N 3.08Å
509	K	94	Very high	83.7	Confident	108 Å²	108	62.2 Å²	62.2	47%	0.47	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-41.7	178	-171	168	169.2	-164.9	0	112.4	T399 K505 L506 I507 L512 Q513	T399-K509 HydrophobicContact CG2-CB 4.44Å; T399-K509 HydrophobicContact CG2-CD 3.41Å; T399-K509 VanDerWaalsContact CG2-CD 3.41Å; T399-K509 HydrophobicContact CG2-CG 3.71Å; K505-K509 PolarHBondContact O-N 3.47Å; K505-K509 VanDerWaalsContact O-N 3.15Å; L506-K509 PolarHBondContact O-N 3.34Å; I507-K509 VanDerWaalsContact C-N 3.27Å; I507-K509 PolarHBondContact O-N 3.29Å; K509-L512 PolarHBondContact O-N 3.06Å; K509-Q513 WeakPolarHBondContact O-CG 3.35Å; K509-Q513 PolarHBondContact O-N 3.18Å; K509-Q513 VanDerWaalsContact O-N 3.08Å
510	L	93	Very high	83	Confident	0 Å²	0	59 Å²	59	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-67.5	-41.3	176.4	-80.8	166.1	0	0	0	112.8	L395 L398 T399 W402 L485 L506 I507 L512 Q513 I514	L395-L510 HydrophobicContact CB-CD1 3.98Å; L395-L510 HydrophobicContact CD2-CD1 3.39Å; L395-L510 HydrophobicContact CG-CD1 4.28Å; L398-L510 HydrophobicContact CB-CD2 4.16Å; L398-L510 HydrophobicContact CD2-CD1 4.04Å; L398-L510 HydrophobicContact CD2-CD2 3.81Å; L398-L510 HydrophobicContact CG-CD2 3.67Å; T399-L510 WeakPolarHBondContact OG1-CG 3.42Å; W402-L510 HydrophobicContact CE3-CD2 4.01Å; W402-L510 HydrophobicContact CZ3-CD2 4.32Å; L485-L510 HydrophobicContact CD1-CB 4.2Å; L506-L510 PolarHBondContact O-N 3.37Å; I507-L510 PolarHBondContact O-N 3.26Å; L510-L512 VanDerWaalsContact C-N 3.28Å; L510-L512 PolarHBondContact O-N 2.96Å; L510-Q513 WeakPolarHBondContact O-CB 3.22Å; L510-Q513 PolarHBondContact O-N 2.82Å; L510-Q513 VanDerWaalsContact O-N 3.12Å; L510-I514 WeakPolarHBondContact O-CG1 3.34Å; L510-I514 PolarHBondContact O-N 3.21Å
511	L	94.2	Very high	81.6	Confident	37 Å²	37	65.6 Å²	65.6	19%	0.194	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-39.2	176.4	-73.8	172.8	0	0	0	111.6	K482 L485 I507 D508 I514 A515	K482-L511 HydrophobicContact CG-CD2 4.3Å; L485-L511 HydrophobicContact CB-CD2 3.82Å; L485-L511 HydrophobicContact CB-CG 4.21Å; I507-L511 HydrophobicContact CG2-CD1 3.79Å; I507-L511 HydrophobicContact CG2-CG 4.19Å; I507-L511 WeakPolarHBondContact O-CB 3.21Å; I507-L511 WeakPolarHBondContact O-CG 3.14Å; I507-L511 PolarHBondContact O-N 3.42Å; D508-L511 PolarHBondContact O-N 3.19Å; L511-I514 PolarHBondContact O-N 2.83Å; L511-A515 WeakPolarHBondContact O-CB 3.31Å; L511-A515 PolarHBondContact O-N 2.88Å
512	L	93.3	Very high	79.3	Confident	128 Å²	128	68.2 Å²	68.2	67%	0.67	37%	0.372	S	S	*	.	H	α-helix	trans	-63.8	-41.6	172.5	-70.9	170.4	0	0	0	112.1	D508 K509 L510 A515 S516	D508-L512 VanDerWaalsContact O-CG 3.31Å; D508-L512 WeakPolarHBondContact O-CG 3.4Å; D508-L512 PolarHBondContact O-N 3.15Å; D508-L512 VanDerWaalsContact O-N 3.08Å; K509-L512 PolarHBondContact O-N 3.06Å; L510-L512 VanDerWaalsContact C-N 3.28Å; L510-L512 PolarHBondContact O-N 2.96Å; L512-A515 PolarHBondContact O-N 3.49Å; L512-S516 PolarHBondContact O-N 2.85Å; L512-S516 PolarHBondContact O-OG 3.45Å
513	Q	92.5	Very high	77.1	Confident	37 Å²	37	70.9 Å²	70.9	17%	0.173	39%	0.385	C	S	.	.	H	α-helix	trans	-66	-39.5	176.8	-76	177.3	-44.9	0	0	112.7	T399 W402 K509 L510 S516 T517	T399-Q513 PolarHBondContact O-NE2 2.84Å; W402-Q513 HydrophobicContact CD2-CB 4Å; W402-Q513 HydrophobicContact CG-CB 3.93Å; W402-Q513 HydrophobicContact CG-CG 4.31Å; W402-Q513 PolarHBondContact NE1-O 2.84Å; K509-Q513 WeakPolarHBondContact O-CG 3.35Å; K509-Q513 PolarHBondContact O-N 3.18Å; K509-Q513 VanDerWaalsContact O-N 3.08Å; L510-Q513 WeakPolarHBondContact O-CB 3.22Å; L510-Q513 PolarHBondContact O-N 2.82Å; L510-Q513 VanDerWaalsContact O-N 3.12Å; Q513-S516 WeakPolarHBondContact CA-OG 3.46Å; Q513-S516 PolarHBondContact O-N 2.96Å; Q513-S516 PolarHBondContact O-OG 3.09Å; Q513-T517 PolarHBondContact O-N 3.37Å; Q513-T517 PolarHBondContact O-OG1 3.38Å
514	I	89.3	Confident	74.6	Confident	5 Å²	5	75.3 Å²	75.3	3%	0.026	42%	0.422	C	S	.	.	H	α-helix	trans	-59.8	-50.7	172.4	-69.3	162.1	0	0	0	109.6	W402 M478 K482 L485 L510 L511 S516 T517 E518	W402-I514 HydrophobicContact CH2-CB 4.41Å; W402-I514 HydrophobicContact CH2-CD1 4.32Å; W402-I514 HydrophobicContact CH2-CG1 3.34Å; W402-I514 HydrophobicContact CZ2-CB 4.36Å; W402-I514 HydrophobicContact CZ2-CG1 3.73Å; W402-I514 HydrophobicContact CZ3-CG1 4.18Å; M478-I514 HydrophobicContact CE-CG1 4.33Å; K482-I514 HydrophobicContact CB-CD1 4.45Å; K482-I514 HydrophobicContact CB-CG2 4.21Å; K482-I514 HydrophobicContact CD-CG2 3.97Å; K482-I514 HydrophobicContact CG-CG2 4.07Å; L485-I514 HydrophobicContact CD1-CD1 3.82Å; L510-I514 WeakPolarHBondContact O-CG1 3.34Å; L510-I514 PolarHBondContact O-N 3.21Å; L511-I514 PolarHBondContact O-N 2.83Å; I514-S516 VanDerWaalsContact C-N 3.32Å; I514-S516 PolarHBondContact O-N 3.46Å; I514-T517 WeakPolarHBondContact O-CB 3.2Å; I514-T517 PolarHBondContact O-N 3.29Å; I514-E518 PolarHBondContact O-N 3.04Å
515	A	87.4	Confident	72.1	Confident	51 Å²	51	80.4 Å²	80.4	42%	0.421	46%	0.456	S	S	.	.	H	α-helix	trans	-61.5	-36.8	179.8	0	0	0	0	0	113.1	L511 L512 T517 E518	L511-A515 WeakPolarHBondContact O-CB 3.31Å; L511-A515 PolarHBondContact O-N 2.88Å; L512-A515 PolarHBondContact O-N 3.49Å; A515-T517 PolarHBondContact O-N 2.87Å; A515-E518 PolarHBondContact O-N 3.42Å
516	S	85.1	Confident	69.3	Low	83 Å²	83	82.2 Å²	82.2	58%	0.58	49%	0.488	S	S	*	.	H	α-helix	trans	-71.3	-17.6	176.5	61.8	0	0	0	0	113.9	L512 Q513 I514 P519	L512-S516 PolarHBondContact O-N 2.85Å; L512-S516 PolarHBondContact O-OG 3.45Å; Q513-S516 WeakPolarHBondContact CA-OG 3.46Å; Q513-S516 PolarHBondContact O-N 2.96Å; Q513-S516 PolarHBondContact O-OG 3.09Å; I514-S516 VanDerWaalsContact C-N 3.32Å; I514-S516 PolarHBondContact O-N 3.46Å; S516-P519 WeakPolarHBondContact O-CD 3.4Å
517	T	78	Confident	68.2	Low	43 Å²	43	84.7 Å²	84.7	26%	0.264	50%	0.504	S	S	.	.	H	α-helix	trans	-85.1	-21.6	179.2	-48.7	0	0	0	0	112	W402 I406 Q513 I514 A515 P519	W402-T517 PolarHBondContact NE1-OG1 2.83Å; I406-T517 HydrophobicContact CB-CG2 4.38Å; I406-T517 HydrophobicContact CD1-CG2 3.57Å; I406-T517 HydrophobicContact CG2-CG2 4.3Å; Q513-T517 PolarHBondContact O-N 3.37Å; Q513-T517 PolarHBondContact O-OG1 3.38Å; I514-T517 WeakPolarHBondContact O-CB 3.2Å; I514-T517 PolarHBondContact O-N 3.29Å; A515-T517 PolarHBondContact O-N 2.87Å; T517-P519 VanDerWaalsContact C-CD 3.47Å
518	E	62	Low	66.8	Low	96 Å²	96	89.2 Å²	89.2	45%	0.449	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-11.9	-175.4	-78.6	175	-175.7	0	0	117.9	K482 I514 A515	K482-E518 IonicContact NZ-OE1 2.75Å; K482-E518 PolarHBondContact NZ-OE1 2.81Å; K482-E518 IonicContact NZ-OE2 2.97Å; K482-E518 PolarHBondContact NZ-OE2 2.98Å; I514-E518 PolarHBondContact O-N 3.04Å; A515-E518 PolarHBondContact O-N 3.42Å
519	P	51.5	Low	65.3	Low	109 Å²	109	91.1 Å²	91.1	71%	0.708	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-4.6	-177.8	-10	28.3	0	0	0	118.7	S516 T517	S516-P519 WeakPolarHBondContact O-CD 3.4Å; T517-P519 VanDerWaalsContact C-CD 3.47Å
520	S	42.2	Very low	63.6	Low	105 Å²	105	90.1 Å²	90.1	73%	0.734	55%	0.548	S	S	*	.	S	Bend	trans	-121	10.2	-170.7	56	0	0	0	0	116.9
521	R	40.4	Very low	61.8	Low	158 Å²	158	95.7 Å²	95.7	60%	0.596	58%	0.582	S	S	*	*			trans	-126.3	46.7	173.4	-67	-171.5	-177.4	165	5.4	113.2	N407	N407-R521 PolarHBondContact OD1-NH2 3.12Å
522	L	32.4	Very low	59.6	Low	161 Å²	161	99.6 Å²	99.6	84%	0.843	61%	0.608	S	S	*	*			trans	-95.2	111.4	149.5	-79.2	162.1	0	0	0	106.2	A524	L522-A524 PolarHBondContact O-N 3.09Å
523	P	36.1	Very low	57.2	Low	106 Å²	106	97.6 Å²	97.6	69%	0.688	60%	0.604	S	S	*	*			trans	-57.4	128.9	164.9	24.5	-29.1	0	0	0	107	C525	P523-C525 VanDerWaalsContact C-N 3.34Å; P523-C525 PolarHBondContact O-N 3.27Å
524	A	35	Very low	54.5	Low	94 Å²	94	102.2 Å²	102.2	78%	0.777	64%	0.637	S	S	*	*			trans	-55.5	102.4	170.7	0	0	0	0	0	107.7	L522 S526	L522-A524 PolarHBondContact O-N 3.09Å; A524-S526 PolarHBondContact O-N 2.65Å
525	C	35.7	Very low	51.6	Low	130 Å²	130	110.3 Å²	110.3	88%	0.878	69%	0.688	S	S	*	*			trans	-62.9	106.7	164.8	-71.8	0	0	0	0	106.3	P523	P523-C525 VanDerWaalsContact C-N 3.34Å; P523-C525 PolarHBondContact O-N 3.27Å
526	S	33	Very low	48.3	Very low	188 Å²	188	115.7 Å²	115.7	100%	1.315	71%	0.712	S	S	*	*			trans	-92.7	0	156.8	27.6	0	0	0	0	108	A524	A524-S526 PolarHBondContact O-N 2.65Å

Retrieved 526 of 526 residues in 224.2 ms (Link to these results)

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