A0A087WYN0_HUMAN Loading...

Transporter

AlphaFold DB , UniProt , Accession A0A087WYN0, Species HUMAN (Homo sapiens, Human), Gene SLC6A6, Length 460 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	Very low	27.8	Very low	216 Å²	216	107.7 Å²	107.7	100%	1.064	58%	0.583	S	S	*	*				0	-45.5	0	-100.4	166.6	164.3	0	0	112.5	D3 A4	M1-D3 VanDerWaalsContact C-N 3.31Å; M1-D3 PolarHBondContact O-N 2.68Å; M1-A4 PolarHBondContact O-N 3.33Å
2	G	23.3	Very low	27.9	Very low	50 Å²	50	108.8 Å²	108.8	52%	0.515	58%	0.581	S	S	.	*	H	α-helix	trans	-57.4	-30	-177.8	0	0	0	0	0	117.1	A4 S6	G2-A4 VanDerWaalsContact C-N 3.34Å; G2-A4 PolarHBondContact O-N 3.02Å; G2-S6 PolarHBondContact O-N 2.74Å; G2-S6 VanDerWaalsContact O-N 3.1Å
3	D	23.2	Very low	27.9	Very low	140 Å²	140	106.6 Å²	106.6	75%	0.749	57%	0.574	S	S	*	*	H	α-helix	trans	-70.7	-27	-178.4	-56.5	-65.3	0	0	0	114	M1 C7	M1-D3 VanDerWaalsContact C-N 3.31Å; M1-D3 PolarHBondContact O-N 2.68Å; D3-C7 WeakPolarHBondContact O-CB 3.38Å; D3-C7 PolarHBondContact O-N 2.85Å; D3-C7 VanDerWaalsContact O-N 3.09Å
4	A	28.3	Very low	27.8	Very low	62 Å²	62	111.6 Å²	111.6	51%	0.512	58%	0.581	S	S	.	*	H	α-helix	trans	-72.1	-43.9	177.8	0	0	0	0	0	111.6	M1 G2 C7 L8	M1-A4 PolarHBondContact O-N 3.33Å; G2-A4 VanDerWaalsContact C-N 3.34Å; G2-A4 PolarHBondContact O-N 3.02Å; A4-C7 PolarHBondContact O-N 3.14Å; A4-L8 WeakPolarHBondContact O-CG 3.32Å; A4-L8 PolarHBondContact O-N 3.4Å
5	E	31.7	Very low	28.1	Very low	130 Å²	130	107.9 Å²	107.9	61%	0.607	56%	0.559	S	S	*	*	H	α-helix	trans	-64.4	-41.7	173.4	-76.4	-176.9	105.5	0	0	111.9	C7 L8 L9	E5-C7 PolarHBondContact O-N 3.39Å; E5-L8 PolarHBondContact O-N 3.15Å; E5-L9 WeakPolarHBondContact O-CB 3.42Å; E5-L9 PolarHBondContact O-N 3.48Å
6	S	24.7	Very low	28.2	Very low	45 Å²	45	106.7 Å²	106.7	32%	0.315	56%	0.558	S	S	.	*	H	α-helix	trans	-64	-27	176.8	-142.4	0	0	0	0	112.4	G2 R10	G2-S6 PolarHBondContact O-N 2.74Å; G2-S6 VanDerWaalsContact O-N 3.1Å; S6-R10 WeakPolarHBondContact O-CB 3.29Å; S6-R10 VanDerWaalsContact O-CD 3.29Å; S6-R10 WeakPolarHBondContact O-CD 3.39Å; S6-R10 WeakPolarHBondContact O-CG 3.41Å; S6-R10 PolarHBondContact O-N 3.09Å; S6-R10 PolarHBondContact O-NE 2.62Å; S6-R10 VanDerWaalsContact O-NE 3.11Å; S6-R10 PolarHBondContact OG-NH2 2.97Å
7	C	26.2	Very low	28.3	Very low	70 Å²	70	111.5 Å²	111.5	47%	0.473	57%	0.567	S	S	.	*	H	α-helix	trans	-78.3	-45	173	-158.4	0	0	0	0	112	D3 A4 E5 R10 Q11	D3-C7 WeakPolarHBondContact O-CB 3.38Å; D3-C7 PolarHBondContact O-N 2.85Å; D3-C7 VanDerWaalsContact O-N 3.09Å; A4-C7 PolarHBondContact O-N 3.14Å; E5-C7 PolarHBondContact O-N 3.39Å; C7-R10 PolarHBondContact O-N 3.5Å; C7-Q11 PolarHBondContact O-N 2.82Å
8	L	30.5	Very low	28.3	Very low	103 Å²	103	110.9 Å²	110.9	54%	0.539	56%	0.56	S	S	.	*	H	α-helix	trans	-60.9	-44.5	177.1	-79.5	164.2	0	0	0	112.7	A4 E5 Q11 Q12	A4-L8 WeakPolarHBondContact O-CG 3.32Å; A4-L8 PolarHBondContact O-N 3.4Å; E5-L8 PolarHBondContact O-N 3.15Å; L8-Q11 PolarHBondContact O-N 3.33Å; L8-Q12 PolarHBondContact O-N 3.28Å
9	L	28.9	Very low	28.8	Very low	102 Å²	102	109.4 Å²	109.4	53%	0.534	55%	0.549	S	S	.	.	H	α-helix	trans	-63.9	-40.8	175	-76.8	163.6	0	0	0	111.5	E5 Q11 Q12 T13	E5-L9 WeakPolarHBondContact O-CB 3.42Å; E5-L9 PolarHBondContact O-N 3.48Å; L9-Q11 VanDerWaalsContact C-N 3.34Å; L9-Q11 PolarHBondContact O-N 2.84Å; L9-Q12 PolarHBondContact O-N 3.46Å; L9-T13 PolarHBondContact O-N 3.3Å; L9-T13 PolarHBondContact O-OG1 3.49Å
10	R	27.1	Very low	29	Very low	165 Å²	165	105.2 Å²	105.2	62%	0.623	53%	0.53	S	S	*	.	H	α-helix	trans	-67.9	-32	175.2	-72.6	173.8	-141.8	-123.1	3.8	112.7	S6 C7 R14	S6-R10 WeakPolarHBondContact O-CB 3.29Å; S6-R10 VanDerWaalsContact O-CD 3.29Å; S6-R10 WeakPolarHBondContact O-CD 3.39Å; S6-R10 WeakPolarHBondContact O-CG 3.41Å; S6-R10 PolarHBondContact O-N 3.09Å; S6-R10 PolarHBondContact O-NE 2.62Å; S6-R10 VanDerWaalsContact O-NE 3.11Å; S6-R10 PolarHBondContact OG-NH2 2.97Å; C7-R10 PolarHBondContact O-N 3.5Å; R10-R14 WeakPolarHBondContact O-CB 3.38Å; R10-R14 VanDerWaalsContact O-CG 3.23Å; R10-R14 WeakPolarHBondContact O-CG 3.42Å; R10-R14 PolarHBondContact O-N 2.97Å
11	Q	29	Very low	29.1	Very low	102 Å²	102	104.1 Å²	104.1	48%	0.477	53%	0.526	S	S	.	.	H	α-helix	trans	-67.6	-48.8	170.6	-80.2	-178.8	-29	0	0	111.1	C7 L8 L9 T13 R14 E15	C7-Q11 PolarHBondContact O-N 2.82Å; L8-Q11 PolarHBondContact O-N 3.33Å; L9-Q11 VanDerWaalsContact C-N 3.34Å; L9-Q11 PolarHBondContact O-N 2.84Å; Q11-T13 PolarHBondContact O-N 2.91Å; Q11-R14 PolarHBondContact O-N 3.48Å; Q11-E15 WeakPolarHBondContact O-CB 3.44Å; Q11-E15 PolarHBondContact O-N 3.49Å
12	Q	29.1	Very low	29.3	Very low	120 Å²	120	95.6 Å²	95.6	56%	0.561	48%	0.484	S	S	*	.	H	α-helix	trans	-60	-45.1	178.8	-76.1	-171.8	-22.1	0	0	112.9	L8 L9 R14 E15 V16	L8-Q12 PolarHBondContact O-N 3.28Å; L9-Q12 PolarHBondContact O-N 3.46Å; Q12-R14 VanDerWaalsContact C-N 3.29Å; Q12-R14 PolarHBondContact O-N 2.98Å; Q12-E15 PolarHBondContact O-N 2.9Å; Q12-V16 WeakPolarHBondContact O-CG2 3.32Å; Q12-V16 PolarHBondContact O-N 3.5Å
13	T	27.6	Very low	29.7	Very low	81 Å²	81	98.9 Å²	98.9	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-72.2	-20.5	179.3	-49.9	0	0	0	0	113.2	L9 Q11	L9-T13 PolarHBondContact O-N 3.3Å; L9-T13 PolarHBondContact O-OG1 3.49Å; Q11-T13 PolarHBondContact O-N 2.91Å
14	R	26.9	Very low	30.3	Very low	177 Å²	177	94.1 Å²	94.1	67%	0.668	46%	0.461	S	S	*	.	H	α-helix	trans	-82.4	-32.4	168.5	-76.3	178.6	178.2	-156.8	-0.6	112.4	R10 Q11 Q12 K18	R10-R14 WeakPolarHBondContact O-CB 3.38Å; R10-R14 VanDerWaalsContact O-CG 3.23Å; R10-R14 WeakPolarHBondContact O-CG 3.42Å; R10-R14 PolarHBondContact O-N 2.97Å; Q11-R14 PolarHBondContact O-N 3.48Å; Q12-R14 VanDerWaalsContact C-N 3.29Å; Q12-R14 PolarHBondContact O-N 2.98Å; R14-K18 WeakPolarHBondContact O-CG 3.31Å
15	E	31.8	Very low	30.4	Very low	55 Å²	55	99.1 Å²	99.1	26%	0.257	47%	0.467	S	S	.	.	H	α-helix	trans	-70.6	-46.6	175.3	-84.1	-56.6	135.6	0	0	111.9	Q11 Q12 R17 K18 K19 Y170	Q11-E15 WeakPolarHBondContact O-CB 3.44Å; Q11-E15 PolarHBondContact O-N 3.49Å; Q12-E15 PolarHBondContact O-N 2.9Å; E15-R17 VanDerWaalsContact C-N 3.27Å; E15-R17 PolarHBondContact O-N 2.97Å; E15-K18 WeakPolarHBondContact O-CA 3.32Å; E15-K18 WeakPolarHBondContact O-CB 3.36Å; E15-K18 PolarHBondContact O-N 3.35Å; E15-K19 WeakPolarHBondContact O-CG 3.43Å; E15-K19 PolarHBondContact O-N 3.48Å; E15-Y170 PolarHBondContact OE1-OH 2.9Å; E15-Y170 PolarHBondContact OE2-OH 2.6Å
16	V	30.2	Very low	30.5	Very low	89 Å²	89	94.7 Å²	94.7	54%	0.539	45%	0.446	S	S	.	.	H	α-helix	trans	-54.2	-41.8	179	171.6	0	0	0	0	112.3	Q12 K18 K19	Q12-V16 WeakPolarHBondContact O-CG2 3.32Å; Q12-V16 PolarHBondContact O-N 3.5Å; V16-K18 PolarHBondContact O-N 3.47Å; V16-K19 PolarHBondContact O-N 3.03Å
17	R	29.2	Very low	30.8	Very low	188 Å²	188	97.4 Å²	97.4	71%	0.709	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-14.3	174.9	-92.5	-173.7	-75.5	-162.5	-6.8	115.2	E15	E15-R17 VanDerWaalsContact C-N 3.27Å; E15-R17 PolarHBondContact O-N 2.97Å
18	K	29.3	Very low	31	Very low	102 Å²	102	100.1 Å²	100.1	44%	0.443	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-15.5	178.9	-69.9	175.7	179.9	-179.5	0	113.7	R14 E15 V16 L21 I22	R14-K18 WeakPolarHBondContact O-CG 3.31Å; E15-K18 WeakPolarHBondContact O-CA 3.32Å; E15-K18 WeakPolarHBondContact O-CB 3.36Å; E15-K18 PolarHBondContact O-N 3.35Å; V16-K18 PolarHBondContact O-N 3.47Å; K18-L21 CarbonylContact O-C 3.6Å; K18-L21 PolarHBondContact O-N 2.8Å; K18-L21 VanDerWaalsContact O-N 3.14Å; K18-I22 HydrophobicContact CB-CD1 3.69Å; K18-I22 HydrophobicContact CB-CG1 4.18Å; K18-I22 HydrophobicContact CD-CD1 4.37Å; K18-I22 WeakPolarHBondContact O-CB 3.43Å; K18-I22 WeakPolarHBondContact O-CG1 3.5Å; K18-I22 PolarHBondContact O-N 3.49Å
19	K	38.3	Very low	30.9	Very low	82 Å²	82	97.2 Å²	97.2	36%	0.357	45%	0.448	S	S	.	.	H	α-helix	trans	-58.6	-43.1	-172.6	-59.8	-175.9	-175	175.3	0	114.2	E15 V16 I22 N23 W166	E15-K19 WeakPolarHBondContact O-CG 3.43Å; E15-K19 PolarHBondContact O-N 3.48Å; V16-K19 PolarHBondContact O-N 3.03Å; K19-I22 PolarHBondContact O-N 2.74Å; K19-N23 PolarHBondContact O-N 3.34Å; K19-W166 HydrophobicContact CD-CH2 4.36Å; K19-W166 HydrophobicContact CD-CZ3 4.16Å
20	P	31.3	Very low	31	Very low	25 Å²	25	95.4 Å²	95.4	16%	0.162	45%	0.447	C	S	.	.	H	α-helix	trans	-66.4	-42.4	174.6	-17.8	31.7	0	0	0	112	I22 Y24 I297	P20-I22 VanDerWaalsContact C-N 3.34Å; P20-I22 PolarHBondContact O-N 3.2Å; P20-Y24 PolarHBondContact O-N 2.84Å; P20-I297 HydrophobicContact CB-CG1 4.16Å
21	L	32.3	Very low	31.1	Very low	83 Å²	83	91.1 Å²	91.1	44%	0.435	45%	0.447	S	S	.	.	H	α-helix	trans	-64.8	-32.3	178.6	-95.2	85.3	0	0	0	113.5	K18 R25	K18-L21 CarbonylContact O-C 3.6Å; K18-L21 PolarHBondContact O-N 2.8Å; K18-L21 VanDerWaalsContact O-N 3.14Å; L21-R25 WeakPolarHBondContact O-CB 3.39Å; L21-R25 VanDerWaalsContact O-CG 3.24Å; L21-R25 WeakPolarHBondContact O-CG 3.47Å; L21-R25 PolarHBondContact O-N 3.37Å
22	I	36	Very low	31.1	Very low	37 Å²	37	90.9 Å²	90.9	19%	0.19	45%	0.449	C	S	.	.	H	α-helix	trans	-79.8	-43.8	-175	-71.9	173.2	0	0	0	111.8	K18 K19 P20 Y24 R25 F26 Y170	K18-I22 HydrophobicContact CB-CD1 3.69Å; K18-I22 HydrophobicContact CB-CG1 4.18Å; K18-I22 HydrophobicContact CD-CD1 4.37Å; K18-I22 WeakPolarHBondContact O-CB 3.43Å; K18-I22 WeakPolarHBondContact O-CG1 3.5Å; K18-I22 PolarHBondContact O-N 3.49Å; K19-I22 PolarHBondContact O-N 2.74Å; P20-I22 VanDerWaalsContact C-N 3.34Å; P20-I22 PolarHBondContact O-N 3.2Å; I22-Y24 PolarHBondContact O-N 2.58Å; I22-R25 CarbonylContact O-C 3.59Å; I22-R25 PolarHBondContact O-N 3.48Å; I22-R25 VanDerWaalsContact O-N 3.08Å; I22-F26 WeakPolarHBondContact O-CB 3.24Å; I22-F26 PolarHBondContact O-N 3.35Å; I22-Y170 HydrophobicContact CD1-CE2 4.02Å; I22-Y170 HydrophobicContact CG2-CD2 4.2Å; I22-Y170 HydrophobicContact CG2-CE2 3.92Å
23	N	33	Very low	31	Very low	119 Å²	119	89.2 Å²	89.2	64%	0.636	46%	0.456	S	S	*	.	H	α-helix	trans	-57.4	-39.3	172.9	-82.5	-1.8	0	0	0	110.9	K19 F26 L27	K19-N23 PolarHBondContact O-N 3.34Å; N23-F26 PolarHBondContact O-N 2.63Å; N23-L27 WeakPolarHBondContact O-CG 3.25Å; N23-L27 PolarHBondContact O-N 3.46Å; N23-L27 VanDerWaalsContact O-N 3.13Å
24	Y	34.7	Very low	30.9	Very low	40 Å²	40	93.4 Å²	93.4	16%	0.157	47%	0.47	C	S	.	.	H	α-helix	trans	-72.9	-32.7	175.5	-164.2	-112.7	0	0	0	113.7	P20 I22 R28 R278 I297	P20-Y24 PolarHBondContact O-N 2.84Å; I22-Y24 PolarHBondContact O-N 2.58Å; Y24-R28 WeakPolarHBondContact O-CB 3.45Å; Y24-R28 PolarHBondContact O-N 2.86Å; Y24-R278 PolarHBondContact OH-NH1 3.45Å; Y24-I297 HydrophobicContact CG-CD1 4.28Å
25	R	31.4	Very low	30.7	Very low	166 Å²	166	91.1 Å²	91.1	63%	0.626	48%	0.478	S	S	*	.	H	α-helix	trans	-69.2	-33.2	171.6	-80.8	176.9	-177.8	-150.6	0.6	112.7	L21 I22 R28 A29	L21-R25 WeakPolarHBondContact O-CB 3.39Å; L21-R25 VanDerWaalsContact O-CG 3.24Å; L21-R25 WeakPolarHBondContact O-CG 3.47Å; L21-R25 PolarHBondContact O-N 3.37Å; I22-R25 CarbonylContact O-C 3.59Å; I22-R25 PolarHBondContact O-N 3.48Å; I22-R25 VanDerWaalsContact O-N 3.08Å; R25-R28 PolarHBondContact O-N 2.85Å; R25-A29 WeakPolarHBondContact O-CB 3.26Å; R25-A29 PolarHBondContact O-N 2.83Å
26	F	32.6	Very low	30.4	Very low	37 Å²	37	99.8 Å²	99.8	16%	0.162	51%	0.508	C	S	.	.	H	α-helix	trans	-64.4	-51.3	173.6	-173.3	-94.7	0	0	0	110.4	I22 N23 R28 A29 A30 Y173 F377 T459	I22-F26 WeakPolarHBondContact O-CB 3.24Å; I22-F26 PolarHBondContact O-N 3.35Å; N23-F26 PolarHBondContact O-N 2.63Å; F26-R28 VanDerWaalsContact C-N 3.28Å; F26-R28 PolarHBondContact O-N 3.14Å; F26-A29 PolarHBondContact O-N 3Å; F26-A29 VanDerWaalsContact O-N 3.1Å; F26-A30 PolarHBondContact O-N 2.81Å; F26-Y173 HydrophobicContact CD2-CD1 4.4Å; F26-Y173 HydrophobicContact CD2-CE1 4.27Å; F26-Y173 HydrophobicContact CD2-CE2 4.45Å; F26-Y173 HydrophobicContact CE2-CD2 4.15Å; F26-Y173 HydrophobicContact CE2-CE2 4.3Å; F26-Y173 HydrophobicContact CE2-CG 4.34Å; F26-F377 HydrophobicContact CE2-CD1 4.21Å; F26-F377 HydrophobicContact CE2-CE1 4.1Å; F26-T459 HydrophobicContact CE1-CG2 4.33Å; F26-T459 HydrophobicContact CZ-CG2 3.8Å
27	L	31.7	Very low	30	Very low	103 Å²	103	98.7 Å²	98.7	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-57.9	-37.3	171.8	-69.2	167	0	0	0	112.7	N23 A31	N23-L27 WeakPolarHBondContact O-CG 3.25Å; N23-L27 PolarHBondContact O-N 3.46Å; N23-L27 VanDerWaalsContact O-N 3.13Å; L27-A31 VanDerWaalsContact O-CB 3.26Å; L27-A31 WeakPolarHBondContact O-CB 3.31Å; L27-A31 PolarHBondContact O-N 3.34Å
28	R	30	Very low	29.8	Very low	126 Å²	126	96.4 Å²	96.4	48%	0.475	53%	0.525	S	S	.	.	H	α-helix	trans	-71.1	-27.8	176.4	-172.3	173.8	-167.9	167.9	4.8	113.6	Y24 R25 F26 N32	Y24-R28 WeakPolarHBondContact O-CB 3.45Å; Y24-R28 PolarHBondContact O-N 2.86Å; R25-R28 PolarHBondContact O-N 2.85Å; F26-R28 VanDerWaalsContact C-N 3.28Å; F26-R28 PolarHBondContact O-N 3.14Å; R28-N32 WeakPolarHBondContact O-CB 3.49Å
29	A	29.4	Very low	29.4	Very low	43 Å²	43	101 Å²	101	36%	0.355	55%	0.548	S	S	.	.	H	α-helix	trans	-78.4	-45.8	174.5	0	0	0	0	0	111	R25 F26 A31 N32	R25-A29 WeakPolarHBondContact O-CB 3.26Å; R25-A29 PolarHBondContact O-N 2.83Å; F26-A29 PolarHBondContact O-N 3Å; F26-A29 VanDerWaalsContact O-N 3.1Å; A29-A31 VanDerWaalsContact C-N 3.34Å; A29-A31 PolarHBondContact O-N 3.31Å; A29-N32 PolarHBondContact O-N 2.78Å
30	A	30	Very low	28.7	Very low	63 Å²	63	101.7 Å²	101.7	52%	0.521	57%	0.569	S	S	.	*	H	α-helix	trans	-60.8	-40.1	176.9	0	0	0	0	0	112.6	F26 N32	F26-A30 PolarHBondContact O-N 2.81Å; A30-N32 VanDerWaalsContact C-N 3.31Å; A30-N32 PolarHBondContact O-N 3.49Å
31	A	30.3	Very low	28.3	Very low	75 Å²	75	110.1 Å²	110.1	62%	0.62	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-14.9	-180	0	0	0	0	0	115.2	L27 A29	L27-A31 VanDerWaalsContact O-CB 3.26Å; L27-A31 WeakPolarHBondContact O-CB 3.31Å; L27-A31 PolarHBondContact O-N 3.34Å; A29-A31 VanDerWaalsContact C-N 3.34Å; A29-A31 PolarHBondContact O-N 3.31Å
32	N	28.8	Very low	27.7	Very low	98 Å²	98	117.4 Å²	117.4	52%	0.524	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.1	10.1	-171.5	-75.8	10.2	0	0	0	113.8	R28 A29 A30 E34	R28-N32 WeakPolarHBondContact O-CB 3.49Å; A29-N32 PolarHBondContact O-N 2.78Å; A30-N32 VanDerWaalsContact C-N 3.31Å; A30-N32 PolarHBondContact O-N 3.49Å; N32-E34 PolarHBondContact O-N 3.02Å
33	A	26.4	Very low	27.1	Very low	85 Å²	85	121.9 Å²	121.9	70%	0.702	66%	0.657	S	S	*	*			trans	-82.1	78.1	-174	0	0	0	0	0	113.4
34	E	24.5	Very low	26.5	Very low	169 Å²	169	121.5 Å²	121.5	79%	0.79	66%	0.664	S	S	*	*			trans	-86.9	142.9	155.8	-92.1	-176.2	162.8	0	0	110.7	N32 R36	N32-E34 PolarHBondContact O-N 3.02Å; E34-R36 PolarHBondContact O-N 2.79Å
35	P	24.2	Very low	25.9	Very low	129 Å²	129	125.6 Å²	125.6	84%	0.838	70%	0.697	S	S	*	*			trans	-75.5	122.6	-172.1	30.2	-34.3	0	0	0	111.8
36	R	24.2	Very low	25.4	Very low	236 Å²	236	121.8 Å²	121.8	89%	0.891	70%	0.701	S	S	*	*			trans	-120.4	129.8	163.9	-63.1	-168.7	-169.2	-171.3	4.2	110.1	E34	E34-R36 PolarHBondContact O-N 2.79Å
37	G	22.7	Very low	25	Very low	67 Å²	67	129.6 Å²	129.6	69%	0.691	74%	0.735	S	S	*	*			trans	-70.6	174.6	179.9	0	0	0	0	0	113.7
38	P	24.5	Very low	24.5	Very low	139 Å²	139	136.3 Å²	136.3	90%	0.903	75%	0.753	S	S	*	*			trans	-78.8	131.9	-167.9	31.3	-34.5	0	0	0	112.2
39	Q	22.1	Very low	24.2	Very low	198 Å²	198	139.4 Å²	139.4	93%	0.925	77%	0.773	S	S	*	*			trans	-127.3	124.3	164.6	-145.6	167.2	12.2	0	0	109.2
40	A	22.8	Very low	23.9	Very low	97 Å²	97	144.1 Å²	144.1	80%	0.802	80%	0.801	S	S	*	*			trans	-84.7	149.7	-169.4	0	0	0	0	0	112.5
41	Q	22.6	Very low	23.6	Very low	202 Å²	202	144.8 Å²	144.8	94%	0.944	81%	0.814	S	S	*	*			trans	-144.4	140.5	159.9	-110.7	167.9	2.4	0	0	111.5
42	R	20.8	Very low	23.3	Very low	236 Å²	236	145.8 Å²	145.8	89%	0.891	82%	0.823	S	S	*	*			trans	-101.3	142.5	-171	-74	176.7	169.2	173.3	-4.6	112
43	T	22.1	Very low	23.1	Very low	132 Å²	132	149.2 Å²	149.2	81%	0.81	83%	0.833	S	S	*	*			trans	14.2	133.7	145.1	58.8	0	0	0	0	121.1
44	S	21.5	Very low	23.2	Very low	111 Å²	111	152.3 Å²	152.3	78%	0.776	84%	0.844	S	S	*	*				175.8	149.5	110.3	-167.1	0	0	0	0	115.3
45	C	20.7	Very low	23.3	Very low	125 Å²	125	153 Å²	153	85%	0.845	85%	0.847	S	S	*	*			trans	61.5	144.8	161.5	-93	0	0	0	0	120.8
46	A	22.4	Very low	23.4	Very low	86 Å²	86	157 Å²	157	71%	0.711	85%	0.846	S	S	*	*			cis	-145.8	151.7	-4.5	0	0	0	0	0	108.1
47	K	22.8	Very low	23.7	Very low	202 Å²	202	153 Å²	153	88%	0.878	85%	0.847	S	S	*	*			cis	64.3	71.9	41.9	-104.8	-168.7	-176.1	-177.8	0	116.1
48	R	22.2	Very low	24	Very low	243 Å²	243	161.2 Å²	161.2	92%	0.917	86%	0.857	S	S	*	*			trans	173.3	136.7	155.7	-93.3	163.5	-152.8	-149.6	7	104.1
49	E	23.7	Very low	24.1	Very low	191 Å²	191	163.6 Å²	163.6	89%	0.893	86%	0.856	S	S	*	*			cis	-138.4	145.6	16.4	-57.5	174.5	134.5	0	0	109.9
50	C	22.3	Very low	24.3	Very low	142 Å²	142	166.5 Å²	166.5	96%	0.959	86%	0.859	S	S	*	*			trans	-145.6	112.3	169.7	-177.3	0	0	0	0	108.7
51	G	24.3	Very low	24.5	Very low	77 Å²	77	167 Å²	167	79%	0.794	86%	0.863	S	S	*	*			trans	127.8	95.5	177.2	0	0	0	0	0	113.6
52	A	24.4	Very low	24.5	Very low	97 Å²	97	160.9 Å²	160.9	80%	0.802	85%	0.854	S	S	*	*			trans	167.1	68.9	148.4	0	0	0	0	0	111.9
53	F	24.5	Very low	24.8	Very low	169 Å²	169	162 Å²	162	74%	0.741	86%	0.858	S	S	*	*			trans	-148.6	41	157.6	-140.9	-97.8	0	0	0	114.3
54	T	27.7	Very low	25	Very low	150 Å²	150	164.4 Å²	164.4	92%	0.92	86%	0.86	S	S	*	*			trans	-109.2	40.8	176.1	-19.6	0	0	0	0	111.4
55	Q	27.1	Very low	25.9	Very low	185 Å²	185	164.2 Å²	164.2	86%	0.864	86%	0.856	S	S	*	*			trans	-151.7	65.4	-174.8	-157.1	169.4	1.3	0	0	113.6
56	R	27.2	Very low	26.8	Very low	213 Å²	213	163.4 Å²	163.4	80%	0.804	85%	0.849	S	S	*	*	S	Bend	trans	-156.2	37.4	164.7	-132.3	178.2	-80.3	-157	-0.8	116.3
57	V	30	Very low	27	Very low	152 Å²	152	164.5 Å²	164.5	92%	0.921	86%	0.859	S	S	*	*	S	Bend	trans	-135	42.7	172.2	-162.4	0	0	0	0	111.6
58	R	28.3	Very low	27.2	Very low	239 Å²	239	158.8 Å²	158.8	90%	0.902	86%	0.857	S	S	*	*			trans	-146.9	51	176.8	-152.2	-179.9	-166.3	176.4	4.7	114.2
59	E	27.1	Very low	27.3	Very low	189 Å²	189	150.7 Å²	150.7	88%	0.883	85%	0.849	S	S	*	*			trans	-160.1	91.1	169.1	-115.9	164.6	-138	0	0	110.7
60	R	27	Very low	27.5	Very low	259 Å²	259	148 Å²	148	98%	0.977	85%	0.846	S	S	*	*			trans	174.3	69.5	155.5	-98.5	167.9	-166	-151.6	3.6	110.1
61	A	25.7	Very low	27.8	Very low	107 Å²	107	151.6 Å²	151.6	88%	0.884	84%	0.839	S	S	*	*			trans	-137.2	122.2	164.6	0	0	0	0	0	108.1
62	G	24	Very low	27.9	Very low	73 Å²	73	155.2 Å²	155.2	75%	0.753	84%	0.835	S	S	*	*			trans	130	96	173	0	0	0	0	0	115.8
63	R	26.8	Very low	28	Very low	259 Å²	259	155.6 Å²	155.6	98%	0.977	83%	0.831	S	S	*	*			trans	-175.8	149.9	130.3	-96.5	166.6	-165	-156.1	4.4	110.3
64	Q	25.2	Very low	28.2	Very low	183 Å²	183	158.5 Å²	158.5	86%	0.855	84%	0.838	S	S	*	*			trans	-143.5	-174.3	-171.6	-117.6	-173.5	9.2	0	0	107.3
65	P	40.4	Very low	28.3	Very low	108 Å²	108	155.4 Å²	155.4	70%	0.701	83%	0.827	S	S	*	*			cis	-119.5	-123.8	-17.7	29.7	-5.1	0	0	0	108.5
66	P	39.5	Very low	28.5	Very low	108 Å²	108	155.3 Å²	155.3	70%	0.701	83%	0.826	S	S	*	*			cis	-131.4	171.9	-34.3	38.2	-20.3	0	0	0	116.9
67	A	27.7	Very low	28.6	Very low	109 Å²	109	156.6 Å²	156.6	90%	0.901	83%	0.832	S	S	*	*			trans	41.4	145.9	144.9	0	0	0	0	0	123.8
68	G	25.9	Very low	28.4	Very low	82 Å²	82	152.8 Å²	152.8	85%	0.845	82%	0.823	S	S	*	*			cis	164.8	169.3	-4.9	0	0	0	0	0	112.8
69	G	25.6	Very low	28.5	Very low	72 Å²	72	153.4 Å²	153.4	74%	0.742	83%	0.825	S	S	*	*			trans	116.8	89.6	155.3	0	0	0	0	0	123
70	T	26.7	Very low	28.5	Very low	135 Å²	135	156.4 Å²	156.4	83%	0.828	83%	0.829	S	S	*	*				54.3	129	129	39.1	0	0	0	0	127.3
71	R	28.1	Very low	28.5	Very low	217 Å²	217	155.2 Å²	155.2	82%	0.819	82%	0.824	S	S	*	*				118.7	118.7	119.2	-92.1	-177.4	177.5	-171.2	2.5	123.4
72	H	27.7	Very low	28.5	Very low	154 Å²	154	154.8 Å²	154.8	71%	0.713	81%	0.814	S	S	*	*			trans	68.7	123.5	132.6	-82.7	-49.4	0	0	0	127.5
73	S	26	Very low	28.7	Very low	104 Å²	104	160.2 Å²	160.2	73%	0.727	82%	0.82	S	S	*	*				56.4	162	122.8	-60.4	0	0	0	0	123.2
74	R	28.4	Very low	29.5	Very low	231 Å²	231	152.8 Å²	152.8	87%	0.872	81%	0.805	S	S	*	*			cis	178.9	135.8	-29.5	-175.1	-167.9	-176.5	-179.2	2.4	109
75	A	29.3	Very low	29.7	Very low	84 Å²	84	155.6 Å²	155.6	69%	0.694	81%	0.808	S	S	*	*			trans	61.7	174	161.2	0	0	0	0	0	118
76	E	31.2	Very low	29.2	Very low	183 Å²	183	155.7 Å²	155.7	86%	0.855	81%	0.811	S	S	*	*			cis	-154	-154.2	2.3	-145.8	169.2	-173.9	0	0	114.6
77	R	29.4	Very low	29.2	Very low	241 Å²	241	162.2 Å²	162.2	91%	0.909	82%	0.822	S	S	*	*			trans	-107.9	163.6	-163.1	-64.2	166.3	166.6	173	-3.8	115.6
78	G	27.2	Very low	29.7	Very low	72 Å²	72	162.8 Å²	162.8	74%	0.742	81%	0.814	S	S	*	*			trans	173.4	123.3	151.2	0	0	0	0	0	111.8
79	R	29.1	Very low	30.1	Very low	251 Å²	251	168.4 Å²	168.4	95%	0.947	81%	0.81	S	S	*	*			cis	90.1	110.6	32	-158.5	-168.8	-150.4	-161.8	9.8	114.2
80	R	27.7	Very low	30.6	Very low	253 Å²	253	169.4 Å²	169.4	96%	0.955	80%	0.802	S	S	*	*			trans	-167.5	165.3	151.6	-108.5	169.5	-161	-135.2	3.7	114
81	R	27.1	Very low	31.2	Very low	234 Å²	234	168.3 Å²	168.3	88%	0.883	80%	0.795	S	S	*	*			trans	-132.8	-179	-178.3	-56.1	176.6	165.1	169.5	-7	109
82	S	26.5	Very low	31.7	Very low	97 Å²	97	161 Å²	161	68%	0.678	78%	0.781	S	S	*	*			cis	-166.4	143.7	6.2	1.8	0	0	0	0	112.3
83	H	27	Very low	32.2	Very low	187 Å²	187	158.7 Å²	158.7	87%	0.866	77%	0.774	S	S	*	*			trans	60.7	165	146	-87.2	-12.1	0	0	0	122.2
84	P	44.7	Very low	32.7	Very low	104 Å²	104	158.6 Å²	158.6	68%	0.675	76%	0.764	S	S	*	*			cis	-135.3	-172	-17.2	33.4	-12.4	0	0	0	115.5
85	R	28.3	Very low	33.1	Very low	242 Å²	242	156.9 Å²	156.9	91%	0.913	76%	0.758	S	S	*	*			trans	73.6	105.9	163.3	-67.4	-177.1	173.5	177	-1.6	120.2
86	S	30.7	Very low	33.4	Very low	109 Å²	109	155 Å²	155	76%	0.762	74%	0.739	S	S	*	*				-177.5	150.1	107.1	51	0	0	0	0	111.1	T88	S86-T88 PolarHBondContact O-N 3.31Å
87	R	38.7	Very low	33.7	Very low	245 Å²	245	149.5 Å²	149.5	93%	0.925	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	52.5	-156.8	-157.9	180	-169.1	175.4	2.4	113
88	T	38.6	Very low	34.2	Very low	121 Å²	121	143.5 Å²	143.5	74%	0.742	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.4	1.1	-176.2	4.6	0	0	0	0	115.9	S86	S86-T88 PolarHBondContact O-N 3.31Å
89	R	34.9	Very low	34.9	Very low	200 Å²	200	143.6 Å²	143.6	76%	0.755	69%	0.69	S	S	*	*	S	Bend	trans	-99	-17	178.7	-94.4	-178.3	173.4	174.4	-1.1	115.3	T91 A92 L93	R89-T91 PolarHBondContact O-N 3.03Å; R89-A92 PolarHBondContact O-N 2.88Å; R89-L93 HydrophobicContact CB-CD1 4.18Å; R89-L93 WeakPolarHBondContact O-CB 3.48Å; R89-L93 PolarHBondContact O-N 3.41Å
90	T	36.1	Very low	35.6	Very low	93 Å²	93	138.9 Å²	138.9	57%	0.571	68%	0.676	S	S	*	*	H	α-helix	trans	-68.6	-40.1	-167	-35.9	0	0	0	0	113.6	L94	T90-L94 HydrophobicContact CG2-CD1 4.16Å; T90-L94 VanDerWaalsContact O-CB 3.32Å; T90-L94 WeakPolarHBondContact O-CB 3.32Å; T90-L94 WeakPolarHBondContact O-CG 3.39Å; T90-L94 PolarHBondContact O-N 2.63Å
91	T	38.5	Very low	36.4	Very low	113 Å²	113	131.4 Å²	131.4	69%	0.693	65%	0.652	S	S	*	*	H	α-helix	trans	-70.3	-38.9	178	35.9	0	0	0	0	112.7	R89 R95	R89-T91 PolarHBondContact O-N 3.03Å; T91-R95 VanDerWaalsContact O-CB 3.32Å; T91-R95 WeakPolarHBondContact O-CB 3.21Å; T91-R95 PolarHBondContact O-N 2.67Å
92	A	37.8	Very low	37.4	Very low	64 Å²	64	125.4 Å²	125.4	53%	0.529	64%	0.635	S	S	.	*	H	α-helix	trans	-67.9	-40.7	174.4	0	0	0	0	0	112.1	R89 R95 S96	R89-A92 PolarHBondContact O-N 2.88Å; A92-R95 PolarHBondContact O-N 3.06Å; A92-S96 WeakPolarHBondContact O-CB 3.43Å; A92-S96 PolarHBondContact O-N 2.79Å; A92-S96 PolarHBondContact O-OG 3.28Å
93	L	38.2	Very low	38.4	Very low	105 Å²	105	122.8 Å²	122.8	55%	0.55	62%	0.62	S	S	.	*	H	α-helix	trans	-68.5	-43.3	176.2	-79.8	166.9	0	0	0	112.2	R89 R95 S96 S97	R89-L93 HydrophobicContact CB-CD1 4.18Å; R89-L93 WeakPolarHBondContact O-CB 3.48Å; R89-L93 PolarHBondContact O-N 3.41Å; L93-R95 PolarHBondContact O-N 3.39Å; L93-S96 PolarHBondContact O-N 2.98Å; L93-S96 PolarHBondContact O-OG 3.14Å; L93-S97 VanDerWaalsContact O-CB 3.27Å; L93-S97 WeakPolarHBondContact O-CB 3.26Å; L93-S97 PolarHBondContact O-N 2.95Å
94	L	37.9	Very low	39.6	Very low	101 Å²	101	118.3 Å²	118.3	53%	0.529	61%	0.606	S	S	.	*	H	α-helix	trans	-58.8	-46	172.7	-84.5	162.2	0	0	0	111.6	T90 S96 S97 Q98	T90-L94 HydrophobicContact CG2-CD1 4.16Å; T90-L94 VanDerWaalsContact O-CB 3.32Å; T90-L94 WeakPolarHBondContact O-CB 3.32Å; T90-L94 WeakPolarHBondContact O-CG 3.39Å; T90-L94 PolarHBondContact O-N 2.63Å; L94-S96 PolarHBondContact O-N 2.95Å; L94-S97 PolarHBondContact O-N 2.89Å; L94-Q98 WeakPolarHBondContact O-CB 3.3Å; L94-Q98 WeakPolarHBondContact O-CG 3.27Å; L94-Q98 PolarHBondContact O-N 2.83Å
95	R	35.1	Very low	39.7	Very low	196 Å²	196	119 Å²	119	74%	0.74	60%	0.598	S	S	*	*	H	α-helix	trans	-64.8	-38	178.1	-156.2	174.4	-167	-173.1	3.6	112.1	T91 A92 L93 T99	T91-R95 VanDerWaalsContact O-CB 3.32Å; T91-R95 WeakPolarHBondContact O-CB 3.21Å; T91-R95 PolarHBondContact O-N 2.67Å; A92-R95 PolarHBondContact O-N 3.06Å; L93-R95 PolarHBondContact O-N 3.39Å; R95-T99 PolarHBondContact O-N 3.37Å; R95-T99 PolarHBondContact O-OG1 3.38Å
96	S	35.7	Very low	41.2	Very low	44 Å²	44	114 Å²	114	31%	0.308	59%	0.585	S	S	.	*	H	α-helix	trans	-73.8	-30	175.4	78.1	0	0	0	0	113.9	A92 L93 L94 T99 K100	A92-S96 WeakPolarHBondContact O-CB 3.43Å; A92-S96 PolarHBondContact O-N 2.79Å; A92-S96 PolarHBondContact O-OG 3.28Å; L93-S96 PolarHBondContact O-N 2.98Å; L93-S96 PolarHBondContact O-OG 3.14Å; L94-S96 PolarHBondContact O-N 2.95Å; S96-T99 WeakPolarHBondContact CA-OG1 3.47Å; S96-T99 PolarHBondContact O-OG1 2.88Å; S96-K100 VanDerWaalsContact O-CB 3.3Å; S96-K100 WeakPolarHBondContact O-CB 3.24Å; S96-K100 VanDerWaalsContact O-CG 3.24Å; S96-K100 WeakPolarHBondContact O-CG 3.27Å; S96-K100 PolarHBondContact O-N 3.35Å
97	S	37.9	Very low	42.1	Very low	68 Å²	68	116.3 Å²	116.3	48%	0.476	58%	0.581	S	S	.	*	H	α-helix	trans	-72.9	-44.4	174.7	-165.6	0	0	0	0	109.8	L93 L94 K100 E101	L93-S97 VanDerWaalsContact O-CB 3.27Å; L93-S97 WeakPolarHBondContact O-CB 3.26Å; L93-S97 PolarHBondContact O-N 2.95Å; L94-S97 PolarHBondContact O-N 2.89Å; S97-K100 PolarHBondContact O-N 3.35Å; S97-E101 VanDerWaalsContact O-CB 3.26Å; S97-E101 WeakPolarHBondContact O-CB 3.3Å; S97-E101 PolarHBondContact O-N 3.09Å
98	Q	40.4	Very low	42.5	Very low	114 Å²	114	109.1 Å²	109.1	53%	0.533	56%	0.561	S	S	.	*	H	α-helix	trans	-64.9	-42.2	175.1	-75.9	-177.9	-24.3	0	0	112.4	L94 E101 M102	L94-Q98 WeakPolarHBondContact O-CB 3.3Å; L94-Q98 WeakPolarHBondContact O-CG 3.27Å; L94-Q98 PolarHBondContact O-N 2.83Å; Q98-E101 PolarHBondContact O-N 2.99Å; Q98-M102 WeakPolarHBondContact O-CB 3.38Å; Q98-M102 VanDerWaalsContact O-CG 3.29Å; Q98-M102 WeakPolarHBondContact O-CG 3.34Å; Q98-M102 PolarHBondContact O-N 2.77Å
99	T	42.4	Very low	43.1	Very low	75 Å²	75	107.9 Å²	107.9	46%	0.46	55%	0.547	S	S	.	.	H	α-helix	trans	-68.5	-35.8	175.1	49.2	0	0	0	0	112.7	R95 S96 M102 A103	R95-T99 PolarHBondContact O-N 3.37Å; R95-T99 PolarHBondContact O-OG1 3.38Å; S96-T99 WeakPolarHBondContact CA-OG1 3.47Å; S96-T99 PolarHBondContact O-OG1 2.88Å; T99-M102 HydrophobicContact CG2-CE 4.23Å; T99-A103 WeakPolarHBondContact O-CB 3.34Å; T99-A103 PolarHBondContact O-N 2.86Å
100	K	42.7	Very low	43.5	Very low	151 Å²	151	102.2 Å²	102.2	66%	0.657	54%	0.537	S	S	*	.	H	α-helix	trans	-66.5	-37.1	171.4	-76.7	176.9	178.7	-177.6	0	112.6	S96 S97 T104	S96-K100 VanDerWaalsContact O-CB 3.3Å; S96-K100 WeakPolarHBondContact O-CB 3.24Å; S96-K100 VanDerWaalsContact O-CG 3.24Å; S96-K100 WeakPolarHBondContact O-CG 3.27Å; S96-K100 PolarHBondContact O-N 3.35Å; S97-K100 PolarHBondContact O-N 3.35Å; K100-T104 VanDerWaalsContact O-CB 3.27Å; K100-T104 WeakPolarHBondContact O-CB 3.41Å; K100-T104 PolarHBondContact O-N 3.26Å; K100-T104 PolarHBondContact O-OG1 2.94Å
101	E	44.2	Very low	43.9	Very low	97 Å²	97	102.9 Å²	102.9	45%	0.453	54%	0.536	S	S	.	.	H	α-helix	trans	-72.3	-41	177.9	-163.1	-173	150.6	0	0	111.5	S97 Q98 T104 K105	S97-E101 VanDerWaalsContact O-CB 3.26Å; S97-E101 WeakPolarHBondContact O-CB 3.3Å; S97-E101 PolarHBondContact O-N 3.09Å; Q98-E101 PolarHBondContact O-N 2.99Å; E101-T104 PolarHBondContact O-N 3.42Å; E101-K105 WeakPolarHBondContact O-CB 3.2Å; E101-K105 VanDerWaalsContact O-CG 3.31Å; E101-K105 WeakPolarHBondContact O-CG 3.49Å; E101-K105 PolarHBondContact O-N 3.01Å; E101-K105 VanDerWaalsContact OE1-CE 3.26Å; E101-K105 WeakPolarHBondContact OE1-CE 3.5Å; E101-K105 IonicContact OE1-NZ 3.02Å; E101-K105 PolarHBondContact OE1-NZ 2.64Å
102	M	49	Very low	44.2	Very low	108 Å²	108	103.2 Å²	103.2	53%	0.532	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-48.9	172.7	-71.3	-171	-57.1	0	0	111.4	Q98 T99 T104 K105 E106	Q98-M102 WeakPolarHBondContact O-CB 3.38Å; Q98-M102 VanDerWaalsContact O-CG 3.29Å; Q98-M102 WeakPolarHBondContact O-CG 3.34Å; Q98-M102 PolarHBondContact O-N 2.77Å; T99-M102 HydrophobicContact CG2-CE 4.23Å; M102-T104 VanDerWaalsContact C-N 3.26Å; M102-T104 PolarHBondContact O-N 3.48Å; M102-K105 CarbonylContact O-C 3.58Å; M102-K105 WeakPolarHBondContact O-CA 3.08Å; M102-K105 WeakPolarHBondContact O-CB 3.06Å; M102-K105 PolarHBondContact O-N 3.26Å; M102-E106 WeakPolarHBondContact O-CG 3.17Å; M102-E106 PolarHBondContact O-N 2.97Å
103	A	47.9	Very low	44.7	Very low	42 Å²	42	103 Å²	103	35%	0.347	52%	0.518	S	S	.	.	H	α-helix	trans	-63	-31.5	176.8	0	0	0	0	0	112.8	T99 K107	T99-A103 WeakPolarHBondContact O-CB 3.34Å; T99-A103 PolarHBondContact O-N 2.86Å; A103-K107 WeakPolarHBondContact O-CB 3.37Å; A103-K107 WeakPolarHBondContact O-CG 3.42Å; A103-K107 PolarHBondContact O-N 2.91Å
104	T	51.8	Low	44.8	Very low	93 Å²	93	104.7 Å²	104.7	57%	0.571	52%	0.521	S	S	*	.	H	α-helix	trans	-71.7	-38.2	172.2	-56.8	0	0	0	0	111.6	K100 E101 M102 K107 L108	K100-T104 VanDerWaalsContact O-CB 3.27Å; K100-T104 WeakPolarHBondContact O-CB 3.41Å; K100-T104 PolarHBondContact O-N 3.26Å; K100-T104 PolarHBondContact O-OG1 2.94Å; E101-T104 PolarHBondContact O-N 3.42Å; M102-T104 VanDerWaalsContact C-N 3.26Å; M102-T104 PolarHBondContact O-N 3.48Å; T104-K107 PolarHBondContact O-N 2.97Å; T104-L108 VanDerWaalsContact O-CB 3.27Å; T104-L108 WeakPolarHBondContact O-CB 3.18Å; T104-L108 PolarHBondContact O-N 2.96Å
105	K	47.3	Very low	45.4	Very low	119 Å²	119	105.3 Å²	105.3	52%	0.517	52%	0.521	S	S	.	.	H	α-helix	trans	-67.1	-42	174.4	-76.6	171.5	-174.3	169.5	0	112	E101 M102 L108 Q109	E101-K105 WeakPolarHBondContact O-CB 3.2Å; E101-K105 VanDerWaalsContact O-CG 3.31Å; E101-K105 WeakPolarHBondContact O-CG 3.49Å; E101-K105 PolarHBondContact O-N 3.01Å; E101-K105 VanDerWaalsContact OE1-CE 3.26Å; E101-K105 WeakPolarHBondContact OE1-CE 3.5Å; E101-K105 IonicContact OE1-NZ 3.02Å; E101-K105 PolarHBondContact OE1-NZ 2.64Å; M102-K105 CarbonylContact O-C 3.58Å; M102-K105 WeakPolarHBondContact O-CA 3.08Å; M102-K105 WeakPolarHBondContact O-CB 3.06Å; M102-K105 PolarHBondContact O-N 3.26Å; K105-L108 PolarHBondContact O-N 3.33Å; K105-Q109 VanDerWaalsContact O-CB 3.24Å; K105-Q109 WeakPolarHBondContact O-CB 3.47Å; K105-Q109 PolarHBondContact O-N 2.82Å
106	E	59.6	Low	45.6	Very low	136 Å²	136	102.2 Å²	102.2	64%	0.636	51%	0.513	S	S	*	.	H	α-helix	trans	-62.5	-43.9	173.6	-72.8	174.6	159.1	0	0	111.6	M102 Q109 C110	M102-E106 WeakPolarHBondContact O-CG 3.17Å; M102-E106 PolarHBondContact O-N 2.97Å; E106-Q109 PolarHBondContact O-N 3.49Å; E106-C110 VanDerWaalsContact O-CB 3.25Å; E106-C110 WeakPolarHBondContact O-CB 3.46Å; E106-C110 PolarHBondContact O-N 2.89Å
107	K	48.5	Very low	45.8	Very low	157 Å²	157	105.2 Å²	105.2	68%	0.683	53%	0.525	S	S	*	.	H	α-helix	trans	-65.1	-37.9	174.2	-76.7	-175.9	177.8	-169.2	0	112.9	A103 T104 L111	A103-K107 WeakPolarHBondContact O-CB 3.37Å; A103-K107 WeakPolarHBondContact O-CG 3.42Å; A103-K107 PolarHBondContact O-N 2.91Å; T104-K107 PolarHBondContact O-N 2.97Å; K107-L111 WeakPolarHBondContact O-CB 3.24Å; K107-L111 PolarHBondContact O-N 3.42Å
108	L	47.6	Very low	46.2	Very low	95 Å²	95	107.6 Å²	107.6	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-70.8	-34	176	-170.9	69.1	0	0	0	111.9	T104 K105 K112	T104-L108 VanDerWaalsContact O-CB 3.27Å; T104-L108 WeakPolarHBondContact O-CB 3.18Å; T104-L108 PolarHBondContact O-N 2.96Å; K105-L108 PolarHBondContact O-N 3.33Å; L108-K112 WeakPolarHBondContact O-CB 3.27Å; L108-K112 VanDerWaalsContact O-CG 3.29Å; L108-K112 WeakPolarHBondContact O-CG 3.3Å; L108-K112 PolarHBondContact O-N 3.15Å
109	Q	50.7	Low	46.1	Very low	95 Å²	95	108.6 Å²	108.6	44%	0.444	54%	0.54	S	S	.	.	H	α-helix	trans	-68.2	-50.4	173.9	-174.2	55.4	42.4	0	0	110.1	K105 E106 L111 K112 D113	K105-Q109 VanDerWaalsContact O-CB 3.24Å; K105-Q109 WeakPolarHBondContact O-CB 3.47Å; K105-Q109 PolarHBondContact O-N 2.82Å; E106-Q109 PolarHBondContact O-N 3.49Å; Q109-L111 VanDerWaalsContact C-N 3.3Å; Q109-L111 PolarHBondContact O-N 3.34Å; Q109-K112 CarbonylContact O-C 3.59Å; Q109-K112 WeakPolarHBondContact O-CA 3.36Å; Q109-K112 WeakPolarHBondContact O-CB 3.36Å; Q109-K112 PolarHBondContact O-N 3.39Å; Q109-D113 VanDerWaalsContact NE2-CG 3.34Å; Q109-D113 PolarHBondContact NE2-OD1 3.23Å; Q109-D113 VanDerWaalsContact NE2-OD1 3.14Å; Q109-D113 PolarHBondContact NE2-OD2 3.11Å; Q109-D113 PolarHBondContact O-N 3.45Å; Q109-D113 VanDerWaalsContact O-OD2 3.12Å
110	C	44.1	Very low	45.6	Very low	81 Å²	81	111.2 Å²	111.2	55%	0.547	55%	0.545	S	S	.	.	H	α-helix	trans	-56.5	-41.3	173.5	-172	0	0	0	0	112	E106 D113 F114	E106-C110 VanDerWaalsContact O-CB 3.25Å; E106-C110 WeakPolarHBondContact O-CB 3.46Å; E106-C110 PolarHBondContact O-N 2.89Å; C110-D113 PolarHBondContact O-N 3.12Å; C110-F114 VanDerWaalsContact O-CB 3.29Å; C110-F114 WeakPolarHBondContact O-CB 3.43Å; C110-F114 PolarHBondContact O-N 3.35Å
111	L	43.7	Very low	44.9	Very low	106 Å²	106	109.6 Å²	109.6	56%	0.555	55%	0.55	S	S	*	*	H	α-helix	trans	-65	-36.1	173.3	-103.2	161	0	0	0	113.8	K107 Q109 H115	K107-L111 WeakPolarHBondContact O-CB 3.24Å; K107-L111 PolarHBondContact O-N 3.42Å; Q109-L111 VanDerWaalsContact C-N 3.3Å; Q109-L111 PolarHBondContact O-N 3.34Å; L111-H115 WeakPolarHBondContact O-CB 3.38Å; L111-H115 PolarHBondContact O-N 2.88Å
112	K	46.6	Very low	44.1	Very low	121 Å²	121	109.8 Å²	109.8	53%	0.526	56%	0.562	S	S	.	*	H	α-helix	trans	-68.8	-41.3	174.1	-77.8	172.3	179.5	-178.2	0	111.5	L108 Q109 H115 K116	L108-K112 WeakPolarHBondContact O-CB 3.27Å; L108-K112 VanDerWaalsContact O-CG 3.29Å; L108-K112 WeakPolarHBondContact O-CG 3.3Å; L108-K112 PolarHBondContact O-N 3.15Å; Q109-K112 CarbonylContact O-C 3.59Å; Q109-K112 WeakPolarHBondContact O-CA 3.36Å; Q109-K112 WeakPolarHBondContact O-CB 3.36Å; Q109-K112 PolarHBondContact O-N 3.39Å; K112-H115 PolarHBondContact O-N 3.46Å; K112-K116 VanDerWaalsContact O-CB 3.23Å; K112-K116 WeakPolarHBondContact O-CB 3.49Å; K112-K116 PolarHBondContact O-N 3.06Å
113	D	46.5	Very low	43.7	Very low	59 Å²	59	110.4 Å²	110.4	32%	0.316	57%	0.574	S	S	.	*	H	α-helix	trans	-68.5	-42.3	177.9	-63.8	-37.4	0	0	0	110.2	Q109 C110 H115 K116 D117	Q109-D113 VanDerWaalsContact NE2-CG 3.34Å; Q109-D113 PolarHBondContact NE2-OD1 3.23Å; Q109-D113 VanDerWaalsContact NE2-OD1 3.14Å; Q109-D113 PolarHBondContact NE2-OD2 3.11Å; Q109-D113 PolarHBondContact O-N 3.45Å; Q109-D113 VanDerWaalsContact O-OD2 3.12Å; C110-D113 PolarHBondContact O-N 3.12Å; D113-H115 PolarHBondContact O-N 2.74Å; D113-K116 WeakPolarHBondContact O-CB 3.4Å; D113-K116 PolarHBondContact O-N 3.1Å; D113-D117 PolarHBondContact O-N 2.91Å
114	F	41.8	Very low	42.9	Very low	140 Å²	140	111.2 Å²	111.2	61%	0.614	59%	0.586	S	S	*	*	H	α-helix	trans	-60.6	-39.7	171.8	-144.3	-95.3	0	0	0	112.6	C110 I118	C110-F114 VanDerWaalsContact O-CB 3.29Å; C110-F114 WeakPolarHBondContact O-CB 3.43Å; C110-F114 PolarHBondContact O-N 3.35Å; F114-I118 HydrophobicContact CD1-CD1 3.66Å; F114-I118 HydrophobicContact CD1-CG1 4.47Å; F114-I118 HydrophobicContact CE1-CD1 3.8Å; F114-I118 WeakPolarHBondContact O-CB 3.49Å; F114-I118 WeakPolarHBondContact O-CG1 3.4Å; F114-I118 PolarHBondContact O-N 3.27Å
115	H	48.9	Very low	42	Very low	115 Å²	115	116.7 Å²	116.7	53%	0.532	60%	0.602	S	S	.	*	H	α-helix	trans	-67.4	-36.4	172.3	-108	79.9	0	0	0	112.8	L111 K112 D113 D117 I118 L119	L111-H115 WeakPolarHBondContact O-CB 3.38Å; L111-H115 PolarHBondContact O-N 2.88Å; K112-H115 PolarHBondContact O-N 3.46Å; D113-H115 PolarHBondContact O-N 2.74Å; H115-D117 VanDerWaalsContact C-N 3.33Å; H115-I118 PolarHBondContact O-N 2.88Å; H115-L119 VanDerWaalsContact O-CB 3.31Å; H115-L119 WeakPolarHBondContact O-CB 3.23Å; H115-L119 PolarHBondContact O-N 3.11Å
116	K	40.3	Very low	41.4	Very low	130 Å²	130	114.8 Å²	114.8	57%	0.565	60%	0.604	S	S	*	*	H	α-helix	trans	-70.5	-30.4	179.9	-169.2	-178.3	-175.7	-174.4	0	112.1	K112 D113 K120	K112-K116 VanDerWaalsContact O-CB 3.23Å; K112-K116 WeakPolarHBondContact O-CB 3.49Å; K112-K116 PolarHBondContact O-N 3.06Å; D113-K116 WeakPolarHBondContact O-CB 3.4Å; D113-K116 PolarHBondContact O-N 3.1Å; K116-K120 WeakPolarHBondContact O-CG 3.32Å; K116-K120 PolarHBondContact O-N 3.19Å
117	D	40.4	Very low	40.1	Very low	107 Å²	107	113.9 Å²	113.9	57%	0.572	61%	0.61	S	S	*	*	H	α-helix	trans	-85.3	-26.2	175.7	-67.8	-27	0	0	0	112.9	D113 H115	D113-D117 PolarHBondContact O-N 2.91Å; H115-D117 VanDerWaalsContact C-N 3.33Å
118	I	45.3	Very low	39.9	Very low	119 Å²	119	107.5 Å²	107.5	61%	0.61	59%	0.589	S	S	*	*	H	α-helix	trans	-76.2	-34.4	169.4	-71.2	173.6	0	0	0	112.2	F114 H115	F114-I118 HydrophobicContact CD1-CD1 3.66Å; F114-I118 HydrophobicContact CD1-CG1 4.47Å; F114-I118 HydrophobicContact CE1-CD1 3.8Å; F114-I118 WeakPolarHBondContact O-CB 3.49Å; F114-I118 WeakPolarHBondContact O-CG1 3.4Å; F114-I118 PolarHBondContact O-N 3.27Å; H115-I118 PolarHBondContact O-N 2.88Å
119	L	39.6	Very low	39.5	Very low	135 Å²	135	105.3 Å²	105.3	71%	0.707	58%	0.579	S	S	*	*	S	Bend	trans	-87.5	-6.2	179.4	-76.6	168.7	0	0	0	114.5	H115 P121	H115-L119 VanDerWaalsContact O-CB 3.31Å; H115-L119 WeakPolarHBondContact O-CB 3.23Å; H115-L119 PolarHBondContact O-N 3.11Å; L119-P121 WeakPolarHBondContact O-CD 3.48Å
120	K	30.1	Very low	39.2	Very low	129 Å²	129	105.7 Å²	105.7	56%	0.561	58%	0.577	S	S	*	*	S	Bend	trans	-75	118	156	-81.3	175	179.1	173.2	0	107.2	K116 S122	K116-K120 WeakPolarHBondContact O-CG 3.32Å; K116-K120 PolarHBondContact O-N 3.19Å; K120-S122 PolarHBondContact O-N 2.88Å
121	P	29.7	Very low	39.4	Very low	118 Å²	118	106.7 Å²	106.7	77%	0.766	58%	0.582	S	S	*	*			trans	-54.7	131.1	158.1	26	-32	0	0	0	106.4	L119	L119-P121 WeakPolarHBondContact O-CD 3.48Å
122	S	26.9	Very low	39.7	Very low	100 Å²	100	107.1 Å²	107.1	70%	0.699	58%	0.581	S	S	*	*			trans	-44.5	137.2	166.4	178.5	0	0	0	0	107.7	K120 G124	K120-S122 PolarHBondContact O-N 2.88Å; S122-G124 PolarHBondContact O-N 3.08Å
123	P	40.1	Very low	39.6	Very low	121 Å²	121	102.4 Å²	102.4	79%	0.786	56%	0.562	S	S	*	*			trans	-66	80.5	173.9	28.5	-33.2	0	0	0	107.8	K125	P123-K125 PolarHBondContact O-N 2.82Å
124	G	32.1	Very low	39.7	Very low	59 Å²	59	106.3 Å²	106.3	61%	0.608	58%	0.578	S	S	*	*			trans	-53.8	126.1	172.8	0	0	0	0	0	105.9	S122 S126	S122-G124 PolarHBondContact O-N 3.08Å; G124-S126 PolarHBondContact O-N 2.78Å
125	K	32.5	Very low	40.1	Very low	208 Å²	208	104 Å²	104	90%	0.904	59%	0.585	S	S	*	*			trans	-64.5	76.8	-173.6	-163.3	173.6	-170.9	174.3	0	109.5	P123 P127	P123-K125 PolarHBondContact O-N 2.82Å; K125-P127 WeakPolarHBondContact O-CD 3.29Å
126	S	34	Very low	40.2	Very low	79 Å²	79	104.2 Å²	104.2	55%	0.552	59%	0.586	S	S	*	*			trans	-63.8	123.9	-178.1	-168	0	0	0	0	107.3	G124 G128	G124-S126 PolarHBondContact O-N 2.78Å; S126-G128 VanDerWaalsContact C-N 3.3Å; S126-G128 PolarHBondContact O-N 2.65Å
127	P	32.3	Very low	40.3	Very low	117 Å²	117	101.3 Å²	101.3	76%	0.76	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	88.7	179.5	-19.5	32.9	0	0	0	110.2	K125	K125-P127 WeakPolarHBondContact O-CD 3.29Å
128	G	43.6	Very low	40.4	Very low	24 Å²	24	101.5 Å²	101.5	25%	0.247	59%	0.589	C	S	.	*	T	Hydrogen-bonded Turn	trans	147.1	11.8	-179	0	0	0	0	0	117.4	S126 E143	S126-G128 VanDerWaalsContact C-N 3.3Å; S126-G128 PolarHBondContact O-N 2.65Å; G128-E143 WeakPolarHBondContact O-CG 3.27Å
129	T	39.4	Very low	40.7	Very low	48 Å²	48	101 Å²	101	29%	0.294	59%	0.594	S	S	.	*			trans	-86.9	134.6	168.5	-38.2	0	0	0	0	110.6	E134 P140	T129-E134 HydrophobicContact CG2-CG 4.35Å; T129-P140 HydrophobicContact CG2-CB 3.78Å
130	R	45.5	Very low	41.5	Very low	104 Å²	104	99.4 Å²	99.4	39%	0.392	59%	0.592	S	S	.	*			trans	-80	130.9	179.1	-168.9	-170.2	-179.6	-160.4	-3.8	110.3	E132 D133	R130-E132 HydrophobicContact CG-CB 4.01Å; R130-E132 HydrophobicContact CG-CG 4.32Å; R130-E132 IonicContact CZ-OE1 3.37Å; R130-E132 IonicContact CZ-OE2 2.66Å; R130-E132 IonicContact NE-OE1 3.88Å; R130-E132 PolarHBondContact NE-OE1 2.62Å; R130-E132 IonicContact NE-OE2 3.11Å; R130-E132 IonicContact NH2-OE1 3.51Å; R130-E132 PolarHBondContact NH2-OE1 3.26Å; R130-E132 IonicContact NH2-OE2 3.81Å; R130-E132 PolarHBondContact NH2-OE2 2.88Å; R130-E132 PolarHBondContact O-N 2.89Å; R130-E132 VanDerWaalsContact O-N 3.14Å; R130-D133 HydrophobicContact CB-CB 4.29Å; R130-D133 WeakPolarHBondContact CB-OD2 3.29Å; R130-D133 WeakPolarHBondContact CD-OD1 3.5Å; R130-D133 WeakPolarHBondContact CD-OD2 3.43Å; R130-D133 IonicContact CZ-OD1 2.68Å; R130-D133 IonicContact NH1-OD1 3.43Å; R130-D133 PolarHBondContact NH1-OD1 3.19Å; R130-D133 PolarHBondContact O-N 3.21Å; R130-D133 VanDerWaalsContact O-N 3.09Å
131	P	48.5	Very low	43	Very low	102 Å²	102	100.2 Å²	100.2	66%	0.662	60%	0.597	S	S	*	*	H	α-helix	trans	-58.8	-27.9	176.7	-24.5	34	0	0	0	113.8
132	E	49.2	Very low	45.1	Very low	114 Å²	114	97.6 Å²	97.6	53%	0.533	57%	0.572	S	S	.	*	H	α-helix	trans	-73.9	-29.4	179.7	-56.3	163.9	-98.2	0	0	112.6	R130 A135	R130-E132 HydrophobicContact CG-CB 4.01Å; R130-E132 HydrophobicContact CG-CG 4.32Å; R130-E132 IonicContact CZ-OE1 3.37Å; R130-E132 IonicContact CZ-OE2 2.66Å; R130-E132 IonicContact NE-OE1 3.88Å; R130-E132 PolarHBondContact NE-OE1 2.62Å; R130-E132 IonicContact NE-OE2 3.11Å; R130-E132 IonicContact NH2-OE1 3.51Å; R130-E132 PolarHBondContact NH2-OE1 3.26Å; R130-E132 IonicContact NH2-OE2 3.81Å; R130-E132 PolarHBondContact NH2-OE2 2.88Å; R130-E132 PolarHBondContact O-N 2.89Å; R130-E132 VanDerWaalsContact O-N 3.14Å; E132-A135 PolarHBondContact O-N 3.06Å
133	D	45.3	Very low	47.4	Very low	23 Å²	23	94.9 Å²	94.9	12%	0.123	55%	0.548	C	S	.	.	H	α-helix	trans	-79.8	-26.5	-179.8	-60	-24.6	0	0	0	111.1	R130 A135 E136 K138	R130-D133 HydrophobicContact CB-CB 4.29Å; R130-D133 WeakPolarHBondContact CB-OD2 3.29Å; R130-D133 WeakPolarHBondContact CD-OD1 3.5Å; R130-D133 WeakPolarHBondContact CD-OD2 3.43Å; R130-D133 IonicContact CZ-OD1 2.68Å; R130-D133 IonicContact NH1-OD1 3.43Å; R130-D133 PolarHBondContact NH1-OD1 3.19Å; R130-D133 PolarHBondContact O-N 3.21Å; R130-D133 VanDerWaalsContact O-N 3.09Å; D133-A135 VanDerWaalsContact C-N 3.32Å; D133-E136 PolarHBondContact O-N 3.39Å; D133-K138 PolarHBondContact O-N 3.06Å
134	E	47.9	Very low	49.3	Very low	140 Å²	140	91.2 Å²	91.2	65%	0.654	52%	0.52	S	S	*	.	H	α-helix	trans	-66.3	-33.5	169.2	-65.2	-174.7	162.3	0	0	111.8	T129 E136 G137	T129-E134 HydrophobicContact CG2-CG 4.35Å; E134-E136 VanDerWaalsContact C-N 3.35Å; E134-E136 PolarHBondContact O-N 3.38Å; E134-G137 PolarHBondContact O-N 3.36Å
135	A	51.5	Low	51.5	Low	91 Å²	91	89.2 Å²	89.2	75%	0.752	49%	0.494	S	S	*	.	H	α-helix	trans	-71.4	-24.4	178.5	0	0	0	0	0	113.9	E132 D133	E132-A135 PolarHBondContact O-N 3.06Å; D133-A135 VanDerWaalsContact C-N 3.32Å
136	E	50.1	Low	53.3	Low	120 Å²	120	84 Å²	84	56%	0.561	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-0.3	176.1	-76.2	-168.7	108.4	0	0	114	D133 E134 K138	D133-E136 PolarHBondContact O-N 3.39Å; E134-E136 VanDerWaalsContact C-N 3.35Å; E134-E136 PolarHBondContact O-N 3.38Å; E136-K138 HydrophobicContact CB-CD 4.14Å; E136-K138 HydrophobicContact CB-CG 4.22Å; E136-K138 PolarHBondContact O-N 2.98Å; E136-K138 VanDerWaalsContact O-N 3.15Å; E136-K138 IonicContact OE1-NZ 3.33Å; E136-K138 PolarHBondContact OE1-NZ 3Å; E136-K138 WeakPolarHBondContact OE2-CE 3.35Å; E136-K138 IonicContact OE2-NZ 3.65Å; E136-K138 PolarHBondContact OE2-NZ 2.82Å
137	G	42.2	Very low	55.3	Low	70 Å²	70	82.6 Å²	82.6	72%	0.722	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	17.7	-178.6	0	0	0	0	0	114.5	E134	E134-G137 PolarHBondContact O-N 3.36Å
138	K	42	Very low	57.2	Low	111 Å²	111	82.7 Å²	82.7	48%	0.483	46%	0.462	S	S	.	.			trans	-74.7	147.2	175.7	-72.7	170.6	-173.2	161.9	0	109.2	D133 E136	D133-K138 PolarHBondContact O-N 3.06Å; E136-K138 HydrophobicContact CB-CD 4.14Å; E136-K138 HydrophobicContact CB-CG 4.22Å; E136-K138 PolarHBondContact O-N 2.98Å; E136-K138 VanDerWaalsContact O-N 3.15Å; E136-K138 IonicContact OE1-NZ 3.33Å; E136-K138 PolarHBondContact OE1-NZ 3Å; E136-K138 WeakPolarHBondContact OE2-CE 3.35Å; E136-K138 IonicContact OE2-NZ 3.65Å; E136-K138 PolarHBondContact OE2-NZ 2.82Å
139	P	51.7	Low	58.7	Low	109 Å²	109	86 Å²	86	71%	0.708	47%	0.474	S	S	*	.			trans	-58.4	139.6	174.9	25.9	-34.2	0	0	0	109.3	Q141	P139-Q141 PolarHBondContact O-N 2.9Å
140	P	56.1	Low	60.4	Low	101 Å²	101	84.3 Å²	84.3	66%	0.656	46%	0.463	S	S	*	.			trans	-57.7	104.7	-172.2	22.4	-33.9	0	0	0	110.3	T129 R142	T129-P140 HydrophobicContact CG2-CB 3.78Å; P140-R142 PolarHBondContact O-N 2.88Å
141	Q	63.5	Low	62	Low	146 Å²	146	79.8 Å²	79.8	68%	0.682	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-83.4	120.5	-175.2	-169.4	166.6	35.8	0	0	108.8	P139 E143	P139-Q141 PolarHBondContact O-N 2.9Å; Q141-E143 PolarHBondContact O-N 2.93Å
142	R	72.4	Confident	63.3	Low	62 Å²	62	76.7 Å²	76.7	23%	0.234	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-54.1	134	177.9	-170.6	175.1	-170.4	167.3	-2.6	110.6	P140 S207 E208 S415 Y416	P140-R142 PolarHBondContact O-N 2.88Å; R142-S207 VanDerWaalsContact CD-O 3.3Å; R142-S207 WeakPolarHBondContact CD-O 3.2Å; R142-S207 PolarHBondContact NH1-O 3.38Å; R142-E208 PolarHBondContact NH1-O 2.81Å; R142-S415 VanDerWaalsContact NH1-CB 3.34Å; R142-S415 PolarHBondContact NH1-OG 3.4Å; R142-S415 PolarHBondContact NH2-OG 3.4Å; R142-Y416 HydrophobicContact CG-CD1 4.13Å; R142-Y416 HydrophobicContact CG-CE1 4.03Å; R142-Y416 VanDerWaalsContact NE-CE1 3.34Å; R142-Y416 PolarHBondContact NH2-OH 3.24Å
143	E	75.8	Confident	64.7	Low	43 Å²	43	72.9 Å²	72.9	20%	0.201	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-46	151	170.8	-92	-175.4	-168.3	0	0	111.7	G128 Q141 V340 Y416	G128-E143 WeakPolarHBondContact O-CG 3.27Å; Q141-E143 PolarHBondContact O-N 2.93Å; E143-V340 HydrophobicContact CB-CG2 4.26Å; E143-V340 WeakPolarHBondContact OE2-CG2 3.45Å; E143-Y416 HydrophobicContact CB-CD1 4.44Å; E143-Y416 VanDerWaalsContact O-CD1 3.27Å; E143-Y416 WeakPolarHBondContact O-CD1 3.44Å
144	K	80.4	Confident	66.3	Low	45 Å²	45	72.3 Å²	72.3	20%	0.196	41%	0.406	C	S	.	.			trans	-128.5	150.7	178.6	-61.5	-64.8	178.3	175.1	0	110.6	S207 S415 Y416 N417 K418	K144-S207 PolarHBondContact NZ-OG 3.46Å; K144-S415 PolarHBondContact NZ-O 3.18Å; K144-Y416 CarbonylContact C-O 3.56Å; K144-Y416 WeakPolarHBondContact CA-O 3.39Å; K144-Y416 WeakPolarHBondContact CB-O 3.49Å; K144-Y416 WeakPolarHBondContact CD-O 3.26Å; K144-N417 WeakPolarHBondContact CD-O 3.46Å; K144-N417 WeakPolarHBondContact CE-O 3.2Å; K144-N417 PolarHBondContact NZ-O 3.36Å; K144-K418 HydrophobicContact CB-CG 4.32Å; K144-K418 HydrophobicContact CG-CG 4.46Å
145	W	77.1	Confident	67.8	Low	17 Å²	17	65.8 Å²	65.8	6%	0.064	38%	0.376	C	S	.	.			trans	-53.1	140	175.9	-67	114.1	0	0	0	111.6	D150 F151 V340 L413 Y416	W145-D150 HydrophobicContact CE3-CB 3.91Å; W145-D150 HydrophobicContact CZ3-CB 4.44Å; W145-F151 AromaticContact CD1-CD2 3.86Å; W145-F151 HydrophobicContact CD2-CB 4.33Å; W145-F151 HydrophobicContact CG-CB 4.08Å; W145-F151 AromaticContact NE1-CD2 3.45Å; W145-V340 HydrophobicContact CH2-CB 4.26Å; W145-V340 HydrophobicContact CH2-CG1 4.5Å; W145-V340 HydrophobicContact CZ3-CB 4.17Å; W145-L413 HydrophobicContact CH2-CD2 4.19Å; W145-L413 HydrophobicContact CZ2-CD2 3.75Å; W145-L413 PolarHBondContact NE1-O 2.98Å; W145-Y416 VanDerWaalsContact CD1-C 3.44Å; W145-Y416 VanDerWaalsContact CD1-O 3.28Å; W145-Y416 PolarHBondContact N-O 3.43Å
146	S	71.8	Confident	68.9	Low	98 Å²	98	61.8 Å²	61.8	69%	0.685	34%	0.342	S	S	*	.	S	Bend	trans	-78.3	-41.6	-176.5	87.5	0	0	0	0	111.4	D150	S146-D150 WeakPolarHBondContact CB-OD2 3.45Å; S146-D150 PolarHBondContact N-OD2 2.75Å; S146-D150 PolarHBondContact OG-OD2 3.11Å
147	S	74.1	Confident	70.1	Confident	49 Å²	49	57.7 Å²	57.7	34%	0.343	33%	0.332	S	S	.	.			trans	-127	159	173.2	-179.1	0	0	0	0	111.3	I149 D150	S147-I149 VanDerWaalsContact C-N 3.26Å; S147-I149 PolarHBondContact OG-N 3.27Å; S147-D150 PolarHBondContact N-OD2 3.21Å; S147-D150 PolarHBondContact O-N 3.44Å
148	K	73.6	Confident	71.6	Confident	119 Å²	119	56.2 Å²	56.2	52%	0.517	32%	0.317	S	S	.	.	H	α-helix	trans	-63.3	-36.1	167.4	-63.9	176.8	-176.3	169.3	0	111.2	D150 F151 V152 Y421	K148-D150 VanDerWaalsContact C-N 3.28Å; K148-D150 PolarHBondContact O-N 3.46Å; K148-F151 WeakPolarHBondContact O-CB 3.25Å; K148-F151 PolarHBondContact O-N 3.44Å; K148-F151 VanDerWaalsContact O-N 3.09Å; K148-V152 WeakPolarHBondContact O-CG2 3.49Å; K148-V152 PolarHBondContact O-N 2.61Å; K148-Y421 VanDerWaalsContact NZ-CZ 3.27Å; K148-Y421 PolarHBondContact NZ-OH 2.6Å
149	I	75.1	Confident	73.1	Confident	94 Å²	94	51.2 Å²	51.2	48%	0.482	30%	0.296	S	S	.	.	H	α-helix	trans	-64.7	-36.9	-177.9	-59.1	175	0	0	0	110.1	S147 F151 V152 L153 Y348	S147-I149 VanDerWaalsContact C-N 3.26Å; S147-I149 PolarHBondContact OG-N 3.27Å; I149-F151 VanDerWaalsContact C-N 3.28Å; I149-F151 PolarHBondContact O-N 3.27Å; I149-V152 PolarHBondContact O-N 3.13Å; I149-L153 HydrophobicContact CG2-CD1 3.67Å; I149-L153 HydrophobicContact CG2-CG 3.99Å; I149-L153 WeakPolarHBondContact O-CB 3.38Å; I149-L153 WeakPolarHBondContact O-CG 3.41Å; I149-L153 PolarHBondContact O-N 2.95Å; I149-Y348 HydrophobicContact CG2-CE1 3.72Å
150	D	75.3	Confident	74.1	Confident	12 Å²	12	47.2 Å²	47.2	6%	0.064	27%	0.269	C	S	.	.	H	α-helix	trans	-55.9	-44.2	172.5	-48.3	-16.4	0	0	0	111.3	W145 S146 S147 K148 S154 Y348	W145-D150 HydrophobicContact CE3-CB 3.91Å; W145-D150 HydrophobicContact CZ3-CB 4.44Å; S146-D150 WeakPolarHBondContact CB-OD2 3.45Å; S146-D150 PolarHBondContact N-OD2 2.75Å; S146-D150 PolarHBondContact OG-OD2 3.11Å; S147-D150 PolarHBondContact N-OD2 3.21Å; S147-D150 PolarHBondContact O-N 3.44Å; K148-D150 VanDerWaalsContact C-N 3.28Å; K148-D150 PolarHBondContact O-N 3.46Å; D150-S154 WeakPolarHBondContact O-CB 3.44Å; D150-S154 PolarHBondContact O-N 2.78Å; D150-S154 PolarHBondContact O-OG 2.97Å; D150-Y348 VanDerWaalsContact OD1-CE2 3.31Å; D150-Y348 WeakPolarHBondContact OD1-CE2 3.39Å; D150-Y348 PolarHBondContact OD1-OH 2.95Å
151	F	78.6	Confident	74.8	Confident	10 Å²	10	43.8 Å²	43.8	4%	0.044	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-52.5	177.9	172.7	-105.4	0	0	0	111.4	W145 K148 I149 L153 S154 V155 I200 L413	W145-F151 AromaticContact CD1-CD2 3.86Å; W145-F151 HydrophobicContact CD2-CB 4.33Å; W145-F151 HydrophobicContact CG-CB 4.08Å; W145-F151 AromaticContact NE1-CD2 3.45Å; K148-F151 WeakPolarHBondContact O-CB 3.25Å; K148-F151 PolarHBondContact O-N 3.44Å; K148-F151 VanDerWaalsContact O-N 3.09Å; I149-F151 VanDerWaalsContact C-N 3.28Å; I149-F151 PolarHBondContact O-N 3.27Å; F151-L153 VanDerWaalsContact C-N 3.32Å; F151-L153 PolarHBondContact O-N 2.84Å; F151-S154 PolarHBondContact O-N 3.35Å; F151-S154 VanDerWaalsContact O-N 3.08Å; F151-V155 HydrophobicContact CD1-CG2 4.47Å; F151-V155 HydrophobicContact CD2-CG2 3.94Å; F151-V155 HydrophobicContact CE1-CG2 4.13Å; F151-V155 HydrophobicContact CE2-CG2 3.56Å; F151-V155 HydrophobicContact CG-CG2 4.4Å; F151-V155 HydrophobicContact CZ-CG2 3.67Å; F151-V155 WeakPolarHBondContact O-CG2 3.49Å; F151-V155 PolarHBondContact O-N 3.42Å; F151-I200 HydrophobicContact CZ-CD1 4.19Å; F151-I200 HydrophobicContact CZ-CG2 3.96Å; F151-L413 HydrophobicContact CE2-CB 4.25Å
152	V	76.6	Confident	75.2	Confident	36 Å²	36	40.3 Å²	40.3	22%	0.218	24%	0.238	C	C	.	.	H	α-helix	trans	-57	-45.7	-179.7	-179.3	0	0	0	0	110.9	K148 I149 V155 A156 D440 A443	K148-V152 WeakPolarHBondContact O-CG2 3.49Å; K148-V152 PolarHBondContact O-N 2.61Å; I149-V152 PolarHBondContact O-N 3.13Å; V152-V155 PolarHBondContact O-N 3.08Å; V152-A156 VanDerWaalsContact O-CB 3.25Å; V152-A156 WeakPolarHBondContact O-CB 3.44Å; V152-A156 PolarHBondContact O-N 2.95Å; V152-D440 WeakPolarHBondContact CG2-OD1 3.5Å; V152-A443 HydrophobicContact CG1-CB 4.08Å
153	L	76.9	Confident	75	Confident	35 Å²	35	37.5 Å²	37.5	18%	0.183	23%	0.228	C	C	.	.	H	α-helix	trans	-70	-32.3	178.2	-66.5	177.7	0	0	0	112.7	I149 F151 A156 G157 V347 Y348 T352	I149-L153 HydrophobicContact CG2-CD1 3.67Å; I149-L153 HydrophobicContact CG2-CG 3.99Å; I149-L153 WeakPolarHBondContact O-CB 3.38Å; I149-L153 WeakPolarHBondContact O-CG 3.41Å; I149-L153 PolarHBondContact O-N 2.95Å; F151-L153 VanDerWaalsContact C-N 3.32Å; F151-L153 PolarHBondContact O-N 2.84Å; L153-A156 PolarHBondContact O-N 2.92Å; L153-G157 PolarHBondContact O-N 3.49Å; L153-V347 HydrophobicContact CB-CG1 3.7Å; L153-V347 WeakPolarHBondContact O-CG1 3.46Å; L153-Y348 HydrophobicContact CD1-CD1 3.41Å; L153-Y348 VanDerWaalsContact CD1-CD1 3.41Å; L153-Y348 HydrophobicContact CD1-CE1 3.5Å; L153-Y348 VanDerWaalsContact CD1-CE1 3.5Å; L153-Y348 HydrophobicContact CD1-CG 3.95Å; L153-T352 HydrophobicContact CD2-CG2 4.47Å
154	S	79.4	Confident	75	Confident	10 Å²	10	35.7 Å²	35.7	7%	0.07	22%	0.22	C	C	.	.	H	α-helix	trans	-70.4	-39.3	175.8	-62.7	0	0	0	0	111.9	D150 F151 G158	D150-S154 WeakPolarHBondContact O-CB 3.44Å; D150-S154 PolarHBondContact O-N 2.78Å; D150-S154 PolarHBondContact O-OG 2.97Å; F151-S154 PolarHBondContact O-N 3.35Å; F151-S154 VanDerWaalsContact O-N 3.08Å; S154-G158 PolarHBondContact O-N 3.48Å
155	V	78.8	Confident	74.8	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-65.9	-47.5	172.3	176.3	0	0	0	0	109.4	F151 V152 G157 G158 F159 F196 M410 L413	F151-V155 HydrophobicContact CD1-CG2 4.47Å; F151-V155 HydrophobicContact CD2-CG2 3.94Å; F151-V155 HydrophobicContact CE1-CG2 4.13Å; F151-V155 HydrophobicContact CE2-CG2 3.56Å; F151-V155 HydrophobicContact CG-CG2 4.4Å; F151-V155 HydrophobicContact CZ-CG2 3.67Å; F151-V155 WeakPolarHBondContact O-CG2 3.49Å; F151-V155 PolarHBondContact O-N 3.42Å; V152-V155 PolarHBondContact O-N 3.08Å; V155-G157 PolarHBondContact O-N 3.42Å; V155-G158 WeakPolarHBondContact O-CA 3.36Å; V155-G158 PolarHBondContact O-N 3.01Å; V155-F159 HydrophobicContact CG1-CD1 4.05Å; V155-F159 HydrophobicContact CG1-CE1 3.95Å; V155-F159 WeakPolarHBondContact O-CD1 3.28Å; V155-F159 WeakPolarHBondContact O-CE1 3.01Å; V155-F159 PolarHBondContact O-N 3.02Å; V155-F159 VanDerWaalsContact O-N 3.11Å; V155-F196 HydrophobicContact CG1-CE2 3.89Å; V155-F196 HydrophobicContact CG1-CZ 3.64Å; V155-M410 HydrophobicContact CG1-SD 4.13Å; V155-L413 HydrophobicContact CG2-CD1 4.09Å
156	A	76.1	Confident	74.8	Confident	6 Å²	6	40 Å²	40	5%	0.05	24%	0.239	C	C	.	.	H	α-helix	trans	-54.8	-52.7	175.1	0	0	0	0	0	112.7	V152 L153 G158 F159 V160	V152-A156 VanDerWaalsContact O-CB 3.25Å; V152-A156 WeakPolarHBondContact O-CB 3.44Å; V152-A156 PolarHBondContact O-N 2.95Å; L153-A156 PolarHBondContact O-N 2.92Å; A156-G158 PolarHBondContact O-N 3.29Å; A156-F159 HydrophobicContact CB-CE1 4.29Å; A156-F159 HydrophobicContact CB-CZ 4.26Å; A156-F159 PolarHBondContact O-N 3.3Å; A156-V160 VanDerWaalsContact O-CB 3.22Å; A156-V160 WeakPolarHBondContact O-CB 3.25Å; A156-V160 WeakPolarHBondContact O-CG2 3.47Å; A156-V160 PolarHBondContact O-N 2.87Å
157	G	75.1	Confident	75.3	Confident	34 Å²	34	37.7 Å²	37.7	35%	0.351	22%	0.215	S	C	.	.	H	α-helix	trans	-60.7	-27.6	174.4	0	0	0	0	0	113.6	L153 V155	L153-G157 PolarHBondContact O-N 3.49Å; V155-G157 PolarHBondContact O-N 3.42Å
158	G	74.3	Confident	75.8	Confident	40 Å²	40	35.9 Å²	35.9	41%	0.412	20%	0.201	S	C	.	.	H	α-helix	trans	-71.3	-39.1	177.8	0	0	0	0	0	114.5	S154 V155 A156	S154-G158 PolarHBondContact O-N 3.48Å; V155-G158 WeakPolarHBondContact O-CA 3.36Å; V155-G158 PolarHBondContact O-N 3.01Å; A156-G158 PolarHBondContact O-N 3.29Å
159	F	73.5	Confident	76.1	Confident	6 Å²	6	30.9 Å²	30.9	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-90.4	-16.7	175.3	63	-101.6	0	0	0	113.4	V155 A156 G161 N164 S402 H444 V447	V155-F159 HydrophobicContact CG1-CD1 4.05Å; V155-F159 HydrophobicContact CG1-CE1 3.95Å; V155-F159 WeakPolarHBondContact O-CD1 3.28Å; V155-F159 WeakPolarHBondContact O-CE1 3.01Å; V155-F159 PolarHBondContact O-N 3.02Å; V155-F159 VanDerWaalsContact O-N 3.11Å; A156-F159 HydrophobicContact CB-CE1 4.29Å; A156-F159 HydrophobicContact CB-CZ 4.26Å; A156-F159 PolarHBondContact O-N 3.3Å; F159-G161 VanDerWaalsContact C-N 3.28Å; F159-G161 PolarHBondContact O-N 3.08Å; F159-N164 PolarHBondContact O-ND2 3.04Å; F159-S402 WeakPolarHBondContact CA-O 3.43Å; F159-S402 VanDerWaalsContact CB-O 3.24Å; F159-S402 WeakPolarHBondContact CB-O 3.18Å; F159-H444 AromaticContact CD1-CE1 3.62Å; F159-H444 AromaticContact CD1-ND1 3.96Å; F159-H444 AromaticContact CE1-CE1 3.06Å; F159-H444 WeakPolarHBondContact CE1-CE1 3.41Å; F159-H444 AromaticContact CE1-ND1 3.26Å; F159-H444 VanDerWaalsContact CE1-ND1 3.26Å; F159-H444 WeakPolarHBondContact CE1-ND1 3.3Å; F159-H444 AromaticContact CE2-ND1 3.77Å; F159-H444 AromaticContact CZ-CE1 3.52Å; F159-H444 AromaticContact CZ-ND1 3.16Å; F159-H444 WeakPolarHBondContact CZ-ND1 3.26Å; F159-V447 HydrophobicContact CD2-CG1 4.23Å; F159-V447 HydrophobicContact CE2-CB 3.85Å; F159-V447 HydrophobicContact CE2-CG1 3.46Å; F159-V447 VanDerWaalsContact CE2-CG1 3.46Å; F159-V447 HydrophobicContact CE2-CG2 4.37Å; F159-V447 HydrophobicContact CZ-CB 4.31Å; F159-V447 HydrophobicContact CZ-CG1 4.31Å; F159-V447 HydrophobicContact CZ-CG2 4.44Å
160	V	71.9	Confident	76.5	Confident	24 Å²	24	29 Å²	29	15%	0.145	17%	0.168	C	C	.	.			trans	-82	69.4	176.2	175.1	0	0	0	0	111.4	A156 F355 V447 F451	A156-V160 VanDerWaalsContact O-CB 3.22Å; A156-V160 WeakPolarHBondContact O-CB 3.25Å; A156-V160 WeakPolarHBondContact O-CG2 3.47Å; A156-V160 PolarHBondContact O-N 2.87Å; V160-F355 HydrophobicContact CG1-CZ 4.45Å; V160-F355 HydrophobicContact CG2-CE2 4.41Å; V160-F355 HydrophobicContact CG2-CZ 3.76Å; V160-V447 HydrophobicContact CG2-CG1 3.55Å; V160-F451 HydrophobicContact CB-CE2 4.3Å; V160-F451 HydrophobicContact CB-CZ 4.48Å; V160-F451 HydrophobicContact CG1-CE2 3.66Å; V160-F451 HydrophobicContact CG1-CZ 3.49Å; V160-F451 VanDerWaalsContact CG1-CZ 3.49Å; V160-F451 HydrophobicContact CG2-CE2 3.76Å; V160-F451 HydrophobicContact CG2-CZ 4.42Å
161	G	70.2	Confident	77	Confident	29 Å²	29	28.7 Å²	28.7	30%	0.299	17%	0.167	S	C	.	.			trans	-89	160.9	175.2	0	0	0	0	0	113.8	F159 G163 N164	F159-G161 VanDerWaalsContact C-N 3.28Å; F159-G161 PolarHBondContact O-N 3.08Å; G161-G163 PolarHBondContact O-N 2.83Å; G161-N164 PolarHBondContact O-N 3.41Å
162	L	71.5	Confident	77.3	Confident	74 Å²	74	28.3 Å²	28.3	39%	0.387	17%	0.165	S	C	.	.	H	α-helix	trans	-47	-35.9	167	-82.8	158.4	0	0	0	112.4	N164 V165 W166 I242	L162-N164 PolarHBondContact O-N 3.42Å; L162-V165 WeakPolarHBondContact O-CB 3.22Å; L162-V165 PolarHBondContact O-N 3.31Å; L162-V165 VanDerWaalsContact O-N 3.08Å; L162-W166 PolarHBondContact O-N 3.33Å; L162-W166 PolarHBondContact O-NE1 2.86Å; L162-I242 HydrophobicContact CD1-CG2 3.72Å
163	G	68.6	Low	77.7	Confident	2 Å²	2	30.8 Å²	30.8	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-53	-38.1	175.6	0	0	0	0	0	113.8	G161 V165 R167 F168	G161-G163 PolarHBondContact O-N 2.83Å; G163-V165 VanDerWaalsContact C-N 3.3Å; G163-V165 PolarHBondContact O-N 2.87Å; G163-R167 WeakPolarHBondContact O-CA 3.24Å; G163-R167 WeakPolarHBondContact O-CB 3.44Å; G163-R167 PolarHBondContact O-N 2.84Å; G163-F168 PolarHBondContact O-N 3.47Å
164	N	75.9	Confident	78.2	Confident	6 Å²	6	33.8 Å²	33.8	3%	0.032	18%	0.183	C	C	.	.	H	α-helix	trans	-72.4	-26.4	-178.9	-62.1	-3.6	0	0	0	112.3	F159 G161 L162 S402 F451	F159-N164 PolarHBondContact O-ND2 3.04Å; G161-N164 PolarHBondContact O-N 3.41Å; L162-N164 PolarHBondContact O-N 3.42Å; N164-S402 WeakPolarHBondContact OD1-CB 3.28Å; N164-S402 PolarHBondContact OD1-OG 3.08Å; N164-F451 HydrophobicContact CB-CD1 3.8Å; N164-F451 HydrophobicContact CB-CE1 4.07Å; N164-F451 HydrophobicContact CB-CG 4.21Å
165	V	76	Confident	78.7	Confident	38 Å²	38	33.7 Å²	33.7	23%	0.23	18%	0.181	C	C	.	.	H	α-helix	trans	-70	-45	179.3	-176.7	0	0	0	0	111.5	L162 G163 P169 F451	L162-V165 WeakPolarHBondContact O-CB 3.22Å; L162-V165 PolarHBondContact O-N 3.31Å; L162-V165 VanDerWaalsContact O-N 3.08Å; G163-V165 VanDerWaalsContact C-N 3.3Å; G163-V165 PolarHBondContact O-N 2.87Å; V165-P169 WeakPolarHBondContact O-CG 3.45Å; V165-F451 HydrophobicContact CG2-CE1 3.84Å
166	W	76.9	Confident	79	Confident	115 Å²	115	34 Å²	34	44%	0.436	19%	0.185	S	C	.	.	H	α-helix	trans	-116	-33.6	-171.9	66.5	-90.3	0	0	0	114.9	K19 L162 Y170	K19-W166 HydrophobicContact CD-CH2 4.36Å; K19-W166 HydrophobicContact CD-CZ3 4.16Å; L162-W166 PolarHBondContact O-N 3.33Å; L162-W166 PolarHBondContact O-NE1 2.86Å; W166-Y170 VanDerWaalsContact O-CB 3.25Å; W166-Y170 WeakPolarHBondContact O-CB 3.16Å; W166-Y170 PolarHBondContact O-N 2.83Å
167	R	83.2	Confident	79.5	Confident	48 Å²	48	33.9 Å²	33.9	18%	0.181	19%	0.185	C	C	.	.	H	α-helix	trans	-74.7	-40.3	-177	-169.7	-175.1	173.3	176.6	-2.2	111.4	G163 Y170 L171 Q398 F401	G163-R167 WeakPolarHBondContact O-CA 3.24Å; G163-R167 WeakPolarHBondContact O-CB 3.44Å; G163-R167 PolarHBondContact O-N 2.84Å; R167-Y170 PolarHBondContact O-N 2.82Å; R167-L171 HydrophobicContact CG-CD1 4.03Å; R167-L171 HydrophobicContact CG-CG 4.25Å; R167-L171 WeakPolarHBondContact O-CB 3.35Å; R167-L171 WeakPolarHBondContact O-CG 3.43Å; R167-L171 PolarHBondContact O-N 2.86Å; R167-Q398 VanDerWaalsContact CD-OE1 3.26Å; R167-F401 VanDerWaalsContact NH1-CD1 3.33Å
168	F	84	Confident	79.9	Confident	11 Å²	11	32.9 Å²	32.9	5%	0.048	17%	0.174	C	C	.	.	H	α-helix	trans	-59.4	-54.7	176.9	178.8	-101	0	0	0	112	G163 Y170 L171 C172 F180 L181 Y184 Q398	G163-F168 PolarHBondContact O-N 3.47Å; F168-Y170 VanDerWaalsContact C-N 3.33Å; F168-Y170 PolarHBondContact O-N 3.41Å; F168-L171 PolarHBondContact O-N 3.49Å; F168-C172 WeakPolarHBondContact CZ-SG 3.34Å; F168-C172 PolarHBondContact O-N 3.33Å; F168-C172 PolarHBondContact O-SG 2.91Å; F168-F180 HydrophobicContact CE2-CE1 4.35Å; F168-L181 HydrophobicContact CZ-CD2 3.86Å; F168-Y184 HydrophobicContact CD2-CD2 4.43Å; F168-Y184 AromaticContact CD2-CE2 3.88Å; F168-Y184 HydrophobicContact CD2-CE2 3.88Å; F168-Y184 HydrophobicContact CE2-CD1 4.15Å; F168-Y184 AromaticContact CE2-CD2 3.87Å; F168-Y184 HydrophobicContact CE2-CD2 3.87Å; F168-Y184 AromaticContact CE2-CE1 3.88Å; F168-Y184 HydrophobicContact CE2-CE1 3.88Å; F168-Y184 AromaticContact CE2-CE2 3.57Å; F168-Y184 HydrophobicContact CE2-CE2 3.57Å; F168-Y184 HydrophobicContact CE2-CG 4.13Å; F168-Y184 AromaticContact CE2-CZ 3.56Å; F168-Y184 HydrophobicContact CZ-CE1 4.38Å; F168-Q398 HydrophobicContact CD2-CG 4.16Å
169	P	81.1	Confident	80.6	Confident	14 Å²	14	31 Å²	31	9%	0.091	16%	0.155	C	C	.	.	H	α-helix	trans	-61.2	-38.1	175.4	13.2	-23.1	0	0	0	114	V165 L171 C172 Y173 Y378	V165-P169 WeakPolarHBondContact O-CG 3.45Å; P169-L171 PolarHBondContact O-N 2.9Å; P169-C172 PolarHBondContact O-N 3.46Å; P169-Y173 VanDerWaalsContact O-CB 3.31Å; P169-Y173 WeakPolarHBondContact O-CB 3.36Å; P169-Y173 PolarHBondContact O-N 3.05Å; P169-Y378 WeakPolarHBondContact CA-OH 3.06Å; P169-Y378 HydrophobicContact CB-CE2 3.82Å
170	Y	83.3	Confident	81.4	Confident	54 Å²	54	30.8 Å²	30.8	21%	0.212	15%	0.154	C	C	.	.	H	α-helix	trans	-60.1	-44.3	175.2	172.6	-108.6	0	0	0	112.6	E15 I22 W166 R167 F168 K174	E15-Y170 PolarHBondContact OE1-OH 2.9Å; E15-Y170 PolarHBondContact OE2-OH 2.6Å; I22-Y170 HydrophobicContact CD1-CE2 4.02Å; I22-Y170 HydrophobicContact CG2-CD2 4.2Å; I22-Y170 HydrophobicContact CG2-CE2 3.92Å; W166-Y170 VanDerWaalsContact O-CB 3.25Å; W166-Y170 WeakPolarHBondContact O-CB 3.16Å; W166-Y170 PolarHBondContact O-N 2.83Å; R167-Y170 PolarHBondContact O-N 2.82Å; F168-Y170 VanDerWaalsContact C-N 3.33Å; F168-Y170 PolarHBondContact O-N 3.41Å; Y170-K174 HydrophobicContact CE1-CD 4.48Å; Y170-K174 VanDerWaalsContact O-CB 3.27Å; Y170-K174 WeakPolarHBondContact O-CB 3.32Å; Y170-K174 PolarHBondContact O-N 3.24Å
171	L	86.1	Confident	82.1	Confident	7 Å²	7	30.7 Å²	30.7	4%	0.037	15%	0.152	C	C	.	.	H	α-helix	trans	-69.6	-43.1	177.9	-71.9	178.5	0	0	0	112.1	R167 F168 P169 Y173 K174 N175 F180 D394 Q398	R167-L171 HydrophobicContact CG-CD1 4.03Å; R167-L171 HydrophobicContact CG-CG 4.25Å; R167-L171 WeakPolarHBondContact O-CB 3.35Å; R167-L171 WeakPolarHBondContact O-CG 3.43Å; R167-L171 PolarHBondContact O-N 2.86Å; F168-L171 PolarHBondContact O-N 3.49Å; P169-L171 PolarHBondContact O-N 2.9Å; L171-Y173 PolarHBondContact O-N 3.36Å; L171-K174 PolarHBondContact O-N 3.46Å; L171-N175 WeakPolarHBondContact O-CB 3.27Å; L171-N175 PolarHBondContact O-N 3.48Å; L171-N175 PolarHBondContact O-ND2 3.48Å; L171-F180 HydrophobicContact CB-CE1 4.29Å; L171-F180 HydrophobicContact CB-CZ 3.97Å; L171-D394 HydrophobicContact CD2-CB 4.21Å; L171-Q398 HydrophobicContact CD1-CB 3.89Å; L171-Q398 HydrophobicContact CD1-CG 4.21Å
172	C	84.9	Confident	83	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.007	16%	0.16	C	C	.	.	H	α-helix	trans	-55.3	-52.9	174.5	-63.8	0	0	0	0	110.3	F168 P169 K174 N175 G176 G177 F180 Y378	F168-C172 WeakPolarHBondContact CZ-SG 3.34Å; F168-C172 PolarHBondContact O-N 3.33Å; F168-C172 PolarHBondContact O-SG 2.91Å; P169-C172 PolarHBondContact O-N 3.46Å; C172-K174 PolarHBondContact O-N 3.17Å; C172-N175 PolarHBondContact O-N 2.82Å; C172-G176 PolarHBondContact O-N 2.98Å; C172-G177 VanDerWaalsContact O-CA 3.27Å; C172-G177 WeakPolarHBondContact O-CA 3.27Å; C172-G177 PolarHBondContact O-N 2.96Å; C172-F180 HydrophobicContact CB-CD1 4.18Å; C172-F180 WeakPolarHBondContact SG-CD1 3.19Å; C172-Y378 HydrophobicContact CB-CE2 3.74Å
173	Y	83.8	Confident	84	Confident	89 Å²	89	30.1 Å²	30.1	35%	0.349	14%	0.142	S	C	.	.	H	α-helix	trans	-57.3	-50	178.5	171.4	-113.3	0	0	0	112.8	F26 P169 L171 N175 F377	F26-Y173 HydrophobicContact CD2-CD1 4.4Å; F26-Y173 HydrophobicContact CD2-CE1 4.27Å; F26-Y173 HydrophobicContact CD2-CE2 4.45Å; F26-Y173 HydrophobicContact CE2-CD2 4.15Å; F26-Y173 HydrophobicContact CE2-CE2 4.3Å; F26-Y173 HydrophobicContact CE2-CG 4.34Å; P169-Y173 VanDerWaalsContact O-CB 3.31Å; P169-Y173 WeakPolarHBondContact O-CB 3.36Å; P169-Y173 PolarHBondContact O-N 3.05Å; L171-Y173 PolarHBondContact O-N 3.36Å; Y173-N175 PolarHBondContact O-N 3.15Å; Y173-F377 HydrophobicContact CD2-CE1 4.12Å; Y173-F377 HydrophobicContact CE2-CD1 4.29Å; Y173-F377 AromaticContact CE2-CE1 3.37Å; Y173-F377 HydrophobicContact CE2-CE1 3.37Å; Y173-F377 AromaticContact CE2-CZ 3.71Å; Y173-F377 HydrophobicContact CE2-CZ 3.71Å
174	K	87.9	Confident	84.9	Confident	98 Å²	98	30.4 Å²	30.4	43%	0.426	14%	0.142	S	C	.	.	H	α-helix	trans	-60	-34.7	-179.9	-178.8	-164.3	159.4	-148.5	0	112.5	Y170 L171 C172 D394	Y170-K174 HydrophobicContact CE1-CD 4.48Å; Y170-K174 VanDerWaalsContact O-CB 3.27Å; Y170-K174 WeakPolarHBondContact O-CB 3.32Å; Y170-K174 PolarHBondContact O-N 3.24Å; L171-K174 PolarHBondContact O-N 3.46Å; C172-K174 PolarHBondContact O-N 3.17Å; K174-D394 IonicContact NZ-OD2 2.71Å; K174-D394 PolarHBondContact NZ-OD2 2.62Å
175	N	89.4	Confident	85.5	Confident	8 Å²	8	34.7 Å²	34.7	4%	0.043	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	28.9	-165.7	-63.1	-22.5	0	0	0	113.8	L171 C172 Y173 F180 V391 D394	L171-N175 WeakPolarHBondContact O-CB 3.27Å; L171-N175 PolarHBondContact O-N 3.48Å; L171-N175 PolarHBondContact O-ND2 3.48Å; C172-N175 PolarHBondContact O-N 2.82Å; Y173-N175 PolarHBondContact O-N 3.15Å; N175-F180 HydrophobicContact CB-CB 4.31Å; N175-F180 HydrophobicContact CB-CD2 3.49Å; N175-F180 VanDerWaalsContact CB-CD2 3.49Å; N175-F180 HydrophobicContact CB-CE2 4.12Å; N175-F180 HydrophobicContact CB-CG 4.19Å; N175-V391 HydrophobicContact CB-CB 4.44Å; N175-V391 HydrophobicContact CB-CG1 4.19Å; N175-V391 HydrophobicContact CB-CG2 3.89Å; N175-D394 WeakPolarHBondContact ND2-CB 3.29Å; N175-D394 PolarHBondContact ND2-OD2 3.42Å
176	G	85	Confident	86.1	Confident	9 Å²	9	37.2 Å²	37.2	9%	0.093	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.1	20.6	171.5	0	0	0	0	0	115.7	C172 G178 A179 D382	C172-G176 PolarHBondContact O-N 2.98Å; G176-G178 PolarHBondContact O-N 3.5Å; G176-A179 WeakPolarHBondContact O-CB 3.45Å; G176-A179 PolarHBondContact O-N 3.33Å; G176-A179 VanDerWaalsContact O-N 3.1Å; G176-D382 PolarHBondContact O-N 3.5Å
177	G	86.9	Confident	86.8	Confident	5 Å²	5	34.7 Å²	34.7	5%	0.052	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	62.7	-122.4	175.9	0	0	0	0	0	111.7	C172 A179 F180 Y378	C172-G177 VanDerWaalsContact O-CA 3.27Å; C172-G177 WeakPolarHBondContact O-CA 3.27Å; C172-G177 PolarHBondContact O-N 2.96Å; G177-A179 PolarHBondContact O-N 3.25Å; G177-F180 PolarHBondContact O-N 3.39Å; G177-Y378 CarbonylContact C-O 3.17Å; G177-Y378 WeakPolarHBondContact CA-O 3.34Å
178	G	83.9	Confident	86.9	Confident	13 Å²	13	32.9 Å²	32.9	13%	0.134	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-60.1	-23.3	176.7	0	0	0	0	0	114.3	G176 F180 L181 Y378 L379	G176-G178 PolarHBondContact O-N 3.5Å; G178-F180 VanDerWaalsContact C-N 3.33Å; G178-F180 PolarHBondContact O-N 3.11Å; G178-L181 WeakPolarHBondContact O-CB 3.19Å; G178-L181 WeakPolarHBondContact O-CG 3.45Å; G178-L181 PolarHBondContact O-N 3.31Å; G178-Y378 PolarHBondContact N-O 3.45Å; G178-L379 WeakPolarHBondContact CA-O 3.48Å
179	A	89.2	Confident	86.9	Confident	1 Å²	1	38 Å²	38	1%	0.008	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-65	-36	179	0	0	0	0	0	112.3	G176 G177 L181 I182 P183 P381 D382 L386	G176-A179 WeakPolarHBondContact O-CB 3.45Å; G176-A179 PolarHBondContact O-N 3.33Å; G176-A179 VanDerWaalsContact O-N 3.1Å; G177-A179 PolarHBondContact O-N 3.25Å; A179-L181 PolarHBondContact O-N 3.16Å; A179-L181 VanDerWaalsContact O-N 3.08Å; A179-I182 PolarHBondContact O-N 2.66Å; A179-I182 VanDerWaalsContact O-N 3.07Å; A179-P183 WeakPolarHBondContact O-CD 3.37Å; A179-P381 HydrophobicContact CB-CB 4.18Å; A179-D382 WeakPolarHBondContact CB-O 3.09Å; A179-L386 HydrophobicContact CB-CD2 4.34Å; A179-L386 HydrophobicContact CB-CG 4.28Å
180	F	89.1	Confident	87.2	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-58.4	-23.7	178.5	179.5	-100.2	0	0	0	113.4	F168 L171 C172 N175 G177 G178 I182 P183 Y184 V391 D394 A395	F168-F180 HydrophobicContact CE2-CE1 4.35Å; L171-F180 HydrophobicContact CB-CE1 4.29Å; L171-F180 HydrophobicContact CB-CZ 3.97Å; C172-F180 HydrophobicContact CB-CD1 4.18Å; C172-F180 WeakPolarHBondContact SG-CD1 3.19Å; N175-F180 HydrophobicContact CB-CB 4.31Å; N175-F180 HydrophobicContact CB-CD2 3.49Å; N175-F180 VanDerWaalsContact CB-CD2 3.49Å; N175-F180 HydrophobicContact CB-CE2 4.12Å; N175-F180 HydrophobicContact CB-CG 4.19Å; G177-F180 PolarHBondContact O-N 3.39Å; G178-F180 VanDerWaalsContact C-N 3.33Å; G178-F180 PolarHBondContact O-N 3.11Å; F180-I182 PolarHBondContact O-N 2.63Å; F180-P183 VanDerWaalsContact O-CD 3.29Å; F180-P183 WeakPolarHBondContact O-CD 3.41Å; F180-P183 WeakPolarHBondContact O-CG 3.06Å; F180-Y184 HydrophobicContact CE1-CD2 4.15Å; F180-Y184 VanDerWaalsContact O-CB 3.24Å; F180-Y184 WeakPolarHBondContact O-CB 3.37Å; F180-Y184 PolarHBondContact O-N 3.2Å; F180-Y184 VanDerWaalsContact O-N 3.15Å; F180-V391 HydrophobicContact CD2-CG1 4.08Å; F180-D394 HydrophobicContact CE2-CB 4.11Å; F180-A395 HydrophobicContact CD2-CB 4.39Å; F180-A395 HydrophobicContact CE2-CB 3.71Å; F180-A395 HydrophobicContact CZ-CB 3.94Å
181	L	86.5	Confident	87.4	Confident	22 Å²	22	39 Å²	39	12%	0.115	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-29.2	177.9	-57.3	174.3	0	0	0	112.2	F168 G178 A179 Y184 F185 L379 Y452	F168-L181 HydrophobicContact CZ-CD2 3.86Å; G178-L181 WeakPolarHBondContact O-CB 3.19Å; G178-L181 WeakPolarHBondContact O-CG 3.45Å; G178-L181 PolarHBondContact O-N 3.31Å; A179-L181 PolarHBondContact O-N 3.16Å; A179-L181 VanDerWaalsContact O-N 3.08Å; L181-Y184 PolarHBondContact O-N 3.29Å; L181-F185 HydrophobicContact CB-CD2 4.2Å; L181-F185 HydrophobicContact CB-CE2 4.07Å; L181-F185 WeakPolarHBondContact O-CB 3.42Å; L181-F185 WeakPolarHBondContact O-CD2 3.08Å; L181-F185 PolarHBondContact O-N 3.48Å; L181-L379 HydrophobicContact CD1-CD2 4.48Å; L181-Y452 HydrophobicContact CD1-CE2 3.75Å; L181-Y452 HydrophobicContact CD2-CD2 4.31Å; L181-Y452 HydrophobicContact CD2-CE2 4.3Å
182	I	90	Very high	87.4	Confident	91 Å²	91	38.6 Å²	38.6	47%	0.467	20%	0.203	S	C	.	.	H	α-helix	trans	-63.6	-61.2	179.9	-63.8	165.4	0	0	0	111.4	A179 F180 Y184 F185 I186 L386	A179-I182 PolarHBondContact O-N 2.66Å; A179-I182 VanDerWaalsContact O-N 3.07Å; F180-I182 PolarHBondContact O-N 2.63Å; I182-Y184 PolarHBondContact O-N 3.35Å; I182-F185 PolarHBondContact O-N 2.85Å; I182-I186 HydrophobicContact CG2-CD1 3.98Å; I182-I186 WeakPolarHBondContact O-CG1 3.26Å; I182-I186 PolarHBondContact O-N 2.98Å; I182-L386 HydrophobicContact CD1-CD1 4.03Å
183	P	92.1	Very high	87.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-31.7	176.1	25	-33.8	0	0	0	112	A179 F180 I186 F187 L386 V391 W392 A395	A179-P183 WeakPolarHBondContact O-CD 3.37Å; F180-P183 VanDerWaalsContact O-CD 3.29Å; F180-P183 WeakPolarHBondContact O-CD 3.41Å; F180-P183 WeakPolarHBondContact O-CG 3.06Å; P183-I186 PolarHBondContact O-N 2.81Å; P183-F187 VanDerWaalsContact O-CD2 3.23Å; P183-F187 WeakPolarHBondContact O-CD2 3.32Å; P183-F187 PolarHBondContact O-N 2.98Å; P183-L386 HydrophobicContact CG-CD2 3.98Å; P183-V391 HydrophobicContact CG-CG1 4.03Å; P183-W392 HydrophobicContact CB-CD2 3.76Å; P183-W392 HydrophobicContact CB-CE3 3.54Å; P183-W392 HydrophobicContact CB-CG 4.4Å; P183-W392 HydrophobicContact CB-CH2 4.13Å; P183-W392 HydrophobicContact CB-CZ2 4.34Å; P183-W392 HydrophobicContact CB-CZ3 3.74Å; P183-A395 HydrophobicContact CB-CB 3.97Å; P183-A395 HydrophobicContact CG-CB 4.2Å
184	Y	88.1	Confident	87.5	Confident	8 Å²	8	38.6 Å²	38.6	3%	0.031	21%	0.213	C	C	.	.	H	α-helix	trans	-60.1	-48.8	174.8	-178.3	-96	0	0	0	112.5	F168 F180 L181 I182 F187 L188 Q398 I399 H448	F168-Y184 HydrophobicContact CD2-CD2 4.43Å; F168-Y184 AromaticContact CD2-CE2 3.88Å; F168-Y184 HydrophobicContact CD2-CE2 3.88Å; F168-Y184 HydrophobicContact CE2-CD1 4.15Å; F168-Y184 AromaticContact CE2-CD2 3.87Å; F168-Y184 HydrophobicContact CE2-CD2 3.87Å; F168-Y184 AromaticContact CE2-CE1 3.88Å; F168-Y184 HydrophobicContact CE2-CE1 3.88Å; F168-Y184 AromaticContact CE2-CE2 3.57Å; F168-Y184 HydrophobicContact CE2-CE2 3.57Å; F168-Y184 HydrophobicContact CE2-CG 4.13Å; F168-Y184 AromaticContact CE2-CZ 3.56Å; F168-Y184 HydrophobicContact CZ-CE1 4.38Å; F180-Y184 HydrophobicContact CE1-CD2 4.15Å; F180-Y184 VanDerWaalsContact O-CB 3.24Å; F180-Y184 WeakPolarHBondContact O-CB 3.37Å; F180-Y184 PolarHBondContact O-N 3.2Å; F180-Y184 VanDerWaalsContact O-N 3.15Å; L181-Y184 PolarHBondContact O-N 3.29Å; I182-Y184 PolarHBondContact O-N 3.35Å; Y184-F187 PolarHBondContact O-N 2.91Å; Y184-L188 WeakPolarHBondContact O-CB 3.31Å; Y184-L188 PolarHBondContact O-N 2.93Å; Y184-Q398 HydrophobicContact CE2-CG 3.99Å; Y184-I399 HydrophobicContact CD1-CD1 4.4Å; Y184-I399 HydrophobicContact CD2-CD1 3.75Å; Y184-I399 HydrophobicContact CD2-CG1 4.01Å; Y184-I399 HydrophobicContact CE1-CD1 4.03Å; Y184-I399 HydrophobicContact CE2-CD1 3.32Å; Y184-I399 HydrophobicContact CE2-CG1 3.92Å; Y184-I399 HydrophobicContact CG-CD1 4.27Å; Y184-I399 VanDerWaalsContact CZ-CD1 3.48Å; Y184-H448 PolarHBondContact OH-CE1 3.09Å; Y184-H448 PolarHBondContact OH-ND1 2.77Å
185	F	87.1	Confident	87.6	Confident	97 Å²	97	35.9 Å²	35.9	43%	0.425	20%	0.204	S	C	.	.	H	α-helix	trans	-67.8	-35.8	176.3	-75.3	-57.3	0	0	0	112.4	L181 I182 L188 F189	L181-F185 HydrophobicContact CB-CD2 4.2Å; L181-F185 HydrophobicContact CB-CE2 4.07Å; L181-F185 WeakPolarHBondContact O-CB 3.42Å; L181-F185 WeakPolarHBondContact O-CD2 3.08Å; L181-F185 PolarHBondContact O-N 3.48Å; I182-F185 PolarHBondContact O-N 2.85Å; F185-L188 HydrophobicContact CD1-CD2 3.92Å; F185-L188 HydrophobicContact CE1-CD2 4.23Å; F185-L188 PolarHBondContact O-N 3.35Å; F185-F189 HydrophobicContact CB-CD2 4.41Å; F185-F189 HydrophobicContact CB-CE2 4.39Å; F185-F189 AromaticContact CD1-CE2 3.95Å; F185-F189 HydrophobicContact CD1-CE2 3.95Å; F185-F189 VanDerWaalsContact O-CD2 3.23Å; F185-F189 WeakPolarHBondContact O-CD2 3.07Å; F185-F189 PolarHBondContact O-N 2.87Å
186	I	90.6	Very high	87.4	Confident	90 Å²	90	35.5 Å²	35.5	46%	0.462	20%	0.202	S	C	.	.	H	α-helix	trans	-60.1	-47.9	174.2	-68.6	165.7	0	0	0	110.8	I182 P183 G190 W392	I182-I186 HydrophobicContact CG2-CD1 3.98Å; I182-I186 WeakPolarHBondContact O-CG1 3.26Å; I182-I186 PolarHBondContact O-N 2.98Å; P183-I186 PolarHBondContact O-N 2.81Å; I186-G190 WeakPolarHBondContact O-CA 3.39Å; I186-G190 PolarHBondContact O-N 3.3Å; I186-W392 HydrophobicContact CD1-CH2 3.87Å; I186-W392 HydrophobicContact CD1-CZ3 3.96Å; I186-W392 HydrophobicContact CG2-CZ3 4.45Å
187	F	90	Very high	87.3	Confident	62 Å²	62	36 Å²	36	27%	0.272	20%	0.202	S	C	.	.	H	α-helix	trans	-69.2	-35	175.6	-77.4	-64.3	0	0	0	112.7	P183 Y184 S191 G192 W392 A395 I399	P183-F187 VanDerWaalsContact O-CD2 3.23Å; P183-F187 WeakPolarHBondContact O-CD2 3.32Å; P183-F187 PolarHBondContact O-N 2.98Å; Y184-F187 PolarHBondContact O-N 2.91Å; F187-S191 PolarHBondContact O-N 3.38Å; F187-S191 PolarHBondContact O-OG 3.27Å; F187-G192 PolarHBondContact O-N 3.02Å; F187-W392 HydrophobicContact CE2-CB 4.21Å; F187-W392 AromaticContact CE2-CE3 3.92Å; F187-W392 HydrophobicContact CE2-CE3 3.92Å; F187-W392 WeakPolarHBondContact CE2-O 3.35Å; F187-W392 HydrophobicContact CZ-CE3 4.45Å; F187-A395 HydrophobicContact CD2-CB 4.08Å; F187-I399 HydrophobicContact CB-CG1 4.04Å
188	L	84.9	Confident	87.3	Confident	10 Å²	10	40.4 Å²	40.4	5%	0.052	22%	0.224	C	C	.	.	I	π-helix	trans	-57.6	-55.2	176.4	175.7	59.4	0	0	0	111.8	Y184 F185 G192 L193 I399 Y403	Y184-L188 WeakPolarHBondContact O-CB 3.31Å; Y184-L188 PolarHBondContact O-N 2.93Å; F185-L188 HydrophobicContact CD1-CD2 3.92Å; F185-L188 HydrophobicContact CE1-CD2 4.23Å; F185-L188 PolarHBondContact O-N 3.35Å; L188-G192 PolarHBondContact O-N 3.37Å; L188-L193 HydrophobicContact CD1-CD1 4.32Å; L188-L193 HydrophobicContact CD1-CD2 4.43Å; L188-L193 HydrophobicContact CD1-CG 3.95Å; L188-L193 HydrophobicContact CG-CD1 4.31Å; L188-L193 HydrophobicContact CG-CG 4.42Å; L188-L193 PolarHBondContact O-N 3.4Å; L188-I399 HydrophobicContact CB-CD1 3.76Å; L188-I399 HydrophobicContact CD1-CD1 4.09Å; L188-I399 HydrophobicContact CG-CD1 4.47Å; L188-Y403 HydrophobicContact CD1-CE2 3.67Å; L188-Y403 WeakPolarHBondContact CD1-OH 3.44Å
189	F	85.1	Confident	87.4	Confident	119 Å²	119	40.8 Å²	40.8	52%	0.522	22%	0.222	S	C	.	.	I	π-helix	trans	-79.6	-33.3	-177.7	-66.1	-68	0	0	0	112.5	F185 L193 P194	F185-F189 HydrophobicContact CB-CD2 4.41Å; F185-F189 HydrophobicContact CB-CE2 4.39Å; F185-F189 AromaticContact CD1-CE2 3.95Å; F185-F189 HydrophobicContact CD1-CE2 3.95Å; F185-F189 VanDerWaalsContact O-CD2 3.23Å; F185-F189 WeakPolarHBondContact O-CD2 3.07Å; F185-F189 PolarHBondContact O-N 2.87Å; F189-L193 HydrophobicContact CD1-CD1 3.65Å; F189-L193 HydrophobicContact CE1-CD1 3.87Å; F189-P194 WeakPolarHBondContact O-CD 3.44Å
190	G	87.4	Confident	87.3	Confident	60 Å²	60	41 Å²	41	62%	0.619	22%	0.223	S	C	*	.	I	π-helix	trans	-79.7	-32	-175.8	0	0	0	0	0	115.3	I186	I186-G190 WeakPolarHBondContact O-CA 3.39Å; I186-G190 PolarHBondContact O-N 3.3Å
191	S	87.9	Confident	87.1	Confident	28 Å²	28	44.6 Å²	44.6	20%	0.196	24%	0.242	C	C	.	.	I	π-helix	trans	-138.4	-37.5	-179.3	63.5	0	0	0	0	114.9	F187 V195	F187-S191 PolarHBondContact O-N 3.38Å; F187-S191 PolarHBondContact O-OG 3.27Å; S191-V195 WeakPolarHBondContact O-CB 3.19Å; S191-V195 VanDerWaalsContact O-CG2 3.23Å; S191-V195 WeakPolarHBondContact O-CG2 3.49Å; S191-V195 PolarHBondContact O-N 3.39Å
192	G	86.1	Confident	87.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-57.2	-63.1	-179	0	0	0	0	0	113	F187 L188 F196	F187-G192 PolarHBondContact O-N 3.02Å; L188-G192 PolarHBondContact O-N 3.37Å; G192-F196 WeakPolarHBondContact O-CB 3.29Å; G192-F196 PolarHBondContact O-N 3.23Å
193	L	83.2	Confident	86.9	Confident	24 Å²	24	41.2 Å²	41.2	13%	0.126	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-45.9	179.5	-68.8	171.1	0	0	0	112.9	L188 F189 V195 F196 F197 Y403	L188-L193 HydrophobicContact CD1-CD1 4.32Å; L188-L193 HydrophobicContact CD1-CD2 4.43Å; L188-L193 HydrophobicContact CD1-CG 3.95Å; L188-L193 HydrophobicContact CG-CD1 4.31Å; L188-L193 HydrophobicContact CG-CG 4.42Å; L188-L193 PolarHBondContact O-N 3.4Å; F189-L193 HydrophobicContact CD1-CD1 3.65Å; F189-L193 HydrophobicContact CE1-CD1 3.87Å; L193-V195 PolarHBondContact O-N 3.26Å; L193-F196 PolarHBondContact O-N 2.93Å; L193-F197 HydrophobicContact CB-CD2 4.44Å; L193-F197 HydrophobicContact CB-CE2 4.19Å; L193-F197 HydrophobicContact CD2-CE2 4.37Å; L193-F197 WeakPolarHBondContact O-CD2 3.44Å; L193-F197 PolarHBondContact O-N 3.45Å; L193-Y403 HydrophobicContact CD2-CE1 4.08Å
194	P	87.3	Confident	86.5	Confident	66 Å²	66	42.9 Å²	42.9	43%	0.429	23%	0.232	S	C	.	.	H	α-helix	trans	-57.7	-46.9	176.6	-28.4	36.1	0	0	0	114.3	F189 L198	F189-P194 WeakPolarHBondContact O-CD 3.44Å; P194-L198 WeakPolarHBondContact O-CB 3.14Å; P194-L198 PolarHBondContact O-N 3.48Å
195	V	88.8	Confident	86.4	Confident	40 Å²	40	50 Å²	50	24%	0.242	26%	0.26	C	S	.	.	H	α-helix	trans	-70.3	-37.7	-179.7	178.8	0	0	0	0	110.8	S191 L193 L198 E199 I405	S191-V195 WeakPolarHBondContact O-CB 3.19Å; S191-V195 VanDerWaalsContact O-CG2 3.23Å; S191-V195 WeakPolarHBondContact O-CG2 3.49Å; S191-V195 PolarHBondContact O-N 3.39Å; L193-V195 PolarHBondContact O-N 3.26Å; V195-L198 WeakPolarHBondContact O-CB 3.44Å; V195-L198 PolarHBondContact O-N 3.48Å; V195-E199 PolarHBondContact O-N 3.36Å; V195-I405 HydrophobicContact CB-CD1 4.44Å; V195-I405 HydrophobicContact CB-CG2 4.4Å; V195-I405 HydrophobicContact CG1-CB 4.23Å; V195-I405 HydrophobicContact CG1-CG2 3.86Å
196	F	85.6	Confident	86.3	Confident	1 Å²	1	46 Å²	46	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-49.3	175	167.6	-94	0	0	0	112.5	V155 G192 L193 L198 E199 I200 Y403 I405 M410 H444	V155-F196 HydrophobicContact CG1-CE2 3.89Å; V155-F196 HydrophobicContact CG1-CZ 3.64Å; G192-F196 WeakPolarHBondContact O-CB 3.29Å; G192-F196 PolarHBondContact O-N 3.23Å; L193-F196 PolarHBondContact O-N 2.93Å; F196-L198 VanDerWaalsContact C-N 3.32Å; F196-L198 PolarHBondContact O-N 2.84Å; F196-E199 PolarHBondContact O-N 2.85Å; F196-I200 HydrophobicContact CD1-CD1 4.26Å; F196-I200 HydrophobicContact CD2-CD1 4.46Å; F196-I200 HydrophobicContact CE1-CD1 3.54Å; F196-I200 HydrophobicContact CE2-CD1 3.8Å; F196-I200 HydrophobicContact CZ-CD1 3.28Å; F196-I200 PolarHBondContact O-N 2.87Å; F196-Y403 HydrophobicContact CB-CD1 4.19Å; F196-Y403 AromaticContact CD2-CD1 3.9Å; F196-Y403 HydrophobicContact CD2-CD1 3.9Å; F196-Y403 HydrophobicContact CG-CD1 4.05Å; F196-I405 HydrophobicContact CB-CG2 4.13Å; F196-M410 HydrophobicContact CD2-CG 4.08Å; F196-M410 HydrophobicContact CD2-SD 4.41Å; F196-M410 HydrophobicContact CE2-CG 4.02Å; F196-M410 HydrophobicContact CE2-SD 3.77Å; F196-H444 AromaticContact CE1-CE1 3.68Å; F196-H444 AromaticContact CE1-NE2 3.07Å; F196-H444 WeakPolarHBondContact CE1-NE2 3.23Å; F196-H444 AromaticContact CE2-CE1 3.83Å; F196-H444 AromaticContact CE2-NE2 3.99Å; F196-H444 AromaticContact CZ-CE1 3.32Å; F196-H444 WeakPolarHBondContact CZ-CE1 3.4Å; F196-H444 AromaticContact CZ-NE2 3.03Å; F196-H444 WeakPolarHBondContact CZ-NE2 3.33Å
197	F	83.4	Confident	86	Confident	18 Å²	18	43.2 Å²	43.2	8%	0.079	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-37.6	176.1	-70.8	-53.9	0	0	0	111.9	L193 E199 I200 I201 L433 C437 A441	L193-F197 HydrophobicContact CB-CD2 4.44Å; L193-F197 HydrophobicContact CB-CE2 4.19Å; L193-F197 HydrophobicContact CD2-CE2 4.37Å; L193-F197 WeakPolarHBondContact O-CD2 3.44Å; L193-F197 PolarHBondContact O-N 3.45Å; F197-E199 PolarHBondContact O-N 2.97Å; F197-I200 PolarHBondContact O-N 3.24Å; F197-I201 WeakPolarHBondContact O-CB 3.23Å; F197-I201 WeakPolarHBondContact O-CD1 3.44Å; F197-I201 VanDerWaalsContact O-CG1 3.24Å; F197-I201 WeakPolarHBondContact O-CG1 3.41Å; F197-I201 PolarHBondContact O-N 3.28Å; F197-L433 HydrophobicContact CD2-CD2 3.93Å; F197-L433 HydrophobicContact CE2-CD1 4.45Å; F197-L433 HydrophobicContact CE2-CD2 3.93Å; F197-L433 HydrophobicContact CG-CD2 4.37Å; F197-L433 HydrophobicContact CZ-CD2 4.37Å; F197-C437 HydrophobicContact CD1-CB 3.98Å; F197-C437 HydrophobicContact CE1-CB 3.53Å; F197-C437 HydrophobicContact CZ-CB 4.07Å; F197-A441 HydrophobicContact CZ-CB 4.41Å
198	L	86.9	Confident	85.7	Confident	98 Å²	98	42.8 Å²	42.8	51%	0.513	23%	0.231	S	C	.	.	H	α-helix	trans	-58	-45.2	175.7	-178.6	64	0	0	0	111.8	P194 V195 F196 I201 I202	P194-L198 WeakPolarHBondContact O-CB 3.14Å; P194-L198 PolarHBondContact O-N 3.48Å; V195-L198 WeakPolarHBondContact O-CB 3.44Å; V195-L198 PolarHBondContact O-N 3.48Å; F196-L198 VanDerWaalsContact C-N 3.32Å; F196-L198 PolarHBondContact O-N 2.84Å; L198-I201 PolarHBondContact O-N 3.35Å; L198-I202 HydrophobicContact CD1-CD1 3.84Å; L198-I202 HydrophobicContact CD1-CG1 4.21Å; L198-I202 HydrophobicContact CD2-CD1 4.49Å; L198-I202 HydrophobicContact CG-CD1 3.75Å; L198-I202 HydrophobicContact CG-CG1 4.46Å; L198-I202 VanDerWaalsContact O-CB 3.25Å; L198-I202 WeakPolarHBondContact O-CB 3.34Å; L198-I202 WeakPolarHBondContact O-CG1 3.16Å; L198-I202 PolarHBondContact O-N 2.9Å
199	E	86.9	Confident	85.6	Confident	21 Å²	21	43.2 Å²	43.2	10%	0.098	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-42.3	177.4	-71.6	-159.6	169	0	0	113.3	V195 F196 F197 I202 G203 I405 C406 M410 T411	V195-E199 PolarHBondContact O-N 3.36Å; F196-E199 PolarHBondContact O-N 2.85Å; F197-E199 PolarHBondContact O-N 2.97Å; E199-I202 PolarHBondContact O-N 3.34Å; E199-G203 PolarHBondContact O-N 3.33Å; E199-I405 HydrophobicContact CG-CG2 4.45Å; E199-C406 WeakPolarHBondContact OE1-CA 3.48Å; E199-C406 PolarHBondContact OE1-N 2.97Å; E199-M410 HydrophobicContact CB-CB 3.99Å; E199-T411 WeakPolarHBondContact O-CA 2.9Å
200	I	85.4	Confident	85.3	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-45.4	177.7	-68.6	174.4	0	0	0	110.6	F151 F196 F197 G203 Q204 M410	F151-I200 HydrophobicContact CZ-CD1 4.19Å; F151-I200 HydrophobicContact CZ-CG2 3.96Å; F196-I200 HydrophobicContact CD1-CD1 4.26Å; F196-I200 HydrophobicContact CD2-CD1 4.46Å; F196-I200 HydrophobicContact CE1-CD1 3.54Å; F196-I200 HydrophobicContact CE2-CD1 3.8Å; F196-I200 HydrophobicContact CZ-CD1 3.28Å; F196-I200 PolarHBondContact O-N 2.87Å; F197-I200 PolarHBondContact O-N 3.24Å; I200-G203 PolarHBondContact O-N 3.45Å; I200-Q204 WeakPolarHBondContact O-CB 3.35Å; I200-Q204 PolarHBondContact O-N 2.98Å; I200-M410 HydrophobicContact CG1-CB 4.11Å
201	I	85.8	Confident	85.3	Confident	77 Å²	77	37.6 Å²	37.6	40%	0.395	20%	0.203	S	C	.	.	H	α-helix	trans	-63.2	-45.3	178.3	-69.1	165.6	0	0	0	110.5	F197 L198 G203 Q204 Y205	F197-I201 WeakPolarHBondContact O-CB 3.23Å; F197-I201 WeakPolarHBondContact O-CD1 3.44Å; F197-I201 VanDerWaalsContact O-CG1 3.24Å; F197-I201 WeakPolarHBondContact O-CG1 3.41Å; F197-I201 PolarHBondContact O-N 3.28Å; L198-I201 PolarHBondContact O-N 3.35Å; I201-G203 VanDerWaalsContact C-N 3.34Å; I201-G203 PolarHBondContact O-N 3.01Å; I201-Q204 PolarHBondContact O-N 3.48Å; I201-Y205 WeakPolarHBondContact O-CB 3.5Å; I201-Y205 PolarHBondContact O-N 3.44Å
202	I	86.1	Confident	85.2	Confident	42 Å²	42	38.7 Å²	38.7	22%	0.215	21%	0.208	C	C	.	.	H	α-helix	trans	-58.9	-45.2	176.2	-79.1	174.1	0	0	0	111.1	L198 E199 T206 C213 I217 T411	L198-I202 HydrophobicContact CD1-CD1 3.84Å; L198-I202 HydrophobicContact CD1-CG1 4.21Å; L198-I202 HydrophobicContact CD2-CD1 4.49Å; L198-I202 HydrophobicContact CG-CD1 3.75Å; L198-I202 HydrophobicContact CG-CG1 4.46Å; L198-I202 VanDerWaalsContact O-CB 3.25Å; L198-I202 WeakPolarHBondContact O-CB 3.34Å; L198-I202 WeakPolarHBondContact O-CG1 3.16Å; L198-I202 PolarHBondContact O-N 2.9Å; E199-I202 PolarHBondContact O-N 3.34Å; I202-T206 WeakPolarHBondContact O-CG2 3.03Å; I202-T206 PolarHBondContact O-N 3.2Å; I202-T206 PolarHBondContact O-OG1 3.46Å; I202-C213 WeakPolarHBondContact CG2-SG 3.07Å; I202-I217 HydrophobicContact CG1-CD1 4.49Å; I202-I217 HydrophobicContact CG2-CD1 3.76Å; I202-T411 HydrophobicContact CG2-CG2 4.15Å
203	G	86.4	Confident	85.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.6	-49.6	175.4	0	0	0	0	0	112.6	E199 I200 I201 Y205 T206 S207 T411 S415	E199-G203 PolarHBondContact O-N 3.33Å; I200-G203 PolarHBondContact O-N 3.45Å; I201-G203 VanDerWaalsContact C-N 3.34Å; I201-G203 PolarHBondContact O-N 3.01Å; G203-Y205 PolarHBondContact O-N 2.89Å; G203-T206 PolarHBondContact O-OG1 3.29Å; G203-S207 VanDerWaalsContact O-CA 3.29Å; G203-S207 WeakPolarHBondContact O-CA 3.16Å; G203-S207 PolarHBondContact O-N 3.11Å; G203-T411 VanDerWaalsContact CA-O 3.27Å; G203-T411 WeakPolarHBondContact CA-O 3.26Å; G203-S415 WeakPolarHBondContact O-CA 3.11Å; G203-S415 VanDerWaalsContact O-CB 3.27Å; G203-S415 WeakPolarHBondContact O-CB 3.44Å
204	Q	84.2	Confident	85.5	Confident	34 Å²	34	41.3 Å²	41.3	16%	0.159	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-41.5	179.8	-176	174.5	6.8	0	0	112.4	I200 I201 S207 G414 N417 K418	I200-Q204 WeakPolarHBondContact O-CB 3.35Å; I200-Q204 PolarHBondContact O-N 2.98Å; I201-Q204 PolarHBondContact O-N 3.48Å; Q204-S207 PolarHBondContact O-OG 3.42Å; Q204-G414 WeakPolarHBondContact CA-O 3.38Å; Q204-N417 HydrophobicContact CG-CB 4.16Å; Q204-N417 PolarHBondContact NE2-ND2 2.88Å; Q204-K418 PolarHBondContact NE2-O 3.3Å
205	Y	85.1	Confident	85.4	Confident	158 Å²	158	42.1 Å²	42.1	62%	0.62	22%	0.215	S	C	*	.	H	α-helix	trans	-66.6	-48.4	180	178.6	-102.4	0	0	0	112.2	I201 G203 Y419	I201-Y205 WeakPolarHBondContact O-CB 3.5Å; I201-Y205 PolarHBondContact O-N 3.44Å; G203-Y205 PolarHBondContact O-N 2.89Å; Y205-Y419 AromaticContact CD2-CE2 3.81Å; Y205-Y419 HydrophobicContact CD2-CE2 3.81Å; Y205-Y419 HydrophobicContact CE2-CE2 4.32Å; Y205-Y419 WeakPolarHBondContact CE2-OH 3.24Å
206	T	85.3	Confident	85.2	Confident	14 Å²	14	46.3 Å²	46.3	9%	0.086	23%	0.23	C	C	.	.	H	α-helix	trans	-76.2	-27.3	179.5	58.6	0	0	0	0	113.1	I202 G203 E208 C213 K216 I217	I202-T206 WeakPolarHBondContact O-CG2 3.03Å; I202-T206 PolarHBondContact O-N 3.2Å; I202-T206 PolarHBondContact O-OG1 3.46Å; G203-T206 PolarHBondContact O-OG1 3.29Å; T206-E208 PolarHBondContact O-N 3.24Å; T206-E208 PolarHBondContact OG1-N 3.15Å; T206-C213 PolarHBondContact OG1-SG 2.94Å; T206-K216 PolarHBondContact O-NZ 2.95Å; T206-I217 HydrophobicContact CG2-CD1 4.41Å; T206-I217 HydrophobicContact CG2-CG1 4.37Å
207	S	84.5	Confident	85.3	Confident	31 Å²	31	50.2 Å²	50.2	22%	0.217	25%	0.25	C	C	.	.			trans	54.9	20.8	-166.6	-73	0	0	0	0	114.3	R142 K144 G203 Q204	R142-S207 VanDerWaalsContact CD-O 3.3Å; R142-S207 WeakPolarHBondContact CD-O 3.2Å; R142-S207 PolarHBondContact NH1-O 3.38Å; K144-S207 PolarHBondContact NZ-OG 3.46Å; G203-S207 VanDerWaalsContact O-CA 3.29Å; G203-S207 WeakPolarHBondContact O-CA 3.16Å; G203-S207 PolarHBondContact O-N 3.11Å; Q204-S207 PolarHBondContact O-OG 3.42Å
208	E	83.1	Confident	85.5	Confident	53 Å²	53	51.3 Å²	51.3	25%	0.248	26%	0.259	C	S	.	.			trans	-102.8	170.7	-174.3	-78.2	-50.7	147.6	0	0	114.8	R142 T206 T212 C213 K216 S415	R142-E208 PolarHBondContact NH1-O 2.81Å; T206-E208 PolarHBondContact O-N 3.24Å; T206-E208 PolarHBondContact OG1-N 3.15Å; E208-T212 WeakPolarHBondContact CB-OG1 3.25Å; E208-T212 VanDerWaalsContact OE2-CB 3.32Å; E208-T212 WeakPolarHBondContact OE2-CB 3.22Å; E208-T212 PolarHBondContact OE2-OG1 3.34Å; E208-C213 HydrophobicContact CB-CB 4.09Å; E208-K216 HydrophobicContact CG-CD 3.65Å; E208-K216 VanDerWaalsContact CG-NZ 3.28Å; E208-K216 WeakPolarHBondContact OE1-CE 3.07Å; E208-K216 IonicContact OE1-NZ 2.74Å; E208-K216 PolarHBondContact OE1-NZ 3.46Å; E208-S415 WeakPolarHBondContact O-CB 3.43Å; E208-S415 PolarHBondContact O-OG 2.86Å
209	G	83.4	Confident	85.5	Confident	18 Å²	18	51.3 Å²	51.3	19%	0.186	27%	0.265	C	S	.	.			trans	-78.5	172.5	172.1	0	0	0	0	0	112.1	I211 T212 C213	G209-I211 PolarHBondContact O-N 2.98Å; G209-I211 VanDerWaalsContact O-N 3.07Å; G209-T212 PolarHBondContact N-OG1 3.36Å; G209-T212 VanDerWaalsContact N-OG1 3.16Å; G209-T212 PolarHBondContact O-N 3.36Å; G209-C213 WeakPolarHBondContact O-CB 3.06Å; G209-C213 PolarHBondContact O-N 3.07Å
210	G	79.4	Confident	85.7	Confident	19 Å²	19	57.1 Å²	57.1	20%	0.196	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.4	-179	0	0	0	0	0	115.5
211	I	85.9	Confident	85.9	Confident	43 Å²	43	61.7 Å²	61.7	22%	0.221	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-62.3	173	-54.5	178.7	0	0	0	110.8	G209 C213 W214 Y226 V229	G209-I211 PolarHBondContact O-N 2.98Å; G209-I211 VanDerWaalsContact O-N 3.07Å; I211-C213 PolarHBondContact O-N 3.48Å; I211-W214 PolarHBondContact O-N 3.38Å; I211-Y226 HydrophobicContact CD1-CD1 4.04Å; I211-Y226 HydrophobicContact CD1-CE1 4Å; I211-Y226 HydrophobicContact CG2-CD2 4.19Å; I211-Y226 HydrophobicContact CG2-CE1 4.26Å; I211-Y226 HydrophobicContact CG2-CE2 3.73Å; I211-V229 HydrophobicContact CD1-CG2 3.97Å; I211-V229 HydrophobicContact CG1-CG2 4.01Å
212	T	86	Confident	86	Confident	51 Å²	51	58.7 Å²	58.7	31%	0.313	30%	0.302	S	S	.	.	H	α-helix	trans	-62.7	-19.8	-173.4	49.4	0	0	0	0	113.6	E208 G209 E215 K216	E208-T212 WeakPolarHBondContact CB-OG1 3.25Å; E208-T212 VanDerWaalsContact OE2-CB 3.32Å; E208-T212 WeakPolarHBondContact OE2-CB 3.22Å; E208-T212 PolarHBondContact OE2-OG1 3.34Å; G209-T212 PolarHBondContact N-OG1 3.36Å; G209-T212 VanDerWaalsContact N-OG1 3.16Å; G209-T212 PolarHBondContact O-N 3.36Å; T212-E215 PolarHBondContact O-N 3.45Å; T212-K216 PolarHBondContact O-N 3.07Å
213	C	87.1	Confident	86.2	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.014	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-43.6	169.6	-178.2	0	0	0	0	112.8	I202 T206 E208 G209 I211 E215 K216 I217 T411	I202-C213 WeakPolarHBondContact CG2-SG 3.07Å; T206-C213 PolarHBondContact OG1-SG 2.94Å; E208-C213 HydrophobicContact CB-CB 4.09Å; G209-C213 WeakPolarHBondContact O-CB 3.06Å; G209-C213 PolarHBondContact O-N 3.07Å; I211-C213 PolarHBondContact O-N 3.48Å; C213-E215 VanDerWaalsContact C-N 3.34Å; C213-K216 PolarHBondContact O-N 2.95Å; C213-I217 WeakPolarHBondContact O-CG1 3.32Å; C213-I217 PolarHBondContact O-N 3.29Å; C213-T411 HydrophobicContact CB-CG2 4.08Å
214	W	88	Confident	86.5	Confident	76 Å²	76	62.5 Å²	62.5	29%	0.288	33%	0.333	S	S	.	.	H	α-helix	trans	-67.7	-36.2	179.3	-72.8	108.7	0	0	0	111.6	I211 K216 I217 C218 F221 I224	I211-W214 PolarHBondContact O-N 3.38Å; W214-K216 VanDerWaalsContact C-N 3.29Å; W214-K216 PolarHBondContact O-N 2.96Å; W214-I217 PolarHBondContact O-N 3.33Å; W214-I217 VanDerWaalsContact O-N 3.15Å; W214-C218 CarbonylContact O-C 3.52Å; W214-C218 PolarHBondContact O-N 3.25Å; W214-F221 HydrophobicContact CE3-CB 3.9Å; W214-F221 HydrophobicContact CZ3-CB 4.42Å; W214-I224 HydrophobicContact CD2-CB 4.38Å; W214-I224 HydrophobicContact CH2-CD1 4.21Å; W214-I224 HydrophobicContact CZ2-CB 4.47Å; W214-I224 HydrophobicContact CZ2-CD1 4.32Å; W214-I224 HydrophobicContact CZ2-CG2 3.92Å; W214-I224 HydrophobicContact CZ3-CD1 4.3Å
215	E	86.1	Confident	86.7	Confident	84 Å²	84	60.9 Å²	60.9	39%	0.393	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-36	177.2	-64	178.6	163.6	0	0	112.7	T212 C213 S222	T212-E215 PolarHBondContact O-N 3.45Å; C213-E215 VanDerWaalsContact C-N 3.34Å; E215-S222 WeakPolarHBondContact CG-OG 3.47Å; E215-S222 PolarHBondContact OE1-OG 3.19Å
216	K	84.8	Confident	87	Confident	127 Å²	127	59.6 Å²	59.6	55%	0.552	32%	0.321	S	S	*	.	H	α-helix	trans	-75.2	-28.5	174.7	-72.2	-174	177	173.8	0	114.1	T206 E208 T212 C213 W214	T206-K216 PolarHBondContact O-NZ 2.95Å; E208-K216 HydrophobicContact CG-CD 3.65Å; E208-K216 VanDerWaalsContact CG-NZ 3.28Å; E208-K216 WeakPolarHBondContact OE1-CE 3.07Å; E208-K216 IonicContact OE1-NZ 2.74Å; E208-K216 PolarHBondContact OE1-NZ 3.46Å; T212-K216 PolarHBondContact O-N 3.07Å; C213-K216 PolarHBondContact O-N 2.95Å; W214-K216 VanDerWaalsContact C-N 3.29Å; W214-K216 PolarHBondContact O-N 2.96Å
217	I	87.4	Confident	87.3	Confident	84 Å²	84	61.3 Å²	61.3	43%	0.431	34%	0.337	S	S	.	.	H	α-helix	trans	-87	-54.3	-178.4	-67.6	170.6	0	0	0	110.8	I202 T206 C213 W214	I202-I217 HydrophobicContact CG1-CD1 4.49Å; I202-I217 HydrophobicContact CG2-CD1 3.76Å; T206-I217 HydrophobicContact CG2-CD1 4.41Å; T206-I217 HydrophobicContact CG2-CG1 4.37Å; C213-I217 WeakPolarHBondContact O-CG1 3.32Å; C213-I217 PolarHBondContact O-N 3.29Å; W214-I217 PolarHBondContact O-N 3.33Å; W214-I217 VanDerWaalsContact O-N 3.15Å
218	C	87.9	Confident	87.6	Confident	40 Å²	40	60.3 Å²	60.3	27%	0.27	33%	0.33	S	S	.	.			trans	-157.9	105.9	178.1	-172.7	0	0	0	0	109.1	W214 L220 F221	W214-C218 CarbonylContact O-C 3.52Å; W214-C218 PolarHBondContact O-N 3.25Å; C218-L220 PolarHBondContact O-N 2.96Å; C218-L220 VanDerWaalsContact O-N 3.08Å; C218-F221 HydrophobicContact CB-CD2 3.78Å; C218-F221 HydrophobicContact CB-CE2 4.39Å; C218-F221 PolarHBondContact O-N 3.46Å
219	P	87.5	Confident	88	Confident	98 Å²	98	61.2 Å²	61.2	64%	0.636	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-61.5	-23.6	-174.3	23.2	-33.7	0	0	0	113.7	F221 S222	P219-F221 PolarHBondContact O-N 2.87Å; P219-S222 WeakPolarHBondContact O-CB 2.95Å; P219-S222 PolarHBondContact O-N 2.99Å; P219-S222 VanDerWaalsContact O-N 3.15Å
220	L	91.1	Very high	88.4	Confident	144 Å²	144	64.6 Å²	64.6	75%	0.754	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-57.6	-30.2	171.8	-175.9	63.2	0	0	0	112.7	C218	C218-L220 PolarHBondContact O-N 2.96Å; C218-L220 VanDerWaalsContact O-N 3.08Å
221	F	89.7	Confident	89	Confident	101 Å²	101	67.5 Å²	67.5	44%	0.443	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-96.5	9.3	-179.6	-61.4	-41.7	0	0	0	114	W214 C218 P219 G223 I224	W214-F221 HydrophobicContact CE3-CB 3.9Å; W214-F221 HydrophobicContact CZ3-CB 4.42Å; C218-F221 HydrophobicContact CB-CD2 3.78Å; C218-F221 HydrophobicContact CB-CE2 4.39Å; C218-F221 PolarHBondContact O-N 3.46Å; P219-F221 PolarHBondContact O-N 2.87Å; F221-G223 PolarHBondContact O-N 3.46Å; F221-G223 VanDerWaalsContact O-N 3.11Å; F221-I224 HydrophobicContact CB-CD1 3.87Å; F221-I224 HydrophobicContact CB-CG1 4.26Å; F221-I224 HydrophobicContact CD1-CD1 4.34Å; F221-I224 HydrophobicContact CG-CD1 4.2Å; F221-I224 WeakPolarHBondContact O-CB 3.12Å; F221-I224 WeakPolarHBondContact O-CG1 3.26Å; F221-I224 PolarHBondContact O-N 3Å
222	S	87.2	Confident	89.2	Confident	14 Å²	14	67.6 Å²	67.6	10%	0.098	37%	0.369	C	S	.	.	H	α-helix	trans	-53.9	-33	174.9	-177.3	0	0	0	0	112.5	E215 P219 I224 G225 Y226	E215-S222 WeakPolarHBondContact CG-OG 3.47Å; E215-S222 PolarHBondContact OE1-OG 3.19Å; P219-S222 WeakPolarHBondContact O-CB 2.95Å; P219-S222 PolarHBondContact O-N 2.99Å; P219-S222 VanDerWaalsContact O-N 3.15Å; S222-I224 PolarHBondContact O-N 3.3Å; S222-I224 VanDerWaalsContact O-N 3.13Å; S222-G225 PolarHBondContact O-N 2.7Å; S222-Y226 WeakPolarHBondContact O-CD2 3.21Å; S222-Y226 PolarHBondContact O-N 3.29Å; S222-Y226 WeakPolarHBondContact OG-CE2 3.25Å
223	G	91	Very high	89.4	Confident	50 Å²	50	68 Å²	68	52%	0.515	37%	0.374	S	S	.	.	H	α-helix	trans	-56.1	-26.2	173.8	0	0	0	0	0	115.3	F221 Y226 A227	F221-G223 PolarHBondContact O-N 3.46Å; F221-G223 VanDerWaalsContact O-N 3.11Å; G223-Y226 PolarHBondContact O-N 3.15Å; G223-A227 WeakPolarHBondContact O-CB 3.48Å; G223-A227 PolarHBondContact O-N 3.48Å
224	I	91.1	Very high	89.7	Confident	71 Å²	71	73.6 Å²	73.6	36%	0.364	40%	0.402	S	S	.	.	H	α-helix	trans	-63.5	-45.2	174.4	-58.6	-178.2	0	0	0	110	W214 F221 S222 Y226 A227 S228	W214-I224 HydrophobicContact CD2-CB 4.38Å; W214-I224 HydrophobicContact CH2-CD1 4.21Å; W214-I224 HydrophobicContact CZ2-CB 4.47Å; W214-I224 HydrophobicContact CZ2-CD1 4.32Å; W214-I224 HydrophobicContact CZ2-CG2 3.92Å; W214-I224 HydrophobicContact CZ3-CD1 4.3Å; F221-I224 HydrophobicContact CB-CD1 3.87Å; F221-I224 HydrophobicContact CB-CG1 4.26Å; F221-I224 HydrophobicContact CD1-CD1 4.34Å; F221-I224 HydrophobicContact CG-CD1 4.2Å; F221-I224 WeakPolarHBondContact O-CB 3.12Å; F221-I224 WeakPolarHBondContact O-CG1 3.26Å; F221-I224 PolarHBondContact O-N 3Å; S222-I224 PolarHBondContact O-N 3.3Å; S222-I224 VanDerWaalsContact O-N 3.13Å; I224-Y226 PolarHBondContact O-N 3.44Å; I224-A227 PolarHBondContact O-N 2.97Å; I224-S228 PolarHBondContact O-N 2.92Å; I224-S228 PolarHBondContact O-OG 3.31Å
225	G	89.7	Confident	89.7	Confident	1 Å²	1	72 Å²	72	1%	0.01	40%	0.399	C	S	.	.	H	α-helix	trans	-61.1	-43.7	179	0	0	0	0	0	112.8	S222 S228 V229	S222-G225 PolarHBondContact O-N 2.7Å; G225-S228 PolarHBondContact O-N 3.12Å; G225-V229 WeakPolarHBondContact O-CG2 3.47Å; G225-V229 PolarHBondContact O-N 3.37Å; G225-V229 VanDerWaalsContact O-N 3.07Å
226	Y	90.9	Very high	89.9	Confident	130 Å²	130	72.4 Å²	72.4	51%	0.51	40%	0.404	S	S	.	.	H	α-helix	trans	-63.3	-43	174.9	-69.3	-77.9	0	0	0	111.9	I211 S222 G223 I224 V229 V230	I211-Y226 HydrophobicContact CD1-CD1 4.04Å; I211-Y226 HydrophobicContact CD1-CE1 4Å; I211-Y226 HydrophobicContact CG2-CD2 4.19Å; I211-Y226 HydrophobicContact CG2-CE1 4.26Å; I211-Y226 HydrophobicContact CG2-CE2 3.73Å; S222-Y226 WeakPolarHBondContact O-CD2 3.21Å; S222-Y226 PolarHBondContact O-N 3.29Å; S222-Y226 WeakPolarHBondContact OG-CE2 3.25Å; G223-Y226 PolarHBondContact O-N 3.15Å; I224-Y226 PolarHBondContact O-N 3.44Å; Y226-V229 PolarHBondContact O-N 3.16Å; Y226-V230 WeakPolarHBondContact O-CG2 3.39Å; Y226-V230 PolarHBondContact O-N 3.28Å
227	A	92.5	Very high	90.3	Very high	50 Å²	50	71.2 Å²	71.2	41%	0.413	41%	0.407	S	S	.	.	H	α-helix	trans	-61.1	-45.2	175.9	0	0	0	0	0	112	G223 I224 V229 V230 I231	G223-A227 WeakPolarHBondContact O-CB 3.48Å; G223-A227 PolarHBondContact O-N 3.48Å; I224-A227 PolarHBondContact O-N 2.97Å; A227-V229 VanDerWaalsContact C-N 3.3Å; A227-V229 PolarHBondContact O-N 3.4Å; A227-V230 PolarHBondContact O-N 2.85Å; A227-I231 WeakPolarHBondContact O-CG1 3.17Å; A227-I231 PolarHBondContact O-N 3.47Å
228	S	90.1	Very high	90.4	Very high	10 Å²	10	71.6 Å²	71.6	7%	0.07	40%	0.404	C	S	.	.	H	α-helix	trans	-59.1	-39.1	175.2	-60.8	0	0	0	0	112.1	I224 G225 I231 V232 C406	I224-S228 PolarHBondContact O-N 2.92Å; I224-S228 PolarHBondContact O-OG 3.31Å; G225-S228 PolarHBondContact O-N 3.12Å; S228-I231 PolarHBondContact O-N 3.18Å; S228-V232 WeakPolarHBondContact O-CB 3.47Å; S228-V232 VanDerWaalsContact O-CG2 3.29Å; S228-V232 WeakPolarHBondContact O-CG2 3.34Å; S228-V232 PolarHBondContact O-N 3.33Å; S228-C406 PolarHBondContact OG-O 3.1Å; S228-C406 VanDerWaalsContact OG-O 3.11Å
229	V	90.5	Very high	90.6	Very high	73 Å²	73	72.7 Å²	72.7	44%	0.442	40%	0.403	S	S	.	.	H	α-helix	trans	-68.3	-38.4	176.8	168.7	0	0	0	0	112.7	I211 G225 Y226 A227 S233	I211-V229 HydrophobicContact CD1-CG2 3.97Å; I211-V229 HydrophobicContact CG1-CG2 4.01Å; G225-V229 WeakPolarHBondContact O-CG2 3.47Å; G225-V229 PolarHBondContact O-N 3.37Å; G225-V229 VanDerWaalsContact O-N 3.07Å; Y226-V229 PolarHBondContact O-N 3.16Å; A227-V229 VanDerWaalsContact C-N 3.3Å; A227-V229 PolarHBondContact O-N 3.4Å; V229-S233 WeakPolarHBondContact O-CB 3.45Å; V229-S233 PolarHBondContact O-N 2.8Å; V229-S233 PolarHBondContact O-OG 3.48Å
230	V	93.1	Very high	90.9	Very high	89 Å²	89	69 Å²	69	54%	0.539	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-46.8	172.6	175.4	0	0	0	0	110.1	Y226 A227 S233 L234	Y226-V230 WeakPolarHBondContact O-CG2 3.39Å; Y226-V230 PolarHBondContact O-N 3.28Å; A227-V230 PolarHBondContact O-N 2.85Å; V230-S233 WeakPolarHBondContact O-CB 3.42Å; V230-S233 PolarHBondContact O-N 2.89Å; V230-L234 HydrophobicContact CG1-CD1 4.33Å; V230-L234 WeakPolarHBondContact O-CG 3.08Å; V230-L234 PolarHBondContact O-N 3.48Å
231	I	91.3	Very high	91	Very high	80 Å²	80	64.5 Å²	64.5	41%	0.41	36%	0.356	S	S	.	.	H	α-helix	trans	-58.8	-52.9	177.7	-67	164.4	0	0	0	110.3	A227 S228 S233 L234 L235 L407	A227-I231 WeakPolarHBondContact O-CG1 3.17Å; A227-I231 PolarHBondContact O-N 3.47Å; S228-I231 PolarHBondContact O-N 3.18Å; I231-S233 VanDerWaalsContact C-N 3.27Å; I231-S233 PolarHBondContact O-N 3.47Å; I231-L234 PolarHBondContact O-N 2.81Å; I231-L234 VanDerWaalsContact O-N 3.1Å; I231-L235 HydrophobicContact CG2-CD1 4.3Å; I231-L235 HydrophobicContact CG2-CG 4.31Å; I231-L235 WeakPolarHBondContact O-CG 3.38Å; I231-L235 PolarHBondContact O-N 2.77Å; I231-L407 HydrophobicContact CB-CD2 4.49Å; I231-L407 HydrophobicContact CG2-CD2 3.7Å
232	V	89.6	Confident	91.2	Very high	45 Å²	45	62.1 Å²	62.1	27%	0.273	35%	0.347	S	S	.	.	H	α-helix	trans	-59.8	-36.4	179.4	169.6	0	0	0	0	112	S228 L235 N236 L407	S228-V232 WeakPolarHBondContact O-CB 3.47Å; S228-V232 VanDerWaalsContact O-CG2 3.29Å; S228-V232 WeakPolarHBondContact O-CG2 3.34Å; S228-V232 PolarHBondContact O-N 3.33Å; V232-L235 PolarHBondContact O-N 2.89Å; V232-N236 VanDerWaalsContact O-CG 3.28Å; V232-N236 PolarHBondContact O-N 2.82Å; V232-N236 PolarHBondContact O-ND2 3.17Å; V232-L407 HydrophobicContact CG2-CB 4Å
233	S	91.3	Very high	91.5	Very high	60 Å²	60	64.8 Å²	64.8	42%	0.42	36%	0.36	S	S	.	.	H	α-helix	trans	-62.8	-45.1	174.4	-58.9	0	0	0	0	111.8	V229 V230 I231 N236 V237	V229-S233 WeakPolarHBondContact O-CB 3.45Å; V229-S233 PolarHBondContact O-N 2.8Å; V229-S233 PolarHBondContact O-OG 3.48Å; V230-S233 WeakPolarHBondContact O-CB 3.42Å; V230-S233 PolarHBondContact O-N 2.89Å; I231-S233 VanDerWaalsContact C-N 3.27Å; I231-S233 PolarHBondContact O-N 3.47Å; S233-N236 PolarHBondContact O-N 3.34Å; S233-V237 WeakPolarHBondContact O-CG2 3.31Å; S233-V237 PolarHBondContact O-N 2.92Å
234	L	92.1	Very high	91.7	Very high	118 Å²	118	62.5 Å²	62.5	62%	0.618	34%	0.337	S	S	*	.	H	α-helix	trans	-65.6	-37.4	175.3	-66.6	172.6	0	0	0	112.4	V230 I231 V237	V230-L234 HydrophobicContact CG1-CD1 4.33Å; V230-L234 WeakPolarHBondContact O-CG 3.08Å; V230-L234 PolarHBondContact O-N 3.48Å; I231-L234 PolarHBondContact O-N 2.81Å; I231-L234 VanDerWaalsContact O-N 3.1Å; L234-V237 PolarHBondContact O-N 2.89Å
235	L	89.4	Confident	91.9	Very high	42 Å²	42	62.6 Å²	62.6	22%	0.22	33%	0.333	C	S	.	.	H	α-helix	trans	-59.8	-48.4	173.2	-65.1	-178.3	0	0	0	110.9	I231 V232 V237 Y238 Y239 L407	I231-L235 HydrophobicContact CG2-CD1 4.3Å; I231-L235 HydrophobicContact CG2-CG 4.31Å; I231-L235 WeakPolarHBondContact O-CG 3.38Å; I231-L235 PolarHBondContact O-N 2.77Å; V232-L235 PolarHBondContact O-N 2.89Å; L235-V237 VanDerWaalsContact C-N 3.32Å; L235-V237 PolarHBondContact O-N 3.38Å; L235-Y238 HydrophobicContact CB-CE1 4.37Å; L235-Y238 HydrophobicContact CD2-CE1 3.62Å; L235-Y238 WeakPolarHBondContact O-CD1 3.43Å; L235-Y238 PolarHBondContact O-N 3.37Å; L235-Y239 HydrophobicContact CB-CD2 4.25Å; L235-Y239 WeakPolarHBondContact O-CB 2.95Å; L235-Y239 WeakPolarHBondContact O-CD2 3.34Å; L235-Y239 PolarHBondContact O-N 2.97Å; L235-L407 HydrophobicContact CD1-CD1 3.8Å
236	N	90.7	Very high	92	Very high	93 Å²	93	65 Å²	65	50%	0.497	35%	0.352	S	S	.	.	H	α-helix	trans	-59.3	-40.6	-179.9	-73.9	-31.2	0	0	0	112.4	V232 S233 Y238 Y239 I240	V232-N236 VanDerWaalsContact O-CG 3.28Å; V232-N236 PolarHBondContact O-N 2.82Å; V232-N236 PolarHBondContact O-ND2 3.17Å; S233-N236 PolarHBondContact O-N 3.34Å; N236-Y238 VanDerWaalsContact C-N 3.33Å; N236-Y238 PolarHBondContact O-N 3.37Å; N236-Y239 PolarHBondContact O-N 3.47Å; N236-I240 WeakPolarHBondContact O-CB 3.31Å; N236-I240 WeakPolarHBondContact O-CG2 3.5Å; N236-I240 PolarHBondContact O-N 2.88Å
237	V	91.8	Very high	92.2	Very high	102 Å²	102	60.2 Å²	60.2	62%	0.618	34%	0.336	S	S	*	.	H	α-helix	trans	-59.9	-37.7	-179.5	169.5	0	0	0	0	112.8	S233 L234 L235 I240	S233-V237 WeakPolarHBondContact O-CG2 3.31Å; S233-V237 PolarHBondContact O-N 2.92Å; L234-V237 PolarHBondContact O-N 2.89Å; L235-V237 VanDerWaalsContact C-N 3.32Å; L235-V237 PolarHBondContact O-N 3.38Å; V237-I240 WeakPolarHBondContact O-CG2 3.37Å
238	Y	91	Very high	92.3	Very high	92 Å²	92	58.7 Å²	58.7	36%	0.361	32%	0.32	S	S	.	.	H	α-helix	trans	-89.2	-33.8	176.5	84.1	-104.6	0	0	0	113	L235 N236 I240 V241 I242	L235-Y238 HydrophobicContact CB-CE1 4.37Å; L235-Y238 HydrophobicContact CD2-CE1 3.62Å; L235-Y238 WeakPolarHBondContact O-CD1 3.43Å; L235-Y238 PolarHBondContact O-N 3.37Å; N236-Y238 VanDerWaalsContact C-N 3.33Å; N236-Y238 PolarHBondContact O-N 3.37Å; Y238-I240 VanDerWaalsContact C-N 3.32Å; Y238-I240 PolarHBondContact O-N 2.99Å; Y238-V241 WeakPolarHBondContact O-CB 3.4Å; Y238-V241 PolarHBondContact O-N 3.4Å; Y238-I242 HydrophobicContact CD2-CD1 3.68Å; Y238-I242 HydrophobicContact CD2-CG1 4.48Å; Y238-I242 HydrophobicContact CE2-CD1 3.85Å; Y238-I242 PolarHBondContact O-N 3.01Å; Y238-I242 VanDerWaalsContact O-N 3.16Å
239	Y	91.2	Very high	92.5	Very high	63 Å²	63	60.7 Å²	60.7	25%	0.247	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-37.2	-179.8	-92	-63.3	0	0	0	112.2	L235 N236 V241 I242 L243 F401	L235-Y239 HydrophobicContact CB-CD2 4.25Å; L235-Y239 WeakPolarHBondContact O-CB 2.95Å; L235-Y239 WeakPolarHBondContact O-CD2 3.34Å; L235-Y239 PolarHBondContact O-N 2.97Å; N236-Y239 PolarHBondContact O-N 3.47Å; Y239-V241 VanDerWaalsContact C-N 3.26Å; Y239-V241 PolarHBondContact O-N 3.03Å; Y239-I242 HydrophobicContact CD1-CD1 4.29Å; Y239-I242 PolarHBondContact O-N 2.76Å; Y239-I242 VanDerWaalsContact O-N 3.16Å; Y239-L243 PolarHBondContact O-N 2.98Å; Y239-F401 VanDerWaalsContact OH-CZ 3.31Å; Y239-F401 WeakPolarHBondContact OH-CZ 3.43Å
240	I	93.8	Very high	92.7	Very high	20 Å²	20	61.9 Å²	61.9	10%	0.103	33%	0.33	C	S	.	.	H	α-helix	trans	-63.8	-32.2	176.6	-157.4	78.5	0	0	0	112	N236 V237 Y238 L243 A244 L325 V328 W329	N236-I240 WeakPolarHBondContact O-CB 3.31Å; N236-I240 WeakPolarHBondContact O-CG2 3.5Å; N236-I240 PolarHBondContact O-N 2.88Å; V237-I240 WeakPolarHBondContact O-CG2 3.37Å; Y238-I240 VanDerWaalsContact C-N 3.32Å; Y238-I240 PolarHBondContact O-N 2.99Å; I240-L243 HydrophobicContact CD1-CD1 4.48Å; I240-L243 PolarHBondContact O-N 3.04Å; I240-A244 PolarHBondContact O-N 2.7Å; I240-L325 HydrophobicContact CB-CD1 4.39Å; I240-L325 HydrophobicContact CG1-CD1 3.91Å; I240-L325 HydrophobicContact CG2-CD1 3.94Å; I240-V328 HydrophobicContact CD1-CG1 3.55Å; I240-V328 HydrophobicContact CG1-CG1 4.08Å; I240-W329 HydrophobicContact CD1-CD2 4.42Å; I240-W329 HydrophobicContact CG1-CD2 4.27Å; I240-W329 HydrophobicContact CG1-CG 4.4Å; I240-W329 HydrophobicContact CG1-CZ2 4.28Å; I240-W329 HydrophobicContact CG2-CZ2 4.33Å
241	V	93.9	Very high	92.8	Very high	51 Å²	51	62.4 Å²	62.4	31%	0.309	33%	0.325	S	S	.	.	H	α-helix	trans	-70.2	-38.9	174.2	177.3	0	0	0	0	111.3	Y238 Y239 L243 A244 W245	Y238-V241 WeakPolarHBondContact O-CB 3.4Å; Y238-V241 PolarHBondContact O-N 3.4Å; Y239-V241 VanDerWaalsContact C-N 3.26Å; Y239-V241 PolarHBondContact O-N 3.03Å; V241-L243 VanDerWaalsContact C-N 3.32Å; V241-L243 PolarHBondContact O-N 3.06Å; V241-A244 WeakPolarHBondContact O-CB 3.23Å; V241-A244 PolarHBondContact O-N 3.44Å; V241-W245 HydrophobicContact CG1-CD2 4.33Å; V241-W245 HydrophobicContact CG1-CH2 4.28Å; V241-W245 HydrophobicContact CG1-CZ2 3.67Å; V241-W245 PolarHBondContact O-N 3.29Å
242	I	92.9	Very high	92.8	Very high	50 Å²	50	60.4 Å²	60.4	26%	0.256	31%	0.314	S	S	.	.	H	α-helix	trans	-63.9	-39.6	174.1	-60.9	171.5	0	0	0	110.9	L162 Y238 Y239 W245 A246	L162-I242 HydrophobicContact CD1-CG2 3.72Å; Y238-I242 HydrophobicContact CD2-CD1 3.68Å; Y238-I242 HydrophobicContact CD2-CG1 4.48Å; Y238-I242 HydrophobicContact CE2-CD1 3.85Å; Y238-I242 PolarHBondContact O-N 3.01Å; Y238-I242 VanDerWaalsContact O-N 3.16Å; Y239-I242 HydrophobicContact CD1-CD1 4.29Å; Y239-I242 PolarHBondContact O-N 2.76Å; Y239-I242 VanDerWaalsContact O-N 3.16Å; I242-W245 HydrophobicContact CB-CE3 4.25Å; I242-W245 HydrophobicContact CG1-CE3 3.96Å; I242-W245 HydrophobicContact CG1-CZ3 3.79Å; I242-W245 HydrophobicContact CG2-CE3 4.47Å; I242-W245 PolarHBondContact O-N 3.28Å; I242-A246 PolarHBondContact O-N 3.12Å
243	L	93.2	Very high	93.1	Very high	70 Å²	70	61 Å²	61	37%	0.366	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-39.9	173.4	-69.1	175.8	0	0	0	111.8	Y239 I240 V241 W245 A246 T247 V328	Y239-L243 PolarHBondContact O-N 2.98Å; I240-L243 HydrophobicContact CD1-CD1 4.48Å; I240-L243 PolarHBondContact O-N 3.04Å; V241-L243 VanDerWaalsContact C-N 3.32Å; V241-L243 PolarHBondContact O-N 3.06Å; L243-W245 VanDerWaalsContact C-N 3.34Å; L243-W245 PolarHBondContact O-N 3.22Å; L243-A246 PolarHBondContact O-N 3.13Å; L243-T247 WeakPolarHBondContact O-CB 3.42Å; L243-T247 PolarHBondContact O-N 2.68Å; L243-T247 PolarHBondContact O-OG1 2.89Å; L243-T247 VanDerWaalsContact O-OG1 3.07Å; L243-V328 HydrophobicContact CB-CG1 3.71Å; L243-V328 HydrophobicContact CB-CG2 4.35Å; L243-V328 HydrophobicContact CD1-CG1 4.12Å
244	A	95.4	Very high	93.2	Very high	3 Å²	3	65.5 Å²	65.5	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-41.2	174.2	0	0	0	0	0	112.5	I240 V241 T247 Y248 C324 L325	I240-A244 PolarHBondContact O-N 2.7Å; V241-A244 WeakPolarHBondContact O-CB 3.23Å; V241-A244 PolarHBondContact O-N 3.44Å; A244-T247 PolarHBondContact O-N 3.4Å; A244-Y248 WeakPolarHBondContact O-CB 3.33Å; A244-Y248 PolarHBondContact O-N 3.4Å; A244-C324 HydrophobicContact CB-CB 4.41Å; A244-L325 HydrophobicContact CB-CB 3.85Å; A244-L325 HydrophobicContact CB-CD1 4.14Å
245	W	94.9	Very high	93.2	Very high	73 Å²	73	64.4 Å²	64.4	28%	0.277	32%	0.324	S	S	.	.	H	α-helix	trans	-61.7	-46.5	171.8	-60.7	-31.1	0	0	0	111.8	V241 I242 L243 T247 Y248 Y249 W300 L305	V241-W245 HydrophobicContact CG1-CD2 4.33Å; V241-W245 HydrophobicContact CG1-CH2 4.28Å; V241-W245 HydrophobicContact CG1-CZ2 3.67Å; V241-W245 PolarHBondContact O-N 3.29Å; I242-W245 HydrophobicContact CB-CE3 4.25Å; I242-W245 HydrophobicContact CG1-CE3 3.96Å; I242-W245 HydrophobicContact CG1-CZ3 3.79Å; I242-W245 HydrophobicContact CG2-CE3 4.47Å; I242-W245 PolarHBondContact O-N 3.28Å; L243-W245 VanDerWaalsContact C-N 3.34Å; L243-W245 PolarHBondContact O-N 3.22Å; W245-T247 VanDerWaalsContact C-N 3.33Å; W245-T247 PolarHBondContact O-N 3.32Å; W245-Y248 WeakPolarHBondContact O-CB 3.31Å; W245-Y248 PolarHBondContact O-N 3.4Å; W245-Y249 WeakPolarHBondContact O-CD2 3.16Å; W245-Y249 PolarHBondContact O-N 2.89Å; W245-W300 HydrophobicContact CB-CZ3 4.39Å; W245-W300 AromaticContact CD2-CH2 3.67Å; W245-W300 HydrophobicContact CD2-CH2 3.67Å; W245-W300 HydrophobicContact CD2-CZ3 4.3Å; W245-W300 AromaticContact CE3-CH2 3.66Å; W245-W300 HydrophobicContact CE3-CH2 3.66Å; W245-W300 HydrophobicContact CE3-CZ2 4.47Å; W245-W300 HydrophobicContact CG-CH2 4.07Å; W245-W300 HydrophobicContact CG-CZ3 4.22Å; W245-W300 HydrophobicContact CH2-CH2 4.45Å; W245-W300 HydrophobicContact CZ2-CH2 4.46Å; W245-W300 HydrophobicContact CZ3-CH2 4.06Å; W245-W300 HydrophobicContact CZ3-CZ2 4.45Å; W245-L305 HydrophobicContact CZ2-CD2 3.83Å
246	A	93.4	Very high	93.2	Very high	51 Å²	51	72.8 Å²	72.8	42%	0.421	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-40.7	178.1	0	0	0	0	0	112.2	I242 L243 Y249 L250	I242-A246 PolarHBondContact O-N 3.12Å; L243-A246 PolarHBondContact O-N 3.13Å; A246-Y249 PolarHBondContact O-N 2.99Å; A246-L250 WeakPolarHBondContact O-CB 3.32Å; A246-L250 PolarHBondContact O-N 3.47Å
247	T	94.4	Very high	93	Very high	29 Å²	29	75.1 Å²	75.1	18%	0.178	37%	0.367	C	S	.	.	H	α-helix	trans	-65	-40.4	174.7	-61.4	0	0	0	0	112.1	L243 A244 W245 L250 F251 C324 L327 V328	L243-T247 WeakPolarHBondContact O-CB 3.42Å; L243-T247 PolarHBondContact O-N 2.68Å; L243-T247 PolarHBondContact O-OG1 2.89Å; L243-T247 VanDerWaalsContact O-OG1 3.07Å; A244-T247 PolarHBondContact O-N 3.4Å; W245-T247 VanDerWaalsContact C-N 3.33Å; W245-T247 PolarHBondContact O-N 3.32Å; T247-L250 WeakPolarHBondContact O-CB 3.24Å; T247-L250 PolarHBondContact O-N 3.01Å; T247-F251 HydrophobicContact CG2-CD2 4Å; T247-F251 HydrophobicContact CG2-CE2 3.5Å; T247-F251 VanDerWaalsContact CG2-CE2 3.5Å; T247-F251 HydrophobicContact CG2-CZ 4.2Å; T247-F251 VanDerWaalsContact O-CD2 3.25Å; T247-F251 WeakPolarHBondContact O-CD2 3.31Å; T247-F251 PolarHBondContact O-N 3.05Å; T247-C324 HydrophobicContact CG2-CB 4.45Å; T247-L327 HydrophobicContact CG2-CD2 4.18Å; T247-V328 HydrophobicContact CG2-CG2 4.39Å; T247-V328 VanDerWaalsContact OG1-CG2 3.29Å; T247-V328 WeakPolarHBondContact OG1-CG2 3.22Å
248	Y	95.3	Very high	93	Very high	18 Å²	18	73.7 Å²	73.7	7%	0.071	36%	0.355	C	S	.	.	H	α-helix	trans	-60.9	-48.4	173	179.5	-89	0	0	0	111.6	A244 W245 L250 F251 Q252 F299 N303 V304 D320 L321	A244-Y248 WeakPolarHBondContact O-CB 3.33Å; A244-Y248 PolarHBondContact O-N 3.4Å; W245-Y248 WeakPolarHBondContact O-CB 3.31Å; W245-Y248 PolarHBondContact O-N 3.4Å; Y248-L250 VanDerWaalsContact C-N 3.31Å; Y248-L250 PolarHBondContact O-N 3.24Å; Y248-F251 PolarHBondContact O-N 3.22Å; Y248-Q252 HydrophobicContact CD1-CG 4.06Å; Y248-Q252 HydrophobicContact CE1-CG 3.64Å; Y248-Q252 WeakPolarHBondContact O-CG 3.41Å; Y248-Q252 PolarHBondContact O-N 2.95Å; Y248-Q252 PolarHBondContact OH-NE2 3.42Å; Y248-F299 HydrophobicContact CE1-CE1 4.4Å; Y248-F299 HydrophobicContact CE1-CZ 4Å; Y248-N303 PolarHBondContact OH-ND2 3.2Å; Y248-V304 HydrophobicContact CD1-CG1 4.31Å; Y248-V304 HydrophobicContact CD1-CG2 4.24Å; Y248-V304 HydrophobicContact CE1-CG1 4.45Å; Y248-V304 HydrophobicContact CE1-CG2 3.78Å; Y248-D320 HydrophobicContact CD2-CB 4.15Å; Y248-D320 HydrophobicContact CE2-CB 3.72Å; Y248-L321 HydrophobicContact CD2-CD2 3.96Å; Y248-L321 HydrophobicContact CG-CD2 3.84Å
249	Y	94.1	Very high	92.8	Very high	53 Å²	53	69.5 Å²	69.5	21%	0.208	34%	0.339	C	S	.	.	H	α-helix	trans	-61.8	-36.5	175.9	-90.7	-89.6	0	0	0	112.7	W245 A246 Q252 S253 W260 F299 W300 V304	W245-Y249 WeakPolarHBondContact O-CD2 3.16Å; W245-Y249 PolarHBondContact O-N 2.89Å; A246-Y249 PolarHBondContact O-N 2.99Å; Y249-Q252 PolarHBondContact O-N 3.08Å; Y249-S253 WeakPolarHBondContact O-CB 3.43Å; Y249-S253 PolarHBondContact O-N 3.45Å; Y249-S253 PolarHBondContact O-OG 2.97Å; Y249-W260 HydrophobicContact CD1-CE3 4.02Å; Y249-W260 AromaticContact CD1-CH2 3.58Å; Y249-W260 HydrophobicContact CD1-CH2 3.58Å; Y249-W260 HydrophobicContact CD1-CZ2 4.18Å; Y249-W260 AromaticContact CD1-CZ3 3.48Å; Y249-W260 HydrophobicContact CD1-CZ3 3.48Å; Y249-W260 VanDerWaalsContact CD1-CZ3 3.48Å; Y249-W260 HydrophobicContact CE1-CD2 4.23Å; Y249-W260 AromaticContact CE1-CE3 3.76Å; Y249-W260 HydrophobicContact CE1-CE3 3.76Å; Y249-W260 HydrophobicContact CE1-CH2 4.15Å; Y249-W260 AromaticContact CE1-CZ3 3.72Å; Y249-W260 HydrophobicContact CE1-CZ3 3.72Å; Y249-F299 HydrophobicContact CD1-CE1 4.44Å; Y249-F299 HydrophobicContact CE1-CD1 4.06Å; Y249-F299 AromaticContact CE1-CE1 3.71Å; Y249-F299 HydrophobicContact CE1-CE1 3.71Å; Y249-F299 HydrophobicContact CE2-CE1 4.45Å; Y249-F299 AromaticContact CZ-CD1 3.95Å; Y249-F299 AromaticContact CZ-CE1 3.72Å; Y249-F299 WeakPolarHBondContact OH-CD1 3.14Å; Y249-W300 AromaticContact CE2-CE3 3.77Å; Y249-W300 HydrophobicContact CE2-CE3 3.77Å; Y249-W300 AromaticContact CE2-CZ3 3.87Å; Y249-W300 HydrophobicContact CE2-CZ3 3.87Å; Y249-V304 HydrophobicContact CE2-CG1 4.35Å; Y249-V304 HydrophobicContact CE2-CG2 4.05Å
250	L	93.8	Very high	92.7	Very high	97 Å²	97	68.8 Å²	68.8	51%	0.508	34%	0.336	S	S	.	.	H	α-helix	trans	-60.9	-48	174.1	178	62.5	0	0	0	111.2	A246 T247 Y248 Q252 S253 F254	A246-L250 WeakPolarHBondContact O-CB 3.32Å; A246-L250 PolarHBondContact O-N 3.47Å; T247-L250 WeakPolarHBondContact O-CB 3.24Å; T247-L250 PolarHBondContact O-N 3.01Å; Y248-L250 VanDerWaalsContact C-N 3.31Å; Y248-L250 PolarHBondContact O-N 3.24Å; L250-Q252 PolarHBondContact O-N 3.07Å; L250-S253 WeakPolarHBondContact O-CB 3.38Å; L250-S253 PolarHBondContact O-N 2.86Å; L250-S253 VanDerWaalsContact O-N 3.12Å; L250-F254 HydrophobicContact CD1-CE2 4.48Å; L250-F254 HydrophobicContact CD1-CZ 4.17Å; L250-F254 HydrophobicContact CG-CE2 4.26Å; L250-F254 HydrophobicContact CG-CZ 4.37Å; L250-F254 WeakPolarHBondContact O-CD2 3.44Å
251	F	94.6	Very high	92.3	Very high	100 Å²	100	69.8 Å²	69.8	44%	0.439	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-41.4	176.9	-70.1	-49.9	0	0	0	112.7	T247 Y248 S253 F254 L327	T247-F251 HydrophobicContact CG2-CD2 4Å; T247-F251 HydrophobicContact CG2-CE2 3.5Å; T247-F251 VanDerWaalsContact CG2-CE2 3.5Å; T247-F251 HydrophobicContact CG2-CZ 4.2Å; T247-F251 VanDerWaalsContact O-CD2 3.25Å; T247-F251 WeakPolarHBondContact O-CD2 3.31Å; T247-F251 PolarHBondContact O-N 3.05Å; Y248-F251 PolarHBondContact O-N 3.22Å; F251-S253 PolarHBondContact O-N 3.2Å; F251-F254 HydrophobicContact CD1-CD2 4.41Å; F251-F254 HydrophobicContact CD1-CE2 4.19Å; F251-F254 PolarHBondContact O-N 3.45Å; F251-L327 HydrophobicContact CE2-CD2 3.74Å; F251-L327 HydrophobicContact CZ-CD2 3.58Å
252	Q	93.1	Very high	91.9	Very high	39 Å²	39	71 Å²	71	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-68.7	-16.9	176.1	-62.2	-66.7	35.9	0	0	113.6	Y248 Y249 L250 F254 P259 W260 F299	Y248-Q252 HydrophobicContact CD1-CG 4.06Å; Y248-Q252 HydrophobicContact CE1-CG 3.64Å; Y248-Q252 WeakPolarHBondContact O-CG 3.41Å; Y248-Q252 PolarHBondContact O-N 2.95Å; Y248-Q252 PolarHBondContact OH-NE2 3.42Å; Y249-Q252 PolarHBondContact O-N 3.08Å; L250-Q252 PolarHBondContact O-N 3.07Å; Q252-F254 VanDerWaalsContact C-N 3.31Å; Q252-P259 HydrophobicContact CB-CG 4.13Å; Q252-W260 HydrophobicContact CB-CH2 4.41Å; Q252-W260 HydrophobicContact CB-CZ3 3.9Å; Q252-F299 HydrophobicContact CG-CZ 4.42Å
253	S	94.8	Very high	91.5	Very high	56 Å²	56	69.9 Å²	69.9	39%	0.392	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-8	176.7	-58	0	0	0	0	113.9	Y249 L250 F251 Q255	Y249-S253 WeakPolarHBondContact O-CB 3.43Å; Y249-S253 PolarHBondContact O-N 3.45Å; Y249-S253 PolarHBondContact O-OG 2.97Å; L250-S253 WeakPolarHBondContact O-CB 3.38Å; L250-S253 PolarHBondContact O-N 2.86Å; L250-S253 VanDerWaalsContact O-N 3.12Å; F251-S253 PolarHBondContact O-N 3.2Å; S253-Q255 VanDerWaalsContact C-N 3.29Å
254	F	93.9	Very high	91.2	Very high	155 Å²	155	73.7 Å²	73.7	68%	0.68	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.6	174.1	-63.2	-59.1	0	0	0	113.7	L250 F251 Q252	L250-F254 HydrophobicContact CD1-CE2 4.48Å; L250-F254 HydrophobicContact CD1-CZ 4.17Å; L250-F254 HydrophobicContact CG-CE2 4.26Å; L250-F254 HydrophobicContact CG-CZ 4.37Å; L250-F254 WeakPolarHBondContact O-CD2 3.44Å; F251-F254 HydrophobicContact CD1-CD2 4.41Å; F251-F254 HydrophobicContact CD1-CE2 4.19Å; F251-F254 PolarHBondContact O-N 3.45Å; Q252-F254 VanDerWaalsContact C-N 3.31Å
255	Q	91.1	Very high	90.8	Very high	96 Å²	96	76.4 Å²	76.4	45%	0.449	38%	0.379	S	S	.	.	S	Bend	trans	-74.4	151.1	174.1	-58.7	-166.3	25.6	0	0	111.2	S253 E257	S253-Q255 VanDerWaalsContact C-N 3.29Å; Q255-E257 VanDerWaalsContact C-N 3.3Å; Q255-E257 VanDerWaalsContact CB-O 3.29Å; Q255-E257 WeakPolarHBondContact CB-O 3.45Å; Q255-E257 PolarHBondContact O-N 3.19Å
256	K	89.3	Confident	90.4	Very high	218 Å²	218	78.8 Å²	78.8	95%	0.948	41%	0.406	S	S	*	.	S	Bend	trans	-62.4	-38.1	177.5	-72.3	-176.3	177.1	-179.4	0	112.5
257	E	88.1	Confident	90.1	Very high	142 Å²	142	79.1 Å²	79.1	66%	0.664	40%	0.397	S	S	*	.	S	Bend	trans	-117.7	137.5	174.4	-68.1	177.3	-171.1	0	0	107.9	Q255	Q255-E257 VanDerWaalsContact C-N 3.3Å; Q255-E257 VanDerWaalsContact CB-O 3.29Å; Q255-E257 WeakPolarHBondContact CB-O 3.45Å; Q255-E257 PolarHBondContact O-N 3.19Å
258	L	89.9	Confident	89.9	Confident	72 Å²	72	79 Å²	79	38%	0.377	40%	0.395	S	S	.	.			trans	-78.8	129.8	-176.5	-64.3	164.2	0	0	0	109.2	W260 A261	L258-W260 HydrophobicContact CB-CD2 4.44Å; L258-W260 HydrophobicContact CB-CZ2 4.4Å; L258-W260 HydrophobicContact CD2-CH2 4.21Å; L258-W260 HydrophobicContact CD2-CZ2 3.78Å; L258-W260 HydrophobicContact CG-CZ2 4.5Å; L258-W260 PolarHBondContact O-N 3.21Å; L258-A261 HydrophobicContact CB-CB 4.26Å; L258-A261 VanDerWaalsContact O-CB 3.25Å; L258-A261 WeakPolarHBondContact O-CB 3.07Å; L258-A261 PolarHBondContact O-N 3.37Å
259	P	87.7	Confident	89.4	Confident	4 Å²	4	79.6 Å²	79.6	3%	0.026	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-6.6	-173.4	25.6	-33.4	0	0	0	114.4	Q252 H265 W267 F299	Q252-P259 HydrophobicContact CB-CG 4.13Å; P259-H265 PolarHBondContact O-CE1 3.02Å; P259-H265 VanDerWaalsContact O-CE1 3.28Å; P259-W267 HydrophobicContact CB-CH2 4.41Å; P259-W267 HydrophobicContact CB-CZ2 4.19Å; P259-F299 HydrophobicContact CB-CD2 4.19Å; P259-F299 HydrophobicContact CB-CE2 3.7Å; P259-F299 HydrophobicContact CB-CZ 4.4Å; P259-F299 HydrophobicContact CG-CE2 3.72Å; P259-F299 HydrophobicContact CG-CZ 3.92Å
260	W	89.6	Confident	88.8	Confident	47 Å²	47	83 Å²	83	18%	0.178	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	6.4	170.9	55.6	81.2	0	0	0	114.2	Y249 Q252 L258 V296 F299	Y249-W260 HydrophobicContact CD1-CE3 4.02Å; Y249-W260 AromaticContact CD1-CH2 3.58Å; Y249-W260 HydrophobicContact CD1-CH2 3.58Å; Y249-W260 HydrophobicContact CD1-CZ2 4.18Å; Y249-W260 AromaticContact CD1-CZ3 3.48Å; Y249-W260 HydrophobicContact CD1-CZ3 3.48Å; Y249-W260 VanDerWaalsContact CD1-CZ3 3.48Å; Y249-W260 HydrophobicContact CE1-CD2 4.23Å; Y249-W260 AromaticContact CE1-CE3 3.76Å; Y249-W260 HydrophobicContact CE1-CE3 3.76Å; Y249-W260 HydrophobicContact CE1-CH2 4.15Å; Y249-W260 AromaticContact CE1-CZ3 3.72Å; Y249-W260 HydrophobicContact CE1-CZ3 3.72Å; Q252-W260 HydrophobicContact CB-CH2 4.41Å; Q252-W260 HydrophobicContact CB-CZ3 3.9Å; L258-W260 HydrophobicContact CB-CD2 4.44Å; L258-W260 HydrophobicContact CB-CZ2 4.4Å; L258-W260 HydrophobicContact CD2-CH2 4.21Å; L258-W260 HydrophobicContact CD2-CZ2 3.78Å; L258-W260 HydrophobicContact CG-CZ2 4.5Å; L258-W260 PolarHBondContact O-N 3.21Å; W260-V296 HydrophobicContact CB-CG2 4.27Å; W260-F299 HydrophobicContact CB-CB 3.98Å; W260-F299 HydrophobicContact CB-CD1 4.18Å; W260-F299 HydrophobicContact CB-CG 4.03Å; W260-F299 AromaticContact CE3-CD1 3.84Å; W260-F299 HydrophobicContact CE3-CD1 3.84Å; W260-F299 AromaticContact CE3-CE1 3.49Å; W260-F299 HydrophobicContact CE3-CE1 3.49Å; W260-F299 VanDerWaalsContact CE3-CE1 3.49Å; W260-F299 HydrophobicContact CE3-CE2 4.44Å; W260-F299 HydrophobicContact CE3-CG 4.45Å; W260-F299 AromaticContact CE3-CZ 3.83Å; W260-F299 HydrophobicContact CE3-CZ 3.83Å; W260-F299 AromaticContact CZ3-CE1 3.93Å; W260-F299 HydrophobicContact CZ3-CE1 3.93Å; W260-F299 HydrophobicContact CZ3-CZ 4.12Å
261	A	86	Confident	88.3	Confident	42 Å²	42	83 Å²	83	35%	0.347	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-36.9	174.2	0	0	0	0	0	112.5	L258	L258-A261 HydrophobicContact CB-CB 4.26Å; L258-A261 VanDerWaalsContact O-CB 3.25Å; L258-A261 WeakPolarHBondContact O-CB 3.07Å; L258-A261 PolarHBondContact O-N 3.37Å
262	H	85.1	Confident	87.7	Confident	76 Å²	76	79 Å²	79	35%	0.352	41%	0.411	S	S	.	.			trans	-121.4	148.6	-169.8	-68.1	-63.5	0	0	0	114.3	N264 H265 N268 E274	H262-N264 VanDerWaalsContact C-N 3.32Å; H262-H265 PolarHBondContact O-ND1 3.24Å; H262-N268 PolarHBondContact O-ND2 3.07Å; H262-E274 WeakPolarHBondContact CA-OE1 3.5Å; H262-E274 WeakPolarHBondContact CB-OE1 3.46Å; H262-E274 IonicContact CE1-OE2 2.62Å; H262-E274 IonicContact CG-OE1 2.63Å; H262-E274 IonicContact ND1-OE1 2.85Å; H262-E274 PolarHBondContact ND1-OE1 3.45Å; H262-E274 VanDerWaalsContact ND1-OE1 3.11Å; H262-E274 IonicContact ND1-OE2 3.15Å; H262-E274 PolarHBondContact ND1-OE2 2.83Å; H262-E274 VanDerWaalsContact ND1-OE2 3.15Å
263	C	84.3	Confident	87.1	Confident	27 Å²	27	78.2 Å²	78.2	18%	0.182	41%	0.407	C	S	.	.	S	Bend	trans	-81	-8.1	178.4	-75.3	0	0	0	0	113.9	H265 N268 C272 M273 E274	C263-H265 VanDerWaalsContact C-N 3.34Å; C263-H265 PolarHBondContact O-N 3.46Å; C263-N268 VanDerWaalsContact CA-ND2 3.33Å; C263-N268 WeakPolarHBondContact CA-ND2 3.41Å; C263-N268 WeakPolarHBondContact O-CB 3.43Å; C263-N268 PolarHBondContact O-ND2 3.13Å; C263-C272 VanDerWaalsContact CA-SG 3.51Å; C263-C272 HydrophobicContact CB-CB 3.7Å; C263-C272 WeakPolarHBondContact CB-SG 3.48Å; C263-C272 WeakPolarHBondContact SG-CB 3.32Å; C263-C272 CovalentContact SG-SG 2.04Å; C263-C272 PolarHBondContact SG-SG 3.49Å; C263-M273 PolarHBondContact SG-N 3.16Å; C263-M273 VanDerWaalsContact SG-N 3.36Å; C263-E274 HydrophobicContact CB-CG 4.1Å; C263-E274 PolarHBondContact N-OE1 3.4Å
264	N	85.5	Confident	86.4	Confident	149 Å²	149	77.3 Å²	77.3	80%	0.797	40%	0.397	S	S	*	.			trans	-82.5	66.3	-177.6	-168.3	25.1	0	0	0	113.7	H262	H262-N264 VanDerWaalsContact C-N 3.32Å
265	H	87	Confident	85.3	Confident	61 Å²	61	73.4 Å²	73.4	28%	0.282	38%	0.383	S	S	.	.	S	Bend	trans	-140.9	154.6	178.7	-64.1	100.4	0	0	0	112.1	P259 H262 C263 W267 N268	P259-H265 PolarHBondContact O-CE1 3.02Å; P259-H265 VanDerWaalsContact O-CE1 3.28Å; H262-H265 PolarHBondContact O-ND1 3.24Å; C263-H265 VanDerWaalsContact C-N 3.34Å; C263-H265 PolarHBondContact O-N 3.46Å; H265-W267 HydrophobicContact CB-CD2 3.76Å; H265-W267 HydrophobicContact CB-CE3 4.13Å; H265-W267 HydrophobicContact CB-CG 4.37Å; H265-W267 HydrophobicContact CB-CH2 3.85Å; H265-W267 HydrophobicContact CB-CZ2 3.43Å; H265-W267 VanDerWaalsContact CB-CZ2 3.43Å; H265-W267 HydrophobicContact CB-CZ3 4.18Å; H265-W267 AromaticContact CD2-CH2 3.33Å; H265-W267 WeakPolarHBondContact CD2-CH2 3.36Å; H265-W267 AromaticContact CD2-CZ2 3.36Å; H265-W267 WeakPolarHBondContact CD2-CZ2 3.29Å; H265-W267 AromaticContact CG-CE2 3.75Å; H265-W267 AromaticContact CG-CH2 3.71Å; H265-W267 AromaticContact CG-CZ2 3.29Å; H265-W267 AromaticContact ND1-CZ2 3.84Å; H265-W267 AromaticContact NE2-CZ2 3.93Å; H265-W267 PolarHBondContact O-N 3.41Å; H265-W267 VanDerWaalsContact O-N 3.13Å; H265-N268 PolarHBondContact O-N 3.01Å; H265-N268 VanDerWaalsContact O-N 3.08Å
266	S	87.8	Confident	84.1	Confident	122 Å²	122	73.4 Å²	73.4	85%	0.853	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.1	-175.1	56.1	0	0	0	0	115.4
267	W	86.6	Confident	82.8	Confident	58 Å²	58	68.6 Å²	68.6	22%	0.22	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-8.9	177.3	55	79.1	0	0	0	114.1	P259 H265 F299 R302 N303	P259-W267 HydrophobicContact CB-CH2 4.41Å; P259-W267 HydrophobicContact CB-CZ2 4.19Å; H265-W267 HydrophobicContact CB-CD2 3.76Å; H265-W267 HydrophobicContact CB-CE3 4.13Å; H265-W267 HydrophobicContact CB-CG 4.37Å; H265-W267 HydrophobicContact CB-CH2 3.85Å; H265-W267 HydrophobicContact CB-CZ2 3.43Å; H265-W267 VanDerWaalsContact CB-CZ2 3.43Å; H265-W267 HydrophobicContact CB-CZ3 4.18Å; H265-W267 AromaticContact CD2-CH2 3.33Å; H265-W267 WeakPolarHBondContact CD2-CH2 3.36Å; H265-W267 AromaticContact CD2-CZ2 3.36Å; H265-W267 WeakPolarHBondContact CD2-CZ2 3.29Å; H265-W267 AromaticContact CG-CE2 3.75Å; H265-W267 AromaticContact CG-CH2 3.71Å; H265-W267 AromaticContact CG-CZ2 3.29Å; H265-W267 AromaticContact ND1-CZ2 3.84Å; H265-W267 AromaticContact NE2-CZ2 3.93Å; H265-W267 PolarHBondContact O-N 3.41Å; H265-W267 VanDerWaalsContact O-N 3.13Å; W267-F299 AromaticContact CE2-CD2 3.86Å; W267-F299 AromaticContact CZ2-CD2 3.73Å; W267-F299 HydrophobicContact CZ2-CD2 3.73Å; W267-F299 HydrophobicContact CZ2-CE2 4.03Å; W267-F299 AromaticContact NE1-CD2 3.85Å; W267-R302 HydrophobicContact CB-CB 4.34Å; W267-R302 WeakPolarHBondContact O-CD 3.25Å; W267-N303 HydrophobicContact CB-CB 4.09Å; W267-N303 HydrophobicContact CD2-CB 3.75Å; W267-N303 HydrophobicContact CE3-CB 4.25Å; W267-N303 HydrophobicContact CG-CB 3.67Å
268	N	89.4	Confident	81.5	Confident	26 Å²	26	63.7 Å²	63.7	14%	0.139	35%	0.348	C	S	.	.			trans	-87.2	148.7	-176.5	-69	-30.3	0	0	0	111.9	H262 C263 H265 C272 E298	H262-N268 PolarHBondContact O-ND2 3.07Å; C263-N268 VanDerWaalsContact CA-ND2 3.33Å; C263-N268 WeakPolarHBondContact CA-ND2 3.41Å; C263-N268 WeakPolarHBondContact O-CB 3.43Å; C263-N268 PolarHBondContact O-ND2 3.13Å; H265-N268 PolarHBondContact O-N 3.01Å; H265-N268 VanDerWaalsContact O-N 3.08Å; N268-C272 HydrophobicContact CB-CB 4.18Å; N268-E298 WeakPolarHBondContact CA-OE2 3.49Å; N268-E298 WeakPolarHBondContact OD1-CB 3.48Å
269	T	86.1	Confident	80	Confident	32 Å²	32	69 Å²	69	20%	0.196	37%	0.368	C	S	.	.			trans	-93.1	165.5	176.1	66.5	0	0	0	0	112.6	H271 C272 E298	T269-H271 PolarHBondContact O-N 2.93Å; T269-H271 PolarHBondContact OG1-N 3.11Å; T269-C272 VanDerWaalsContact O-CB 3.32Å; T269-C272 WeakPolarHBondContact O-CB 3.43Å; T269-C272 PolarHBondContact O-N 3.15Å; T269-E298 WeakPolarHBondContact CG2-OE2 3.27Å; T269-E298 PolarHBondContact N-OE2 3.08Å; T269-E298 PolarHBondContact OG1-OE1 2.99Å; T269-E298 PolarHBondContact OG1-OE2 3.25Å; T269-E298 VanDerWaalsContact OG1-OE2 3.05Å
270	P	82.2	Confident	78.9	Confident	123 Å²	123	72.9 Å²	72.9	80%	0.799	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-8.1	167.9	-24	35.3	0	0	0	114.9
271	H	81.6	Confident	77.4	Confident	97 Å²	97	79.1 Å²	79.1	45%	0.449	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	3.6	175.4	-57.7	-55.7	0	0	0	113.4	T269 F292 T293	T269-H271 PolarHBondContact O-N 2.93Å; T269-H271 PolarHBondContact OG1-N 3.11Å; H271-F292 WeakPolarHBondContact O-CA 3.41Å; H271-F292 WeakPolarHBondContact O-CD1 3.44Å; H271-T293 PolarHBondContact O-N 3.29Å; H271-T293 PolarHBondContact O-OG1 3.45Å
272	C	83	Confident	76.2	Confident	18 Å²	18	81 Å²	81	12%	0.122	43%	0.427	C	S	.	.	B	Isolated β-bridge	trans	-70.8	131.2	172.4	-171.5	0	0	0	0	110.6	C263 N268 T269 T293 E298	C263-C272 VanDerWaalsContact CA-SG 3.51Å; C263-C272 HydrophobicContact CB-CB 3.7Å; C263-C272 WeakPolarHBondContact CB-SG 3.48Å; C263-C272 WeakPolarHBondContact SG-CB 3.32Å; C263-C272 CovalentContact SG-SG 2.04Å; C263-C272 PolarHBondContact SG-SG 3.49Å; N268-C272 HydrophobicContact CB-CB 4.18Å; T269-C272 VanDerWaalsContact O-CB 3.32Å; T269-C272 WeakPolarHBondContact O-CB 3.43Å; T269-C272 PolarHBondContact O-N 3.15Å; C272-T293 CarbonylContact C-O 3.57Å; C272-T293 WeakPolarHBondContact CA-O 3.05Å; C272-E298 VanDerWaalsContact CA-OE1 3.26Å; C272-E298 WeakPolarHBondContact CA-OE1 3.06Å; C272-E298 VanDerWaalsContact CB-OE1 3.3Å; C272-E298 WeakPolarHBondContact CB-OE1 3.29Å; C272-E298 PolarHBondContact N-OE1 3.49Å
273	M	80.9	Confident	74.8	Confident	21 Å²	21	80.2 Å²	80.2	10%	0.103	43%	0.428	C	S	.	.			trans	-132.6	130.8	175.4	-175.1	-173.8	-60.2	0	0	112.4	C263 R278 I287 F292 T293 P295	C263-M273 PolarHBondContact SG-N 3.16Å; C263-M273 VanDerWaalsContact SG-N 3.36Å; M273-R278 HydrophobicContact SD-CB 4.3Å; M273-I287 HydrophobicContact CE-CB 4.44Å; M273-I287 HydrophobicContact CE-CD1 3.36Å; M273-I287 HydrophobicContact CE-CG1 3.81Å; M273-I287 HydrophobicContact CE-CG2 3.8Å; M273-I287 HydrophobicContact SD-CD1 4.03Å; M273-F292 HydrophobicContact CB-CB 4.25Å; M273-F292 HydrophobicContact CB-CD1 4.22Å; M273-F292 HydrophobicContact CB-CG 4.46Å; M273-F292 HydrophobicContact CE-CB 3.95Å; M273-F292 HydrophobicContact CE-CD1 3.52Å; M273-F292 HydrophobicContact CE-CD2 3.45Å; M273-F292 VanDerWaalsContact CE-CD2 3.45Å; M273-F292 HydrophobicContact CE-CE1 3.76Å; M273-F292 HydrophobicContact CE-CE2 3.66Å; M273-F292 HydrophobicContact CE-CG 3.37Å; M273-F292 HydrophobicContact CE-CZ 3.83Å; M273-T293 PolarHBondContact N-O 3.04Å; M273-P295 WeakPolarHBondContact O-CD 3.36Å
274	E	80.2	Confident	73.4	Confident	37 Å²	37	82.9 Å²	82.9	17%	0.173	43%	0.434	C	S	.	.			trans	-77.3	141.2	177.1	-56	-172.1	176.3	0	0	112.1	H262 C263 T276 M277 R278	H262-E274 WeakPolarHBondContact CA-OE1 3.5Å; H262-E274 WeakPolarHBondContact CB-OE1 3.46Å; H262-E274 IonicContact CE1-OE2 2.62Å; H262-E274 IonicContact CG-OE1 2.63Å; H262-E274 IonicContact ND1-OE1 2.85Å; H262-E274 PolarHBondContact ND1-OE1 3.45Å; H262-E274 VanDerWaalsContact ND1-OE1 3.11Å; H262-E274 IonicContact ND1-OE2 3.15Å; H262-E274 PolarHBondContact ND1-OE2 2.83Å; H262-E274 VanDerWaalsContact ND1-OE2 3.15Å; C263-E274 HydrophobicContact CB-CG 4.1Å; C263-E274 PolarHBondContact N-OE1 3.4Å; E274-T276 PolarHBondContact O-N 3.46Å; E274-T276 VanDerWaalsContact O-N 3.17Å; E274-M277 PolarHBondContact O-N 2.94Å; E274-M277 VanDerWaalsContact O-N 3.11Å; E274-R278 PolarHBondContact O-N 3.27Å; E274-R278 VanDerWaalsContact O-N 3.16Å
275	D	69.8	Low	71.9	Confident	73 Å²	73	82.4 Å²	82.4	39%	0.39	43%	0.43	S	S	.	.	H	α-helix	trans	-66.7	-16.8	-177.7	-80.3	-46.6	0	0	0	113.5	R278	D275-R278 IonicContact OD1-NH1 3.41Å; D275-R278 PolarHBondContact OD1-NH1 3.43Å
276	T	67.3	Low	70.4	Confident	96 Å²	96	84.9 Å²	84.9	59%	0.589	45%	0.45	S	S	*	.	H	α-helix	trans	-66.1	-51.2	169	44.6	0	0	0	0	111.3	E274 R278 K279	E274-T276 PolarHBondContact O-N 3.46Å; E274-T276 VanDerWaalsContact O-N 3.17Å; T276-R278 VanDerWaalsContact C-N 3.28Å; T276-R278 PolarHBondContact O-N 3.34Å; T276-K279 PolarHBondContact O-N 2.87Å
277	M	61.7	Low	68.8	Low	118 Å²	118	80.4 Å²	80.4	58%	0.581	42%	0.416	S	S	*	.	H	α-helix	trans	-64.5	-34.5	178.3	-62.9	-59.9	176.3	0	0	111.7	E274 K279 N280	E274-M277 PolarHBondContact O-N 2.94Å; E274-M277 VanDerWaalsContact O-N 3.11Å; M277-K279 PolarHBondContact O-N 3.23Å; M277-N280 WeakPolarHBondContact O-CB 3.45Å; M277-N280 PolarHBondContact O-N 3.49Å; M277-N280 VanDerWaalsContact O-N 3.09Å
278	R	59.1	Low	67.4	Low	39 Å²	39	81.9 Å²	81.9	15%	0.147	44%	0.435	C	S	.	.	H	α-helix	trans	-60.1	-26.8	176.2	-172.9	177.9	172.5	-171.7	-0.3	114.1	Y24 M273 E274 D275 T276 N280	Y24-R278 PolarHBondContact OH-NH1 3.45Å; M273-R278 HydrophobicContact SD-CB 4.3Å; E274-R278 PolarHBondContact O-N 3.27Å; E274-R278 VanDerWaalsContact O-N 3.16Å; D275-R278 IonicContact OD1-NH1 3.41Å; D275-R278 PolarHBondContact OD1-NH1 3.43Å; T276-R278 VanDerWaalsContact C-N 3.28Å; T276-R278 PolarHBondContact O-N 3.34Å; R278-N280 VanDerWaalsContact C-N 3.31Å
279	K	58.4	Low	65.6	Low	182 Å²	182	85.4 Å²	85.4	79%	0.791	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-13.8	177.5	-70.7	178.8	-178.2	179.7	0	113.4	T276 M277 K281	T276-K279 PolarHBondContact O-N 2.87Å; M277-K279 PolarHBondContact O-N 3.23Å; K279-K281 PolarHBondContact O-N 3.11Å
280	N	66.4	Low	64.4	Low	86 Å²	86	87.2 Å²	87.2	46%	0.46	47%	0.473	S	S	.	.			trans	-80.8	98.5	-179.9	-162.1	-5.2	0	0	0	110.8	M277 R278 S282 V283 W284	M277-N280 WeakPolarHBondContact O-CB 3.45Å; M277-N280 PolarHBondContact O-N 3.49Å; M277-N280 VanDerWaalsContact O-N 3.09Å; R278-N280 VanDerWaalsContact C-N 3.31Å; N280-S282 PolarHBondContact O-N 2.65Å; N280-S282 VanDerWaalsContact O-N 3.1Å; N280-S282 PolarHBondContact OD1-OG 3.27Å; N280-S282 VanDerWaalsContact OD1-OG 3.13Å; N280-V283 HydrophobicContact CB-CG2 4.01Å; N280-V283 PolarHBondContact O-N 3.06Å; N280-W284 PolarHBondContact O-N 3.09Å
281	K	57.6	Low	63.8	Low	178 Å²	178	89 Å²	89	77%	0.774	48%	0.476	S	S	*	.	H	α-helix	trans	-53.8	-32.6	-171.6	-78.7	-173.5	173.8	-176.7	0	114.4	K279 V283	K279-K281 PolarHBondContact O-N 3.11Å; K281-V283 VanDerWaalsContact C-N 3.33Å; K281-V283 PolarHBondContact O-N 3.31Å
282	S	60.2	Low	63.4	Low	81 Å²	81	87.6 Å²	87.6	57%	0.566	47%	0.468	S	S	*	.	H	α-helix	trans	-67	-32.9	179.4	52.4	0	0	0	0	113.1	N280	N280-S282 PolarHBondContact O-N 2.65Å; N280-S282 VanDerWaalsContact O-N 3.1Å; N280-S282 PolarHBondContact OD1-OG 3.27Å; N280-S282 VanDerWaalsContact OD1-OG 3.13Å
283	V	56.8	Low	63.4	Low	61 Å²	61	88.8 Å²	88.8	37%	0.37	48%	0.475	S	S	.	.	H	α-helix	trans	-81.8	-36.1	-179.3	-160.9	0	0	0	0	110.1	N280 K281 I285 T286 I287	N280-V283 HydrophobicContact CB-CG2 4.01Å; N280-V283 PolarHBondContact O-N 3.06Å; K281-V283 VanDerWaalsContact C-N 3.33Å; K281-V283 PolarHBondContact O-N 3.31Å; V283-I285 VanDerWaalsContact C-N 3.29Å; V283-I285 PolarHBondContact O-N 3.2Å; V283-T286 PolarHBondContact O-N 3.49Å; V283-I287 HydrophobicContact CB-CD1 4.09Å; V283-I287 HydrophobicContact CG1-CD1 3.43Å; V283-I287 VanDerWaalsContact CG1-CD1 3.43Å; V283-I287 HydrophobicContact CG1-CG1 4.28Å; V283-I287 WeakPolarHBondContact O-CB 3.34Å; V283-I287 WeakPolarHBondContact O-CD1 3.49Å; V283-I287 WeakPolarHBondContact O-CG1 3.37Å; V283-I287 PolarHBondContact O-N 3.36Å; V283-I287 VanDerWaalsContact O-N 3.17Å
284	W	54	Low	63.6	Low	83 Å²	83	88 Å²	88	31%	0.314	47%	0.472	S	S	.	.	H	α-helix	trans	-59.4	-33.7	-176.1	-153.6	87.4	0	0	0	114.3	N280 I287 S288	N280-W284 PolarHBondContact O-N 3.09Å; W284-I287 WeakPolarHBondContact O-CB 3.37Å; W284-I287 PolarHBondContact O-N 3.3Å; W284-S288 PolarHBondContact O-N 2.85Å
285	I	54.4	Low	63.9	Low	138 Å²	138	86.5 Å²	86.5	71%	0.708	47%	0.465	S	S	*	.	H	α-helix	trans	-68.5	-42	-179.6	-66	174	0	0	0	111.2	V283 I287	V283-I285 VanDerWaalsContact C-N 3.29Å; V283-I285 PolarHBondContact O-N 3.2Å; I285-I287 VanDerWaalsContact C-N 3.26Å; I285-I287 PolarHBondContact O-N 2.87Å
286	T	55.3	Low	64.8	Low	114 Å²	114	86.2 Å²	86.2	70%	0.699	47%	0.466	S	S	*	.	H	α-helix	trans	-69.2	-26.5	174.9	-44.3	0	0	0	0	112.2	V283 S289	V283-T286 PolarHBondContact O-N 3.49Å; T286-S289 PolarHBondContact O-OG 3.05Å
287	I	54.7	Low	65.7	Low	27 Å²	27	82.5 Å²	82.5	14%	0.138	44%	0.442	C	S	.	.	H	α-helix	trans	-79.2	-23.5	-173.9	-88.3	165.1	0	0	0	114.4	M273 V283 W284 I285 S289 T290 F292	M273-I287 HydrophobicContact CE-CB 4.44Å; M273-I287 HydrophobicContact CE-CD1 3.36Å; M273-I287 HydrophobicContact CE-CG1 3.81Å; M273-I287 HydrophobicContact CE-CG2 3.8Å; M273-I287 HydrophobicContact SD-CD1 4.03Å; V283-I287 HydrophobicContact CB-CD1 4.09Å; V283-I287 HydrophobicContact CG1-CD1 3.43Å; V283-I287 VanDerWaalsContact CG1-CD1 3.43Å; V283-I287 HydrophobicContact CG1-CG1 4.28Å; V283-I287 WeakPolarHBondContact O-CB 3.34Å; V283-I287 WeakPolarHBondContact O-CD1 3.49Å; V283-I287 WeakPolarHBondContact O-CG1 3.37Å; V283-I287 PolarHBondContact O-N 3.36Å; V283-I287 VanDerWaalsContact O-N 3.17Å; W284-I287 WeakPolarHBondContact O-CB 3.37Å; W284-I287 PolarHBondContact O-N 3.3Å; I285-I287 VanDerWaalsContact C-N 3.26Å; I285-I287 PolarHBondContact O-N 2.87Å; I287-S289 PolarHBondContact O-N 3.43Å; I287-T290 PolarHBondContact O-N 2.86Å; I287-F292 HydrophobicContact CB-CE2 4.1Å; I287-F292 HydrophobicContact CG1-CE2 3.87Å; I287-F292 HydrophobicContact CG1-CZ 4.22Å; I287-F292 HydrophobicContact CG2-CD2 3.88Å; I287-F292 HydrophobicContact CG2-CE2 3.79Å
288	S	55.5	Low	67	Low	90 Å²	90	77 Å²	77	63%	0.629	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-4.4	-171.2	-170.1	0	0	0	0	115.3	W284	W284-S288 PolarHBondContact O-N 2.85Å
289	S	52.1	Low	68.6	Low	100 Å²	100	75.1 Å²	75.1	70%	0.699	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-12.8	179.6	56.2	0	0	0	0	114.5	T286 I287	T286-S289 PolarHBondContact O-OG 3.05Å; I287-S289 PolarHBondContact O-N 3.43Å
290	T	61.1	Low	70.2	Confident	69 Å²	69	69.1 Å²	69.1	42%	0.423	38%	0.38	S	S	.	.	S	Bend	trans	-131.7	146	-172.3	35.7	0	0	0	0	113.4	I287 F292	I287-T290 PolarHBondContact O-N 2.86Å; T290-F292 WeakPolarHBondContact O-CD2 3.34Å; T290-F292 PolarHBondContact O-N 3.01Å; T290-F292 VanDerWaalsContact O-N 3.09Å; T290-F292 WeakPolarHBondContact OG1-CE2 3.32Å; T290-F292 WeakPolarHBondContact OG1-CZ 3.33Å
291	N	70.1	Confident	71.4	Confident	162 Å²	162	67.6 Å²	67.6	87%	0.866	37%	0.371	S	S	*	.			trans	-83.1	80.5	-176.4	-73.6	-48	0	0	0	111.3
292	F	73.1	Confident	72.9	Confident	66 Å²	66	65.3 Å²	65.3	29%	0.289	36%	0.357	S	S	.	.			trans	-74.7	148.3	175.2	-66.6	-86.3	0	0	0	113.6	H271 M273 I287 T290	H271-F292 WeakPolarHBondContact O-CA 3.41Å; H271-F292 WeakPolarHBondContact O-CD1 3.44Å; M273-F292 HydrophobicContact CB-CB 4.25Å; M273-F292 HydrophobicContact CB-CD1 4.22Å; M273-F292 HydrophobicContact CB-CG 4.46Å; M273-F292 HydrophobicContact CE-CB 3.95Å; M273-F292 HydrophobicContact CE-CD1 3.52Å; M273-F292 HydrophobicContact CE-CD2 3.45Å; M273-F292 VanDerWaalsContact CE-CD2 3.45Å; M273-F292 HydrophobicContact CE-CE1 3.76Å; M273-F292 HydrophobicContact CE-CE2 3.66Å; M273-F292 HydrophobicContact CE-CG 3.37Å; M273-F292 HydrophobicContact CE-CZ 3.83Å; I287-F292 HydrophobicContact CB-CE2 4.1Å; I287-F292 HydrophobicContact CG1-CE2 3.87Å; I287-F292 HydrophobicContact CG1-CZ 4.22Å; I287-F292 HydrophobicContact CG2-CD2 3.88Å; I287-F292 HydrophobicContact CG2-CE2 3.79Å; T290-F292 WeakPolarHBondContact O-CD2 3.34Å; T290-F292 PolarHBondContact O-N 3.01Å; T290-F292 VanDerWaalsContact O-N 3.09Å; T290-F292 WeakPolarHBondContact OG1-CE2 3.32Å; T290-F292 WeakPolarHBondContact OG1-CZ 3.33Å
293	T	82.1	Confident	74.4	Confident	44 Å²	44	62.6 Å²	62.6	27%	0.27	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-112.8	149.9	178.2	26.3	0	0	0	0	110.6	H271 C272 M273 E298	H271-T293 PolarHBondContact O-N 3.29Å; H271-T293 PolarHBondContact O-OG1 3.45Å; C272-T293 CarbonylContact C-O 3.57Å; C272-T293 WeakPolarHBondContact CA-O 3.05Å; M273-T293 PolarHBondContact N-O 3.04Å; T293-E298 WeakPolarHBondContact CB-OE1 3.37Å; T293-E298 PolarHBondContact OG1-OE1 3.42Å
294	S	85.1	Confident	76.1	Confident	4 Å²	4	59.8 Å²	59.8	3%	0.028	32%	0.319	C	S	.	.			trans	-88.6	150.8	177.3	63.3	0	0	0	0	111.3	V296 I297 E298	S294-V296 PolarHBondContact O-N 3.48Å; S294-V296 VanDerWaalsContact O-N 3.14Å; S294-I297 PolarHBondContact O-N 3.47Å; S294-I297 WeakPolarHBondContact OG-CD1 3.46Å; S294-I297 WeakPolarHBondContact OG-CG1 3.33Å; S294-E298 PolarHBondContact O-N 3.41Å
295	P	87.3	Confident	77.8	Confident	5 Å²	5	58 Å²	58	3%	0.032	32%	0.316	C	S	.	.	H	α-helix	trans	-58.5	-29.2	-180	22	-34	0	0	0	112.8	M273 F299	M273-P295 WeakPolarHBondContact O-CD 3.36Å; P295-F299 WeakPolarHBondContact O-CB 3.34Å; P295-F299 PolarHBondContact O-N 3.06Å
296	V	88.1	Confident	79.4	Confident	68 Å²	68	54 Å²	54	41%	0.412	30%	0.3	S	S	.	.	H	α-helix	trans	-65.7	-41.1	174.6	-173.4	0	0	0	0	112.3	W260 S294 W300	W260-V296 HydrophobicContact CB-CG2 4.27Å; S294-V296 PolarHBondContact O-N 3.48Å; S294-V296 VanDerWaalsContact O-N 3.14Å; V296-W300 WeakPolarHBondContact O-CB 3.3Å; V296-W300 PolarHBondContact O-N 2.86Å; V296-W300 VanDerWaalsContact O-N 3.14Å
297	I	86.8	Confident	81	Confident	17 Å²	17	53.7 Å²	53.7	9%	0.087	29%	0.293	C	S	.	.	H	α-helix	trans	-70.8	-44.7	177.5	-66.5	172.1	0	0	0	109.8	P20 Y24 S294 W300 E301	P20-I297 HydrophobicContact CB-CG1 4.16Å; Y24-I297 HydrophobicContact CG-CD1 4.28Å; S294-I297 PolarHBondContact O-N 3.47Å; S294-I297 WeakPolarHBondContact OG-CD1 3.46Å; S294-I297 WeakPolarHBondContact OG-CG1 3.33Å; I297-W300 PolarHBondContact O-N 2.84Å; I297-E301 HydrophobicContact CG2-CG 4.15Å; I297-E301 WeakPolarHBondContact O-CB 3.45Å; I297-E301 WeakPolarHBondContact O-CG 3.23Å; I297-E301 PolarHBondContact O-N 3.17Å
298	E	89.8	Confident	82.6	Confident	3 Å²	3	54.6 Å²	54.6	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-66.7	-40.4	179.6	-65.3	-155	-141.7	0	0	112.6	N268 T269 C272 T293 S294 W300 R302	N268-E298 WeakPolarHBondContact CA-OE2 3.49Å; N268-E298 WeakPolarHBondContact OD1-CB 3.48Å; T269-E298 WeakPolarHBondContact CG2-OE2 3.27Å; T269-E298 PolarHBondContact N-OE2 3.08Å; T269-E298 PolarHBondContact OG1-OE1 2.99Å; T269-E298 PolarHBondContact OG1-OE2 3.25Å; T269-E298 VanDerWaalsContact OG1-OE2 3.05Å; C272-E298 VanDerWaalsContact CA-OE1 3.26Å; C272-E298 WeakPolarHBondContact CA-OE1 3.06Å; C272-E298 VanDerWaalsContact CB-OE1 3.3Å; C272-E298 WeakPolarHBondContact CB-OE1 3.29Å; C272-E298 PolarHBondContact N-OE1 3.49Å; T293-E298 WeakPolarHBondContact CB-OE1 3.37Å; T293-E298 PolarHBondContact OG1-OE1 3.42Å; S294-E298 PolarHBondContact O-N 3.41Å; E298-W300 PolarHBondContact O-N 2.86Å; E298-R302 WeakPolarHBondContact O-CA 3.35Å; E298-R302 WeakPolarHBondContact O-CB 3.46Å; E298-R302 PolarHBondContact O-N 3.24Å; E298-R302 IonicContact OE2-NE 3.5Å; E298-R302 PolarHBondContact OE2-NE 2.93Å
299	F	91.4	Very high	84.1	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.312	C	S	.	.	I	π-helix	trans	-57.7	-47.6	171.6	-178.9	-96.6	0	0	0	111.4	Y248 Y249 Q252 P259 W260 W267 P295 N303 V304	Y248-F299 HydrophobicContact CE1-CE1 4.4Å; Y248-F299 HydrophobicContact CE1-CZ 4Å; Y249-F299 HydrophobicContact CD1-CE1 4.44Å; Y249-F299 HydrophobicContact CE1-CD1 4.06Å; Y249-F299 AromaticContact CE1-CE1 3.71Å; Y249-F299 HydrophobicContact CE1-CE1 3.71Å; Y249-F299 HydrophobicContact CE2-CE1 4.45Å; Y249-F299 AromaticContact CZ-CD1 3.95Å; Y249-F299 AromaticContact CZ-CE1 3.72Å; Y249-F299 WeakPolarHBondContact OH-CD1 3.14Å; Q252-F299 HydrophobicContact CG-CZ 4.42Å; P259-F299 HydrophobicContact CB-CD2 4.19Å; P259-F299 HydrophobicContact CB-CE2 3.7Å; P259-F299 HydrophobicContact CB-CZ 4.4Å; P259-F299 HydrophobicContact CG-CE2 3.72Å; P259-F299 HydrophobicContact CG-CZ 3.92Å; W260-F299 HydrophobicContact CB-CB 3.98Å; W260-F299 HydrophobicContact CB-CD1 4.18Å; W260-F299 HydrophobicContact CB-CG 4.03Å; W260-F299 AromaticContact CE3-CD1 3.84Å; W260-F299 HydrophobicContact CE3-CD1 3.84Å; W260-F299 AromaticContact CE3-CE1 3.49Å; W260-F299 HydrophobicContact CE3-CE1 3.49Å; W260-F299 VanDerWaalsContact CE3-CE1 3.49Å; W260-F299 HydrophobicContact CE3-CE2 4.44Å; W260-F299 HydrophobicContact CE3-CG 4.45Å; W260-F299 AromaticContact CE3-CZ 3.83Å; W260-F299 HydrophobicContact CE3-CZ 3.83Å; W260-F299 AromaticContact CZ3-CE1 3.93Å; W260-F299 HydrophobicContact CZ3-CE1 3.93Å; W260-F299 HydrophobicContact CZ3-CZ 4.12Å; W267-F299 AromaticContact CE2-CD2 3.86Å; W267-F299 AromaticContact CZ2-CD2 3.73Å; W267-F299 HydrophobicContact CZ2-CD2 3.73Å; W267-F299 HydrophobicContact CZ2-CE2 4.03Å; W267-F299 AromaticContact NE1-CD2 3.85Å; P295-F299 WeakPolarHBondContact O-CB 3.34Å; P295-F299 PolarHBondContact O-N 3.06Å; F299-N303 HydrophobicContact CD2-CB 4.16Å; F299-N303 HydrophobicContact CE2-CB 4.45Å; F299-N303 WeakPolarHBondContact CE2-ND2 3.38Å; F299-N303 WeakPolarHBondContact O-CA 3.31Å; F299-N303 VanDerWaalsContact O-CB 3.28Å; F299-N303 WeakPolarHBondContact O-CB 3.29Å; F299-N303 PolarHBondContact O-N 3.48Å; F299-N303 VanDerWaalsContact O-N 3.1Å; F299-V304 HydrophobicContact CD1-CG2 3.68Å; F299-V304 HydrophobicContact CE1-CG2 3.33Å; F299-V304 HydrophobicContact CG-CG2 4.5Å; F299-V304 HydrophobicContact CZ-CG2 3.92Å; F299-V304 WeakPolarHBondContact O-CG2 3.43Å; F299-V304 PolarHBondContact O-N 2.84Å
300	W	92.8	Very high	85.8	Confident	55 Å²	55	53 Å²	53	21%	0.208	29%	0.292	C	S	.	.	I	π-helix	trans	-63.6	-52.5	178.6	175	-111.8	0	0	0	113	W245 Y249 V296 I297 E298 V304 L305	W245-W300 HydrophobicContact CB-CZ3 4.39Å; W245-W300 AromaticContact CD2-CH2 3.67Å; W245-W300 HydrophobicContact CD2-CH2 3.67Å; W245-W300 HydrophobicContact CD2-CZ3 4.3Å; W245-W300 AromaticContact CE3-CH2 3.66Å; W245-W300 HydrophobicContact CE3-CH2 3.66Å; W245-W300 HydrophobicContact CE3-CZ2 4.47Å; W245-W300 HydrophobicContact CG-CH2 4.07Å; W245-W300 HydrophobicContact CG-CZ3 4.22Å; W245-W300 HydrophobicContact CH2-CH2 4.45Å; W245-W300 HydrophobicContact CZ2-CH2 4.46Å; W245-W300 HydrophobicContact CZ3-CH2 4.06Å; W245-W300 HydrophobicContact CZ3-CZ2 4.45Å; Y249-W300 AromaticContact CE2-CE3 3.77Å; Y249-W300 HydrophobicContact CE2-CE3 3.77Å; Y249-W300 AromaticContact CE2-CZ3 3.87Å; Y249-W300 HydrophobicContact CE2-CZ3 3.87Å; V296-W300 WeakPolarHBondContact O-CB 3.3Å; V296-W300 PolarHBondContact O-N 2.86Å; V296-W300 VanDerWaalsContact O-N 3.14Å; I297-W300 PolarHBondContact O-N 2.84Å; E298-W300 PolarHBondContact O-N 2.86Å; W300-V304 HydrophobicContact CE3-CB 4.04Å; W300-V304 HydrophobicContact CE3-CG1 3.95Å; W300-V304 HydrophobicContact CE3-CG2 4.43Å; W300-V304 HydrophobicContact CZ3-CB 4.47Å; W300-V304 HydrophobicContact CZ3-CG1 3.87Å; W300-L305 HydrophobicContact CD2-CD1 4.19Å; W300-L305 HydrophobicContact CD2-CG 4.19Å; W300-L305 HydrophobicContact CE3-CG 4.45Å; W300-L305 HydrophobicContact CH2-CD1 4.46Å; W300-L305 HydrophobicContact CH2-CD2 4Å; W300-L305 HydrophobicContact CH2-CG 4.31Å; W300-L305 HydrophobicContact CZ2-CD1 3.7Å; W300-L305 HydrophobicContact CZ2-CD2 4.02Å; W300-L305 HydrophobicContact CZ2-CG 4.01Å; W300-L305 HydrophobicContact CZ3-CD2 4.41Å; W300-L305 WeakPolarHBondContact O-CB 3.35Å; W300-L305 WeakPolarHBondContact O-CG 3.47Å; W300-L305 PolarHBondContact O-N 2.88Å
301	E	91.5	Very high	87.1	Confident	55 Å²	55	57.1 Å²	57.1	26%	0.257	31%	0.31	S	S	.	.	I	π-helix	trans	-77.7	-38.2	-171.7	-66.8	-173.2	174.1	0	0	112.9	I297 S306 L307	I297-E301 HydrophobicContact CG2-CG 4.15Å; I297-E301 WeakPolarHBondContact O-CB 3.45Å; I297-E301 WeakPolarHBondContact O-CG 3.23Å; I297-E301 PolarHBondContact O-N 3.17Å; E301-S306 VanDerWaalsContact O-CA 3.31Å; E301-S306 WeakPolarHBondContact O-CA 3.34Å; E301-S306 PolarHBondContact O-N 3.26Å; E301-S306 VanDerWaalsContact O-N 3.15Å; E301-L307 HydrophobicContact CB-CD1 3.83Å; E301-L307 HydrophobicContact CB-CG 4.36Å; E301-L307 HydrophobicContact CG-CD1 3.83Å; E301-L307 PolarHBondContact O-N 2.62Å
302	R	89.8	Confident	88.1	Confident	130 Å²	130	55.7 Å²	55.7	49%	0.491	30%	0.302	S	S	.	.	I	π-helix	trans	-97.7	-39.1	-173.6	-57	-177.9	168.3	-88.6	-5.3	113.2	W267 E298 S306	W267-R302 HydrophobicContact CB-CB 4.34Å; W267-R302 WeakPolarHBondContact O-CD 3.25Å; E298-R302 WeakPolarHBondContact O-CA 3.35Å; E298-R302 WeakPolarHBondContact O-CB 3.46Å; E298-R302 PolarHBondContact O-N 3.24Å; E298-R302 IonicContact OE2-NE 3.5Å; E298-R302 PolarHBondContact OE2-NE 2.93Å; R302-S306 WeakPolarHBondContact O-CA 3.36Å; R302-S306 PolarHBondContact O-OG 2.97Å
303	N	90.5	Very high	88.9	Confident	24 Å²	24	58.5 Å²	58.5	13%	0.128	32%	0.316	C	S	.	.	I	π-helix	trans	-92.3	-56.5	-179.1	-172.7	44.4	0	0	0	113.2	Y248 W267 F299 K318	Y248-N303 PolarHBondContact OH-ND2 3.2Å; W267-N303 HydrophobicContact CB-CB 4.09Å; W267-N303 HydrophobicContact CD2-CB 3.75Å; W267-N303 HydrophobicContact CE3-CB 4.25Å; W267-N303 HydrophobicContact CG-CB 3.67Å; F299-N303 HydrophobicContact CD2-CB 4.16Å; F299-N303 HydrophobicContact CE2-CB 4.45Å; F299-N303 WeakPolarHBondContact CE2-ND2 3.38Å; F299-N303 WeakPolarHBondContact O-CA 3.31Å; F299-N303 VanDerWaalsContact O-CB 3.28Å; F299-N303 WeakPolarHBondContact O-CB 3.29Å; F299-N303 PolarHBondContact O-N 3.48Å; F299-N303 VanDerWaalsContact O-N 3.1Å; N303-K318 PolarHBondContact O-NZ 2.98Å
304	V	92	Very high	88.9	Confident	2 Å²	2	62 Å²	62	1%	0.012	34%	0.339	C	S	.	.	I	π-helix	trans	-69.5	-59.8	-175	-176.3	0	0	0	0	110.8	Y248 Y249 F299 W300 L321	Y248-V304 HydrophobicContact CD1-CG1 4.31Å; Y248-V304 HydrophobicContact CD1-CG2 4.24Å; Y248-V304 HydrophobicContact CE1-CG1 4.45Å; Y248-V304 HydrophobicContact CE1-CG2 3.78Å; Y249-V304 HydrophobicContact CE2-CG1 4.35Å; Y249-V304 HydrophobicContact CE2-CG2 4.05Å; F299-V304 HydrophobicContact CD1-CG2 3.68Å; F299-V304 HydrophobicContact CE1-CG2 3.33Å; F299-V304 HydrophobicContact CG-CG2 4.5Å; F299-V304 HydrophobicContact CZ-CG2 3.92Å; F299-V304 WeakPolarHBondContact O-CG2 3.43Å; F299-V304 PolarHBondContact O-N 2.84Å; W300-V304 HydrophobicContact CE3-CB 4.04Å; W300-V304 HydrophobicContact CE3-CG1 3.95Å; W300-V304 HydrophobicContact CE3-CG2 4.43Å; W300-V304 HydrophobicContact CZ3-CB 4.47Å; W300-V304 HydrophobicContact CZ3-CG1 3.87Å; V304-L321 HydrophobicContact CG1-CD1 4.33Å; V304-L321 HydrophobicContact CG1-CD2 4.26Å; V304-L321 VanDerWaalsContact O-CD1 3.31Å; V304-L321 WeakPolarHBondContact O-CD1 3.49Å
305	L	90.2	Very high	89	Confident	45 Å²	45	64.7 Å²	64.7	24%	0.236	37%	0.368	C	S	.	.	S	Bend	trans	-79.5	-36.6	-179.6	-63.6	-176.4	0	0	0	112.8	W245 W300 L307	W245-L305 HydrophobicContact CZ2-CD2 3.83Å; W300-L305 HydrophobicContact CD2-CD1 4.19Å; W300-L305 HydrophobicContact CD2-CG 4.19Å; W300-L305 HydrophobicContact CE3-CG 4.45Å; W300-L305 HydrophobicContact CH2-CD1 4.46Å; W300-L305 HydrophobicContact CH2-CD2 4Å; W300-L305 HydrophobicContact CH2-CG 4.31Å; W300-L305 HydrophobicContact CZ2-CD1 3.7Å; W300-L305 HydrophobicContact CZ2-CD2 4.02Å; W300-L305 HydrophobicContact CZ2-CG 4.01Å; W300-L305 HydrophobicContact CZ3-CD2 4.41Å; W300-L305 WeakPolarHBondContact O-CB 3.35Å; W300-L305 WeakPolarHBondContact O-CG 3.47Å; W300-L305 PolarHBondContact O-N 2.88Å; L305-L307 HydrophobicContact CB-CD2 4.06Å; L305-L307 HydrophobicContact CB-CG 4.22Å; L305-L307 HydrophobicContact CD1-CD2 3.78Å; L305-L307 HydrophobicContact CD1-CG 4.35Å
306	S	89.2	Confident	89	Confident	53 Å²	53	69.8 Å²	69.8	37%	0.371	40%	0.403	S	S	.	.			trans	43	65.4	-162.6	-67.1	0	0	0	0	111.9	E301 R302 S308 K318	E301-S306 VanDerWaalsContact O-CA 3.31Å; E301-S306 WeakPolarHBondContact O-CA 3.34Å; E301-S306 PolarHBondContact O-N 3.26Å; E301-S306 VanDerWaalsContact O-N 3.15Å; R302-S306 WeakPolarHBondContact O-CA 3.36Å; R302-S306 PolarHBondContact O-OG 2.97Å; S306-S308 PolarHBondContact O-N 3.31Å; S306-K318 VanDerWaalsContact CB-CE 3.45Å; S306-K318 WeakPolarHBondContact OG-CE 3.48Å; S306-K318 PolarHBondContact OG-NZ 3.33Å
307	L	87.3	Confident	89	Confident	108 Å²	108	71.9 Å²	71.9	57%	0.565	41%	0.412	S	S	*	.			trans	-49.6	124.1	-175.3	-70.4	177.9	0	0	0	112.4	E301 L305	E301-L307 HydrophobicContact CB-CD1 3.83Å; E301-L307 HydrophobicContact CB-CG 4.36Å; E301-L307 HydrophobicContact CG-CD1 3.83Å; E301-L307 PolarHBondContact O-N 2.62Å; L305-L307 HydrophobicContact CB-CD2 4.06Å; L305-L307 HydrophobicContact CB-CG 4.22Å; L305-L307 HydrophobicContact CD1-CD2 3.78Å; L305-L307 HydrophobicContact CD1-CG 4.35Å
308	S	89.4	Confident	89.3	Confident	47 Å²	47	73.7 Å²	73.7	33%	0.329	42%	0.419	S	S	.	.			trans	-76.1	161.3	171.4	75.8	0	0	0	0	111.1	S306 G310 H313	S306-S308 PolarHBondContact O-N 3.31Å; S308-G310 PolarHBondContact O-N 3.01Å; S308-G310 PolarHBondContact OG-O 3.09Å; S308-G310 VanDerWaalsContact OG-O 3.09Å; S308-H313 WeakPolarHBondContact CB-O 3.43Å; S308-H313 PolarHBondContact OG-O 3.26Å
309	P	85.9	Confident	89.5	Confident	129 Å²	129	82.2 Å²	82.2	84%	0.838	45%	0.451	S	S	*	.	S	Bend	trans	-67.8	-16.8	-177.4	26	-35.1	0	0	0	114.4	H313	P309-H313 HydrophobicContact CG-CB 4.44Å
310	G	88.9	Confident	89.5	Confident	26 Å²	26	86.4 Å²	86.4	27%	0.268	47%	0.473	S	S	.	.	B	Isolated β-bridge	trans	-173.5	166.1	-177.9	0	0	0	0	0	113.2	S308 D312 H313	S308-G310 PolarHBondContact O-N 3.01Å; S308-G310 PolarHBondContact OG-O 3.09Å; S308-G310 VanDerWaalsContact OG-O 3.09Å; G310-D312 PolarHBondContact O-N 3.28Å; G310-H313 CarbonylContact O-C 3.44Å; G310-H313 PolarHBondContact O-N 3.11Å; G310-H313 VanDerWaalsContact O-N 3.14Å; G310-H313 VanDerWaalsContact O-O 3.07Å
311	I	89	Confident	89.6	Confident	157 Å²	157	85 Å²	85	81%	0.805	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-29.3	-179.5	-167.5	168.1	0	0	0	112.5	H313	I311-H313 PolarHBondContact O-N 3.16Å
312	D	91.2	Very high	89.8	Confident	132 Å²	132	83.7 Å²	83.7	71%	0.706	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.9	177.8	-43.8	-77.6	0	0	0	112.7	G310	G310-D312 PolarHBondContact O-N 3.28Å
313	H	88.9	Confident	90.1	Very high	125 Å²	125	82.9 Å²	82.9	58%	0.579	47%	0.473	S	S	*	.	B	Isolated β-bridge	trans	-126.8	82.7	178.6	-60.9	-33.3	0	0	0	109	S308 P309 G310 I311 G315	S308-H313 WeakPolarHBondContact CB-O 3.43Å; S308-H313 PolarHBondContact OG-O 3.26Å; P309-H313 HydrophobicContact CG-CB 4.44Å; G310-H313 CarbonylContact O-C 3.44Å; G310-H313 PolarHBondContact O-N 3.11Å; G310-H313 VanDerWaalsContact O-N 3.14Å; G310-H313 VanDerWaalsContact O-O 3.07Å; I311-H313 PolarHBondContact O-N 3.16Å; H313-G315 PolarHBondContact O-N 3.24Å
314	P	82	Confident	90.3	Very high	117 Å²	117	82.2 Å²	82.2	76%	0.76	47%	0.471	S	S	*	.			trans	-65.8	-5.9	-174.7	25	-34.6	0	0	0	115
315	G	86.4	Confident	90.5	Very high	61 Å²	61	84.5 Å²	84.5	63%	0.629	48%	0.483	S	S	*	.			trans	75.7	-159.4	176.8	0	0	0	0	0	113.4	H313	H313-G315 PolarHBondContact O-N 3.24Å
316	S	87.1	Confident	90.8	Very high	111 Å²	111	87.1 Å²	87.1	78%	0.776	50%	0.496	S	S	*	.			trans	-97.5	151.7	175.4	54	0	0	0	0	111.5	K318	S316-K318 PolarHBondContact O-N 2.94Å
317	L	89.5	Confident	91.2	Very high	112 Å²	112	88 Å²	88	59%	0.586	50%	0.496	S	S	*	.			trans	-70.5	123	177.6	-174.5	67.9	0	0	0	110.8	W319 A322	L317-W319 HydrophobicContact CD2-CE3 4.33Å; L317-W319 HydrophobicContact CD2-CH2 4.27Å; L317-W319 HydrophobicContact CD2-CZ3 4.15Å; L317-W319 PolarHBondContact O-N 3.01Å; L317-A322 HydrophobicContact CD2-CB 4.2Å; L317-A322 HydrophobicContact CG-CB 4.35Å
318	K	91.8	Very high	91.6	Very high	55 Å²	55	83.4 Å²	83.4	24%	0.239	47%	0.473	C	S	.	.			trans	-73.8	99.4	170.2	-81.3	-79.7	178.6	158.5	0	110.7	N303 S306 S316 D320 L321 A322	N303-K318 PolarHBondContact O-NZ 2.98Å; S306-K318 VanDerWaalsContact CB-CE 3.45Å; S306-K318 WeakPolarHBondContact OG-CE 3.48Å; S306-K318 PolarHBondContact OG-NZ 3.33Å; S316-K318 PolarHBondContact O-N 2.94Å; K318-D320 VanDerWaalsContact C-N 3.29Å; K318-D320 PolarHBondContact O-N 3.48Å; K318-L321 HydrophobicContact CB-CB 4.15Å; K318-L321 HydrophobicContact CB-CD1 4.27Å; K318-L321 HydrophobicContact CB-CG 4.26Å; K318-L321 PolarHBondContact O-N 3.42Å; K318-L321 VanDerWaalsContact O-N 3.16Å; K318-A322 PolarHBondContact O-N 3.16Å
319	W	93.8	Very high	91.9	Very high	182 Å²	182	88 Å²	88	69%	0.689	48%	0.483	S	S	*	.	H	α-helix	trans	-57.3	-37.3	-178.8	-68.1	107.4	0	0	0	113.6	L317 L321 A322 L323	L317-W319 HydrophobicContact CD2-CE3 4.33Å; L317-W319 HydrophobicContact CD2-CH2 4.27Å; L317-W319 HydrophobicContact CD2-CZ3 4.15Å; L317-W319 PolarHBondContact O-N 3.01Å; W319-L321 VanDerWaalsContact C-N 3.33Å; W319-L321 PolarHBondContact O-N 2.99Å; W319-A322 PolarHBondContact O-N 3.16Å; W319-A322 VanDerWaalsContact O-N 3.16Å; W319-L323 WeakPolarHBondContact O-CG 3.45Å; W319-L323 PolarHBondContact O-N 3.36Å
320	D	93.1	Very high	92.3	Very high	88 Å²	88	85.6 Å²	85.6	47%	0.471	46%	0.462	S	S	.	.	H	α-helix	trans	-61.1	-42.6	177.8	-43.1	-61.9	0	0	0	111.8	Y248 K318 C324	Y248-D320 HydrophobicContact CD2-CB 4.15Å; Y248-D320 HydrophobicContact CE2-CB 3.72Å; K318-D320 VanDerWaalsContact C-N 3.29Å; K318-D320 PolarHBondContact O-N 3.48Å; D320-C324 PolarHBondContact O-N 3.42Å; D320-C324 PolarHBondContact O-SG 3.4Å
321	L	94.1	Very high	92.5	Very high	27 Å²	27	88.1 Å²	88.1	14%	0.141	47%	0.473	C	S	.	.	H	α-helix	trans	-72.3	-34.8	175.4	-68.8	-173.6	0	0	0	112.1	Y248 V304 K318 W319 C324 L325	Y248-L321 HydrophobicContact CD2-CD2 3.96Å; Y248-L321 HydrophobicContact CG-CD2 3.84Å; V304-L321 HydrophobicContact CG1-CD1 4.33Å; V304-L321 HydrophobicContact CG1-CD2 4.26Å; V304-L321 VanDerWaalsContact O-CD1 3.31Å; V304-L321 WeakPolarHBondContact O-CD1 3.49Å; K318-L321 HydrophobicContact CB-CB 4.15Å; K318-L321 HydrophobicContact CB-CD1 4.27Å; K318-L321 HydrophobicContact CB-CG 4.26Å; K318-L321 PolarHBondContact O-N 3.42Å; K318-L321 VanDerWaalsContact O-N 3.16Å; W319-L321 VanDerWaalsContact C-N 3.33Å; W319-L321 PolarHBondContact O-N 2.99Å; L321-C324 PolarHBondContact O-N 3.07Å; L321-L325 VanDerWaalsContact O-CB 3.25Å; L321-L325 WeakPolarHBondContact O-CB 3.4Å; L321-L325 PolarHBondContact O-N 2.98Å
322	A	95.1	Very high	92.6	Very high	27 Å²	27	82.6 Å²	82.6	22%	0.223	45%	0.448	C	S	.	.	H	α-helix	trans	-64.6	-39.9	175.3	0	0	0	0	0	111.9	L317 K318 W319 L325 L326	L317-A322 HydrophobicContact CD2-CB 4.2Å; L317-A322 HydrophobicContact CG-CB 4.35Å; K318-A322 PolarHBondContact O-N 3.16Å; W319-A322 PolarHBondContact O-N 3.16Å; W319-A322 VanDerWaalsContact O-N 3.16Å; A322-L325 PolarHBondContact O-N 3.36Å; A322-L326 WeakPolarHBondContact O-CB 3.45Å; A322-L326 PolarHBondContact O-N 3.34Å
323	L	95.8	Very high	92.7	Very high	112 Å²	112	81.3 Å²	81.3	59%	0.586	44%	0.436	S	S	*	.	H	α-helix	trans	-68.1	-42.3	173.9	-69.7	173.3	0	0	0	111.9	W319 L325 L326 L327	W319-L323 WeakPolarHBondContact O-CG 3.45Å; W319-L323 PolarHBondContact O-N 3.36Å; L323-L325 VanDerWaalsContact C-N 3.32Å; L323-L325 PolarHBondContact O-N 3.32Å; L323-L326 PolarHBondContact O-N 3.19Å; L323-L327 PolarHBondContact O-N 2.95Å
324	C	96.3	Very high	92.7	Very high	11 Å²	11	81.7 Å²	81.7	7%	0.074	44%	0.436	C	S	.	.	H	α-helix	trans	-60.9	-41.8	172.8	-67.9	0	0	0	0	111.6	A244 T247 D320 L321 L327 V328	A244-C324 HydrophobicContact CB-CB 4.41Å; T247-C324 HydrophobicContact CG2-CB 4.45Å; D320-C324 PolarHBondContact O-N 3.42Å; D320-C324 PolarHBondContact O-SG 3.4Å; L321-C324 PolarHBondContact O-N 3.07Å; C324-L327 PolarHBondContact O-N 3.36Å; C324-V328 VanDerWaalsContact O-CG2 3.32Å; C324-V328 WeakPolarHBondContact O-CG2 3.43Å; C324-V328 PolarHBondContact O-N 2.89Å
325	L	95.9	Very high	93.1	Very high	50 Å²	50	77.8 Å²	77.8	26%	0.262	41%	0.411	S	S	.	.	H	α-helix	trans	-63.7	-43.2	176.7	178.5	61.1	0	0	0	112	I240 A244 L321 A322 L323 V328 W329	I240-L325 HydrophobicContact CB-CD1 4.39Å; I240-L325 HydrophobicContact CG1-CD1 3.91Å; I240-L325 HydrophobicContact CG2-CD1 3.94Å; A244-L325 HydrophobicContact CB-CB 3.85Å; A244-L325 HydrophobicContact CB-CD1 4.14Å; L321-L325 VanDerWaalsContact O-CB 3.25Å; L321-L325 WeakPolarHBondContact O-CB 3.4Å; L321-L325 PolarHBondContact O-N 2.98Å; A322-L325 PolarHBondContact O-N 3.36Å; L323-L325 VanDerWaalsContact C-N 3.32Å; L323-L325 PolarHBondContact O-N 3.32Å; L325-V328 PolarHBondContact O-N 3.1Å; L325-W329 VanDerWaalsContact O-CD1 3.31Å; L325-W329 PolarHBondContact O-N 3.03Å
326	L	96.6	Very high	93.1	Very high	100 Å²	100	80 Å²	80	52%	0.524	41%	0.407	S	S	.	.	H	α-helix	trans	-60.3	-44.9	174.3	179.1	62.8	0	0	0	111.4	A322 L323 W329 L330	A322-L326 WeakPolarHBondContact O-CB 3.45Å; A322-L326 PolarHBondContact O-N 3.34Å; L323-L326 PolarHBondContact O-N 3.19Å; L326-W329 PolarHBondContact O-N 3.3Å; L326-L330 HydrophobicContact CG-CD1 4.36Å; L326-L330 WeakPolarHBondContact O-CG 3.44Å; L326-L330 PolarHBondContact O-N 3.27Å
327	L	96.4	Very high	93	Very high	71 Å²	71	82.4 Å²	82.4	37%	0.372	40%	0.4	S	S	.	.	H	α-helix	trans	-60.7	-45.8	177.1	179.5	63.7	0	0	0	111.8	T247 F251 L323 C324 W329 L330 V331	T247-L327 HydrophobicContact CG2-CD2 4.18Å; F251-L327 HydrophobicContact CE2-CD2 3.74Å; F251-L327 HydrophobicContact CZ-CD2 3.58Å; L323-L327 PolarHBondContact O-N 2.95Å; C324-L327 PolarHBondContact O-N 3.36Å; L327-W329 VanDerWaalsContact C-N 3.34Å; L327-W329 PolarHBondContact O-N 3.44Å; L327-L330 PolarHBondContact O-N 3.34Å; L327-V331 HydrophobicContact CD1-CG2 4.46Å; L327-V331 WeakPolarHBondContact O-CG2 3.48Å; L327-V331 PolarHBondContact O-N 2.88Å
328	V	96	Very high	92.6	Very high	11 Å²	11	85.1 Å²	85.1	7%	0.067	41%	0.407	C	S	.	.	H	α-helix	trans	-60.9	-43.2	177.1	173.7	0	0	0	0	110.9	I240 L243 T247 C324 L325 L330 V331 C332	I240-V328 HydrophobicContact CD1-CG1 3.55Å; I240-V328 HydrophobicContact CG1-CG1 4.08Å; L243-V328 HydrophobicContact CB-CG1 3.71Å; L243-V328 HydrophobicContact CB-CG2 4.35Å; L243-V328 HydrophobicContact CD1-CG1 4.12Å; T247-V328 HydrophobicContact CG2-CG2 4.39Å; T247-V328 VanDerWaalsContact OG1-CG2 3.29Å; T247-V328 WeakPolarHBondContact OG1-CG2 3.22Å; C324-V328 VanDerWaalsContact O-CG2 3.32Å; C324-V328 WeakPolarHBondContact O-CG2 3.43Å; C324-V328 PolarHBondContact O-N 2.89Å; L325-V328 PolarHBondContact O-N 3.1Å; V328-L330 PolarHBondContact O-N 2.93Å; V328-V331 PolarHBondContact O-N 3.39Å; V328-C332 WeakPolarHBondContact O-CB 3.34Å; V328-C332 PolarHBondContact O-N 2.97Å; V328-C332 PolarHBondContact O-SG 3.06Å; V328-C332 VanDerWaalsContact O-SG 3.36Å
329	W	95.3	Very high	92	Very high	143 Å²	143	83.3 Å²	83.3	54%	0.542	40%	0.404	S	S	.	.	H	α-helix	trans	-59	-44.7	174.7	-90.4	110.6	0	0	0	112.9	I240 L325 L326 L327 C332 F333	I240-W329 HydrophobicContact CD1-CD2 4.42Å; I240-W329 HydrophobicContact CG1-CD2 4.27Å; I240-W329 HydrophobicContact CG1-CG 4.4Å; I240-W329 HydrophobicContact CG1-CZ2 4.28Å; I240-W329 HydrophobicContact CG2-CZ2 4.33Å; L325-W329 VanDerWaalsContact O-CD1 3.31Å; L325-W329 PolarHBondContact O-N 3.03Å; L326-W329 PolarHBondContact O-N 3.3Å; L327-W329 VanDerWaalsContact C-N 3.34Å; L327-W329 PolarHBondContact O-N 3.44Å; W329-C332 PolarHBondContact O-N 3.23Å; W329-F333 VanDerWaalsContact O-CB 3.26Å; W329-F333 WeakPolarHBondContact O-CB 3.32Å; W329-F333 PolarHBondContact O-N 2.72Å
330	L	95.4	Very high	91	Very high	79 Å²	79	75.7 Å²	75.7	41%	0.414	38%	0.377	S	S	.	.	H	α-helix	trans	-61.8	-44.6	176.4	-69.2	171.3	0	0	0	111.6	L326 L327 V328 F333 F334	L326-L330 HydrophobicContact CG-CD1 4.36Å; L326-L330 WeakPolarHBondContact O-CG 3.44Å; L326-L330 PolarHBondContact O-N 3.27Å; L327-L330 PolarHBondContact O-N 3.34Å; V328-L330 PolarHBondContact O-N 2.93Å; L330-F333 PolarHBondContact O-N 2.9Å; L330-F334 WeakPolarHBondContact O-CD2 3.45Å; L330-F334 PolarHBondContact O-N 3.01Å
331	V	92.9	Very high	90.1	Very high	80 Å²	80	78.6 Å²	78.6	49%	0.485	38%	0.382	S	S	.	.	H	α-helix	trans	-61.6	-51.3	176.4	172	0	0	0	0	110.9	L327 V328 F333 F334 C335	L327-V331 HydrophobicContact CD1-CG2 4.46Å; L327-V331 WeakPolarHBondContact O-CG2 3.48Å; L327-V331 PolarHBondContact O-N 2.88Å; V328-V331 PolarHBondContact O-N 3.39Å; V331-F333 VanDerWaalsContact C-N 3.26Å; V331-F333 PolarHBondContact O-N 3.23Å; V331-F334 PolarHBondContact O-N 2.97Å; V331-C335 PolarHBondContact O-N 3.44Å; V331-C335 PolarHBondContact O-SG 3.17Å
332	C	91.8	Very high	89.4	Confident	41 Å²	41	78.7 Å²	78.7	28%	0.277	38%	0.384	S	S	.	.	H	α-helix	trans	-56.9	-40.1	177.2	-72.8	0	0	0	0	112.2	V328 W329 C335 I336	V328-C332 WeakPolarHBondContact O-CB 3.34Å; V328-C332 PolarHBondContact O-N 2.97Å; V328-C332 PolarHBondContact O-SG 3.06Å; V328-C332 VanDerWaalsContact O-SG 3.36Å; W329-C332 PolarHBondContact O-N 3.23Å; C332-C335 PolarHBondContact O-N 3.4Å; C332-I336 WeakPolarHBondContact O-CG1 3.46Å; C332-I336 PolarHBondContact O-N 3.16Å
333	F	91.8	Very high	88.7	Confident	105 Å²	105	79.4 Å²	79.4	46%	0.461	39%	0.386	S	S	.	.	H	α-helix	trans	-63.8	-48	176.4	177.2	-127.4	0	0	0	112.2	W329 L330 V331 C335 I336 W337	W329-F333 VanDerWaalsContact O-CB 3.26Å; W329-F333 WeakPolarHBondContact O-CB 3.32Å; W329-F333 PolarHBondContact O-N 2.72Å; L330-F333 PolarHBondContact O-N 2.9Å; V331-F333 VanDerWaalsContact C-N 3.26Å; V331-F333 PolarHBondContact O-N 3.23Å; F333-C335 VanDerWaalsContact C-N 3.31Å; F333-C335 PolarHBondContact O-N 3.16Å; F333-I336 PolarHBondContact O-N 2.94Å; F333-I336 VanDerWaalsContact O-N 3.11Å; F333-W337 AromaticContact CD1-CE3 3.96Å; F333-W337 HydrophobicContact CD1-CE3 3.96Å; F333-W337 HydrophobicContact CD1-CZ3 4.23Å; F333-W337 HydrophobicContact CE1-CD2 4.25Å; F333-W337 AromaticContact CE1-CE3 3.23Å; F333-W337 HydrophobicContact CE1-CE3 3.23Å; F333-W337 HydrophobicContact CE1-CH2 4.18Å; F333-W337 AromaticContact CE1-CZ3 3.21Å; F333-W337 HydrophobicContact CE1-CZ3 3.21Å; F333-W337 HydrophobicContact CE2-CD2 4.29Å; F333-W337 HydrophobicContact CE2-CE3 4.02Å; F333-W337 AromaticContact CZ-CD2 3.84Å; F333-W337 HydrophobicContact CZ-CD2 3.84Å; F333-W337 AromaticContact CZ-CE3 3.25Å; F333-W337 HydrophobicContact CZ-CE3 3.25Å; F333-W337 HydrophobicContact CZ-CH2 4.05Å; F333-W337 AromaticContact CZ-CZ3 3.4Å; F333-W337 HydrophobicContact CZ-CZ3 3.4Å; F333-W337 WeakPolarHBondContact O-CB 3.25Å; F333-W337 PolarHBondContact O-N 3.17Å
334	F	90.6	Very high	87.8	Confident	133 Å²	133	74.1 Å²	74.1	58%	0.583	36%	0.359	S	S	*	.	H	α-helix	trans	-64.5	-32.8	176.2	-73	-59.4	0	0	0	113.4	L330 V331 I336 W337	L330-F334 WeakPolarHBondContact O-CD2 3.45Å; L330-F334 PolarHBondContact O-N 3.01Å; V331-F334 PolarHBondContact O-N 2.97Å; F334-I336 PolarHBondContact O-N 3.3Å; F334-W337 HydrophobicContact CD1-CE3 4.28Å; F334-W337 HydrophobicContact CE1-CE3 4.18Å; F334-W337 HydrophobicContact CE1-CZ3 4.27Å
335	C	88.6	Confident	87.2	Confident	35 Å²	35	81.5 Å²	81.5	24%	0.236	39%	0.39	C	S	.	.	H	α-helix	trans	-63.7	-26	173.8	-67.3	0	0	0	0	113.5	V331 C332 F333 T343 V346	V331-C335 PolarHBondContact O-N 3.44Å; V331-C335 PolarHBondContact O-SG 3.17Å; C332-C335 PolarHBondContact O-N 3.4Å; F333-C335 VanDerWaalsContact C-N 3.31Å; F333-C335 PolarHBondContact O-N 3.16Å; C335-T343 PolarHBondContact O-OG1 3.43Å; C335-V346 HydrophobicContact CB-CG1 4.38Å
336	I	86.6	Confident	86.8	Confident	107 Å²	107	81.4 Å²	81.4	55%	0.549	39%	0.391	S	S	.	.	H	α-helix	trans	-110.9	-26.6	-172.2	-61.1	170.5	0	0	0	112.9	C332 F333 F334 K338 G339	C332-I336 WeakPolarHBondContact O-CG1 3.46Å; C332-I336 PolarHBondContact O-N 3.16Å; F333-I336 PolarHBondContact O-N 2.94Å; F333-I336 VanDerWaalsContact O-N 3.11Å; F334-I336 PolarHBondContact O-N 3.3Å; I336-K338 VanDerWaalsContact C-N 3.3Å; I336-K338 PolarHBondContact O-N 2.84Å; I336-K338 VanDerWaalsContact O-N 3.08Å; I336-G339 PolarHBondContact O-N 3.35Å
337	W	85.8	Confident	86.2	Confident	161 Å²	161	77.4 Å²	77.4	61%	0.61	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45	-51.3	-171.4	-172.5	-38.3	0	0	0	112.7	F333 F334 G339	F333-W337 AromaticContact CD1-CE3 3.96Å; F333-W337 HydrophobicContact CD1-CE3 3.96Å; F333-W337 HydrophobicContact CD1-CZ3 4.23Å; F333-W337 HydrophobicContact CE1-CD2 4.25Å; F333-W337 AromaticContact CE1-CE3 3.23Å; F333-W337 HydrophobicContact CE1-CE3 3.23Å; F333-W337 HydrophobicContact CE1-CH2 4.18Å; F333-W337 AromaticContact CE1-CZ3 3.21Å; F333-W337 HydrophobicContact CE1-CZ3 3.21Å; F333-W337 HydrophobicContact CE2-CD2 4.29Å; F333-W337 HydrophobicContact CE2-CE3 4.02Å; F333-W337 AromaticContact CZ-CD2 3.84Å; F333-W337 HydrophobicContact CZ-CD2 3.84Å; F333-W337 AromaticContact CZ-CE3 3.25Å; F333-W337 HydrophobicContact CZ-CE3 3.25Å; F333-W337 HydrophobicContact CZ-CH2 4.05Å; F333-W337 AromaticContact CZ-CZ3 3.4Å; F333-W337 HydrophobicContact CZ-CZ3 3.4Å; F333-W337 WeakPolarHBondContact O-CB 3.25Å; F333-W337 PolarHBondContact O-N 3.17Å; F334-W337 HydrophobicContact CD1-CE3 4.28Å; F334-W337 HydrophobicContact CE1-CE3 4.18Å; F334-W337 HydrophobicContact CE1-CZ3 4.27Å; W337-G339 PolarHBondContact O-N 3.08Å
338	K	81.4	Confident	85.7	Confident	170 Å²	170	78 Å²	78	74%	0.739	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	22.1	-176.5	-75.4	-179.4	178.7	177.5	0	114.3	I336	I336-K338 VanDerWaalsContact C-N 3.3Å; I336-K338 PolarHBondContact O-N 2.84Å; I336-K338 VanDerWaalsContact O-N 3.08Å
339	G	79.6	Confident	85.3	Confident	17 Å²	17	83.8 Å²	83.8	18%	0.175	39%	0.393	C	S	.	.			trans	68.5	-168.9	175.4	0	0	0	0	0	114.5	I336 W337 R341 S342 T343	I336-G339 PolarHBondContact O-N 3.35Å; W337-G339 PolarHBondContact O-N 3.08Å; G339-R341 PolarHBondContact O-N 3.04Å; G339-R341 VanDerWaalsContact O-N 3.11Å; G339-S342 WeakPolarHBondContact O-CB 3.41Å; G339-S342 PolarHBondContact O-N 3.33Å; G339-T343 PolarHBondContact O-N 3.45Å; G339-T343 VanDerWaalsContact O-N 3.1Å; G339-T343 PolarHBondContact O-OG1 3.37Å
340	V	72.6	Confident	84.8	Confident	21 Å²	21	80.6 Å²	80.6	13%	0.127	39%	0.389	C	S	.	.	H	α-helix	trans	-60.5	-26.9	-170.6	-65.8	0	0	0	0	113.8	E143 W145 S342 G344 Y416	E143-V340 HydrophobicContact CB-CG2 4.26Å; E143-V340 WeakPolarHBondContact OE2-CG2 3.45Å; W145-V340 HydrophobicContact CH2-CB 4.26Å; W145-V340 HydrophobicContact CH2-CG1 4.5Å; W145-V340 HydrophobicContact CZ3-CB 4.17Å; V340-S342 VanDerWaalsContact C-N 3.3Å; V340-S342 PolarHBondContact O-N 2.92Å; V340-G344 PolarHBondContact O-N 3.29Å; V340-Y416 HydrophobicContact CG1-CD1 4.1Å; V340-Y416 HydrophobicContact CG1-CD2 4.19Å; V340-Y416 HydrophobicContact CG1-CE1 3.84Å; V340-Y416 HydrophobicContact CG1-CE2 3.92Å; V340-Y416 HydrophobicContact CG1-CG 4.31Å; V340-Y416 HydrophobicContact CG2-CD1 3.97Å; V340-Y416 HydrophobicContact CG2-CE1 4.15Å
341	R	73.3	Confident	84.1	Confident	150 Å²	150	76.9 Å²	76.9	57%	0.566	37%	0.37	S	S	*	.	H	α-helix	trans	-66.4	-30.2	173.9	-64.7	-177.3	-177.9	-176.5	3.2	113.2	G339	G339-R341 PolarHBondContact O-N 3.04Å; G339-R341 VanDerWaalsContact O-N 3.11Å
342	S	79.1	Confident	83.7	Confident	28 Å²	28	76.2 Å²	76.2	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-83	-45.9	175	-164.4	0	0	0	0	110.6	G339 V340 G344 K345 V346	G339-S342 WeakPolarHBondContact O-CB 3.41Å; G339-S342 PolarHBondContact O-N 3.33Å; V340-S342 VanDerWaalsContact C-N 3.3Å; V340-S342 PolarHBondContact O-N 2.92Å; S342-G344 VanDerWaalsContact C-N 3.31Å; S342-G344 PolarHBondContact O-N 3.26Å; S342-K345 PolarHBondContact O-N 2.9Å; S342-K345 VanDerWaalsContact O-N 3.11Å; S342-V346 PolarHBondContact O-N 3.24Å; S342-V346 VanDerWaalsContact O-N 3.12Å
343	T	81.2	Confident	83.4	Confident	42 Å²	42	78.9 Å²	78.9	26%	0.258	37%	0.373	S	S	.	.	H	α-helix	trans	-53	-49.2	174.9	-48.7	0	0	0	0	111	C335 G339 K345 V346 V347	C335-T343 PolarHBondContact O-OG1 3.43Å; G339-T343 PolarHBondContact O-N 3.45Å; G339-T343 VanDerWaalsContact O-N 3.1Å; G339-T343 PolarHBondContact O-OG1 3.37Å; T343-K345 VanDerWaalsContact C-N 3.27Å; T343-K345 PolarHBondContact O-N 2.95Å; T343-V346 PolarHBondContact O-N 3.15Å; T343-V346 VanDerWaalsContact O-N 3.15Å; T343-V347 HydrophobicContact CG2-CG2 4.18Å; T343-V347 WeakPolarHBondContact O-CB 3.44Å; T343-V347 VanDerWaalsContact O-CG2 3.24Å; T343-V347 WeakPolarHBondContact O-CG2 3.46Å; T343-V347 PolarHBondContact O-N 3.33Å
344	G	77.6	Confident	82.9	Confident	2 Å²	2	75.9 Å²	75.9	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-56.9	-36.6	179.7	0	0	0	0	0	113.5	V340 S342 Y348	V340-G344 PolarHBondContact O-N 3.29Å; S342-G344 VanDerWaalsContact C-N 3.31Å; S342-G344 PolarHBondContact O-N 3.26Å; G344-Y348 WeakPolarHBondContact O-CD2 3.27Å; G344-Y348 WeakPolarHBondContact O-CE2 3.35Å
345	K	83.7	Confident	82.4	Confident	166 Å²	166	71.6 Å²	71.6	72%	0.722	35%	0.346	S	S	*	.	H	α-helix	trans	-70.6	-44.6	175.9	-71	-179.1	179	-174.8	0	112.7	S342 T343 V347 Y348	S342-K345 PolarHBondContact O-N 2.9Å; S342-K345 VanDerWaalsContact O-N 3.11Å; T343-K345 VanDerWaalsContact C-N 3.27Å; T343-K345 PolarHBondContact O-N 2.95Å; K345-V347 VanDerWaalsContact C-N 3.27Å; K345-V347 PolarHBondContact O-N 3.47Å; K345-Y348 PolarHBondContact O-N 2.94Å
346	V	86.3	Confident	82.3	Confident	47 Å²	47	72.4 Å²	72.4	29%	0.285	36%	0.355	S	S	.	.	H	α-helix	trans	-62.5	-39.1	177	174.8	0	0	0	0	110.8	C335 S342 T343 Y348 F349 T350	C335-V346 HydrophobicContact CB-CG1 4.38Å; S342-V346 PolarHBondContact O-N 3.24Å; S342-V346 VanDerWaalsContact O-N 3.12Å; T343-V346 PolarHBondContact O-N 3.15Å; T343-V346 VanDerWaalsContact O-N 3.15Å; V346-Y348 VanDerWaalsContact C-N 3.26Å; V346-Y348 PolarHBondContact O-N 3.17Å; V346-F349 PolarHBondContact O-N 3.45Å; V346-T350 HydrophobicContact CG1-CG2 3.82Å; V346-T350 PolarHBondContact O-N 3.38Å; V346-T350 PolarHBondContact O-OG1 3.3Å
347	V	84.4	Confident	82.1	Confident	16 Å²	16	71.4 Å²	71.4	10%	0.097	35%	0.349	C	S	.	.	H	α-helix	trans	-57.9	-31.5	178.3	159.6	0	0	0	0	113.3	L153 T343 K345 F349 T350 A351	L153-V347 HydrophobicContact CB-CG1 3.7Å; L153-V347 WeakPolarHBondContact O-CG1 3.46Å; T343-V347 HydrophobicContact CG2-CG2 4.18Å; T343-V347 WeakPolarHBondContact O-CB 3.44Å; T343-V347 VanDerWaalsContact O-CG2 3.24Å; T343-V347 WeakPolarHBondContact O-CG2 3.46Å; T343-V347 PolarHBondContact O-N 3.33Å; K345-V347 VanDerWaalsContact C-N 3.27Å; K345-V347 PolarHBondContact O-N 3.47Å; V347-F349 PolarHBondContact O-N 3.47Å; V347-T350 WeakPolarHBondContact CA-OG1 3.24Å; V347-T350 PolarHBondContact O-N 2.94Å; V347-A351 HydrophobicContact CG1-CB 4.2Å; V347-A351 WeakPolarHBondContact O-CB 3.33Å; V347-A351 PolarHBondContact O-N 3.31Å
348	Y	84.8	Confident	81.9	Confident	85 Å²	85	64.4 Å²	64.4	33%	0.333	32%	0.323	S	S	.	.	H	α-helix	trans	-55.9	-39.9	173.1	-79.3	-92.9	0	0	0	111.9	I149 D150 L153 G344 K345 V346 T352	I149-Y348 HydrophobicContact CG2-CE1 3.72Å; D150-Y348 VanDerWaalsContact OD1-CE2 3.31Å; D150-Y348 WeakPolarHBondContact OD1-CE2 3.39Å; D150-Y348 PolarHBondContact OD1-OH 2.95Å; L153-Y348 HydrophobicContact CD1-CD1 3.41Å; L153-Y348 VanDerWaalsContact CD1-CD1 3.41Å; L153-Y348 HydrophobicContact CD1-CE1 3.5Å; L153-Y348 VanDerWaalsContact CD1-CE1 3.5Å; L153-Y348 HydrophobicContact CD1-CG 3.95Å; G344-Y348 WeakPolarHBondContact O-CD2 3.27Å; G344-Y348 WeakPolarHBondContact O-CE2 3.35Å; K345-Y348 PolarHBondContact O-N 2.94Å; V346-Y348 VanDerWaalsContact C-N 3.26Å; V346-Y348 PolarHBondContact O-N 3.17Å; Y348-T352 WeakPolarHBondContact O-CB 3.29Å; Y348-T352 WeakPolarHBondContact O-CG2 3.24Å; Y348-T352 PolarHBondContact O-OG1 3.39Å
349	F	87.9	Confident	82	Confident	131 Å²	131	60.5 Å²	60.5	58%	0.575	31%	0.31	S	S	*	.	H	α-helix	trans	-80.4	-51.7	175.4	-177.7	-101.7	0	0	0	111.6	V346 V347 A351 T352 F353	V346-F349 PolarHBondContact O-N 3.45Å; V347-F349 PolarHBondContact O-N 3.47Å; F349-A351 VanDerWaalsContact C-N 3.31Å; F349-A351 PolarHBondContact O-N 2.91Å; F349-T352 PolarHBondContact O-N 3.23Å; F349-F353 HydrophobicContact CD2-CB 4.36Å; F349-F353 HydrophobicContact CE1-CB 4.28Å; F349-F353 HydrophobicContact CE1-CG 4.31Å; F349-F353 HydrophobicContact CE2-CB 4.04Å; F349-F353 HydrophobicContact CE2-CD2 4.03Å; F349-F353 HydrophobicContact CE2-CG 4.17Å; F349-F353 HydrophobicContact CZ-CB 4Å; F349-F353 HydrophobicContact CZ-CD1 4.36Å; F349-F353 AromaticContact CZ-CD2 3.88Å; F349-F353 HydrophobicContact CZ-CD2 3.88Å; F349-F353 HydrophobicContact CZ-CE2 4.46Å; F349-F353 AromaticContact CZ-CG 3.82Å; F349-F353 HydrophobicContact CZ-CG 3.82Å; F349-F353 WeakPolarHBondContact O-CB 3.23Å; F349-F353 PolarHBondContact O-N 3.17Å
350	T	85.6	Confident	82.4	Confident	76 Å²	76	64.2 Å²	64.2	47%	0.466	33%	0.329	S	S	.	.	H	α-helix	trans	-70.7	-23.1	-171.1	60	0	0	0	0	114.1	V346 V347 P354	V346-T350 HydrophobicContact CG1-CG2 3.82Å; V346-T350 PolarHBondContact O-N 3.38Å; V346-T350 PolarHBondContact O-OG1 3.3Å; V347-T350 WeakPolarHBondContact CA-OG1 3.24Å; V347-T350 PolarHBondContact O-N 2.94Å; T350-P354 WeakPolarHBondContact O-CD 3.31Å; T350-P354 VanDerWaalsContact O-CG 3.26Å; T350-P354 WeakPolarHBondContact O-CG 3.45Å
351	A	81.5	Confident	82.9	Confident	2 Å²	2	66.8 Å²	66.8	2%	0.017	34%	0.342	C	S	.	.	H	α-helix	trans	-84.1	-39.8	171.3	0	0	0	0	0	112.4	V347 F349 F355	V347-A351 HydrophobicContact CG1-CB 4.2Å; V347-A351 WeakPolarHBondContact O-CB 3.33Å; V347-A351 PolarHBondContact O-N 3.31Å; F349-A351 VanDerWaalsContact C-N 3.31Å; F349-A351 PolarHBondContact O-N 2.91Å; A351-F355 WeakPolarHBondContact O-CD2 3.13Å; A351-F355 VanDerWaalsContact O-CE2 3.28Å; A351-F355 WeakPolarHBondContact O-CE2 3.39Å
352	T	82.9	Confident	83.4	Confident	65 Å²	65	60.7 Å²	60.7	40%	0.399	32%	0.32	S	S	.	.	H	α-helix	trans	-81.8	-36.1	-175.1	63.8	0	0	0	0	114	L153 Y348 F349 F355 A356	L153-T352 HydrophobicContact CD2-CG2 4.47Å; Y348-T352 WeakPolarHBondContact O-CB 3.29Å; Y348-T352 WeakPolarHBondContact O-CG2 3.24Å; Y348-T352 PolarHBondContact O-OG1 3.39Å; F349-T352 PolarHBondContact O-N 3.23Å; T352-F355 WeakPolarHBondContact O-CB 3.37Å; T352-F355 PolarHBondContact O-N 3.09Å; T352-F355 VanDerWaalsContact O-N 3.08Å; T352-A356 PolarHBondContact O-N 2.88Å; T352-A356 VanDerWaalsContact O-N 3.11Å
353	F	85.8	Confident	83.7	Confident	97 Å²	97	63.4 Å²	63.4	43%	0.425	34%	0.336	S	S	.	.	H	α-helix	trans	-59.7	-41.8	-177.9	177.2	-101.1	0	0	0	113.3	F349 F355 A356 M357	F349-F353 HydrophobicContact CD2-CB 4.36Å; F349-F353 HydrophobicContact CE1-CB 4.28Å; F349-F353 HydrophobicContact CE1-CG 4.31Å; F349-F353 HydrophobicContact CE2-CB 4.04Å; F349-F353 HydrophobicContact CE2-CD2 4.03Å; F349-F353 HydrophobicContact CE2-CG 4.17Å; F349-F353 HydrophobicContact CZ-CB 4Å; F349-F353 HydrophobicContact CZ-CD1 4.36Å; F349-F353 AromaticContact CZ-CD2 3.88Å; F349-F353 HydrophobicContact CZ-CD2 3.88Å; F349-F353 HydrophobicContact CZ-CE2 4.46Å; F349-F353 AromaticContact CZ-CG 3.82Å; F349-F353 HydrophobicContact CZ-CG 3.82Å; F349-F353 WeakPolarHBondContact O-CB 3.23Å; F349-F353 PolarHBondContact O-N 3.17Å; F353-F355 VanDerWaalsContact C-N 3.31Å; F353-F355 PolarHBondContact O-N 2.89Å; F353-A356 PolarHBondContact O-N 3.11Å; F353-M357 HydrophobicContact CD1-CG 4.05Å; F353-M357 HydrophobicContact CD2-CG 4.23Å; F353-M357 HydrophobicContact CE1-CG 3.55Å; F353-M357 HydrophobicContact CE1-SD 4.37Å; F353-M357 HydrophobicContact CE2-CG 3.75Å; F353-M357 HydrophobicContact CE2-SD 3.96Å; F353-M357 HydrophobicContact CG-CG 4.37Å; F353-M357 HydrophobicContact CZ-CG 3.38Å; F353-M357 HydrophobicContact CZ-SD 3.66Å; F353-M357 WeakPolarHBondContact O-CB 3.27Å; F353-M357 WeakPolarHBondContact O-CG 3.34Å; F353-M357 PolarHBondContact O-N 2.88Å
354	P	82.4	Confident	83.8	Confident	42 Å²	42	68.2 Å²	68.2	27%	0.273	35%	0.349	S	S	.	.	H	α-helix	trans	-57.3	-38.5	171.9	-27.7	36.5	0	0	0	113.9	T350 M357 L358	T350-P354 WeakPolarHBondContact O-CD 3.31Å; T350-P354 VanDerWaalsContact O-CG 3.26Å; T350-P354 WeakPolarHBondContact O-CG 3.45Å; P354-M357 PolarHBondContact O-N 2.99Å; P354-L358 VanDerWaalsContact O-CB 3.25Å; P354-L358 WeakPolarHBondContact O-CB 3.18Å; P354-L358 WeakPolarHBondContact O-CG 3.39Å; P354-L358 PolarHBondContact O-N 3.28Å
355	F	79.8	Confident	84.1	Confident	43 Å²	43	68.5 Å²	68.5	19%	0.189	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-44.7	175	-68.1	-71.2	0	0	0	111.8	V160 A351 T352 F353 M357 L358 L359 V447 F450 F451	V160-F355 HydrophobicContact CG1-CZ 4.45Å; V160-F355 HydrophobicContact CG2-CE2 4.41Å; V160-F355 HydrophobicContact CG2-CZ 3.76Å; A351-F355 WeakPolarHBondContact O-CD2 3.13Å; A351-F355 VanDerWaalsContact O-CE2 3.28Å; A351-F355 WeakPolarHBondContact O-CE2 3.39Å; T352-F355 WeakPolarHBondContact O-CB 3.37Å; T352-F355 PolarHBondContact O-N 3.09Å; T352-F355 VanDerWaalsContact O-N 3.08Å; F353-F355 VanDerWaalsContact C-N 3.31Å; F353-F355 PolarHBondContact O-N 2.89Å; F355-M357 PolarHBondContact O-N 3.29Å; F355-L358 PolarHBondContact O-N 2.88Å; F355-L359 WeakPolarHBondContact O-CB 3.25Å; F355-L359 PolarHBondContact O-N 2.9Å; F355-V447 HydrophobicContact CE1-CB 4.2Å; F355-V447 HydrophobicContact CE1-CG1 3.8Å; F355-V447 HydrophobicContact CE1-CG2 3.8Å; F355-V447 HydrophobicContact CE2-CG2 4.32Å; F355-V447 HydrophobicContact CZ-CB 4.1Å; F355-V447 HydrophobicContact CZ-CG1 3.63Å; F355-V447 HydrophobicContact CZ-CG2 3.41Å; F355-V447 VanDerWaalsContact CZ-CG2 3.41Å; F355-F450 HydrophobicContact CB-CE1 4.44Å; F355-F450 HydrophobicContact CB-CZ 4.43Å; F355-F450 AromaticContact CD1-CD1 3.41Å; F355-F450 HydrophobicContact CD1-CD1 3.41Å; F355-F450 VanDerWaalsContact CD1-CD1 3.41Å; F355-F450 AromaticContact CD1-CE1 3.58Å; F355-F450 HydrophobicContact CD1-CE1 3.58Å; F355-F450 AromaticContact CD1-CG 3.93Å; F355-F450 HydrophobicContact CD1-CG 3.93Å; F355-F450 HydrophobicContact CD1-CZ 4.23Å; F355-F450 AromaticContact CE1-CD1 3.8Å; F355-F450 HydrophobicContact CE1-CD1 3.8Å; F355-F450 HydrophobicContact CE1-CE1 4.33Å; F355-F450 HydrophobicContact CE1-CG 4.33Å; F355-F450 HydrophobicContact CG-CE1 4.47Å; F355-F450 WeakPolarHBondContact O-CZ 3.38Å; F355-F451 HydrophobicContact CE1-CD2 4.43Å; F355-F451 AromaticContact CE1-CE2 3.8Å; F355-F451 HydrophobicContact CE1-CE2 3.8Å; F355-F451 HydrophobicContact CZ-CE2 4.21Å
356	A	85.1	Confident	84.1	Confident	53 Å²	53	65 Å²	65	44%	0.438	34%	0.341	S	S	.	.	H	α-helix	trans	-60.7	-45.7	175.9	0	0	0	0	0	111.7	T352 F353 L359 V360	T352-A356 PolarHBondContact O-N 2.88Å; T352-A356 VanDerWaalsContact O-N 3.11Å; F353-A356 PolarHBondContact O-N 3.11Å; A356-L359 PolarHBondContact O-N 2.75Å; A356-V360 WeakPolarHBondContact O-CG2 3.19Å; A356-V360 PolarHBondContact O-N 2.86Å
357	M	84.3	Confident	84.1	Confident	85 Å²	85	67 Å²	67	42%	0.419	35%	0.353	S	S	.	.	H	α-helix	trans	-63.5	-45.4	177.9	-75	-61	-62.2	0	0	112.7	F353 P354 F355 L359 V360 L361	F353-M357 HydrophobicContact CD1-CG 4.05Å; F353-M357 HydrophobicContact CD2-CG 4.23Å; F353-M357 HydrophobicContact CE1-CG 3.55Å; F353-M357 HydrophobicContact CE1-SD 4.37Å; F353-M357 HydrophobicContact CE2-CG 3.75Å; F353-M357 HydrophobicContact CE2-SD 3.96Å; F353-M357 HydrophobicContact CG-CG 4.37Å; F353-M357 HydrophobicContact CZ-CG 3.38Å; F353-M357 HydrophobicContact CZ-SD 3.66Å; F353-M357 WeakPolarHBondContact O-CB 3.27Å; F353-M357 WeakPolarHBondContact O-CG 3.34Å; F353-M357 PolarHBondContact O-N 2.88Å; P354-M357 PolarHBondContact O-N 2.99Å; F355-M357 PolarHBondContact O-N 3.29Å; M357-L359 VanDerWaalsContact C-N 3.26Å; M357-L359 PolarHBondContact O-N 2.83Å; M357-V360 PolarHBondContact O-N 3.34Å; M357-L361 WeakPolarHBondContact O-CG 3.2Å; M357-L361 PolarHBondContact O-N 3.32Å
358	L	81.6	Confident	84.1	Confident	14 Å²	14	69.5 Å²	69.5	7%	0.073	37%	0.365	C	S	.	.	H	α-helix	trans	-66.6	-28.3	176.9	-72.9	170.1	0	0	0	112	P354 F355 L361 L362 F450 F451 A454	P354-L358 VanDerWaalsContact O-CB 3.25Å; P354-L358 WeakPolarHBondContact O-CB 3.18Å; P354-L358 WeakPolarHBondContact O-CG 3.39Å; P354-L358 PolarHBondContact O-N 3.28Å; F355-L358 PolarHBondContact O-N 2.88Å; L358-L361 HydrophobicContact CD2-CD1 4.47Å; L358-L362 VanDerWaalsContact O-CB 3.22Å; L358-L362 WeakPolarHBondContact O-CB 3.21Å; L358-L362 PolarHBondContact O-N 3.08Å; L358-F450 HydrophobicContact CB-CE1 3.41Å; L358-F450 VanDerWaalsContact CB-CE1 3.41Å; L358-F450 HydrophobicContact CB-CZ 3.55Å; L358-F450 HydrophobicContact CD1-CE1 3.87Å; L358-F450 HydrophobicContact CG-CE1 4.29Å; L358-F451 HydrophobicContact CD1-CD1 4.46Å; L358-F451 HydrophobicContact CD1-CE1 3.58Å; L358-F451 HydrophobicContact CD1-CZ 3.6Å; L358-A454 HydrophobicContact CB-CB 4.19Å; L358-A454 HydrophobicContact CD2-CB 4.2Å
359	L	82.9	Confident	84	Confident	89 Å²	89	71.5 Å²	71.5	47%	0.466	39%	0.389	S	S	.	.	H	α-helix	trans	-71.1	-41.5	173.5	-179.9	61.6	0	0	0	111.2	F355 A356 M357 L362 V363 F450	F355-L359 WeakPolarHBondContact O-CB 3.25Å; F355-L359 PolarHBondContact O-N 2.9Å; A356-L359 PolarHBondContact O-N 2.75Å; M357-L359 VanDerWaalsContact C-N 3.26Å; M357-L359 PolarHBondContact O-N 2.83Å; L359-L362 HydrophobicContact CD1-CD2 4.33Å; L359-L362 WeakPolarHBondContact O-CB 3.3Å; L359-L362 PolarHBondContact O-N 3.36Å; L359-V363 WeakPolarHBondContact O-CG2 3.25Å; L359-V363 PolarHBondContact O-N 3.1Å; L359-F450 HydrophobicContact CB-CE2 4.06Å; L359-F450 HydrophobicContact CB-CZ 4.17Å; L359-F450 HydrophobicContact CD1-CE2 4.47Å
360	V	87.2	Confident	83.7	Confident	95 Å²	95	67.4 Å²	67.4	58%	0.576	38%	0.384	S	S	*	.	H	α-helix	trans	-63.2	-43.5	173.3	172.2	0	0	0	0	110.7	A356 M357 L362 R364	A356-V360 WeakPolarHBondContact O-CG2 3.19Å; A356-V360 PolarHBondContact O-N 2.86Å; M357-V360 PolarHBondContact O-N 3.34Å; V360-L362 VanDerWaalsContact C-N 3.31Å; V360-L362 PolarHBondContact O-N 2.96Å; V360-R364 VanDerWaalsContact O-CB 3.31Å; V360-R364 WeakPolarHBondContact O-CB 3.41Å; V360-R364 PolarHBondContact O-N 3.28Å
361	L	84.1	Confident	83.3	Confident	74 Å²	74	64.1 Å²	64.1	39%	0.387	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-34.1	173.6	-69	174.4	0	0	0	112.2	M357 L358 R364 G365 W458	M357-L361 WeakPolarHBondContact O-CG 3.2Å; M357-L361 PolarHBondContact O-N 3.32Å; L358-L361 HydrophobicContact CD2-CD1 4.47Å; L361-R364 PolarHBondContact O-N 3.3Å; L361-G365 PolarHBondContact O-N 3.27Å; L361-W458 HydrophobicContact CD1-CZ2 4.07Å
362	L	82.5	Confident	83.2	Confident	22 Å²	22	66.7 Å²	66.7	12%	0.115	39%	0.391	C	S	.	.	H	α-helix	trans	-64.1	-53.8	174.2	173.2	59.8	0	0	0	111.9	L358 L359 V360 R364 G365 L366 Y453 A457	L358-L362 VanDerWaalsContact O-CB 3.22Å; L358-L362 WeakPolarHBondContact O-CB 3.21Å; L358-L362 PolarHBondContact O-N 3.08Å; L359-L362 HydrophobicContact CD1-CD2 4.33Å; L359-L362 WeakPolarHBondContact O-CB 3.3Å; L359-L362 PolarHBondContact O-N 3.36Å; V360-L362 VanDerWaalsContact C-N 3.31Å; V360-L362 PolarHBondContact O-N 2.96Å; L362-R364 VanDerWaalsContact C-N 3.27Å; L362-R364 PolarHBondContact O-N 3.07Å; L362-G365 PolarHBondContact O-N 3.18Å; L362-L366 HydrophobicContact CD1-CD1 3.75Å; L362-L366 HydrophobicContact CD1-CG 3.98Å; L362-L366 HydrophobicContact CG-CD1 4.16Å; L362-L366 WeakPolarHBondContact O-CB 3.48Å; L362-L366 VanDerWaalsContact O-CG 3.31Å; L362-L366 WeakPolarHBondContact O-CG 3.36Å; L362-L366 PolarHBondContact O-N 2.8Å; L362-Y453 WeakPolarHBondContact CD1-O 3.36Å; L362-A457 HydrophobicContact CB-CB 4.23Å; L362-A457 HydrophobicContact CD1-CB 3.81Å
363	V	85.4	Confident	83.2	Confident	85 Å²	85	67 Å²	67	52%	0.515	40%	0.399	S	S	.	.	H	α-helix	trans	-58	-43.9	175.5	174.7	0	0	0	0	110	L359 L366 T367	L359-V363 WeakPolarHBondContact O-CG2 3.25Å; L359-V363 PolarHBondContact O-N 3.1Å; V363-L366 PolarHBondContact O-N 3.43Å; V363-T367 VanDerWaalsContact O-CG2 3.31Å; V363-T367 WeakPolarHBondContact O-CG2 3.33Å; V363-T367 PolarHBondContact O-N 3.46Å; V363-T367 VanDerWaalsContact O-N 3.12Å
364	R	84.9	Confident	82.8	Confident	144 Å²	144	62.8 Å²	62.8	54%	0.543	38%	0.384	S	S	.	.	H	α-helix	trans	-63.3	-47.3	178.9	-175.6	55.9	-179.2	144.5	-5	112.4	V360 L361 L362 L366 T367 L368	V360-R364 VanDerWaalsContact O-CB 3.31Å; V360-R364 WeakPolarHBondContact O-CB 3.41Å; V360-R364 PolarHBondContact O-N 3.28Å; L361-R364 PolarHBondContact O-N 3.3Å; L362-R364 VanDerWaalsContact C-N 3.27Å; L362-R364 PolarHBondContact O-N 3.07Å; R364-L366 PolarHBondContact O-N 3.25Å; R364-T367 PolarHBondContact NH1-OG1 3.29Å; R364-T367 PolarHBondContact O-N 2.89Å; R364-T367 VanDerWaalsContact O-N 3.15Å; R364-T367 PolarHBondContact O-OG1 2.99Å; R364-L368 PolarHBondContact O-N 3.36Å
365	G	82.6	Confident	82.6	Confident	7 Å²	7	62.8 Å²	62.8	7%	0.072	38%	0.381	C	S	.	.	H	α-helix	trans	-58.5	-45.6	177.6	0	0	0	0	0	112.1	L361 L362 T367 L368 A371	L361-G365 PolarHBondContact O-N 3.27Å; L362-G365 PolarHBondContact O-N 3.18Å; G365-T367 VanDerWaalsContact C-N 3.26Å; G365-T367 PolarHBondContact O-N 3.13Å; G365-L368 PolarHBondContact O-N 2.98Å; G365-L368 VanDerWaalsContact O-N 3.11Å; G365-A371 WeakPolarHBondContact O-CB 3.49Å
366	L	83.7	Confident	82.7	Confident	94 Å²	94	67.7 Å²	67.7	49%	0.492	40%	0.402	S	S	.	.	H	α-helix	trans	-65.1	-25.6	177.1	-67	176.3	0	0	0	113.8	L362 V363 R364 L368 I375	L362-L366 HydrophobicContact CD1-CD1 3.75Å; L362-L366 HydrophobicContact CD1-CG 3.98Å; L362-L366 HydrophobicContact CG-CD1 4.16Å; L362-L366 WeakPolarHBondContact O-CB 3.48Å; L362-L366 VanDerWaalsContact O-CG 3.31Å; L362-L366 WeakPolarHBondContact O-CG 3.36Å; L362-L366 PolarHBondContact O-N 2.8Å; V363-L366 PolarHBondContact O-N 3.43Å; R364-L366 PolarHBondContact O-N 3.25Å; L366-L368 VanDerWaalsContact C-N 3.34Å; L366-I375 HydrophobicContact CD2-CD1 3.63Å
367	T	86.1	Confident	82.4	Confident	87 Å²	87	70 Å²	70	53%	0.534	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.2	174.4	63.2	0	0	0	0	114.6	V363 R364 G365	V363-T367 VanDerWaalsContact O-CG2 3.31Å; V363-T367 WeakPolarHBondContact O-CG2 3.33Å; V363-T367 PolarHBondContact O-N 3.46Å; V363-T367 VanDerWaalsContact O-N 3.12Å; R364-T367 PolarHBondContact NH1-OG1 3.29Å; R364-T367 PolarHBondContact O-N 2.89Å; R364-T367 VanDerWaalsContact O-N 3.15Å; R364-T367 PolarHBondContact O-OG1 2.99Å; G365-T367 VanDerWaalsContact C-N 3.26Å; G365-T367 PolarHBondContact O-N 3.13Å
368	L	84.9	Confident	82.1	Confident	70 Å²	70	66.1 Å²	66.1	37%	0.366	38%	0.383	S	S	.	.	S	Bend	trans	-83.5	141	-178.1	-73.2	169.6	0	0	0	112.1	R364 G365 L366 G370 A371	R364-L368 PolarHBondContact O-N 3.36Å; G365-L368 PolarHBondContact O-N 2.98Å; G365-L368 VanDerWaalsContact O-N 3.11Å; L366-L368 VanDerWaalsContact C-N 3.34Å; L368-G370 PolarHBondContact O-N 3.46Å; L368-A371 WeakPolarHBondContact O-CB 3.2Å; L368-A371 PolarHBondContact O-N 3.37Å
369	P	83.7	Confident	82	Confident	127 Å²	127	67.8 Å²	67.8	83%	0.825	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	117.8	177	29.2	-33.8	0	0	0	110
370	G	80.8	Confident	82.1	Confident	45 Å²	45	71.3 Å²	71.3	46%	0.464	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	117.9	-17.5	-175.5	0	0	0	0	0	114.2	L368 G372 A373 G374	L368-G370 PolarHBondContact O-N 3.46Å; G370-G372 VanDerWaalsContact C-N 3.27Å; G370-G372 PolarHBondContact O-N 2.98Å; G370-G372 VanDerWaalsContact O-N 3.08Å; G370-A373 WeakPolarHBondContact O-CA 3.37Å; G370-A373 WeakPolarHBondContact O-CB 3.48Å; G370-A373 PolarHBondContact O-N 3.39Å; G370-G374 PolarHBondContact O-N 2.84Å
371	A	78.3	Confident	82.1	Confident	7 Å²	7	70 Å²	70	6%	0.058	39%	0.394	C	S	.	.	H	α-helix	trans	-51.6	-40.9	-174.1	0	0	0	0	0	114.3	G365 L368 A373 G374 I375	G365-A371 WeakPolarHBondContact O-CB 3.49Å; L368-A371 WeakPolarHBondContact O-CB 3.2Å; L368-A371 PolarHBondContact O-N 3.37Å; A371-A373 VanDerWaalsContact C-N 3.3Å; A371-A373 PolarHBondContact O-N 3.34Å; A371-G374 PolarHBondContact O-N 3.03Å; A371-I375 WeakPolarHBondContact O-CB 3.39Å; A371-I375 VanDerWaalsContact O-CG1 3.32Å; A371-I375 WeakPolarHBondContact O-CG1 3.49Å; A371-I375 PolarHBondContact O-N 3.24Å
372	G	78.8	Confident	82.3	Confident	56 Å²	56	69.1 Å²	69.1	58%	0.577	39%	0.389	S	S	*	.	H	α-helix	trans	-63.3	-30.8	177	0	0	0	0	0	114.5	G370 K376	G370-G372 VanDerWaalsContact C-N 3.27Å; G370-G372 PolarHBondContact O-N 2.98Å; G370-G372 VanDerWaalsContact O-N 3.08Å; G372-K376 VanDerWaalsContact O-CB 3.24Å; G372-K376 WeakPolarHBondContact O-CB 3.31Å; G372-K376 PolarHBondContact O-N 3.17Å
373	A	81.6	Confident	82.7	Confident	70 Å²	70	73.7 Å²	73.7	58%	0.579	41%	0.413	S	S	*	.	H	α-helix	trans	-73.9	-41.6	174.4	0	0	0	0	0	111.2	G370 A371 K376 F377	G370-A373 WeakPolarHBondContact O-CA 3.37Å; G370-A373 WeakPolarHBondContact O-CB 3.48Å; G370-A373 PolarHBondContact O-N 3.39Å; A371-A373 VanDerWaalsContact C-N 3.3Å; A371-A373 PolarHBondContact O-N 3.34Å; A373-K376 PolarHBondContact O-N 3.41Å; A373-F377 VanDerWaalsContact O-CB 3.27Å; A373-F377 WeakPolarHBondContact O-CB 3.27Å; A373-F377 PolarHBondContact O-N 3.28Å
374	G	77.6	Confident	83	Confident	9 Å²	9	73.4 Å²	73.4	9%	0.093	41%	0.411	C	S	.	.	H	α-helix	trans	-59.8	-47.9	173.7	0	0	0	0	0	113.4	G370 A371 F377 Y378 T459	G370-G374 PolarHBondContact O-N 2.84Å; A371-G374 PolarHBondContact O-N 3.03Å; G374-F377 PolarHBondContact O-N 3.41Å; G374-Y378 WeakPolarHBondContact O-CB 3.32Å; G374-Y378 PolarHBondContact O-N 3.48Å; G374-T459 WeakPolarHBondContact CA-O 3.48Å
375	I	79.6	Confident	83.2	Confident	42 Å²	42	72.1 Å²	72.1	22%	0.215	41%	0.406	C	S	.	.	H	α-helix	trans	-59.9	-48.1	174.1	-71.6	169.8	0	0	0	111.1	L366 A371 F377 Y378 L379 L456	L366-I375 HydrophobicContact CD2-CD1 3.63Å; A371-I375 WeakPolarHBondContact O-CB 3.39Å; A371-I375 VanDerWaalsContact O-CG1 3.32Å; A371-I375 WeakPolarHBondContact O-CG1 3.49Å; A371-I375 PolarHBondContact O-N 3.24Å; I375-F377 VanDerWaalsContact C-N 3.34Å; I375-F377 PolarHBondContact O-N 3.22Å; I375-Y378 PolarHBondContact O-N 3.4Å; I375-L379 HydrophobicContact CG2-CD1 4.09Å; I375-L379 WeakPolarHBondContact O-CB 3.27Å; I375-L379 PolarHBondContact O-N 3.41Å; I375-L456 HydrophobicContact CG1-CB 4.17Å; I375-L456 HydrophobicContact CG1-CD2 4.46Å; I375-L456 HydrophobicContact CG2-CD2 4.31Å
376	K	81.5	Confident	83.6	Confident	147 Å²	147	73.3 Å²	73.3	64%	0.639	41%	0.411	S	S	*	.	H	α-helix	trans	-61	-43.4	178.1	-177.1	176.9	179.2	179.8	0	111.4	G372 A373 Y380	G372-K376 VanDerWaalsContact O-CB 3.24Å; G372-K376 WeakPolarHBondContact O-CB 3.31Å; G372-K376 PolarHBondContact O-N 3.17Å; A373-K376 PolarHBondContact O-N 3.41Å; K376-Y380 VanDerWaalsContact O-CB 3.32Å; K376-Y380 WeakPolarHBondContact O-CB 3.27Å; K376-Y380 PolarHBondContact O-N 2.71Å
377	F	79.1	Confident	84.1	Confident	102 Å²	102	77 Å²	77	45%	0.447	43%	0.426	S	S	.	.	H	α-helix	trans	-66.1	-37.3	179.5	-175.7	-111.6	0	0	0	112.5	F26 Y173 A373 G374 I375	F26-F377 HydrophobicContact CE2-CD1 4.21Å; F26-F377 HydrophobicContact CE2-CE1 4.1Å; Y173-F377 HydrophobicContact CD2-CE1 4.12Å; Y173-F377 HydrophobicContact CE2-CD1 4.29Å; Y173-F377 AromaticContact CE2-CE1 3.37Å; Y173-F377 HydrophobicContact CE2-CE1 3.37Å; Y173-F377 AromaticContact CE2-CZ 3.71Å; Y173-F377 HydrophobicContact CE2-CZ 3.71Å; A373-F377 VanDerWaalsContact O-CB 3.27Å; A373-F377 WeakPolarHBondContact O-CB 3.27Å; A373-F377 PolarHBondContact O-N 3.28Å; G374-F377 PolarHBondContact O-N 3.41Å; I375-F377 VanDerWaalsContact C-N 3.34Å; I375-F377 PolarHBondContact O-N 3.22Å
378	Y	77.9	Confident	84.4	Confident	3 Å²	3	76.4 Å²	76.4	1%	0.012	42%	0.419	C	S	.	.	H	α-helix	trans	-72.5	-40.6	176.6	179.7	-103.3	0	0	0	113.5	P169 C172 G177 G178 G374 I375 S455 L456 T459	P169-Y378 WeakPolarHBondContact CA-OH 3.06Å; P169-Y378 HydrophobicContact CB-CE2 3.82Å; C172-Y378 HydrophobicContact CB-CE2 3.74Å; G177-Y378 CarbonylContact C-O 3.17Å; G177-Y378 WeakPolarHBondContact CA-O 3.34Å; G178-Y378 PolarHBondContact N-O 3.45Å; G374-Y378 WeakPolarHBondContact O-CB 3.32Å; G374-Y378 PolarHBondContact O-N 3.48Å; I375-Y378 PolarHBondContact O-N 3.4Å; Y378-S455 PolarHBondContact OH-OG 2.99Å; Y378-S455 VanDerWaalsContact OH-OG 3.06Å; Y378-L456 HydrophobicContact CD1-CD2 3.47Å; Y378-L456 VanDerWaalsContact CD1-CD2 3.47Å; Y378-L456 HydrophobicContact CE1-CD2 3.83Å; Y378-T459 HydrophobicContact CD2-CG2 3.79Å; Y378-T459 HydrophobicContact CE2-CG2 4.42Å; Y378-T459 HydrophobicContact CG-CG2 3.99Å
379	L	79.8	Confident	84.8	Confident	48 Å²	48	77.2 Å²	77.2	25%	0.251	43%	0.428	S	S	.	.	H	α-helix	trans	-89.5	-10.1	-176.9	-68.6	-177.8	0	0	0	114.7	G178 L181 I375 P381 Y452 L456	G178-L379 WeakPolarHBondContact CA-O 3.48Å; L181-L379 HydrophobicContact CD1-CD2 4.48Å; I375-L379 HydrophobicContact CG2-CD1 4.09Å; I375-L379 WeakPolarHBondContact O-CB 3.27Å; I375-L379 PolarHBondContact O-N 3.41Å; L379-P381 VanDerWaalsContact O-CD 3.27Å; L379-P381 WeakPolarHBondContact O-CD 3.2Å; L379-P381 VanDerWaalsContact O-N 3.14Å; L379-Y452 HydrophobicContact CD2-CE2 3.92Å; L379-Y452 WeakPolarHBondContact CD2-OH 3.29Å; L379-L456 HydrophobicContact CD1-CD1 4.37Å; L379-L456 HydrophobicContact CD1-CD2 3.72Å; L379-L456 HydrophobicContact CD2-CD2 3.91Å; L379-L456 HydrophobicContact CG-CD2 3.66Å
380	Y	83.8	Confident	85.3	Confident	164 Å²	164	75.2 Å²	75.2	64%	0.643	41%	0.408	S	S	*	.			trans	-60.2	117.6	178.9	-162.7	-94.6	0	0	0	110.2	K376 D382	K376-Y380 VanDerWaalsContact O-CB 3.32Å; K376-Y380 WeakPolarHBondContact O-CB 3.27Å; K376-Y380 PolarHBondContact O-N 2.71Å; Y380-D382 PolarHBondContact O-N 2.7Å
381	P	86.9	Confident	85.9	Confident	67 Å²	67	73.1 Å²	73.1	44%	0.435	39%	0.387	S	S	.	.			trans	-84.2	109.1	-172.2	31.4	-32.1	0	0	0	110.9	A179 L379 I383	A179-P381 HydrophobicContact CB-CB 4.18Å; L379-P381 VanDerWaalsContact O-CD 3.27Å; L379-P381 WeakPolarHBondContact O-CD 3.2Å; L379-P381 VanDerWaalsContact O-N 3.14Å; P381-I383 PolarHBondContact O-N 3.15Å
382	D	88.8	Confident	86.7	Confident	56 Å²	56	77 Å²	77	30%	0.299	40%	0.4	S	S	.	.			trans	-85.3	88.5	166	-177.7	5.9	0	0	0	109.6	G176 A179 Y380 T384 R385	G176-D382 PolarHBondContact O-N 3.5Å; A179-D382 WeakPolarHBondContact CB-O 3.09Å; Y380-D382 PolarHBondContact O-N 2.7Å; D382-T384 VanDerWaalsContact CG-OG1 3.28Å; D382-T384 PolarHBondContact O-N 3.04Å; D382-T384 VanDerWaalsContact O-N 3.16Å; D382-T384 WeakPolarHBondContact OD1-CB 3.44Å; D382-T384 WeakPolarHBondContact OD1-CG2 3.44Å; D382-T384 PolarHBondContact OD1-N 2.86Å; D382-T384 VanDerWaalsContact OD1-N 3.1Å; D382-T384 PolarHBondContact OD1-OG1 3.38Å; D382-T384 PolarHBondContact OD2-OG1 3.03Å; D382-R385 HydrophobicContact CB-CG 4.17Å; D382-R385 WeakPolarHBondContact O-CB 3.23Å; D382-R385 PolarHBondContact O-N 2.85Å; D382-R385 VanDerWaalsContact O-N 3.1Å; D382-R385 IonicContact OD2-CZ 3.76Å; D382-R385 IonicContact OD2-NE 3.43Å; D382-R385 PolarHBondContact OD2-NE 3.14Å; D382-R385 IonicContact OD2-NH2 3.77Å
383	I	90.4	Very high	87.4	Confident	118 Å²	118	78.6 Å²	78.6	61%	0.605	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-58.6	-27	-179.4	-58.5	177.7	0	0	0	111.5	P381 R385 L386	P381-I383 PolarHBondContact O-N 3.15Å; I383-R385 PolarHBondContact O-N 3.28Å; I383-R385 VanDerWaalsContact O-N 3.14Å; I383-L386 HydrophobicContact CG2-CD1 4.3Å; I383-L386 WeakPolarHBondContact O-CB 3.16Å; I383-L386 PolarHBondContact O-N 2.87Å
384	T	91.8	Very high	87.9	Confident	79 Å²	79	76.3 Å²	76.3	49%	0.485	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-62.5	-23.4	179	74.8	0	0	0	0	112.7	D382 L386	D382-T384 VanDerWaalsContact CG-OG1 3.28Å; D382-T384 PolarHBondContact O-N 3.04Å; D382-T384 VanDerWaalsContact O-N 3.16Å; D382-T384 WeakPolarHBondContact OD1-CB 3.44Å; D382-T384 WeakPolarHBondContact OD1-CG2 3.44Å; D382-T384 PolarHBondContact OD1-N 2.86Å; D382-T384 VanDerWaalsContact OD1-N 3.1Å; D382-T384 PolarHBondContact OD1-OG1 3.38Å; D382-T384 PolarHBondContact OD2-OG1 3.03Å; T384-L386 VanDerWaalsContact C-N 3.28Å; T384-L386 PolarHBondContact O-N 2.98Å
385	R	89.8	Confident	88.5	Confident	116 Å²	116	75.9 Å²	75.9	44%	0.438	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-68.3	-24.8	174.8	-65.7	-57.6	103.3	141.1	10.4	113.1	D382 I383 E387 D388 V391	D382-R385 HydrophobicContact CB-CG 4.17Å; D382-R385 WeakPolarHBondContact O-CB 3.23Å; D382-R385 PolarHBondContact O-N 2.85Å; D382-R385 VanDerWaalsContact O-N 3.1Å; D382-R385 IonicContact OD2-CZ 3.76Å; D382-R385 IonicContact OD2-NE 3.43Å; D382-R385 PolarHBondContact OD2-NE 3.14Å; D382-R385 IonicContact OD2-NH2 3.77Å; I383-R385 PolarHBondContact O-N 3.28Å; I383-R385 VanDerWaalsContact O-N 3.14Å; R385-E387 PolarHBondContact O-N 3.14Å; R385-D388 WeakPolarHBondContact O-CB 3.48Å; R385-D388 PolarHBondContact O-N 3.28Å; R385-V391 HydrophobicContact CB-CG2 4.18Å; R385-V391 WeakPolarHBondContact O-CG2 3.44Å
386	L	91.5	Very high	89.1	Confident	33 Å²	33	74.3 Å²	74.3	17%	0.173	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-68	-17.9	-178.1	-63.4	-179.7	0	0	0	113.6	A179 I182 P183 I383 T384 D388 V391 W392	A179-L386 HydrophobicContact CB-CD2 4.34Å; A179-L386 HydrophobicContact CB-CG 4.28Å; I182-L386 HydrophobicContact CD1-CD1 4.03Å; P183-L386 HydrophobicContact CG-CD2 3.98Å; I383-L386 HydrophobicContact CG2-CD1 4.3Å; I383-L386 WeakPolarHBondContact O-CB 3.16Å; I383-L386 PolarHBondContact O-N 2.87Å; T384-L386 VanDerWaalsContact C-N 3.28Å; T384-L386 PolarHBondContact O-N 2.98Å; L386-D388 VanDerWaalsContact C-N 3.3Å; L386-V391 HydrophobicContact CD2-CG1 4.19Å; L386-W392 PolarHBondContact O-NE1 2.94Å
387	E	93.2	Very high	89.5	Confident	171 Å²	171	70.2 Å²	70.2	80%	0.799	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-72.6	-22.1	173	-61.9	-178.2	-178.2	0	0	112.6	R385 P389	R385-E387 PolarHBondContact O-N 3.14Å; E387-P389 WeakPolarHBondContact O-CD 3.38Å
388	D	93.3	Very high	89.9	Confident	74 Å²	74	65.4 Å²	65.4	40%	0.396	33%	0.328	S	S	.	.	S	Bend	trans	-81.1	118.2	179.3	-176.3	-9.6	0	0	0	110.8	R385 L386 Q390 V391	R385-D388 WeakPolarHBondContact O-CB 3.48Å; R385-D388 PolarHBondContact O-N 3.28Å; L386-D388 VanDerWaalsContact C-N 3.3Å; D388-Q390 PolarHBondContact O-N 2.85Å; D388-Q390 VanDerWaalsContact O-N 3.08Å; D388-Q390 VanDerWaalsContact OD1-CB 3.31Å; D388-Q390 WeakPolarHBondContact OD1-CB 3.2Å; D388-Q390 WeakPolarHBondContact OD1-CG 3.33Å; D388-Q390 PolarHBondContact OD1-N 3.08Å; D388-V391 HydrophobicContact CB-CG2 4.23Å; D388-V391 WeakPolarHBondContact O-CB 3.18Å; D388-V391 PolarHBondContact O-N 3.13Å
389	P	93.8	Very high	90.3	Very high	87 Å²	87	65.3 Å²	65.3	57%	0.565	33%	0.328	S	S	*	.	H	α-helix	trans	-57.6	-23.7	176.6	-24.7	35.5	0	0	0	114.2	E387 V391 W392 I393	E387-P389 WeakPolarHBondContact O-CD 3.38Å; P389-V391 PolarHBondContact O-N 2.84Å; P389-W392 PolarHBondContact O-N 3.46Å; P389-I393 WeakPolarHBondContact O-CG1 3.35Å; P389-I393 PolarHBondContact O-N 3.15Å
390	Q	93	Very high	90.7	Very high	86 Å²	86	66.9 Å²	66.9	40%	0.402	33%	0.333	S	S	.	.	H	α-helix	trans	-61.7	-32.7	175.8	-65.5	-61.3	-64.1	0	0	112.4	D388 W392 I393 D394	D388-Q390 PolarHBondContact O-N 2.85Å; D388-Q390 VanDerWaalsContact O-N 3.08Å; D388-Q390 VanDerWaalsContact OD1-CB 3.31Å; D388-Q390 WeakPolarHBondContact OD1-CB 3.2Å; D388-Q390 WeakPolarHBondContact OD1-CG 3.33Å; D388-Q390 PolarHBondContact OD1-N 3.08Å; Q390-W392 VanDerWaalsContact C-N 3.33Å; Q390-W392 PolarHBondContact O-N 3.1Å; Q390-I393 PolarHBondContact O-N 2.93Å; Q390-D394 WeakPolarHBondContact O-CB 3.04Å; Q390-D394 PolarHBondContact O-N 2.98Å
391	V	93.7	Very high	90.6	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-41	177.4	172.9	0	0	0	0	110.9	N175 F180 P183 R385 L386 D388 P389 A395	N175-V391 HydrophobicContact CB-CB 4.44Å; N175-V391 HydrophobicContact CB-CG1 4.19Å; N175-V391 HydrophobicContact CB-CG2 3.89Å; F180-V391 HydrophobicContact CD2-CG1 4.08Å; P183-V391 HydrophobicContact CG-CG1 4.03Å; R385-V391 HydrophobicContact CB-CG2 4.18Å; R385-V391 WeakPolarHBondContact O-CG2 3.44Å; L386-V391 HydrophobicContact CD2-CG1 4.19Å; D388-V391 HydrophobicContact CB-CG2 4.23Å; D388-V391 WeakPolarHBondContact O-CB 3.18Å; D388-V391 PolarHBondContact O-N 3.13Å; P389-V391 PolarHBondContact O-N 2.84Å; V391-A395 VanDerWaalsContact O-CB 3.27Å; V391-A395 WeakPolarHBondContact O-CB 3.4Å; V391-A395 PolarHBondContact O-N 3.23Å
392	W	95	Very high	90.4	Very high	89 Å²	89	59.4 Å²	59.4	34%	0.337	30%	0.297	S	S	.	.	H	α-helix	trans	-70.1	-40.6	176.1	-63.7	82.8	0	0	0	111.9	P183 I186 F187 L386 P389 Q390 A395 G396	P183-W392 HydrophobicContact CB-CD2 3.76Å; P183-W392 HydrophobicContact CB-CE3 3.54Å; P183-W392 HydrophobicContact CB-CG 4.4Å; P183-W392 HydrophobicContact CB-CH2 4.13Å; P183-W392 HydrophobicContact CB-CZ2 4.34Å; P183-W392 HydrophobicContact CB-CZ3 3.74Å; I186-W392 HydrophobicContact CD1-CH2 3.87Å; I186-W392 HydrophobicContact CD1-CZ3 3.96Å; I186-W392 HydrophobicContact CG2-CZ3 4.45Å; F187-W392 HydrophobicContact CE2-CB 4.21Å; F187-W392 AromaticContact CE2-CE3 3.92Å; F187-W392 HydrophobicContact CE2-CE3 3.92Å; F187-W392 WeakPolarHBondContact CE2-O 3.35Å; F187-W392 HydrophobicContact CZ-CE3 4.45Å; L386-W392 PolarHBondContact O-NE1 2.94Å; P389-W392 PolarHBondContact O-N 3.46Å; Q390-W392 VanDerWaalsContact C-N 3.33Å; Q390-W392 PolarHBondContact O-N 3.1Å; W392-A395 PolarHBondContact O-N 3.27Å; W392-G396 PolarHBondContact O-N 3.1Å
393	I	93.8	Very high	90	Very high	88 Å²	88	56.9 Å²	56.9	45%	0.451	28%	0.284	S	S	.	.	H	α-helix	trans	-64.4	-44.9	176.2	-67.1	164.9	0	0	0	111.1	P389 Q390 T397	P389-I393 WeakPolarHBondContact O-CG1 3.35Å; P389-I393 PolarHBondContact O-N 3.15Å; Q390-I393 PolarHBondContact O-N 2.93Å; I393-T397 WeakPolarHBondContact O-CB 3.41Å; I393-T397 PolarHBondContact O-N 3.07Å; I393-T397 PolarHBondContact O-OG1 3.24Å
394	D	92.1	Very high	89.6	Confident	23 Å²	23	52.2 Å²	52.2	12%	0.123	26%	0.263	C	S	.	.	H	α-helix	trans	-64.4	-40.1	176.3	-86.4	-14.1	0	0	0	111.2	L171 K174 N175 F180 Q390 Q398	L171-D394 HydrophobicContact CD2-CB 4.21Å; K174-D394 IonicContact NZ-OD2 2.71Å; K174-D394 PolarHBondContact NZ-OD2 2.62Å; N175-D394 WeakPolarHBondContact ND2-CB 3.29Å; N175-D394 PolarHBondContact ND2-OD2 3.42Å; F180-D394 HydrophobicContact CE2-CB 4.11Å; Q390-D394 WeakPolarHBondContact O-CB 3.04Å; Q390-D394 PolarHBondContact O-N 2.98Å; D394-Q398 VanDerWaalsContact O-CB 3.3Å; D394-Q398 WeakPolarHBondContact O-CB 3.43Å; D394-Q398 PolarHBondContact O-N 3.14Å
395	A	90.7	Very high	89.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-50.8	176.8	0	0	0	0	0	112.2	F180 P183 F187 V391 W392 Q398 I399	F180-A395 HydrophobicContact CD2-CB 4.39Å; F180-A395 HydrophobicContact CE2-CB 3.71Å; F180-A395 HydrophobicContact CZ-CB 3.94Å; P183-A395 HydrophobicContact CB-CB 3.97Å; P183-A395 HydrophobicContact CG-CB 4.2Å; F187-A395 HydrophobicContact CD2-CB 4.08Å; V391-A395 VanDerWaalsContact O-CB 3.27Å; V391-A395 WeakPolarHBondContact O-CB 3.4Å; V391-A395 PolarHBondContact O-N 3.23Å; W392-A395 PolarHBondContact O-N 3.27Å; A395-Q398 PolarHBondContact O-N 3.43Å; A395-I399 PolarHBondContact O-N 2.61Å; A395-I399 VanDerWaalsContact O-N 3.09Å
396	G	91.4	Very high	89.1	Confident	9 Å²	9	46.5 Å²	46.5	9%	0.093	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-48.4	175.1	0	0	0	0	0	111.7	W392 Q398 I399 F400	W392-G396 PolarHBondContact O-N 3.1Å; G396-Q398 VanDerWaalsContact C-N 3.28Å; G396-Q398 PolarHBondContact O-N 3.1Å; G396-I399 PolarHBondContact O-N 3.16Å; G396-I399 VanDerWaalsContact O-N 3.09Å; G396-F400 WeakPolarHBondContact O-CD2 3.4Å; G396-F400 PolarHBondContact O-N 2.99Å
397	T	90.3	Very high	88.7	Confident	61 Å²	61	47 Å²	47	37%	0.374	25%	0.245	S	C	.	.	H	α-helix	trans	-59.8	-37.9	178.8	-57.7	0	0	0	0	111.9	I393 F401	I393-T397 WeakPolarHBondContact O-CB 3.41Å; I393-T397 PolarHBondContact O-N 3.07Å; I393-T397 PolarHBondContact O-OG1 3.24Å; T397-F401 WeakPolarHBondContact O-CB 3.33Å; T397-F401 PolarHBondContact O-N 3.38Å
398	Q	88.1	Confident	88.3	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-66.6	-40.2	175.8	-177.1	59.9	33.4	0	0	111.9	R167 F168 L171 Y184 D394 A395 G396 S402	R167-Q398 VanDerWaalsContact CD-OE1 3.26Å; F168-Q398 HydrophobicContact CD2-CG 4.16Å; L171-Q398 HydrophobicContact CD1-CB 3.89Å; L171-Q398 HydrophobicContact CD1-CG 4.21Å; Y184-Q398 HydrophobicContact CE2-CG 3.99Å; D394-Q398 VanDerWaalsContact O-CB 3.3Å; D394-Q398 WeakPolarHBondContact O-CB 3.43Å; D394-Q398 PolarHBondContact O-N 3.14Å; A395-Q398 PolarHBondContact O-N 3.43Å; G396-Q398 VanDerWaalsContact C-N 3.28Å; G396-Q398 PolarHBondContact O-N 3.1Å; Q398-S402 PolarHBondContact NE2-OG 3.23Å; Q398-S402 VanDerWaalsContact O-CB 3.27Å; Q398-S402 WeakPolarHBondContact O-CB 3.2Å; Q398-S402 PolarHBondContact O-N 3.43Å; Q398-S402 PolarHBondContact O-OG 3.07Å
399	I	86.2	Confident	87.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-52.5	175	-68.3	-66.4	0	0	0	110.7	Y184 F187 L188 A395 G396 F401 S402 Y403	Y184-I399 HydrophobicContact CD1-CD1 4.4Å; Y184-I399 HydrophobicContact CD2-CD1 3.75Å; Y184-I399 HydrophobicContact CD2-CG1 4.01Å; Y184-I399 HydrophobicContact CE1-CD1 4.03Å; Y184-I399 HydrophobicContact CE2-CD1 3.32Å; Y184-I399 HydrophobicContact CE2-CG1 3.92Å; Y184-I399 HydrophobicContact CG-CD1 4.27Å; Y184-I399 VanDerWaalsContact CZ-CD1 3.48Å; F187-I399 HydrophobicContact CB-CG1 4.04Å; L188-I399 HydrophobicContact CB-CD1 3.76Å; L188-I399 HydrophobicContact CD1-CD1 4.09Å; L188-I399 HydrophobicContact CG-CD1 4.47Å; A395-I399 PolarHBondContact O-N 2.61Å; A395-I399 VanDerWaalsContact O-N 3.09Å; G396-I399 PolarHBondContact O-N 3.16Å; G396-I399 VanDerWaalsContact O-N 3.09Å; I399-F401 VanDerWaalsContact C-N 3.29Å; I399-F401 PolarHBondContact O-N 3.28Å; I399-S402 PolarHBondContact O-N 3.04Å; I399-Y403 HydrophobicContact CD1-CE2 4.49Å; I399-Y403 HydrophobicContact CG2-CD2 4.3Å; I399-Y403 WeakPolarHBondContact O-CD2 3.47Å; I399-Y403 PolarHBondContact O-N 3.13Å
400	F	86.4	Confident	87.6	Confident	82 Å²	82	33.8 Å²	33.8	36%	0.36	18%	0.184	S	C	.	.	H	α-helix	trans	-59	-40.6	179.6	-84.1	-103.1	0	0	0	112.4	G396 A404 I405	G396-F400 WeakPolarHBondContact O-CD2 3.4Å; G396-F400 PolarHBondContact O-N 2.99Å; F400-A404 PolarHBondContact O-N 3.18Å; F400-I405 HydrophobicContact CD1-CD1 4.11Å; F400-I405 HydrophobicContact CD1-CG1 4.21Å; F400-I405 HydrophobicContact CE1-CD1 4.38Å; F400-I405 HydrophobicContact CG-CD1 4.24Å; F400-I405 HydrophobicContact CG-CG1 4.49Å
401	F	83.3	Confident	87.3	Confident	70 Å²	70	30.2 Å²	30.2	31%	0.307	17%	0.168	S	C	.	.	H	α-helix	trans	-72.5	-37.9	177.9	-171.1	-94.9	0	0	0	113.5	R167 Y239 T397 I399	R167-F401 VanDerWaalsContact NH1-CD1 3.33Å; Y239-F401 VanDerWaalsContact OH-CZ 3.31Å; Y239-F401 WeakPolarHBondContact OH-CZ 3.43Å; T397-F401 WeakPolarHBondContact O-CB 3.33Å; T397-F401 PolarHBondContact O-N 3.38Å; I399-F401 VanDerWaalsContact C-N 3.29Å; I399-F401 PolarHBondContact O-N 3.28Å
402	S	82.3	Confident	87	Confident	4 Å²	4	32.1 Å²	32.1	3%	0.028	18%	0.181	C	C	.	.	H	α-helix	trans	-67.6	-42.3	179.4	-54.2	0	0	0	0	111.2	F159 N164 Q398 I399	F159-S402 WeakPolarHBondContact CA-O 3.43Å; F159-S402 VanDerWaalsContact CB-O 3.24Å; F159-S402 WeakPolarHBondContact CB-O 3.18Å; N164-S402 WeakPolarHBondContact OD1-CB 3.28Å; N164-S402 PolarHBondContact OD1-OG 3.08Å; Q398-S402 PolarHBondContact NE2-OG 3.23Å; Q398-S402 VanDerWaalsContact O-CB 3.27Å; Q398-S402 WeakPolarHBondContact O-CB 3.2Å; Q398-S402 PolarHBondContact O-N 3.43Å; Q398-S402 PolarHBondContact O-OG 3.07Å; I399-S402 PolarHBondContact O-N 3.04Å
403	Y	79.3	Confident	86.4	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-84.9	-6.9	-176.6	-79.9	-102	0	0	0	113.8	L188 L193 F196 I399 I405 H444 H448	L188-Y403 HydrophobicContact CD1-CE2 3.67Å; L188-Y403 WeakPolarHBondContact CD1-OH 3.44Å; L193-Y403 HydrophobicContact CD2-CE1 4.08Å; F196-Y403 HydrophobicContact CB-CD1 4.19Å; F196-Y403 AromaticContact CD2-CD1 3.9Å; F196-Y403 HydrophobicContact CD2-CD1 3.9Å; F196-Y403 HydrophobicContact CG-CD1 4.05Å; I399-Y403 HydrophobicContact CD1-CE2 4.49Å; I399-Y403 HydrophobicContact CG2-CD2 4.3Å; I399-Y403 WeakPolarHBondContact O-CD2 3.47Å; I399-Y403 PolarHBondContact O-N 3.13Å; Y403-I405 PolarHBondContact O-N 3.09Å; Y403-I405 VanDerWaalsContact O-N 3.13Å; Y403-H444 AromaticContact CE1-CE1 3.94Å; Y403-H444 AromaticContact CE1-ND1 3.71Å; Y403-H448 AromaticContact CE2-CE1 3.61Å; Y403-H448 AromaticContact CE2-NE2 3.41Å; Y403-H448 WeakPolarHBondContact CE2-NE2 3.45Å; Y403-H448 AromaticContact CZ-NE2 3.56Å; Y403-H448 PolarHBondContact OH-CD2 3.5Å; Y403-H448 PolarHBondContact OH-NE2 3.22Å
404	A	82.3	Confident	85.9	Confident	21 Å²	21	25.4 Å²	25.4	17%	0.174	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	29.6	-177.2	0	0	0	0	0	114.3	F400 L407	F400-A404 PolarHBondContact O-N 3.18Å; A404-L407 HydrophobicContact CB-CD1 4.18Å; A404-L407 WeakPolarHBondContact O-CB 3.31Å
405	I	85.4	Confident	85.6	Confident	7 Å²	7	24.3 Å²	24.3	4%	0.036	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	154	179	19.8	177.8	0	0	0	111.3	V195 F196 E199 F400 Y403 L407	V195-I405 HydrophobicContact CB-CD1 4.44Å; V195-I405 HydrophobicContact CB-CG2 4.4Å; V195-I405 HydrophobicContact CG1-CB 4.23Å; V195-I405 HydrophobicContact CG1-CG2 3.86Å; F196-I405 HydrophobicContact CB-CG2 4.13Å; E199-I405 HydrophobicContact CG-CG2 4.45Å; F400-I405 HydrophobicContact CD1-CD1 4.11Å; F400-I405 HydrophobicContact CD1-CG1 4.21Å; F400-I405 HydrophobicContact CE1-CD1 4.38Å; F400-I405 HydrophobicContact CG-CD1 4.24Å; F400-I405 HydrophobicContact CG-CG1 4.49Å; Y403-I405 PolarHBondContact O-N 3.09Å; Y403-I405 VanDerWaalsContact O-N 3.13Å; I405-L407 PolarHBondContact O-N 3.05Å
406	C	85.3	Confident	85.2	Confident	68 Å²	68	26.6 Å²	26.6	46%	0.459	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	8.6	-173.6	-52.7	0	0	0	0	115	E199 S228	E199-C406 WeakPolarHBondContact OE1-CA 3.48Å; E199-C406 PolarHBondContact OE1-N 2.97Å; S228-C406 PolarHBondContact OG-O 3.1Å; S228-C406 VanDerWaalsContact OG-O 3.11Å
407	L	84.6	Confident	84.6	Confident	42 Å²	42	27.7 Å²	27.7	22%	0.22	16%	0.159	C	C	.	.	S	Bend	trans	-98.2	-5.1	176	-58.3	-179.1	0	0	0	113.5	I231 V232 L235 A404 I405 A409	I231-L407 HydrophobicContact CB-CD2 4.49Å; I231-L407 HydrophobicContact CG2-CD2 3.7Å; V232-L407 HydrophobicContact CG2-CB 4Å; L235-L407 HydrophobicContact CD1-CD1 3.8Å; A404-L407 HydrophobicContact CB-CD1 4.18Å; A404-L407 WeakPolarHBondContact O-CB 3.31Å; I405-L407 PolarHBondContact O-N 3.05Å; L407-A409 PolarHBondContact O-N 2.89Å
408	G	84.9	Confident	83.7	Confident	13 Å²	13	30.7 Å²	30.7	13%	0.134	17%	0.167	C	C	.	.	S	Bend	trans	72.6	1.9	-179.6	0	0	0	0	0	114.8	S412	G408-S412 WeakPolarHBondContact O-CB 3.41Å; G408-S412 PolarHBondContact O-N 3.36Å
409	A	85	Confident	82.4	Confident	40 Å²	40	37.5 Å²	37.5	33%	0.331	19%	0.194	S	C	.	.	H	α-helix	trans	-64.2	-46.2	174.9	0	0	0	0	0	111.2	L407 S412 L413	L407-A409 PolarHBondContact O-N 2.89Å; A409-S412 WeakPolarHBondContact O-CB 3.48Å; A409-S412 PolarHBondContact O-N 3.35Å; A409-L413 WeakPolarHBondContact O-CG 3.34Å; A409-L413 PolarHBondContact O-N 2.86Å
410	M	85.6	Confident	80.7	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.015	24%	0.235	C	C	.	.	H	α-helix	trans	-69	-37.5	178	-62	-56.8	134.6	0	0	112	V155 F196 E199 I200 S412 L413 G414	V155-M410 HydrophobicContact CG1-SD 4.13Å; F196-M410 HydrophobicContact CD2-CG 4.08Å; F196-M410 HydrophobicContact CD2-SD 4.41Å; F196-M410 HydrophobicContact CE2-CG 4.02Å; F196-M410 HydrophobicContact CE2-SD 3.77Å; E199-M410 HydrophobicContact CB-CB 3.99Å; I200-M410 HydrophobicContact CG1-CB 4.11Å; M410-S412 VanDerWaalsContact C-N 3.31Å; M410-S412 PolarHBondContact O-N 2.89Å; M410-L413 HydrophobicContact CE-CD1 4.02Å; M410-L413 PolarHBondContact O-N 3.31Å; M410-L413 HydrophobicContact SD-CD1 4Å; M410-G414 PolarHBondContact O-N 3.11Å
411	T	87.4	Confident	78.6	Confident	11 Å²	11	48.1 Å²	48.1	7%	0.067	24%	0.238	C	C	.	.	H	α-helix	trans	-54.8	-47.4	168.4	-44.7	0	0	0	0	111.3	E199 I202 G203 C213 S415	E199-T411 WeakPolarHBondContact O-CA 2.9Å; I202-T411 HydrophobicContact CG2-CG2 4.15Å; G203-T411 VanDerWaalsContact CA-O 3.27Å; G203-T411 WeakPolarHBondContact CA-O 3.26Å; C213-T411 HydrophobicContact CB-CG2 4.08Å; T411-S415 WeakPolarHBondContact O-CB 3.18Å; T411-S415 PolarHBondContact O-N 3.08Å; T411-S415 PolarHBondContact O-OG 3.14Å
412	S	87.3	Confident	76.4	Confident	40 Å²	40	51.6 Å²	51.6	28%	0.28	26%	0.26	S	S	.	.	H	α-helix	trans	-63.9	-47	177.5	-164.4	0	0	0	0	111.8	G408 A409 M410 G414 S415 Y416	G408-S412 WeakPolarHBondContact O-CB 3.41Å; G408-S412 PolarHBondContact O-N 3.36Å; A409-S412 WeakPolarHBondContact O-CB 3.48Å; A409-S412 PolarHBondContact O-N 3.35Å; M410-S412 VanDerWaalsContact C-N 3.31Å; M410-S412 PolarHBondContact O-N 2.89Å; S412-G414 PolarHBondContact O-N 3.04Å; S412-S415 PolarHBondContact O-N 2.92Å; S412-S415 PolarHBondContact O-OG 2.84Å; S412-Y416 WeakPolarHBondContact O-CD2 3.37Å; S412-Y416 WeakPolarHBondContact O-CE2 3.36Å
413	L	83.8	Confident	74.3	Confident	36 Å²	36	53.2 Å²	53.2	19%	0.188	27%	0.271	C	S	.	.	H	α-helix	trans	-62.3	-43.3	177.7	-67.4	174.5	0	0	0	112.6	W145 F151 V155 A409 M410 S415 Y416	W145-L413 HydrophobicContact CH2-CD2 4.19Å; W145-L413 HydrophobicContact CZ2-CD2 3.75Å; W145-L413 PolarHBondContact NE1-O 2.98Å; F151-L413 HydrophobicContact CE2-CB 4.25Å; V155-L413 HydrophobicContact CG2-CD1 4.09Å; A409-L413 WeakPolarHBondContact O-CG 3.34Å; A409-L413 PolarHBondContact O-N 2.86Å; M410-L413 HydrophobicContact CE-CD1 4.02Å; M410-L413 PolarHBondContact O-N 3.31Å; M410-L413 HydrophobicContact SD-CD1 4Å; L413-S415 VanDerWaalsContact C-N 3.3Å; L413-S415 PolarHBondContact O-N 3.23Å; L413-Y416 PolarHBondContact O-N 3.16Å
414	G	83.3	Confident	72	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.7	-31.6	178.3	0	0	0	0	0	113.2	Q204 M410 S412 Y416 N417	Q204-G414 WeakPolarHBondContact CA-O 3.38Å; M410-G414 PolarHBondContact O-N 3.11Å; S412-G414 PolarHBondContact O-N 3.04Å; G414-Y416 VanDerWaalsContact C-N 3.3Å; G414-Y416 PolarHBondContact O-N 2.83Å; G414-N417 WeakPolarHBondContact O-CA 3.31Å; G414-N417 WeakPolarHBondContact O-CB 3.37Å; G414-N417 PolarHBondContact O-N 2.84Å
415	S	85.1	Confident	69.6	Low	0 Å²	0	72.8 Å²	72.8	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-69.1	-21.1	179.7	71.9	0	0	0	0	115.4	R142 K144 G203 E208 T411 S412 L413 N417	R142-S415 VanDerWaalsContact NH1-CB 3.34Å; R142-S415 PolarHBondContact NH1-OG 3.4Å; R142-S415 PolarHBondContact NH2-OG 3.4Å; K144-S415 PolarHBondContact NZ-O 3.18Å; G203-S415 WeakPolarHBondContact O-CA 3.11Å; G203-S415 VanDerWaalsContact O-CB 3.27Å; G203-S415 WeakPolarHBondContact O-CB 3.44Å; E208-S415 WeakPolarHBondContact O-CB 3.43Å; E208-S415 PolarHBondContact O-OG 2.86Å; T411-S415 WeakPolarHBondContact O-CB 3.18Å; T411-S415 PolarHBondContact O-N 3.08Å; T411-S415 PolarHBondContact O-OG 3.14Å; S412-S415 PolarHBondContact O-N 2.92Å; S412-S415 PolarHBondContact O-OG 2.84Å; L413-S415 VanDerWaalsContact C-N 3.3Å; L413-S415 PolarHBondContact O-N 3.23Å; S415-N417 PolarHBondContact O-N 3.21Å
416	Y	81.5	Confident	66.8	Low	49 Å²	49	77 Å²	77	19%	0.192	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	0.9	167.9	-61.5	-84.3	0	0	0	112.3	R142 E143 K144 W145 V340 S412 L413 G414	R142-Y416 HydrophobicContact CG-CD1 4.13Å; R142-Y416 HydrophobicContact CG-CE1 4.03Å; R142-Y416 VanDerWaalsContact NE-CE1 3.34Å; R142-Y416 PolarHBondContact NH2-OH 3.24Å; E143-Y416 HydrophobicContact CB-CD1 4.44Å; E143-Y416 VanDerWaalsContact O-CD1 3.27Å; E143-Y416 WeakPolarHBondContact O-CD1 3.44Å; K144-Y416 CarbonylContact C-O 3.56Å; K144-Y416 WeakPolarHBondContact CA-O 3.39Å; K144-Y416 WeakPolarHBondContact CB-O 3.49Å; K144-Y416 WeakPolarHBondContact CD-O 3.26Å; W145-Y416 VanDerWaalsContact CD1-C 3.44Å; W145-Y416 VanDerWaalsContact CD1-O 3.28Å; W145-Y416 PolarHBondContact N-O 3.43Å; V340-Y416 HydrophobicContact CG1-CD1 4.1Å; V340-Y416 HydrophobicContact CG1-CD2 4.19Å; V340-Y416 HydrophobicContact CG1-CE1 3.84Å; V340-Y416 HydrophobicContact CG1-CE2 3.92Å; V340-Y416 HydrophobicContact CG1-CG 4.31Å; V340-Y416 HydrophobicContact CG2-CD1 3.97Å; V340-Y416 HydrophobicContact CG2-CE1 4.15Å; S412-Y416 WeakPolarHBondContact O-CD2 3.37Å; S412-Y416 WeakPolarHBondContact O-CE2 3.36Å; L413-Y416 PolarHBondContact O-N 3.16Å; G414-Y416 VanDerWaalsContact C-N 3.3Å; G414-Y416 PolarHBondContact O-N 2.83Å
417	N	79.4	Confident	64.1	Low	31 Å²	31	84.3 Å²	84.3	17%	0.166	39%	0.39	C	S	.	.	S	Bend	trans	-82.4	156.4	174.5	-159.6	3	0	0	0	112	K144 Q204 G414 S415	K144-N417 WeakPolarHBondContact CD-O 3.46Å; K144-N417 WeakPolarHBondContact CE-O 3.2Å; K144-N417 PolarHBondContact NZ-O 3.36Å; Q204-N417 HydrophobicContact CG-CB 4.16Å; Q204-N417 PolarHBondContact NE2-ND2 2.88Å; G414-N417 WeakPolarHBondContact O-CA 3.31Å; G414-N417 WeakPolarHBondContact O-CB 3.37Å; G414-N417 PolarHBondContact O-N 2.84Å; S415-N417 PolarHBondContact O-N 3.21Å
418	K	71.8	Confident	61.9	Low	125 Å²	125	87.2 Å²	87.2	54%	0.543	41%	0.411	S	S	.	.			trans	-79.1	133.4	-178.3	-65.2	178.5	-177.4	175.5	0	110.2	K144 Q204	K144-K418 HydrophobicContact CB-CG 4.32Å; K144-K418 HydrophobicContact CG-CG 4.46Å; Q204-K418 PolarHBondContact NE2-O 3.3Å
419	Y	59.6	Low	59.6	Low	143 Å²	143	90 Å²	90	56%	0.561	44%	0.439	S	S	*	.	S	Bend	trans	-66.3	-45	-174.8	-172.5	-88.9	0	0	0	113	Y205 Y421	Y205-Y419 AromaticContact CD2-CE2 3.81Å; Y205-Y419 HydrophobicContact CD2-CE2 3.81Å; Y205-Y419 HydrophobicContact CE2-CE2 4.32Å; Y205-Y419 WeakPolarHBondContact CE2-OH 3.24Å; Y419-Y421 PolarHBondContact O-N 2.04Å
420	K	50.3	Low	57.2	Low	197 Å²	197	93.9 Å²	93.9	86%	0.857	45%	0.454	S	S	*	.			trans	-87.9	93.4	172.8	-77.5	-169.6	175.4	-177.4	0	110.8
421	Y	42.8	Very low	54.8	Low	109 Å²	109	101.5 Å²	101.5	43%	0.427	49%	0.489	S	S	.	.			trans	-123.8	118.4	157.6	-170.6	-95.7	0	0	0	109.7	K148 Y419 S423	K148-Y421 VanDerWaalsContact NZ-CZ 3.27Å; K148-Y421 PolarHBondContact NZ-OH 2.6Å; Y419-Y421 PolarHBondContact O-N 2.04Å; Y421-S423 PolarHBondContact O-N 3.24Å
422	N	36.9	Very low	52.5	Low	143 Å²	143	107 Å²	107	77%	0.765	53%	0.527	S	S	*	.			trans	-86.5	114.7	-162.8	-159.8	11	0	0	0	111.7
423	S	37.8	Very low	50	Low	38 Å²	38	108 Å²	108	27%	0.266	53%	0.529	S	S	.	.			trans	-110.6	19.8	-173.4	-63.3	0	0	0	0	115.1	Y421 K435	Y421-S423 PolarHBondContact O-N 3.24Å; S423-K435 PolarHBondContact OG-N 3.3Å
424	Y	32.5	Very low	48	Very low	220 Å²	220	108.2 Å²	108.2	86%	0.863	53%	0.533	S	S	*	.			trans	-107.5	69.4	179.6	-77.1	-83	0	0	0	113.5
425	R	31	Very low	45.8	Very low	213 Å²	213	112.6 Å²	112.6	80%	0.804	55%	0.552	S	S	*	*	S	Bend	trans	-160.4	121.9	151.4	-140.6	169.8	176.3	174.3	-3.1	114	K435	R425-K435 PolarHBondContact O-NZ 3.01Å
426	S	26.1	Very low	44	Very low	95 Å²	95	113.9 Å²	113.9	66%	0.664	56%	0.561	S	S	*	*			trans	53.5	99.8	155.4	53.5	0	0	0	0	119.4	K435	S426-K435 PolarHBondContact O-NZ 2.92Å
427	W	29.6	Very low	42.2	Very low	222 Å²	222	111.8 Å²	111.8	84%	0.841	55%	0.553	S	S	*	*				-156.8	135	108.6	-176.2	-92.5	0	0	0	109.1
428	P	38.1	Very low	40.5	Very low	104 Å²	104	113.1 Å²	113.1	68%	0.675	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	116.2	-179.7	32.4	-30.7	0	0	0	111
429	G	37.3	Very low	39.3	Very low	70 Å²	70	112.6 Å²	112.6	72%	0.722	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	165.6	-28.6	174.3	0	0	0	0	0	115.7
430	L	34.7	Very low	39	Very low	123 Å²	123	106.2 Å²	106.2	64%	0.644	54%	0.539	S	S	*	.			trans	-139.7	84.5	177.4	-163.6	70.3	0	0	0	109.6	L433	L430-L433 HydrophobicContact CD2-CD1 4.25Å
431	H	34.9	Very low	38.9	Very low	162 Å²	162	97.8 Å²	97.8	75%	0.75	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	142.8	177.7	-77.2	-175.2	0	0	0	111.1
432	C	37.8	Very low	39.1	Very low	128 Å²	128	94.9 Å²	94.9	87%	0.865	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.5	27.3	174.1	-53.1	0	0	0	0	118.7
433	L	35.6	Very low	39.7	Very low	59 Å²	59	89.2 Å²	89.2	31%	0.309	48%	0.478	S	S	.	.			trans	-118.1	136.9	156.5	-72.4	175.1	0	0	0	111.4	F197 L430 C437	F197-L433 HydrophobicContact CD2-CD2 3.93Å; F197-L433 HydrophobicContact CE2-CD1 4.45Å; F197-L433 HydrophobicContact CE2-CD2 3.93Å; F197-L433 HydrophobicContact CG-CD2 4.37Å; F197-L433 HydrophobicContact CZ-CD2 4.37Å; L430-L433 HydrophobicContact CD2-CD1 4.25Å; L433-C437 HydrophobicContact CB-CB 4.23Å; L433-C437 HydrophobicContact CD2-CB 4.14Å
434	P	41.3	Very low	40.7	Very low	42 Å²	42	87.7 Å²	87.7	27%	0.273	47%	0.466	S	S	.	.			trans	-61.3	148.9	168.1	-22.6	32.8	0	0	0	111.6	S436 C437 D438	P434-S436 PolarHBondContact O-N 3.18Å; P434-C437 WeakPolarHBondContact O-CA 3.35Å; P434-C437 VanDerWaalsContact O-CB 3.3Å; P434-C437 WeakPolarHBondContact O-CB 3.35Å; P434-C437 PolarHBondContact O-N 2.97Å; P434-D438 PolarHBondContact O-N 3.38Å
435	K	38.5	Very low	41.8	Very low	92 Å²	92	81.7 Å²	81.7	40%	0.4	45%	0.448	S	S	.	.	H	α-helix	trans	-65.3	-7.6	179.2	-81	-170.7	167.3	-179.6	0	115.2	S423 R425 S426	S423-K435 PolarHBondContact OG-N 3.3Å; R425-K435 PolarHBondContact O-NZ 3.01Å; S426-K435 PolarHBondContact O-NZ 2.92Å
436	S	45.8	Very low	42.8	Very low	27 Å²	27	77.6 Å²	77.6	19%	0.189	44%	0.441	C	S	.	.	H	α-helix	trans	-72.1	-49.4	162.3	44.2	0	0	0	0	110.6	P434 D438 N439 D440	P434-S436 PolarHBondContact O-N 3.18Å; S436-D438 VanDerWaalsContact C-N 3.28Å; S436-D438 PolarHBondContact O-N 3.2Å; S436-N439 PolarHBondContact O-N 3.44Å; S436-N439 VanDerWaalsContact O-N 3.14Å; S436-D440 VanDerWaalsContact C-OD2 3.29Å; S436-D440 PolarHBondContact O-N 2.83Å; S436-D440 VanDerWaalsContact O-OD2 3.12Å
437	C	45.3	Very low	44.2	Very low	4 Å²	4	73.6 Å²	73.6	3%	0.027	41%	0.413	C	S	.	.	H	α-helix	trans	-65.5	-24.5	-176.4	-58.5	0	0	0	0	113.7	F197 L433 P434 D440 A441	F197-C437 HydrophobicContact CD1-CB 3.98Å; F197-C437 HydrophobicContact CE1-CB 3.53Å; F197-C437 HydrophobicContact CZ-CB 4.07Å; L433-C437 HydrophobicContact CB-CB 4.23Å; L433-C437 HydrophobicContact CD2-CB 4.14Å; P434-C437 WeakPolarHBondContact O-CA 3.35Å; P434-C437 VanDerWaalsContact O-CB 3.3Å; P434-C437 WeakPolarHBondContact O-CB 3.35Å; P434-C437 PolarHBondContact O-N 2.97Å; C437-D440 WeakPolarHBondContact CA-OD2 3.38Å; C437-A441 WeakPolarHBondContact O-CB 3.49Å; C437-A441 PolarHBondContact O-N 2.88Å
438	D	42.1	Very low	45.7	Very low	59 Å²	59	64.1 Å²	64.1	32%	0.316	38%	0.378	S	S	.	.	H	α-helix	trans	-66.4	-46	171.8	-65.3	-35.6	0	0	0	111.9	P434 S436 A441 A442	P434-D438 PolarHBondContact O-N 3.38Å; S436-D438 VanDerWaalsContact C-N 3.28Å; S436-D438 PolarHBondContact O-N 3.2Å; D438-A441 PolarHBondContact O-N 3.21Å; D438-A442 PolarHBondContact O-N 3.27Å
439	N	47.5	Very low	46.5	Very low	115 Å²	115	61.5 Å²	61.5	62%	0.615	36%	0.363	S	S	*	.	H	α-helix	trans	-69	-37.7	175	-77.3	-9.7	0	0	0	111.1	S436 A442 A443	S436-N439 PolarHBondContact O-N 3.44Å; S436-N439 VanDerWaalsContact O-N 3.14Å; N439-A442 PolarHBondContact O-N 2.84Å; N439-A443 WeakPolarHBondContact O-CB 3.49Å; N439-A443 PolarHBondContact O-N 2.89Å
440	D	53.4	Low	47.3	Very low	8 Å²	8	60 Å²	60	4%	0.043	34%	0.336	C	S	.	.	H	α-helix	trans	-62.2	-47.4	174.2	-55.8	-32.2	0	0	0	109.7	V152 S436 C437 A442 A443 H444	V152-D440 WeakPolarHBondContact CG2-OD1 3.5Å; S436-D440 VanDerWaalsContact C-OD2 3.29Å; S436-D440 PolarHBondContact O-N 2.83Å; S436-D440 VanDerWaalsContact O-OD2 3.12Å; C437-D440 WeakPolarHBondContact CA-OD2 3.38Å; D440-A442 PolarHBondContact O-N 3.03Å; D440-A443 CarbonylContact O-C 3.56Å; D440-A443 WeakPolarHBondContact O-CA 3.46Å; D440-A443 WeakPolarHBondContact O-CB 3.07Å; D440-A443 PolarHBondContact O-N 3.25Å; D440-A443 VanDerWaalsContact O-N 3.13Å; D440-H444 VanDerWaalsContact C-CD2 3.49Å; D440-H444 PolarHBondContact O-CD2 3.36Å; D440-H444 PolarHBondContact O-N 2.97Å
441	A	48.6	Very low	48.3	Very low	21 Å²	21	54.6 Å²	54.6	17%	0.174	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-41.3	178	0	0	0	0	0	112.3	F197 C437 D438 H444 I445	F197-A441 HydrophobicContact CZ-CB 4.41Å; C437-A441 WeakPolarHBondContact O-CB 3.49Å; C437-A441 PolarHBondContact O-N 2.88Å; D438-A441 PolarHBondContact O-N 3.21Å; A441-H444 PolarHBondContact O-N 3.49Å; A441-I445 WeakPolarHBondContact O-CB 3.44Å; A441-I445 VanDerWaalsContact O-CG1 3.29Å; A441-I445 WeakPolarHBondContact O-CG1 3.44Å; A441-I445 PolarHBondContact O-N 3.27Å
442	A	45.4	Very low	49.4	Very low	48 Å²	48	49.6 Å²	49.6	40%	0.397	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-43.5	172.8	0	0	0	0	0	111.6	D438 N439 D440 I445 L446	D438-A442 PolarHBondContact O-N 3.27Å; N439-A442 PolarHBondContact O-N 2.84Å; D440-A442 PolarHBondContact O-N 3.03Å; A442-I445 PolarHBondContact O-N 3.23Å; A442-L446 WeakPolarHBondContact O-CB 3.46Å; A442-L446 VanDerWaalsContact O-CG 3.25Å; A442-L446 WeakPolarHBondContact O-CG 3Å; A442-L446 PolarHBondContact O-N 3.4Å
443	A	50.6	Low	50.1	Low	24 Å²	24	49.5 Å²	49.5	20%	0.198	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-42.6	173.3	0	0	0	0	0	112	V152 N439 D440 L446 V447	V152-A443 HydrophobicContact CG1-CB 4.08Å; N439-A443 WeakPolarHBondContact O-CB 3.49Å; N439-A443 PolarHBondContact O-N 2.89Å; D440-A443 CarbonylContact O-C 3.56Å; D440-A443 WeakPolarHBondContact O-CA 3.46Å; D440-A443 WeakPolarHBondContact O-CB 3.07Å; D440-A443 PolarHBondContact O-N 3.25Å; D440-A443 VanDerWaalsContact O-N 3.13Å; A443-L446 PolarHBondContact O-N 3.28Å; A443-V447 WeakPolarHBondContact O-CB 3.43Å; A443-V447 VanDerWaalsContact O-CG2 3.23Å; A443-V447 WeakPolarHBondContact O-CG2 3.38Å; A443-V447 PolarHBondContact O-N 2.78Å
444	H	58.4	Low	50.9	Low	5 Å²	5	46.9 Å²	46.9	2%	0.023	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-45.5	175.7	-77.8	-72	0	0	0	112.4	F159 F196 Y403 D440 A441 V447 H448	F159-H444 AromaticContact CD1-CE1 3.62Å; F159-H444 AromaticContact CD1-ND1 3.96Å; F159-H444 AromaticContact CE1-CE1 3.06Å; F159-H444 WeakPolarHBondContact CE1-CE1 3.41Å; F159-H444 AromaticContact CE1-ND1 3.26Å; F159-H444 VanDerWaalsContact CE1-ND1 3.26Å; F159-H444 WeakPolarHBondContact CE1-ND1 3.3Å; F159-H444 AromaticContact CE2-ND1 3.77Å; F159-H444 AromaticContact CZ-CE1 3.52Å; F159-H444 AromaticContact CZ-ND1 3.16Å; F159-H444 WeakPolarHBondContact CZ-ND1 3.26Å; F196-H444 AromaticContact CE1-CE1 3.68Å; F196-H444 AromaticContact CE1-NE2 3.07Å; F196-H444 WeakPolarHBondContact CE1-NE2 3.23Å; F196-H444 AromaticContact CE2-CE1 3.83Å; F196-H444 AromaticContact CE2-NE2 3.99Å; F196-H444 AromaticContact CZ-CE1 3.32Å; F196-H444 WeakPolarHBondContact CZ-CE1 3.4Å; F196-H444 AromaticContact CZ-NE2 3.03Å; F196-H444 WeakPolarHBondContact CZ-NE2 3.33Å; Y403-H444 AromaticContact CE1-CE1 3.94Å; Y403-H444 AromaticContact CE1-ND1 3.71Å; D440-H444 VanDerWaalsContact C-CD2 3.49Å; D440-H444 PolarHBondContact O-CD2 3.36Å; D440-H444 PolarHBondContact O-N 2.97Å; A441-H444 PolarHBondContact O-N 3.49Å; H444-V447 PolarHBondContact O-N 3.05Å; H444-H448 WeakPolarHBondContact O-CB 3.32Å; H444-H448 PolarHBondContact O-N 2.94Å
445	I	54.9	Low	51.5	Low	95 Å²	95	45 Å²	45	49%	0.487	24%	0.239	S	C	.	.	H	α-helix	trans	-62.2	-49	176.5	-69.5	164.9	0	0	0	109.4	A441 A442 V447 H448 S449	A441-I445 WeakPolarHBondContact O-CB 3.44Å; A441-I445 VanDerWaalsContact O-CG1 3.29Å; A441-I445 WeakPolarHBondContact O-CG1 3.44Å; A441-I445 PolarHBondContact O-N 3.27Å; A442-I445 PolarHBondContact O-N 3.23Å; I445-V447 VanDerWaalsContact C-N 3.33Å; I445-V447 PolarHBondContact O-N 3.09Å; I445-H448 PolarHBondContact O-N 3.25Å; I445-S449 WeakPolarHBondContact O-CB 3.5Å; I445-S449 PolarHBondContact O-N 3.1Å; I445-S449 PolarHBondContact O-OG 3.42Å
446	L	52.8	Low	52.2	Low	126 Å²	126	41.3 Å²	41.3	66%	0.66	22%	0.224	S	C	*	.	H	α-helix	trans	-57.8	-44.1	177.2	-74.5	168.6	0	0	0	112	A442 A443 F450	A442-L446 WeakPolarHBondContact O-CB 3.46Å; A442-L446 VanDerWaalsContact O-CG 3.25Å; A442-L446 WeakPolarHBondContact O-CG 3Å; A442-L446 PolarHBondContact O-N 3.4Å; A443-L446 PolarHBondContact O-N 3.28Å; L446-F450 WeakPolarHBondContact O-CB 3.09Å; L446-F450 PolarHBondContact O-N 3.19Å
447	V	55.1	Low	52.1	Low	12 Å²	12	40.4 Å²	40.4	7%	0.073	22%	0.218	C	C	.	.	H	α-helix	trans	-68.9	-46.8	179.2	173.1	0	0	0	0	111.7	F159 V160 F355 A443 H444 I445 F450 F451	F159-V447 HydrophobicContact CD2-CG1 4.23Å; F159-V447 HydrophobicContact CE2-CB 3.85Å; F159-V447 HydrophobicContact CE2-CG1 3.46Å; F159-V447 VanDerWaalsContact CE2-CG1 3.46Å; F159-V447 HydrophobicContact CE2-CG2 4.37Å; F159-V447 HydrophobicContact CZ-CB 4.31Å; F159-V447 HydrophobicContact CZ-CG1 4.31Å; F159-V447 HydrophobicContact CZ-CG2 4.44Å; V160-V447 HydrophobicContact CG2-CG1 3.55Å; F355-V447 HydrophobicContact CE1-CB 4.2Å; F355-V447 HydrophobicContact CE1-CG1 3.8Å; F355-V447 HydrophobicContact CE1-CG2 3.8Å; F355-V447 HydrophobicContact CE2-CG2 4.32Å; F355-V447 HydrophobicContact CZ-CB 4.1Å; F355-V447 HydrophobicContact CZ-CG1 3.63Å; F355-V447 HydrophobicContact CZ-CG2 3.41Å; F355-V447 VanDerWaalsContact CZ-CG2 3.41Å; A443-V447 WeakPolarHBondContact O-CB 3.43Å; A443-V447 VanDerWaalsContact O-CG2 3.23Å; A443-V447 WeakPolarHBondContact O-CG2 3.38Å; A443-V447 PolarHBondContact O-N 2.78Å; H444-V447 PolarHBondContact O-N 3.05Å; I445-V447 VanDerWaalsContact C-N 3.33Å; I445-V447 PolarHBondContact O-N 3.09Å; V447-F450 CarbonylContact O-C 3.36Å; V447-F450 WeakPolarHBondContact O-CB 3.33Å; V447-F450 PolarHBondContact O-N 3.35Å; V447-F451 HydrophobicContact CG1-CD2 3.72Å; V447-F451 HydrophobicContact CG1-CE2 3.89Å; V447-F451 VanDerWaalsContact O-CD2 3.31Å; V447-F451 WeakPolarHBondContact O-CD2 3.36Å; V447-F451 PolarHBondContact O-N 3.25Å
448	H	61.6	Low	52.2	Low	22 Å²	22	47.7 Å²	47.7	10%	0.102	25%	0.245	C	C	.	.	H	α-helix	trans	-67.7	-39.2	178.4	-87.5	-95.2	0	0	0	112.6	Y184 Y403 H444 I445 F450 F451 Y452	Y184-H448 PolarHBondContact OH-CE1 3.09Å; Y184-H448 PolarHBondContact OH-ND1 2.77Å; Y403-H448 AromaticContact CE2-CE1 3.61Å; Y403-H448 AromaticContact CE2-NE2 3.41Å; Y403-H448 WeakPolarHBondContact CE2-NE2 3.45Å; Y403-H448 AromaticContact CZ-NE2 3.56Å; Y403-H448 PolarHBondContact OH-CD2 3.5Å; Y403-H448 PolarHBondContact OH-NE2 3.22Å; H444-H448 WeakPolarHBondContact O-CB 3.32Å; H444-H448 PolarHBondContact O-N 2.94Å; I445-H448 PolarHBondContact O-N 3.25Å; H448-F450 VanDerWaalsContact C-N 3.29Å; H448-F450 PolarHBondContact O-N 3.14Å; H448-F451 PolarHBondContact O-N 3.39Å; H448-Y452 WeakPolarHBondContact O-CB 3.36Å; H448-Y452 PolarHBondContact O-N 3.05Å
449	S	54.4	Low	52.2	Low	50 Å²	50	45.4 Å²	45.4	35%	0.35	23%	0.234	S	C	.	.	H	α-helix	trans	-60.1	-41.6	169.5	-65.3	0	0	0	0	111	I445 Y452 Y453	I445-S449 WeakPolarHBondContact O-CB 3.5Å; I445-S449 PolarHBondContact O-N 3.1Å; I445-S449 PolarHBondContact O-OG 3.42Å; S449-Y452 WeakPolarHBondContact O-CB 2.97Å; S449-Y452 PolarHBondContact O-N 3Å; S449-Y453 WeakPolarHBondContact O-CD2 3.42Å; S449-Y453 PolarHBondContact O-N 3.03Å
450	F	53.7	Low	51.5	Low	37 Å²	37	42.4 Å²	42.4	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-66.7	-40.8	177.4	-178.9	-84	0	0	0	112.8	F355 L358 L359 L446 V447 H448 Y452 Y453 A454	F355-F450 HydrophobicContact CB-CE1 4.44Å; F355-F450 HydrophobicContact CB-CZ 4.43Å; F355-F450 AromaticContact CD1-CD1 3.41Å; F355-F450 HydrophobicContact CD1-CD1 3.41Å; F355-F450 VanDerWaalsContact CD1-CD1 3.41Å; F355-F450 AromaticContact CD1-CE1 3.58Å; F355-F450 HydrophobicContact CD1-CE1 3.58Å; F355-F450 AromaticContact CD1-CG 3.93Å; F355-F450 HydrophobicContact CD1-CG 3.93Å; F355-F450 HydrophobicContact CD1-CZ 4.23Å; F355-F450 AromaticContact CE1-CD1 3.8Å; F355-F450 HydrophobicContact CE1-CD1 3.8Å; F355-F450 HydrophobicContact CE1-CE1 4.33Å; F355-F450 HydrophobicContact CE1-CG 4.33Å; F355-F450 HydrophobicContact CG-CE1 4.47Å; F355-F450 WeakPolarHBondContact O-CZ 3.38Å; L358-F450 HydrophobicContact CB-CE1 3.41Å; L358-F450 VanDerWaalsContact CB-CE1 3.41Å; L358-F450 HydrophobicContact CB-CZ 3.55Å; L358-F450 HydrophobicContact CD1-CE1 3.87Å; L358-F450 HydrophobicContact CG-CE1 4.29Å; L359-F450 HydrophobicContact CB-CE2 4.06Å; L359-F450 HydrophobicContact CB-CZ 4.17Å; L359-F450 HydrophobicContact CD1-CE2 4.47Å; L446-F450 WeakPolarHBondContact O-CB 3.09Å; L446-F450 PolarHBondContact O-N 3.19Å; V447-F450 CarbonylContact O-C 3.36Å; V447-F450 WeakPolarHBondContact O-CB 3.33Å; V447-F450 PolarHBondContact O-N 3.35Å; H448-F450 VanDerWaalsContact C-N 3.29Å; H448-F450 PolarHBondContact O-N 3.14Å; F450-Y452 VanDerWaalsContact C-N 3.33Å; F450-Y453 PolarHBondContact O-N 3.32Å; F450-A454 HydrophobicContact CE1-CB 4.36Å; F450-A454 WeakPolarHBondContact O-CB 3.14Å; F450-A454 PolarHBondContact O-N 2.88Å
451	F	56.2	Low	51.5	Low	10 Å²	10	44.2 Å²	44.2	4%	0.044	24%	0.239	C	C	.	.	H	α-helix	trans	-65.8	-36.2	173	-89	-79	0	0	0	112.3	V160 N164 V165 F355 L358 V447 H448 S455	V160-F451 HydrophobicContact CB-CE2 4.3Å; V160-F451 HydrophobicContact CB-CZ 4.48Å; V160-F451 HydrophobicContact CG1-CE2 3.66Å; V160-F451 HydrophobicContact CG1-CZ 3.49Å; V160-F451 VanDerWaalsContact CG1-CZ 3.49Å; V160-F451 HydrophobicContact CG2-CE2 3.76Å; V160-F451 HydrophobicContact CG2-CZ 4.42Å; N164-F451 HydrophobicContact CB-CD1 3.8Å; N164-F451 HydrophobicContact CB-CE1 4.07Å; N164-F451 HydrophobicContact CB-CG 4.21Å; V165-F451 HydrophobicContact CG2-CE1 3.84Å; F355-F451 HydrophobicContact CE1-CD2 4.43Å; F355-F451 AromaticContact CE1-CE2 3.8Å; F355-F451 HydrophobicContact CE1-CE2 3.8Å; F355-F451 HydrophobicContact CZ-CE2 4.21Å; L358-F451 HydrophobicContact CD1-CD1 4.46Å; L358-F451 HydrophobicContact CD1-CE1 3.58Å; L358-F451 HydrophobicContact CD1-CZ 3.6Å; V447-F451 HydrophobicContact CG1-CD2 3.72Å; V447-F451 HydrophobicContact CG1-CE2 3.89Å; V447-F451 VanDerWaalsContact O-CD2 3.31Å; V447-F451 WeakPolarHBondContact O-CD2 3.36Å; V447-F451 PolarHBondContact O-N 3.25Å; H448-F451 PolarHBondContact O-N 3.39Å; F451-S455 VanDerWaalsContact O-CB 3.3Å; F451-S455 WeakPolarHBondContact O-CB 3.34Å; F451-S455 PolarHBondContact O-N 3.11Å; F451-S455 PolarHBondContact O-OG 3.17Å
452	Y	58.2	Low	51.6	Low	58 Å²	58	45.4 Å²	45.4	23%	0.227	24%	0.243	C	C	.	.	H	α-helix	trans	-59.4	-51.1	168.9	169.6	-97.2	0	0	0	111.2	L181 L379 H448 S449 F450 A454 S455 L456	L181-Y452 HydrophobicContact CD1-CE2 3.75Å; L181-Y452 HydrophobicContact CD2-CD2 4.31Å; L181-Y452 HydrophobicContact CD2-CE2 4.3Å; L379-Y452 HydrophobicContact CD2-CE2 3.92Å; L379-Y452 WeakPolarHBondContact CD2-OH 3.29Å; H448-Y452 WeakPolarHBondContact O-CB 3.36Å; H448-Y452 PolarHBondContact O-N 3.05Å; S449-Y452 WeakPolarHBondContact O-CB 2.97Å; S449-Y452 PolarHBondContact O-N 3Å; F450-Y452 VanDerWaalsContact C-N 3.33Å; Y452-A454 PolarHBondContact O-N 3.43Å; Y452-S455 PolarHBondContact O-N 3.1Å; Y452-S455 PolarHBondContact O-OG 3.5Å; Y452-L456 HydrophobicContact CD1-CD1 4.47Å; Y452-L456 HydrophobicContact CE1-CD1 4Å; Y452-L456 PolarHBondContact O-N 3.24Å
453	Y	53.7	Low	51.9	Low	125 Å²	125	45.2 Å²	45.2	49%	0.49	23%	0.234	S	C	.	.	H	α-helix	trans	-63.1	-42.5	176.5	-70.6	-60.6	0	0	0	112.9	L362 S449 F450 S455 L456 A457	L362-Y453 WeakPolarHBondContact CD1-O 3.36Å; S449-Y453 WeakPolarHBondContact O-CD2 3.42Å; S449-Y453 PolarHBondContact O-N 3.03Å; F450-Y453 PolarHBondContact O-N 3.32Å; Y453-S455 VanDerWaalsContact C-N 3.29Å; Y453-S455 PolarHBondContact O-N 3.09Å; Y453-L456 HydrophobicContact CD1-CD1 4.14Å; Y453-L456 WeakPolarHBondContact O-CB 3.42Å; Y453-L456 PolarHBondContact O-N 3Å; Y453-L456 VanDerWaalsContact O-N 3.16Å; Y453-A457 PolarHBondContact O-N 3.27Å
454	A	50.8	Low	52	Low	4 Å²	4	46.5 Å²	46.5	3%	0.033	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-37.6	175	0	0	0	0	0	111.7	L358 F450 Y452 L456 A457 W458	L358-A454 HydrophobicContact CB-CB 4.19Å; L358-A454 HydrophobicContact CD2-CB 4.2Å; F450-A454 HydrophobicContact CE1-CB 4.36Å; F450-A454 WeakPolarHBondContact O-CB 3.14Å; F450-A454 PolarHBondContact O-N 2.88Å; Y452-A454 PolarHBondContact O-N 3.43Å; A454-L456 PolarHBondContact O-N 3.24Å; A454-A457 WeakPolarHBondContact O-CB 3.39Å; A454-A457 PolarHBondContact O-N 3.43Å; A454-W458 PolarHBondContact O-N 2.88Å
455	S	54.9	Low	51.6	Low	2 Å²	2	49.1 Å²	49.1	1%	0.014	25%	0.25	C	C	.	.	H	α-helix	trans	-62.6	-30.3	176.5	76.7	0	0	0	0	113	Y378 F451 Y452 Y453 A457	Y378-S455 PolarHBondContact OH-OG 2.99Å; Y378-S455 VanDerWaalsContact OH-OG 3.06Å; F451-S455 VanDerWaalsContact O-CB 3.3Å; F451-S455 WeakPolarHBondContact O-CB 3.34Å; F451-S455 PolarHBondContact O-N 3.11Å; F451-S455 PolarHBondContact O-OG 3.17Å; Y452-S455 PolarHBondContact O-N 3.1Å; Y452-S455 PolarHBondContact O-OG 3.5Å; Y453-S455 VanDerWaalsContact C-N 3.29Å; Y453-S455 PolarHBondContact O-N 3.09Å; S455-A457 VanDerWaalsContact C-N 3.32Å; S455-A457 PolarHBondContact O-N 3.3Å
456	L	52.2	Low	51.4	Low	15 Å²	15	46 Å²	46	8%	0.079	23%	0.234	C	C	.	.	H	α-helix	trans	-69.5	-25.4	173.6	-63.9	172.7	0	0	0	113.7	I375 Y378 L379 Y452 Y453 A454 T459	I375-L456 HydrophobicContact CG1-CB 4.17Å; I375-L456 HydrophobicContact CG1-CD2 4.46Å; I375-L456 HydrophobicContact CG2-CD2 4.31Å; Y378-L456 HydrophobicContact CD1-CD2 3.47Å; Y378-L456 VanDerWaalsContact CD1-CD2 3.47Å; Y378-L456 HydrophobicContact CE1-CD2 3.83Å; L379-L456 HydrophobicContact CD1-CD1 4.37Å; L379-L456 HydrophobicContact CD1-CD2 3.72Å; L379-L456 HydrophobicContact CD2-CD2 3.91Å; L379-L456 HydrophobicContact CG-CD2 3.66Å; Y452-L456 HydrophobicContact CD1-CD1 4.47Å; Y452-L456 HydrophobicContact CE1-CD1 4Å; Y452-L456 PolarHBondContact O-N 3.24Å; Y453-L456 HydrophobicContact CD1-CD1 4.14Å; Y453-L456 WeakPolarHBondContact O-CB 3.42Å; Y453-L456 PolarHBondContact O-N 3Å; Y453-L456 VanDerWaalsContact O-N 3.16Å; A454-L456 PolarHBondContact O-N 3.24Å; L456-T459 PolarHBondContact O-OG1 3.35Å; L456-T459 VanDerWaalsContact O-OG1 3.09Å
457	A	44.8	Very low	51.3	Low	9 Å²	9	40.3 Å²	40.3	7%	0.074	20%	0.203	C	C	.	.	H	α-helix	trans	-77.4	-33.9	178.3	0	0	0	0	0	113.1	L362 Y453 A454 S455 T459 G460	L362-A457 HydrophobicContact CB-CB 4.23Å; L362-A457 HydrophobicContact CD1-CB 3.81Å; Y453-A457 PolarHBondContact O-N 3.27Å; A454-A457 WeakPolarHBondContact O-CB 3.39Å; A454-A457 PolarHBondContact O-N 3.43Å; S455-A457 VanDerWaalsContact C-N 3.32Å; S455-A457 PolarHBondContact O-N 3.3Å; A457-T459 PolarHBondContact O-N 3.33Å; A457-G460 PolarHBondContact O-N 3.23Å
458	W	46.8	Very low	51	Low	156 Å²	156	42.5 Å²	42.5	59%	0.591	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-10.2	-179.6	-81.1	79.1	0	0	0	113.4	L361 A454	L361-W458 HydrophobicContact CD1-CZ2 4.07Å; A454-W458 PolarHBondContact O-N 2.88Å
459	T	43.5	Very low	50.1	Low	12 Å²	12	44.2 Å²	44.2	7%	0.074	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-3.4	176.1	58.4	0	0	0	0	114	F26 G374 Y378 L456 A457	F26-T459 HydrophobicContact CE1-CG2 4.33Å; F26-T459 HydrophobicContact CZ-CG2 3.8Å; G374-T459 WeakPolarHBondContact CA-O 3.48Å; Y378-T459 HydrophobicContact CD2-CG2 3.79Å; Y378-T459 HydrophobicContact CE2-CG2 4.42Å; Y378-T459 HydrophobicContact CG-CG2 3.99Å; L456-T459 PolarHBondContact O-OG1 3.35Å; L456-T459 VanDerWaalsContact O-OG1 3.09Å; A457-T459 PolarHBondContact O-N 3.33Å
460	G	32.8	Very low	49.8	Very low	52 Å²	52	43.6 Å²	43.6	54%	0.536	21%	0.211	S	C	.	.			trans	-83.7	0	-172.9	0	0	0	0	0	116.7	A457	A457-G460 PolarHBondContact O-N 3.23Å

Retrieved 460 of 460 residues in 2526.3 ms (Link to these results)

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