A0A087YC68_POEFO Loading...

Sodium/hydrogen exchanger

AlphaFold DB , UniProt , Accession A0A087YC68, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 696 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	45.2	Very low	44.4	Very low	215 Å²	215	80.9 Å²	80.9	100%	1.059	50%	0.499	S	S	*	.				0	-9.3	0	-81.6	157.8	78.4	0	0	112.6	G5	M1-G5 PolarHBondContact O-N 3.13Å
2	D	47.2	Very low	45	Very low	137 Å²	137	88.3 Å²	88.3	73%	0.733	51%	0.511	S	S	*	.	H	α-helix	trans	-77.2	-25.8	-176.3	-54.1	-61.9	0	0	0	115.4	G5 N6	D2-G5 PolarHBondContact O-N 3.24Å; D2-N6 PolarHBondContact O-N 3.41Å; D2-N6 VanDerWaalsContact O-N 3.16Å
3	A	40.7	Very low	45.7	Very low	85 Å²	85	95.4 Å²	95.4	70%	0.702	52%	0.524	S	S	*	.	H	α-helix	trans	-69.3	-33.5	173.8	0	0	0	0	0	112.9	A7	A3-A7 WeakPolarHBondContact O-CB 3.36Å; A3-A7 PolarHBondContact O-N 3.06Å
4	L	41.3	Very low	45.7	Very low	143 Å²	143	90.8 Å²	90.8	75%	0.749	51%	0.505	S	S	*	.	H	α-helix	trans	-74.8	-33.3	175	-99.6	113.3	0	0	0	112.2	A8	L4-A8 WeakPolarHBondContact O-CB 3.35Å; L4-A8 PolarHBondContact O-N 3.2Å
5	G	39.2	Very low	46.3	Very low	40 Å²	40	97.3 Å²	97.3	41%	0.412	52%	0.519	S	S	.	.	H	α-helix	trans	-65.3	-43.1	175.4	0	0	0	0	0	112.9	M1 D2 A8 S9	M1-G5 PolarHBondContact O-N 3.13Å; D2-G5 PolarHBondContact O-N 3.24Å; G5-A8 PolarHBondContact O-N 3.28Å; G5-S9 WeakPolarHBondContact O-CB 3.47Å; G5-S9 PolarHBondContact O-N 3Å; G5-S9 PolarHBondContact O-OG 2.93Å
6	N	45.9	Very low	46.7	Very low	119 Å²	119	95.9 Å²	95.9	64%	0.636	52%	0.515	S	S	*	.	H	α-helix	trans	-69.8	-35.6	175.8	-83.5	-13.4	0	0	0	113	D2 S9 A10	D2-N6 PolarHBondContact O-N 3.41Å; D2-N6 VanDerWaalsContact O-N 3.16Å; N6-S9 PolarHBondContact O-N 3.35Å; N6-S9 PolarHBondContact O-OG 3.21Å; N6-A10 WeakPolarHBondContact O-CB 3.4Å; N6-A10 PolarHBondContact O-N 3.46Å
7	A	44.3	Very low	46.9	Very low	24 Å²	24	97.1 Å²	97.1	20%	0.198	52%	0.519	C	S	.	.	H	α-helix	trans	-67.1	-38.2	173.8	0	0	0	0	0	112.3	A3 A11	A3-A7 WeakPolarHBondContact O-CB 3.36Å; A3-A7 PolarHBondContact O-N 3.06Å; A7-A11 VanDerWaalsContact O-CB 3.27Å; A7-A11 WeakPolarHBondContact O-CB 3.49Å; A7-A11 PolarHBondContact O-N 3.36Å
8	A	46.4	Very low	47	Very low	38 Å²	38	95.6 Å²	95.6	31%	0.314	51%	0.51	S	S	.	.	H	α-helix	trans	-73.8	-27.4	177.6	0	0	0	0	0	113.3	L4 G5 R12	L4-A8 WeakPolarHBondContact O-CB 3.35Å; L4-A8 PolarHBondContact O-N 3.2Å; G5-A8 PolarHBondContact O-N 3.28Å; A8-R12 WeakPolarHBondContact O-CB 3.45Å; A8-R12 PolarHBondContact O-N 3.06Å; A8-R12 PolarHBondContact O-NE 3.41Å
9	S	45.1	Very low	47.3	Very low	37 Å²	37	95.6 Å²	95.6	26%	0.259	51%	0.51	S	S	.	.	H	α-helix	trans	-77.9	-40.7	174.2	74.8	0	0	0	0	111.4	G5 N6 R12 R13	G5-S9 WeakPolarHBondContact O-CB 3.47Å; G5-S9 PolarHBondContact O-N 3Å; G5-S9 PolarHBondContact O-OG 2.93Å; N6-S9 PolarHBondContact O-N 3.35Å; N6-S9 PolarHBondContact O-OG 3.21Å; S9-R12 PolarHBondContact O-N 3.34Å; S9-R13 WeakPolarHBondContact O-CG 3.28Å; S9-R13 PolarHBondContact O-N 2.96Å
10	A	46.9	Very low	47.5	Very low	32 Å²	32	95.5 Å²	95.5	26%	0.264	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-43.4	173.8	0	0	0	0	0	112.1	N6 R12 R13 A14	N6-A10 WeakPolarHBondContact O-CB 3.4Å; N6-A10 PolarHBondContact O-N 3.46Å; A10-R12 VanDerWaalsContact C-N 3.32Å; A10-R12 PolarHBondContact O-N 3.22Å; A10-R13 PolarHBondContact O-N 3.16Å; A10-A14 WeakPolarHBondContact O-CB 3.41Å; A10-A14 PolarHBondContact O-N 3.06Å
11	A	46.1	Very low	47.6	Very low	20 Å²	20	92.8 Å²	92.8	17%	0.165	50%	0.496	C	S	.	.	H	α-helix	trans	-64.8	-34.6	175.2	0	0	0	0	0	112.6	A7 R15	A7-A11 VanDerWaalsContact O-CB 3.27Å; A7-A11 WeakPolarHBondContact O-CB 3.49Å; A7-A11 PolarHBondContact O-N 3.36Å; A11-R15 WeakPolarHBondContact O-CB 3.23Å; A11-R15 WeakPolarHBondContact O-CG 3.13Å; A11-R15 PolarHBondContact O-N 2.8Å
12	R	51.7	Low	48	Very low	169 Å²	169	89.3 Å²	89.3	64%	0.638	47%	0.471	S	S	*	.	H	α-helix	trans	-66	-45.3	171.9	-94.9	180	-82.6	-157.9	-2.7	111.6	A8 S9 A10 A14 R15 T16	A8-R12 WeakPolarHBondContact O-CB 3.45Å; A8-R12 PolarHBondContact O-N 3.06Å; A8-R12 PolarHBondContact O-NE 3.41Å; S9-R12 PolarHBondContact O-N 3.34Å; A10-R12 VanDerWaalsContact C-N 3.32Å; A10-R12 PolarHBondContact O-N 3.22Å; R12-A14 PolarHBondContact O-N 3.45Å; R12-R15 PolarHBondContact O-N 2.86Å; R12-T16 PolarHBondContact O-N 3.31Å; R12-T16 PolarHBondContact O-OG1 3.37Å
13	R	54.1	Low	48.3	Very low	181 Å²	181	86.1 Å²	86.1	68%	0.683	46%	0.456	S	S	*	.	H	α-helix	trans	-62.3	-39.5	176.2	-72.2	177.4	-172.3	-175.3	3.2	112.7	S9 A10 T16 M17	S9-R13 WeakPolarHBondContact O-CG 3.28Å; S9-R13 PolarHBondContact O-N 2.96Å; A10-R13 PolarHBondContact O-N 3.16Å; R13-T16 VanDerWaalsContact CA-OG1 3.3Å; R13-T16 WeakPolarHBondContact CA-OG1 3.36Å; R13-T16 PolarHBondContact O-N 3.46Å; R13-T16 PolarHBondContact O-OG1 3Å; R13-M17 WeakPolarHBondContact O-CB 3.04Å; R13-M17 WeakPolarHBondContact O-CG 2.86Å; R13-M17 PolarHBondContact O-N 2.95Å
14	A	46.2	Very low	48.6	Very low	31 Å²	31	87.1 Å²	87.1	26%	0.256	45%	0.449	S	S	.	.	H	α-helix	trans	-65.3	-42.8	174.2	0	0	0	0	0	111.6	A10 R12 M17 L18	A10-A14 WeakPolarHBondContact O-CB 3.41Å; A10-A14 PolarHBondContact O-N 3.06Å; R12-A14 PolarHBondContact O-N 3.45Å; A14-M17 PolarHBondContact O-N 3.13Å; A14-L18 WeakPolarHBondContact O-CB 3.35Å; A14-L18 WeakPolarHBondContact O-CD1 3.5Å; A14-L18 PolarHBondContact O-N 2.77Å
15	R	53.5	Low	48.7	Very low	188 Å²	188	82.6 Å²	82.6	71%	0.709	43%	0.425	S	S	*	.	H	α-helix	trans	-62.8	-41.7	173.9	-79.2	-177.5	-177.7	-169.5	0.2	112.7	A11 R12 L18 L19	A11-R15 WeakPolarHBondContact O-CB 3.23Å; A11-R15 WeakPolarHBondContact O-CG 3.13Å; A11-R15 PolarHBondContact O-N 2.8Å; R12-R15 PolarHBondContact O-N 2.86Å; R15-L18 PolarHBondContact O-N 3.29Å; R15-L19 WeakPolarHBondContact O-CB 3.14Å; R15-L19 PolarHBondContact O-N 3.47Å
16	T	52.8	Low	49	Very low	76 Å²	76	84.8 Å²	84.8	47%	0.466	43%	0.428	S	S	.	.	H	α-helix	trans	-66.9	-36.2	174.8	22.3	0	0	0	0	112.3	R12 R13 L19 L20	R12-T16 PolarHBondContact O-N 3.31Å; R12-T16 PolarHBondContact O-OG1 3.37Å; R13-T16 VanDerWaalsContact CA-OG1 3.3Å; R13-T16 WeakPolarHBondContact CA-OG1 3.36Å; R13-T16 PolarHBondContact O-N 3.46Å; R13-T16 PolarHBondContact O-OG1 3Å; T16-L19 PolarHBondContact O-N 3.27Å; T16-L20 WeakPolarHBondContact O-CB 3.35Å; T16-L20 WeakPolarHBondContact O-CG 3.25Å; T16-L20 PolarHBondContact O-N 3.11Å
17	M	50.3	Low	48.8	Very low	116 Å²	116	82 Å²	82	57%	0.571	42%	0.421	S	S	*	.	H	α-helix	trans	-65.2	-42.3	172.3	-80.3	-66.6	-169.7	0	0	112.3	R13 A14 L19 L20 V21	R13-M17 WeakPolarHBondContact O-CB 3.04Å; R13-M17 WeakPolarHBondContact O-CG 2.86Å; R13-M17 PolarHBondContact O-N 2.95Å; A14-M17 PolarHBondContact O-N 3.13Å; M17-L19 VanDerWaalsContact C-N 3.34Å; M17-L19 PolarHBondContact O-N 3.4Å; M17-L20 WeakPolarHBondContact O-CB 3.36Å; M17-L20 PolarHBondContact O-N 3.47Å; M17-L20 HydrophobicContact SD-CD1 4.36Å; M17-V21 WeakPolarHBondContact O-CG2 3.45Å; M17-V21 PolarHBondContact O-N 3.32Å
18	L	49.1	Very low	48.7	Very low	69 Å²	69	83.9 Å²	83.9	36%	0.361	43%	0.43	S	S	.	.	H	α-helix	trans	-59.9	-43.2	173.3	-100.4	132	0	0	0	112.1	A14 R15 W22 L68	A14-L18 WeakPolarHBondContact O-CB 3.35Å; A14-L18 WeakPolarHBondContact O-CD1 3.5Å; A14-L18 PolarHBondContact O-N 2.77Å; R15-L18 PolarHBondContact O-N 3.29Å; L18-W22 VanDerWaalsContact O-CB 3.27Å; L18-W22 WeakPolarHBondContact O-CB 3.13Å; L18-W22 PolarHBondContact O-N 3.31Å; L18-L68 HydrophobicContact CD2-CD1 3.4Å; L18-L68 HydrophobicContact CD2-CD2 4.39Å; L18-L68 HydrophobicContact CD2-CG 3.96Å; L18-L68 HydrophobicContact CG-CD1 4.07Å; L18-L68 HydrophobicContact CG-CG 4.45Å
19	L	53.7	Low	48.2	Very low	97 Å²	97	86.3 Å²	86.3	51%	0.508	45%	0.445	S	S	.	.	H	α-helix	trans	-63.8	-41.7	173.8	-86.7	153.8	0	0	0	111.6	R15 T16 M17 W22 T23	R15-L19 WeakPolarHBondContact O-CB 3.14Å; R15-L19 PolarHBondContact O-N 3.47Å; T16-L19 PolarHBondContact O-N 3.27Å; M17-L19 VanDerWaalsContact C-N 3.34Å; M17-L19 PolarHBondContact O-N 3.4Å; L19-W22 HydrophobicContact CD2-CE3 4.25Å; L19-W22 PolarHBondContact O-N 3.02Å; L19-T23 WeakPolarHBondContact O-CB 3.1Å; L19-T23 VanDerWaalsContact O-CG2 3.28Å; L19-T23 WeakPolarHBondContact O-CG2 3.15Å; L19-T23 PolarHBondContact O-N 3.13Å; L19-T23 PolarHBondContact O-OG1 3.4Å
20	L	49.6	Very low	47.6	Very low	92 Å²	92	87.4 Å²	87.4	48%	0.482	46%	0.462	S	S	.	.	H	α-helix	trans	-63.2	-46.8	177.3	-84.2	160.6	0	0	0	112	T16 M17 W22 T23 L24	T16-L20 WeakPolarHBondContact O-CB 3.35Å; T16-L20 WeakPolarHBondContact O-CG 3.25Å; T16-L20 PolarHBondContact O-N 3.11Å; M17-L20 WeakPolarHBondContact O-CB 3.36Å; M17-L20 PolarHBondContact O-N 3.47Å; M17-L20 HydrophobicContact SD-CD1 4.36Å; L20-W22 VanDerWaalsContact C-N 3.34Å; L20-W22 PolarHBondContact O-N 3.04Å; L20-T23 VanDerWaalsContact CA-OG1 3.27Å; L20-T23 WeakPolarHBondContact CA-OG1 3.22Å; L20-T23 PolarHBondContact O-N 3.17Å; L20-T23 PolarHBondContact O-OG1 3.05Å; L20-L24 WeakPolarHBondContact O-CB 3.5Å; L20-L24 PolarHBondContact O-N 3.44Å
21	V	50.9	Low	46.8	Very low	40 Å²	40	92.9 Å²	92.9	24%	0.242	49%	0.486	C	S	.	.	H	α-helix	trans	-62.6	-42.4	176.1	172	0	0	0	0	110.7	M17 L24 L25	M17-V21 WeakPolarHBondContact O-CG2 3.45Å; M17-V21 PolarHBondContact O-N 3.32Å; V21-L24 PolarHBondContact O-N 3.47Å; V21-L25 HydrophobicContact CG1-CD1 3.91Å; V21-L25 WeakPolarHBondContact O-CB 3.49Å; V21-L25 WeakPolarHBondContact O-CG 3.11Å; V21-L25 PolarHBondContact O-N 3.5Å
22	W	53.2	Low	46.1	Very low	142 Å²	142	98.5 Å²	98.5	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-64.8	-39.4	175.4	-176.1	60.7	0	0	0	112.6	L18 L19 L20 L25 N26	L18-W22 VanDerWaalsContact O-CB 3.27Å; L18-W22 WeakPolarHBondContact O-CB 3.13Å; L18-W22 PolarHBondContact O-N 3.31Å; L19-W22 HydrophobicContact CD2-CE3 4.25Å; L19-W22 PolarHBondContact O-N 3.02Å; L20-W22 VanDerWaalsContact C-N 3.34Å; L20-W22 PolarHBondContact O-N 3.04Å; W22-L25 PolarHBondContact O-N 3.43Å; W22-N26 VanDerWaalsContact CE2-ND2 3.32Å; W22-N26 PolarHBondContact NE1-ND2 3.38Å; W22-N26 WeakPolarHBondContact O-CB 3.18Å; W22-N26 PolarHBondContact O-N 3.3Å; W22-N26 PolarHBondContact O-ND2 3.25Å
23	T	52.5	Low	45.1	Very low	69 Å²	69	95 Å²	95	42%	0.423	51%	0.514	S	S	.	.	H	α-helix	trans	-69.2	-34	174	53.1	0	0	0	0	112.6	L19 L20 N26 A27	L19-T23 WeakPolarHBondContact O-CB 3.1Å; L19-T23 VanDerWaalsContact O-CG2 3.28Å; L19-T23 WeakPolarHBondContact O-CG2 3.15Å; L19-T23 PolarHBondContact O-N 3.13Å; L19-T23 PolarHBondContact O-OG1 3.4Å; L20-T23 VanDerWaalsContact CA-OG1 3.27Å; L20-T23 WeakPolarHBondContact CA-OG1 3.22Å; L20-T23 PolarHBondContact O-N 3.17Å; L20-T23 PolarHBondContact O-OG1 3.05Å; T23-N26 PolarHBondContact O-N 3.44Å; T23-A27 WeakPolarHBondContact O-CB 3.22Å; T23-A27 PolarHBondContact O-N 3.48Å
24	L	46.9	Very low	44.3	Very low	107 Å²	107	94.2 Å²	94.2	56%	0.56	52%	0.524	S	S	*	.	H	α-helix	trans	-67	-44.4	174	-91.3	151.9	0	0	0	111.2	L20 V21 N26 A27 V28	L20-L24 WeakPolarHBondContact O-CB 3.5Å; L20-L24 PolarHBondContact O-N 3.44Å; V21-L24 PolarHBondContact O-N 3.47Å; L24-N26 VanDerWaalsContact C-N 3.33Å; L24-N26 PolarHBondContact O-N 2.87Å; L24-A27 PolarHBondContact O-N 3.07Å; L24-V28 VanDerWaalsContact O-CG2 3.28Å; L24-V28 WeakPolarHBondContact O-CG2 3.11Å; L24-V28 PolarHBondContact O-N 3.47Å
25	L	44.3	Very low	43.7	Very low	47 Å²	47	99.9 Å²	99.9	25%	0.246	55%	0.549	C	S	.	.	H	α-helix	trans	-60.2	-41.7	174.1	-78.8	158.7	0	0	0	111.8	V21 W22 S29 T61	V21-L25 HydrophobicContact CG1-CD1 3.91Å; V21-L25 WeakPolarHBondContact O-CB 3.49Å; V21-L25 WeakPolarHBondContact O-CG 3.11Å; V21-L25 PolarHBondContact O-N 3.5Å; W22-L25 PolarHBondContact O-N 3.43Å; L25-S29 PolarHBondContact O-N 2.99Å; L25-S29 PolarHBondContact O-OG 2.81Å; L25-T61 HydrophobicContact CD2-CG2 4.42Å
26	N	46.5	Very low	42.9	Very low	86 Å²	86	93.9 Å²	93.9	46%	0.46	55%	0.546	S	S	.	.	H	α-helix	trans	-71.4	-34.5	176	-75.5	-33.3	0	0	0	113.1	W22 T23 L24 S29	W22-N26 VanDerWaalsContact CE2-ND2 3.32Å; W22-N26 PolarHBondContact NE1-ND2 3.38Å; W22-N26 WeakPolarHBondContact O-CB 3.18Å; W22-N26 PolarHBondContact O-N 3.3Å; W22-N26 PolarHBondContact O-ND2 3.25Å; T23-N26 PolarHBondContact O-N 3.44Å; L24-N26 VanDerWaalsContact C-N 3.33Å; L24-N26 PolarHBondContact O-N 2.87Å; N26-S29 PolarHBondContact O-N 3.12Å
27	A	40.9	Very low	42.3	Very low	60 Å²	60	93.4 Å²	93.4	50%	0.496	56%	0.556	S	S	.	*	H	α-helix	trans	-72.3	-35.7	179.2	0	0	0	0	0	112.6	T23 L24 S29 G30	T23-A27 WeakPolarHBondContact O-CB 3.22Å; T23-A27 PolarHBondContact O-N 3.48Å; L24-A27 PolarHBondContact O-N 3.07Å; A27-S29 PolarHBondContact O-N 2.91Å; A27-G30 PolarHBondContact O-N 3.11Å
28	V	41.3	Very low	41.8	Very low	65 Å²	65	95.8 Å²	95.8	39%	0.394	57%	0.568	S	S	.	*	H	α-helix	trans	-68.2	-25.2	175.6	171.9	0	0	0	0	111.6	L24 G30 V57 L60	L24-V28 VanDerWaalsContact O-CG2 3.28Å; L24-V28 WeakPolarHBondContact O-CG2 3.11Å; L24-V28 PolarHBondContact O-N 3.47Å; V28-G30 VanDerWaalsContact C-N 3.25Å; V28-G30 PolarHBondContact O-N 3.42Å; V28-V57 HydrophobicContact CG1-CG1 4.27Å; V28-V57 HydrophobicContact CG1-CG2 3.78Å; V28-L60 HydrophobicContact CG2-CD2 4.49Å
29	S	37.7	Very low	41.6	Very low	88 Å²	88	97 Å²	97	62%	0.615	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-3.4	177.3	-54.6	0	0	0	0	114.1	L25 N26 A27	L25-S29 PolarHBondContact O-N 2.99Å; L25-S29 PolarHBondContact O-OG 2.81Å; N26-S29 PolarHBondContact O-N 3.12Å; A27-S29 PolarHBondContact O-N 2.91Å
30	G	32.6	Very low	41.5	Very low	61 Å²	61	100.7 Å²	100.7	63%	0.629	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	2.5	-165.8	0	0	0	0	0	118.1	A27 V28	A27-G30 PolarHBondContact O-N 3.11Å; V28-G30 VanDerWaalsContact C-N 3.25Å; V28-G30 PolarHBondContact O-N 3.42Å
31	L	29.5	Very low	41.6	Very low	147 Å²	147	103.8 Å²	103.8	77%	0.77	61%	0.605	S	S	*	*			trans	-102.8	98.8	-175.3	-88.1	136.1	0	0	0	112.2
32	K	30.3	Very low	41.7	Very low	138 Å²	138	105.9 Å²	105.9	60%	0.6	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-101.9	121.2	169.5	-132.1	173.8	-173.1	172.2	0	108.7
33	A	31.1	Very low	41.8	Very low	95 Å²	95	101.9 Å²	101.9	79%	0.785	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-103.8	128.2	166.4	0	0	0	0	0	108
34	D	36.8	Very low	42.2	Very low	165 Å²	165	102.5 Å²	102.5	88%	0.882	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-90.7	126.3	175	-169.5	36.5	0	0	0	107.8
35	D	34.7	Very low	43.1	Very low	149 Å²	149	103.6 Å²	103.6	80%	0.797	61%	0.611	S	S	*	*			trans	-160.3	137.9	150.8	-152.2	16.5	0	0	0	112.2
36	G	36.2	Very low	44.3	Very low	62 Å²	62	105.8 Å²	105.8	64%	0.639	62%	0.619	S	S	*	*			trans	-94.4	160.5	-173.1	0	0	0	0	0	114.8
37	G	40.9	Very low	45.3	Very low	66 Å²	66	107.3 Å²	107.3	68%	0.68	62%	0.623	S	S	*	*			trans	102.4	113.6	148.4	0	0	0	0	0	119
38	M	38.7	Very low	46.5	Very low	167 Å²	167	107.3 Å²	107.3	82%	0.823	62%	0.623	S	S	*	*			trans	84.4	138.1	144.9	-56	-78.3	-156.4	0	0	121.9
39	V	45.1	Very low	48.1	Very low	94 Å²	94	110.9 Å²	110.9	57%	0.57	64%	0.635	S	S	*	*			trans	83.3	113.7	164.5	-158.8	0	0	0	0	117.7	E41 L42 V43	V39-E41 VanDerWaalsContact C-N 3.25Å; V39-E41 PolarHBondContact O-N 3Å; V39-E41 VanDerWaalsContact O-N 3.1Å; V39-L42 HydrophobicContact CB-CB 4.37Å; V39-L42 CarbonylContact O-C 3.48Å; V39-L42 WeakPolarHBondContact O-CA 3.44Å; V39-L42 WeakPolarHBondContact O-CB 3.12Å; V39-L42 PolarHBondContact O-N 3.09Å; V39-V43 WeakPolarHBondContact O-CG2 3.12Å; V39-V43 PolarHBondContact O-N 2.93Å
40	E	52.5	Low	49.6	Very low	175 Å²	175	111.5 Å²	111.5	82%	0.818	63%	0.629	S	S	*	*	H	α-helix	trans	-48.9	-34.3	-178.3	-91.9	172.4	148.3	0	0	115.1	V43 T44	E40-V43 PolarHBondContact O-N 2.98Å; E40-T44 WeakPolarHBondContact O-CG2 3.44Å; E40-T44 PolarHBondContact O-N 3.07Å; E40-T44 PolarHBondContact O-OG1 3.47Å
41	E	51	Low	51.2	Low	156 Å²	156	110.9 Å²	110.9	73%	0.729	62%	0.615	S	S	*	*	H	α-helix	trans	-76.1	-37.5	179.6	-156.3	168	-158.2	0	0	112.1	V39 V43 T44 E45	V39-E41 VanDerWaalsContact C-N 3.25Å; V39-E41 PolarHBondContact O-N 3Å; V39-E41 VanDerWaalsContact O-N 3.1Å; E41-V43 VanDerWaalsContact C-N 3.33Å; E41-T44 WeakPolarHBondContact CA-OG1 3.35Å; E41-T44 PolarHBondContact O-N 3.02Å; E41-T44 PolarHBondContact O-OG1 3.45Å; E41-E45 PolarHBondContact O-N 2.76Å; E41-E45 VanDerWaalsContact O-N 3.1Å
42	L	52.3	Low	53.2	Low	85 Å²	85	110.1 Å²	110.1	45%	0.445	61%	0.607	S	S	.	*	H	α-helix	trans	-72.8	-28.7	172.2	-122.8	152.1	0	0	0	111.5	V39 K46	V39-L42 HydrophobicContact CB-CB 4.37Å; V39-L42 CarbonylContact O-C 3.48Å; V39-L42 WeakPolarHBondContact O-CA 3.44Å; V39-L42 WeakPolarHBondContact O-CB 3.12Å; V39-L42 PolarHBondContact O-N 3.09Å; L42-K46 HydrophobicContact CD2-CD 4.35Å; L42-K46 HydrophobicContact CD2-CG 4.44Å; L42-K46 VanDerWaalsContact O-CB 3.25Å; L42-K46 WeakPolarHBondContact O-CB 3.47Å; L42-K46 VanDerWaalsContact O-CG 3.24Å; L42-K46 WeakPolarHBondContact O-CG 3.44Å; L42-K46 PolarHBondContact O-N 3.17Å
43	V	56.5	Low	55.4	Low	58 Å²	58	109.4 Å²	109.4	35%	0.352	60%	0.6	S	S	.	*	H	α-helix	trans	-68	-42.5	171	172.7	0	0	0	0	110	V39 E40 E41 K46 E47	V39-V43 WeakPolarHBondContact O-CG2 3.12Å; V39-V43 PolarHBondContact O-N 2.93Å; E40-V43 PolarHBondContact O-N 2.98Å; E41-V43 VanDerWaalsContact C-N 3.33Å; V43-K46 PolarHBondContact O-N 2.82Å; V43-E47 HydrophobicContact CG1-CG 4.22Å; V43-E47 WeakPolarHBondContact CG1-OE1 3.44Å; V43-E47 VanDerWaalsContact O-CB 3.25Å; V43-E47 WeakPolarHBondContact O-CB 3.4Å; V43-E47 WeakPolarHBondContact O-CG 3.49Å; V43-E47 PolarHBondContact O-N 2.87Å
44	T	59.6	Low	57.1	Low	82 Å²	82	108.1 Å²	108.1	50%	0.503	58%	0.578	S	S	.	*	H	α-helix	trans	-66.3	-38	175.6	49.8	0	0	0	0	113.3	E40 E41 A48	E40-T44 WeakPolarHBondContact O-CG2 3.44Å; E40-T44 PolarHBondContact O-N 3.07Å; E40-T44 PolarHBondContact O-OG1 3.47Å; E41-T44 WeakPolarHBondContact CA-OG1 3.35Å; E41-T44 PolarHBondContact O-N 3.02Å; E41-T44 PolarHBondContact O-OG1 3.45Å; T44-A48 VanDerWaalsContact O-CB 3.31Å; T44-A48 WeakPolarHBondContact O-CB 3.42Å; T44-A48 PolarHBondContact O-N 3.38Å
45	E	67.3	Low	58.6	Low	129 Å²	129	103.5 Å²	103.5	60%	0.603	55%	0.554	S	S	*	*	H	α-helix	trans	-67.3	-44.2	173.3	-79.5	-171.9	151	0	0	111.8	E41 E47 A48 E49	E41-E45 PolarHBondContact O-N 2.76Å; E41-E45 VanDerWaalsContact O-N 3.1Å; E45-E47 PolarHBondContact O-N 3.35Å; E45-A48 PolarHBondContact O-N 3.34Å; E45-E49 WeakPolarHBondContact O-CG 3.42Å; E45-E49 PolarHBondContact O-N 2.89Å
46	K	69.5	Low	60.5	Low	94 Å²	94	98.9 Å²	98.9	41%	0.409	53%	0.533	S	S	.	.	H	α-helix	trans	-63.7	-39.5	175.6	-78.1	-179.7	175.7	-177	0	112.4	L42 V43 A48 E49 E50	L42-K46 HydrophobicContact CD2-CD 4.35Å; L42-K46 HydrophobicContact CD2-CG 4.44Å; L42-K46 VanDerWaalsContact O-CB 3.25Å; L42-K46 WeakPolarHBondContact O-CB 3.47Å; L42-K46 VanDerWaalsContact O-CG 3.24Å; L42-K46 WeakPolarHBondContact O-CG 3.44Å; L42-K46 PolarHBondContact O-N 3.17Å; V43-K46 PolarHBondContact O-N 2.82Å; K46-A48 VanDerWaalsContact C-N 3.34Å; K46-E49 PolarHBondContact O-N 3.02Å; K46-E50 WeakPolarHBondContact O-CB 3.09Å; K46-E50 VanDerWaalsContact O-CG 3.31Å; K46-E50 WeakPolarHBondContact O-CG 3.21Å; K46-E50 PolarHBondContact O-N 2.66Å
47	E	66.6	Low	62.3	Low	118 Å²	118	97.6 Å²	97.6	55%	0.551	51%	0.512	S	S	*	.	H	α-helix	trans	-65.7	-38	174.6	-77	176.2	-179.1	0	0	111.5	V43 E45 S51	V43-E47 HydrophobicContact CG1-CG 4.22Å; V43-E47 WeakPolarHBondContact CG1-OE1 3.44Å; V43-E47 VanDerWaalsContact O-CB 3.25Å; V43-E47 WeakPolarHBondContact O-CB 3.4Å; V43-E47 WeakPolarHBondContact O-CG 3.49Å; V43-E47 PolarHBondContact O-N 2.87Å; E45-E47 PolarHBondContact O-N 3.35Å; E47-S51 VanDerWaalsContact O-CB 3.31Å; E47-S51 WeakPolarHBondContact O-CB 3.41Å; E47-S51 PolarHBondContact O-N 3.44Å
48	A	66.8	Low	63.6	Low	59 Å²	59	95.1 Å²	95.1	49%	0.488	48%	0.484	S	S	.	.	H	α-helix	trans	-67.5	-42.2	174.3	0	0	0	0	0	112.1	T44 E45 K46 S51 H52	T44-A48 VanDerWaalsContact O-CB 3.31Å; T44-A48 WeakPolarHBondContact O-CB 3.42Å; T44-A48 PolarHBondContact O-N 3.38Å; E45-A48 PolarHBondContact O-N 3.34Å; K46-A48 VanDerWaalsContact C-N 3.34Å; A48-S51 PolarHBondContact O-N 2.74Å; A48-H52 VanDerWaalsContact O-CB 3.3Å; A48-H52 WeakPolarHBondContact O-CB 2.9Å; A48-H52 PolarHBondContact O-N 3.02Å
49	E	73.6	Confident	65.3	Low	140 Å²	140	92.2 Å²	92.2	65%	0.654	47%	0.471	S	S	*	.	H	α-helix	trans	-63.8	-43.2	174.5	-76.8	-174	167.8	0	0	111.9	E45 K46 H52 R53	E45-E49 WeakPolarHBondContact O-CG 3.42Å; E45-E49 PolarHBondContact O-N 2.89Å; K46-E49 PolarHBondContact O-N 3.02Å; E49-H52 PolarHBondContact O-N 2.86Å; E49-R53 WeakPolarHBondContact O-CB 3.5Å; E49-R53 PolarHBondContact O-N 2.76Å
50	E	70.1	Confident	66.7	Low	102 Å²	102	91.4 Å²	91.4	48%	0.477	46%	0.463	S	S	.	.	H	α-helix	trans	-66	-40	176	-76.2	-173.6	170	0	0	111.9	K46 R53 Q54	K46-E50 WeakPolarHBondContact O-CB 3.09Å; K46-E50 VanDerWaalsContact O-CG 3.31Å; K46-E50 WeakPolarHBondContact O-CG 3.21Å; K46-E50 PolarHBondContact O-N 2.66Å; E50-R53 PolarHBondContact O-N 3.12Å; E50-Q54 WeakPolarHBondContact O-CB 3.37Å; E50-Q54 PolarHBondContact O-N 3.48Å
51	S	65.8	Low	67.6	Low	48 Å²	48	84.6 Å²	84.6	34%	0.336	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-46.1	173	-169.1	0	0	0	0	111.2	E47 A48 R53 Q54 D55	E47-S51 VanDerWaalsContact O-CB 3.31Å; E47-S51 WeakPolarHBondContact O-CB 3.41Å; E47-S51 PolarHBondContact O-N 3.44Å; A48-S51 PolarHBondContact O-N 2.74Å; S51-R53 VanDerWaalsContact C-N 3.3Å; S51-R53 PolarHBondContact O-N 3.01Å; S51-Q54 PolarHBondContact O-N 3.44Å; S51-Q54 VanDerWaalsContact O-N 3.14Å; S51-D55 WeakPolarHBondContact O-CB 3.29Å; S51-D55 VanDerWaalsContact O-CG 3.24Å; S51-D55 PolarHBondContact O-N 2.99Å
52	H	71.9	Confident	68.5	Low	130 Å²	130	79 Å²	79	60%	0.602	41%	0.406	S	S	*	.	H	α-helix	trans	-61.4	-39.9	177.5	-176.7	-86.7	0	0	0	111.5	A48 E49 D55 S56	A48-H52 VanDerWaalsContact O-CB 3.3Å; A48-H52 WeakPolarHBondContact O-CB 2.9Å; A48-H52 PolarHBondContact O-N 3.02Å; E49-H52 PolarHBondContact O-N 2.86Å; H52-D55 PolarHBondContact O-N 2.87Å; H52-S56 VanDerWaalsContact O-CB 3.32Å; H52-S56 WeakPolarHBondContact O-CB 3.34Å; H52-S56 PolarHBondContact O-N 3.27Å; H52-S56 PolarHBondContact O-OG 3.35Å
53	R	76.4	Confident	69.7	Low	123 Å²	123	79.6 Å²	79.6	46%	0.464	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-44.3	174.2	-170.7	179.8	68.8	-173.6	-5.9	111	E49 E50 S51 S56 V57	E49-R53 WeakPolarHBondContact O-CB 3.5Å; E49-R53 PolarHBondContact O-N 2.76Å; E50-R53 PolarHBondContact O-N 3.12Å; S51-R53 VanDerWaalsContact C-N 3.3Å; S51-R53 PolarHBondContact O-N 3.01Å; R53-S56 WeakPolarHBondContact O-CB 3.43Å; R53-S56 PolarHBondContact O-N 3.39Å; R53-V57 WeakPolarHBondContact O-CG2 3.28Å; R53-V57 PolarHBondContact O-N 2.97Å
54	Q	67	Low	70.5	Confident	69 Å²	69	77.8 Å²	77.8	32%	0.322	40%	0.399	S	S	.	.	H	α-helix	trans	-64.2	-43.1	177.8	-170.6	63.4	28.7	0	0	112.1	E50 S51 S56 V57 N58	E50-Q54 WeakPolarHBondContact O-CB 3.37Å; E50-Q54 PolarHBondContact O-N 3.48Å; S51-Q54 PolarHBondContact O-N 3.44Å; S51-Q54 VanDerWaalsContact O-N 3.14Å; Q54-S56 VanDerWaalsContact C-N 3.3Å; Q54-S56 PolarHBondContact O-N 2.88Å; Q54-V57 PolarHBondContact O-N 3.21Å; Q54-N58 VanDerWaalsContact O-CG 3.27Å; Q54-N58 PolarHBondContact O-N 3.33Å
55	D	68.1	Low	71	Confident	68 Å²	68	74.6 Å²	74.6	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-66.2	-36.1	177.7	-65.3	-20.9	0	0	0	111	S51 H52 N58 L59	S51-D55 WeakPolarHBondContact O-CB 3.29Å; S51-D55 VanDerWaalsContact O-CG 3.24Å; S51-D55 PolarHBondContact O-N 2.99Å; H52-D55 PolarHBondContact O-N 2.87Å; D55-N58 PolarHBondContact O-N 3.31Å; D55-L59 WeakPolarHBondContact O-CB 3.41Å; D55-L59 WeakPolarHBondContact O-CG 3.32Å; D55-L59 PolarHBondContact O-N 3.49Å
56	S	75.4	Confident	71.2	Confident	51 Å²	51	70 Å²	70	36%	0.357	36%	0.358	S	S	.	.	H	α-helix	trans	-63.1	-39.8	172	-60.8	0	0	0	0	112.4	H52 R53 Q54 L59 L60	H52-S56 VanDerWaalsContact O-CB 3.32Å; H52-S56 WeakPolarHBondContact O-CB 3.34Å; H52-S56 PolarHBondContact O-N 3.27Å; H52-S56 PolarHBondContact O-OG 3.35Å; R53-S56 WeakPolarHBondContact O-CB 3.43Å; R53-S56 PolarHBondContact O-N 3.39Å; Q54-S56 VanDerWaalsContact C-N 3.3Å; Q54-S56 PolarHBondContact O-N 2.88Å; S56-L59 PolarHBondContact O-N 3.5Å; S56-L60 VanDerWaalsContact O-CB 3.3Å; S56-L60 WeakPolarHBondContact O-CB 3.35Å; S56-L60 PolarHBondContact O-N 3.29Å
57	V	72.6	Confident	71.6	Confident	35 Å²	35	68.5 Å²	68.5	21%	0.212	36%	0.357	C	S	.	.	H	α-helix	trans	-67	-40.1	174.9	172.1	0	0	0	0	111.2	V28 R53 Q54 L60 T61	V28-V57 HydrophobicContact CG1-CG1 4.27Å; V28-V57 HydrophobicContact CG1-CG2 3.78Å; R53-V57 WeakPolarHBondContact O-CG2 3.28Å; R53-V57 PolarHBondContact O-N 2.97Å; Q54-V57 PolarHBondContact O-N 3.21Å; V57-L60 PolarHBondContact O-N 3.39Å; V57-T61 PolarHBondContact O-N 3.33Å; V57-T61 PolarHBondContact O-OG1 3.38Å
58	N	69.7	Low	72	Confident	15 Å²	15	64.6 Å²	64.6	8%	0.08	34%	0.34	C	S	.	.	H	α-helix	trans	-62.9	-47.8	175.1	-67.1	-17	0	0	0	110.9	Q54 D55 L60 T61 F62	Q54-N58 VanDerWaalsContact O-CG 3.27Å; Q54-N58 PolarHBondContact O-N 3.33Å; D55-N58 PolarHBondContact O-N 3.31Å; N58-L60 PolarHBondContact O-N 3.21Å; N58-T61 WeakPolarHBondContact O-CB 3.49Å; N58-T61 PolarHBondContact O-N 3.09Å; N58-T61 VanDerWaalsContact O-N 3.11Å; N58-F62 WeakPolarHBondContact O-CD2 3.27Å; N58-F62 PolarHBondContact O-N 2.99Å
59	L	73.1	Confident	72.2	Confident	106 Å²	106	61.8 Å²	61.8	56%	0.555	32%	0.317	S	S	*	.	H	α-helix	trans	-59.8	-43.5	175.3	-75.4	167.9	0	0	0	112	D55 S56 T61 F62 I63	D55-L59 WeakPolarHBondContact O-CB 3.41Å; D55-L59 WeakPolarHBondContact O-CG 3.32Å; D55-L59 PolarHBondContact O-N 3.49Å; S56-L59 PolarHBondContact O-N 3.5Å; L59-T61 VanDerWaalsContact C-N 3.25Å; L59-T61 PolarHBondContact O-N 2.94Å; L59-F62 PolarHBondContact O-N 3Å; L59-I63 WeakPolarHBondContact O-CG1 3.34Å; L59-I63 PolarHBondContact O-N 3.44Å
60	L	75.4	Confident	72.4	Confident	76 Å²	76	57.8 Å²	57.8	40%	0.398	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-37.9	175	-180	64.1	0	0	0	111.6	V28 S56 V57 N58 I63 S64	V28-L60 HydrophobicContact CG2-CD2 4.49Å; S56-L60 VanDerWaalsContact O-CB 3.3Å; S56-L60 WeakPolarHBondContact O-CB 3.35Å; S56-L60 PolarHBondContact O-N 3.29Å; V57-L60 PolarHBondContact O-N 3.39Å; N58-L60 PolarHBondContact O-N 3.21Å; L60-I63 PolarHBondContact O-N 3.11Å; L60-S64 VanDerWaalsContact O-CB 3.23Å; L60-S64 WeakPolarHBondContact O-CB 3.48Å; L60-S64 PolarHBondContact O-N 3.15Å; L60-S64 PolarHBondContact O-OG 3.34Å
61	T	71.3	Confident	72.8	Confident	32 Å²	32	58 Å²	58	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-44.9	176.5	-55.8	0	0	0	0	110.9	L25 V57 N58 L59 S64 L65	L25-T61 HydrophobicContact CD2-CG2 4.42Å; V57-T61 PolarHBondContact O-N 3.33Å; V57-T61 PolarHBondContact O-OG1 3.38Å; N58-T61 WeakPolarHBondContact O-CB 3.49Å; N58-T61 PolarHBondContact O-N 3.09Å; N58-T61 VanDerWaalsContact O-N 3.11Å; L59-T61 VanDerWaalsContact C-N 3.25Å; L59-T61 PolarHBondContact O-N 2.94Å; T61-S64 PolarHBondContact O-N 2.97Å; T61-L65 VanDerWaalsContact O-CB 3.29Å; T61-L65 WeakPolarHBondContact O-CB 3.34Å; T61-L65 PolarHBondContact O-N 3.4Å
62	F	70.7	Confident	72.8	Confident	38 Å²	38	55.9 Å²	55.9	17%	0.167	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-42.6	175.1	-72	-63.2	0	0	0	112.8	N58 L59 L65 L66 V162 F410 L417	N58-F62 WeakPolarHBondContact O-CD2 3.27Å; N58-F62 PolarHBondContact O-N 2.99Å; L59-F62 PolarHBondContact O-N 3Å; F62-L65 WeakPolarHBondContact O-CB 3.42Å; F62-L65 PolarHBondContact O-N 3.45Å; F62-L66 WeakPolarHBondContact O-CB 3.48Å; F62-L66 PolarHBondContact O-N 3.47Å; F62-V162 HydrophobicContact CE1-CG1 4.45Å; F62-V162 HydrophobicContact CZ-CG1 4.03Å; F62-F410 HydrophobicContact CD1-CE2 4.41Å; F62-L417 HydrophobicContact CE1-CD2 3.87Å
63	I	77.6	Confident	72.8	Confident	99 Å²	99	50.4 Å²	50.4	51%	0.508	26%	0.263	S	S	.	.	H	α-helix	trans	-66.2	-41.8	176.9	-67.8	168.9	0	0	0	110.8	L59 L60 L65 L66 T67	L59-I63 WeakPolarHBondContact O-CG1 3.34Å; L59-I63 PolarHBondContact O-N 3.44Å; L60-I63 PolarHBondContact O-N 3.11Å; I63-L65 VanDerWaalsContact C-N 3.3Å; I63-L65 PolarHBondContact O-N 3.36Å; I63-L66 PolarHBondContact O-N 3.49Å; I63-T67 HydrophobicContact CG2-CG2 4.3Å; I63-T67 WeakPolarHBondContact O-CB 3.48Å; I63-T67 VanDerWaalsContact O-CG2 3.28Å; I63-T67 WeakPolarHBondContact O-CG2 3.13Å; I63-T67 PolarHBondContact O-N 2.72Å; I63-T67 PolarHBondContact O-OG1 3.36Å
64	S	72.9	Confident	72.7	Confident	19 Å²	19	51.6 Å²	51.6	13%	0.133	27%	0.268	C	S	.	.	H	α-helix	trans	-63.2	-38.5	176.3	-60.5	0	0	0	0	111.5	L60 T61 T67 L68	L60-S64 VanDerWaalsContact O-CB 3.23Å; L60-S64 WeakPolarHBondContact O-CB 3.48Å; L60-S64 PolarHBondContact O-N 3.15Å; L60-S64 PolarHBondContact O-OG 3.34Å; T61-S64 PolarHBondContact O-N 2.97Å; S64-T67 VanDerWaalsContact CA-OG1 3.3Å; S64-T67 WeakPolarHBondContact CA-OG1 3.48Å; S64-T67 PolarHBondContact O-OG1 3.27Å; S64-L68 WeakPolarHBondContact O-CB 3.32Å; S64-L68 PolarHBondContact O-N 3.27Å
65	L	69	Low	72.7	Confident	15 Å²	15	50.4 Å²	50.4	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-65.8	-48.5	174.4	-175.8	143.9	0	0	0	111.6	T61 F62 I63 T67 L68 T69 V97 S413	T61-L65 VanDerWaalsContact O-CB 3.29Å; T61-L65 WeakPolarHBondContact O-CB 3.34Å; T61-L65 PolarHBondContact O-N 3.4Å; F62-L65 WeakPolarHBondContact O-CB 3.42Å; F62-L65 PolarHBondContact O-N 3.45Å; I63-L65 VanDerWaalsContact C-N 3.3Å; I63-L65 PolarHBondContact O-N 3.36Å; L65-T67 PolarHBondContact O-N 3.18Å; L65-L68 PolarHBondContact O-N 2.85Å; L65-T69 HydrophobicContact CD2-CG2 4.42Å; L65-T69 WeakPolarHBondContact O-CG2 3.11Å; L65-T69 PolarHBondContact O-N 3.36Å; L65-T69 PolarHBondContact O-OG1 2.78Å; L65-V97 HydrophobicContact CD1-CB 3.57Å; L65-V97 HydrophobicContact CD1-CG1 3.54Å; L65-V97 HydrophobicContact CD1-CG2 3.59Å; L65-V97 HydrophobicContact CG-CG2 4.35Å; L65-S413 WeakPolarHBondContact CD2-OG 3.23Å
66	L	71.4	Confident	72.6	Confident	34 Å²	34	50.2 Å²	50.2	18%	0.178	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-45.8	177.9	-171.5	66.9	0	0	0	111.4	F62 I63 L68 T69 I70 F410	F62-L66 WeakPolarHBondContact O-CB 3.48Å; F62-L66 PolarHBondContact O-N 3.47Å; I63-L66 PolarHBondContact O-N 3.49Å; L66-L68 VanDerWaalsContact C-N 3.34Å; L66-L68 PolarHBondContact O-N 3.49Å; L66-T69 WeakPolarHBondContact CA-OG1 3.35Å; L66-T69 PolarHBondContact O-N 3.06Å; L66-T69 PolarHBondContact O-OG1 3.49Å; L66-I70 HydrophobicContact CG-CD1 4.11Å; L66-I70 WeakPolarHBondContact O-CG1 3.49Å; L66-I70 PolarHBondContact O-N 2.88Å; L66-F410 HydrophobicContact CD1-CB 3.93Å; L66-F410 HydrophobicContact CD1-CD2 4.36Å
67	T	79.3	Confident	72.2	Confident	62 Å²	62	55.6 Å²	55.6	38%	0.38	28%	0.276	S	S	.	.	H	α-helix	trans	-61.8	-40.7	176.7	50.8	0	0	0	0	112.3	I63 S64 L65 I70 L71	I63-T67 HydrophobicContact CG2-CG2 4.3Å; I63-T67 WeakPolarHBondContact O-CB 3.48Å; I63-T67 VanDerWaalsContact O-CG2 3.28Å; I63-T67 WeakPolarHBondContact O-CG2 3.13Å; I63-T67 PolarHBondContact O-N 2.72Å; I63-T67 PolarHBondContact O-OG1 3.36Å; S64-T67 VanDerWaalsContact CA-OG1 3.3Å; S64-T67 WeakPolarHBondContact CA-OG1 3.48Å; S64-T67 PolarHBondContact O-OG1 3.27Å; L65-T67 PolarHBondContact O-N 3.18Å; T67-I70 PolarHBondContact O-N 2.75Å; T67-L71 WeakPolarHBondContact O-CB 3.45Å; T67-L71 WeakPolarHBondContact O-CG 3.23Å; T67-L71 PolarHBondContact O-N 3.38Å
68	L	73.8	Confident	72	Confident	35 Å²	35	59.9 Å²	59.9	18%	0.183	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-39.7	175.7	-173.1	149.3	0	0	0	112.1	L18 S64 L65 L66 T72 Y93	L18-L68 HydrophobicContact CD2-CD1 3.4Å; L18-L68 HydrophobicContact CD2-CD2 4.39Å; L18-L68 HydrophobicContact CD2-CG 3.96Å; L18-L68 HydrophobicContact CG-CD1 4.07Å; L18-L68 HydrophobicContact CG-CG 4.45Å; S64-L68 WeakPolarHBondContact O-CB 3.32Å; S64-L68 PolarHBondContact O-N 3.27Å; L65-L68 PolarHBondContact O-N 2.85Å; L66-L68 VanDerWaalsContact C-N 3.34Å; L66-L68 PolarHBondContact O-N 3.49Å; L68-T72 HydrophobicContact CD2-CG2 4.36Å; L68-T72 WeakPolarHBondContact O-CB 3.38Å; L68-T72 VanDerWaalsContact O-CG2 3.23Å; L68-T72 WeakPolarHBondContact O-CG2 3.21Å; L68-T72 PolarHBondContact O-N 2.72Å; L68-T72 PolarHBondContact O-OG1 3.06Å; L68-Y93 HydrophobicContact CD2-CD1 3.82Å; L68-Y93 HydrophobicContact CD2-CE1 4.06Å; L68-Y93 HydrophobicContact CD2-CG 4.37Å
69	T	71.8	Confident	71.9	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-49.8	172.6	60.7	0	0	0	0	110.7	L65 L66 L71 T72 I73 S413	L65-T69 HydrophobicContact CD2-CG2 4.42Å; L65-T69 WeakPolarHBondContact O-CG2 3.11Å; L65-T69 PolarHBondContact O-N 3.36Å; L65-T69 PolarHBondContact O-OG1 2.78Å; L66-T69 WeakPolarHBondContact CA-OG1 3.35Å; L66-T69 PolarHBondContact O-N 3.06Å; L66-T69 PolarHBondContact O-OG1 3.49Å; T69-L71 PolarHBondContact O-N 3.17Å; T69-T72 PolarHBondContact O-N 3.34Å; T69-T72 PolarHBondContact O-OG1 3.21Å; T69-I73 WeakPolarHBondContact O-CB 3.3Å; T69-I73 WeakPolarHBondContact O-CD1 3.41Å; T69-I73 WeakPolarHBondContact O-CG1 3.22Å; T69-I73 PolarHBondContact O-N 3.45Å; T69-S413 WeakPolarHBondContact CG2-OG 3.46Å
70	I	77.5	Confident	71.3	Confident	55 Å²	55	70.7 Å²	70.7	28%	0.282	33%	0.326	S	S	.	.	H	α-helix	trans	-62.4	-44.2	-179.5	-64.2	165.4	0	0	0	112	L66 T67 T72 I73 W74 L406	L66-I70 HydrophobicContact CG-CD1 4.11Å; L66-I70 WeakPolarHBondContact O-CG1 3.49Å; L66-I70 PolarHBondContact O-N 2.88Å; T67-I70 PolarHBondContact O-N 2.75Å; I70-T72 VanDerWaalsContact C-N 3.27Å; I70-T72 PolarHBondContact O-N 2.86Å; I70-I73 WeakPolarHBondContact O-CB 3.32Å; I70-I73 PolarHBondContact O-N 3Å; I70-W74 PolarHBondContact O-N 3.25Å; I70-L406 HydrophobicContact CD1-CD2 3.62Å
71	L	77.5	Confident	70.6	Confident	106 Å²	106	70.6 Å²	70.6	56%	0.555	33%	0.328	S	S	*	.	H	α-helix	trans	-61	-37.1	177.7	-80.9	163.4	0	0	0	112.4	T67 T69 L75	T67-L71 WeakPolarHBondContact O-CB 3.45Å; T67-L71 WeakPolarHBondContact O-CG 3.23Å; T67-L71 PolarHBondContact O-N 3.38Å; T69-L71 PolarHBondContact O-N 3.17Å; L71-L75 PolarHBondContact O-N 3.14Å; L71-L75 VanDerWaalsContact O-N 3.09Å
72	T	67.3	Low	69.9	Low	5 Å²	5	78.3 Å²	78.3	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-78.6	-37.8	-179.5	53	0	0	0	0	111.7	L68 T69 I70 W74 L75 F76 Y93	L68-T72 HydrophobicContact CD2-CG2 4.36Å; L68-T72 WeakPolarHBondContact O-CB 3.38Å; L68-T72 VanDerWaalsContact O-CG2 3.23Å; L68-T72 WeakPolarHBondContact O-CG2 3.21Å; L68-T72 PolarHBondContact O-N 2.72Å; L68-T72 PolarHBondContact O-OG1 3.06Å; T69-T72 PolarHBondContact O-N 3.34Å; T69-T72 PolarHBondContact O-OG1 3.21Å; I70-T72 VanDerWaalsContact C-N 3.27Å; I70-T72 PolarHBondContact O-N 2.86Å; T72-W74 VanDerWaalsContact C-N 3.28Å; T72-W74 PolarHBondContact O-N 2.96Å; T72-L75 WeakPolarHBondContact O-CA 3.17Å; T72-L75 WeakPolarHBondContact O-CB 3.13Å; T72-L75 PolarHBondContact O-N 2.84Å; T72-L75 VanDerWaalsContact O-N 3.08Å; T72-F76 VanDerWaalsContact O-CD2 3.25Å; T72-F76 WeakPolarHBondContact O-CD2 3.4Å; T72-F76 PolarHBondContact O-N 3.26Å; T72-Y93 WeakPolarHBondContact CB-OH 3.34Å; T72-Y93 HydrophobicContact CG2-CE1 4.29Å; T72-Y93 HydrophobicContact CG2-CE2 4.23Å; T72-Y93 WeakPolarHBondContact CG2-OH 3.11Å; T72-Y93 VanDerWaalsContact OG1-CE2 3.26Å; T72-Y93 WeakPolarHBondContact OG1-CE2 3.18Å
73	I	70.6	Confident	69.4	Low	15 Å²	15	84 Å²	84	8%	0.077	38%	0.379	C	S	.	.	H	α-helix	trans	-52	-50.2	168.5	-69.4	165.6	0	0	0	110.2	T69 I70 L75 F76 K77 E86 N409	T69-I73 WeakPolarHBondContact O-CB 3.3Å; T69-I73 WeakPolarHBondContact O-CD1 3.41Å; T69-I73 WeakPolarHBondContact O-CG1 3.22Å; T69-I73 PolarHBondContact O-N 3.45Å; I70-I73 WeakPolarHBondContact O-CB 3.32Å; I70-I73 PolarHBondContact O-N 3Å; I73-L75 VanDerWaalsContact C-N 3.33Å; I73-L75 PolarHBondContact O-N 2.86Å; I73-F76 PolarHBondContact O-N 3.06Å; I73-K77 WeakPolarHBondContact O-CB 3.14Å; I73-K77 PolarHBondContact O-N 3.39Å; I73-E86 HydrophobicContact CB-CG 4.16Å; I73-E86 HydrophobicContact CD1-CG 3.56Å; I73-E86 WeakPolarHBondContact CD1-OE1 3.26Å; I73-E86 HydrophobicContact CG1-CG 3.55Å; I73-E86 HydrophobicContact CG2-CG 3.59Å; I73-E86 WeakPolarHBondContact CG2-OE1 3.06Å; I73-E86 WeakPolarHBondContact CG2-OE2 3.27Å; I73-N409 WeakPolarHBondContact CD1-OD1 3.42Å
74	W	73.8	Confident	68.7	Low	148 Å²	148	82.9 Å²	82.9	56%	0.561	37%	0.373	S	S	*	.	H	α-helix	trans	-57.9	-45.1	176.2	177	88.1	0	0	0	112	I70 T72 F76 K77 H78	I70-W74 PolarHBondContact O-N 3.25Å; T72-W74 VanDerWaalsContact C-N 3.28Å; T72-W74 PolarHBondContact O-N 2.96Å; W74-F76 VanDerWaalsContact C-N 3.35Å; W74-F76 PolarHBondContact O-N 3.28Å; W74-K77 PolarHBondContact O-N 3.39Å; W74-H78 PolarHBondContact O-N 3.46Å; W74-H78 VanDerWaalsContact O-N 3.08Å
75	L	68.5	Low	68.6	Low	43 Å²	43	83.7 Å²	83.7	23%	0.225	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-41	177.9	-174.3	70.7	0	0	0	112.2	L71 T72 I73 H78 R79	L71-L75 PolarHBondContact O-N 3.14Å; L71-L75 VanDerWaalsContact O-N 3.09Å; T72-L75 WeakPolarHBondContact O-CA 3.17Å; T72-L75 WeakPolarHBondContact O-CB 3.13Å; T72-L75 PolarHBondContact O-N 2.84Å; T72-L75 VanDerWaalsContact O-N 3.08Å; I73-L75 VanDerWaalsContact C-N 3.33Å; I73-L75 PolarHBondContact O-N 2.86Å; L75-H78 PolarHBondContact O-N 2.78Å; L75-R79 WeakPolarHBondContact O-CB 3.26Å; L75-R79 VanDerWaalsContact O-CG 3.24Å; L75-R79 WeakPolarHBondContact O-CG 3.24Å; L75-R79 PolarHBondContact O-N 2.75Å
76	F	65.4	Low	68.9	Low	65 Å²	65	85.3 Å²	85.3	29%	0.285	38%	0.382	S	S	.	.	H	α-helix	trans	-71.9	-40.1	179.5	-87.1	-75.4	0	0	0	112.5	T72 I73 W74 H78 R79 R80 V81 L89	T72-F76 VanDerWaalsContact O-CD2 3.25Å; T72-F76 WeakPolarHBondContact O-CD2 3.4Å; T72-F76 PolarHBondContact O-N 3.26Å; I73-F76 PolarHBondContact O-N 3.06Å; W74-F76 VanDerWaalsContact C-N 3.35Å; W74-F76 PolarHBondContact O-N 3.28Å; F76-H78 PolarHBondContact O-N 3.23Å; F76-R79 CarbonylContact O-C 3.5Å; F76-R79 PolarHBondContact O-N 3.18Å; F76-R80 PolarHBondContact O-N 2.98Å; F76-R80 VanDerWaalsContact O-N 3.08Å; F76-V81 HydrophobicContact CD1-CB 4.2Å; F76-V81 HydrophobicContact CD1-CG2 3.99Å; F76-V81 HydrophobicContact CE1-CG2 4.22Å; F76-L89 HydrophobicContact CB-CD1 4.01Å; F76-L89 HydrophobicContact CD1-CD1 4.21Å; F76-L89 HydrophobicContact CD2-CD1 3.73Å; F76-L89 HydrophobicContact CE2-CD1 4.25Å; F76-L89 HydrophobicContact CE2-CD2 4.24Å; F76-L89 HydrophobicContact CG-CD1 3.72Å; F76-L89 HydrophobicContact CZ-CD2 4.26Å
77	K	66.9	Low	69.2	Low	163 Å²	163	83.9 Å²	83.9	71%	0.709	38%	0.375	S	S	*	.	H	α-helix	trans	-56.9	-38.2	171.7	-167.1	168.7	-173	166.3	0	110.9	I73 W74	I73-K77 WeakPolarHBondContact O-CB 3.14Å; I73-K77 PolarHBondContact O-N 3.39Å; W74-K77 PolarHBondContact O-N 3.39Å
78	H	69.1	Low	69.2	Low	125 Å²	125	81 Å²	81	58%	0.579	36%	0.358	S	S	*	.	H	α-helix	trans	-73.5	-28.7	175.8	-160.9	64.8	0	0	0	113.8	W74 L75 F76	W74-H78 PolarHBondContact O-N 3.46Å; W74-H78 VanDerWaalsContact O-N 3.08Å; L75-H78 PolarHBondContact O-N 2.78Å; F76-H78 PolarHBondContact O-N 3.23Å
79	R	67.1	Low	69.5	Low	152 Å²	152	80.1 Å²	80.1	57%	0.574	35%	0.353	S	S	*	.	H	α-helix	trans	-90.1	-0.9	-179.4	-68.8	-84.4	-103	-160.3	-3.9	114.3	L75 F76 V81	L75-R79 WeakPolarHBondContact O-CB 3.26Å; L75-R79 VanDerWaalsContact O-CG 3.24Å; L75-R79 WeakPolarHBondContact O-CG 3.24Å; L75-R79 PolarHBondContact O-N 2.75Å; F76-R79 CarbonylContact O-C 3.5Å; F76-R79 PolarHBondContact O-N 3.18Å; R79-V81 VanDerWaalsContact C-N 3.3Å; R79-V81 HydrophobicContact CB-CG2 4.46Å; R79-V81 PolarHBondContact O-N 3.39Å
80	R	60.7	Low	70	Confident	197 Å²	197	80.1 Å²	80.1	74%	0.743	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	39.5	175.7	-79.2	-125.8	-170.3	-175.3	2.8	114.7	F76 R82	F76-R80 PolarHBondContact O-N 2.98Å; F76-R80 VanDerWaalsContact O-N 3.08Å; R80-R82 PolarHBondContact O-N 3.39Å
81	V	59.6	Low	70.4	Confident	74 Å²	74	77.5 Å²	77.5	45%	0.448	34%	0.34	S	S	.	.			trans	-75.8	97.5	172.6	-174.1	0	0	0	0	108.6	F76 R79 F83	F76-V81 HydrophobicContact CD1-CB 4.2Å; F76-V81 HydrophobicContact CD1-CG2 3.99Å; F76-V81 HydrophobicContact CE1-CG2 4.22Å; R79-V81 VanDerWaalsContact C-N 3.3Å; R79-V81 HydrophobicContact CB-CG2 4.46Å; R79-V81 PolarHBondContact O-N 3.39Å; V81-F83 VanDerWaalsContact C-N 3.28Å; V81-F83 PolarHBondContact O-N 2.93Å
82	R	58.4	Low	70.7	Confident	193 Å²	193	75.4 Å²	75.4	73%	0.728	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-9.6	-170.9	-109.2	178.2	179	174	-2.2	116.2	R80	R80-R82 PolarHBondContact O-N 3.39Å
83	F	58.4	Low	71.4	Confident	159 Å²	159	77.5 Å²	77.5	70%	0.697	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-12.7	-168	-77	-79.2	0	0	0	115.2	V81	V81-F83 VanDerWaalsContact C-N 3.28Å; V81-F83 PolarHBondContact O-N 2.93Å
84	L	63.1	Low	72	Confident	74 Å²	74	76.8 Å²	76.8	39%	0.387	33%	0.333	S	S	.	.	S	Bend	trans	-127.2	119.4	-179	-87.5	158.1	0	0	0	109.8	L89	L84-L89 HydrophobicContact CB-CD2 4.26Å; L84-L89 HydrophobicContact CB-CG 4.29Å; L84-L89 HydrophobicContact CD1-CD2 4.23Å
85	H	71.3	Confident	72.6	Confident	37 Å²	37	71.9 Å²	71.9	17%	0.171	32%	0.317	C	S	.	.			trans	-70.3	155.7	172.8	-174	-104.5	0	0	0	111.3	T87 G88 L89 T252 A255	H85-T87 VanDerWaalsContact C-N 3.32Å; H85-T87 PolarHBondContact ND1-N 3.38Å; H85-T87 PolarHBondContact ND1-OG1 3.36Å; H85-T87 PolarHBondContact O-N 2.73Å; H85-G88 PolarHBondContact O-N 3.05Å; H85-G88 VanDerWaalsContact O-N 3.12Å; H85-L89 PolarHBondContact O-N 3.18Å; H85-T252 HydrophobicContact CB-CG2 3.39Å; H85-T252 VanDerWaalsContact CG-CG2 3.47Å; H85-T252 PolarHBondContact ND1-OG1 3.48Å; H85-A255 WeakPolarHBondContact NE2-CB 3.25Å
86	E	75.4	Confident	73.3	Confident	49 Å²	49	74.2 Å²	74.2	23%	0.229	33%	0.329	C	S	.	.	H	α-helix	trans	-49.2	-48.7	-178.5	-170.5	174.1	151.8	0	0	113.4	I73 G88 L89 A90 F405 N409	I73-E86 HydrophobicContact CB-CG 4.16Å; I73-E86 HydrophobicContact CD1-CG 3.56Å; I73-E86 WeakPolarHBondContact CD1-OE1 3.26Å; I73-E86 HydrophobicContact CG1-CG 3.55Å; I73-E86 HydrophobicContact CG2-CG 3.59Å; I73-E86 WeakPolarHBondContact CG2-OE1 3.06Å; I73-E86 WeakPolarHBondContact CG2-OE2 3.27Å; E86-G88 VanDerWaalsContact C-N 3.35Å; E86-G88 PolarHBondContact O-N 2.88Å; E86-L89 WeakPolarHBondContact O-CB 3.46Å; E86-L89 PolarHBondContact O-N 3.45Å; E86-L89 VanDerWaalsContact O-N 3.15Å; E86-A90 PolarHBondContact O-N 2.95Å; E86-F405 WeakPolarHBondContact OE1-CE2 3.35Å; E86-F405 WeakPolarHBondContact OE1-CZ 3.36Å; E86-N409 PolarHBondContact OE1-ND2 2.93Å; E86-N409 PolarHBondContact OE1-OD1 2.9Å
87	T	77.8	Confident	73.9	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.018	32%	0.324	C	S	.	.	H	α-helix	trans	-60.7	-39.9	-179.9	55.7	0	0	0	0	112.9	H85 L89 A90 M91 T252 E408 F412	H85-T87 VanDerWaalsContact C-N 3.32Å; H85-T87 PolarHBondContact ND1-N 3.38Å; H85-T87 PolarHBondContact ND1-OG1 3.36Å; H85-T87 PolarHBondContact O-N 2.73Å; T87-L89 VanDerWaalsContact C-N 3.31Å; T87-L89 PolarHBondContact O-N 2.88Å; T87-A90 PolarHBondContact O-N 3.15Å; T87-M91 PolarHBondContact O-N 3.03Å; T87-M91 VanDerWaalsContact O-N 3.16Å; T87-T252 PolarHBondContact OG1-OG1 3.07Å; T87-E408 VanDerWaalsContact CG2-OE1 3.29Å; T87-E408 WeakPolarHBondContact CG2-OE1 3.46Å; T87-F412 HydrophobicContact CG2-CD2 3.6Å; T87-F412 HydrophobicContact CG2-CE2 3.53Å; T87-F412 HydrophobicContact CG2-CG 4.33Å; T87-F412 HydrophobicContact CG2-CZ 4.21Å
88	G	79.7	Confident	74.5	Confident	3 Å²	3	64.7 Å²	64.7	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-34.9	177.6	0	0	0	0	0	112.4	H85 E86 I92 W509	H85-G88 PolarHBondContact O-N 3.05Å; H85-G88 VanDerWaalsContact O-N 3.12Å; E86-G88 VanDerWaalsContact C-N 3.35Å; E86-G88 PolarHBondContact O-N 2.88Å; G88-I92 WeakPolarHBondContact O-CG1 3.44Å; G88-I92 PolarHBondContact O-N 3.17Å; G88-W509 PolarHBondContact O-NE1 3.2Å
89	L	80.4	Confident	75.2	Confident	15 Å²	15	61 Å²	61	8%	0.079	28%	0.277	C	S	.	.	H	α-helix	trans	-70.7	-45.5	174.4	-67.6	170	0	0	0	111.5	F76 L84 H85 E86 T87 M91 I92 Y93	F76-L89 HydrophobicContact CB-CD1 4.01Å; F76-L89 HydrophobicContact CD1-CD1 4.21Å; F76-L89 HydrophobicContact CD2-CD1 3.73Å; F76-L89 HydrophobicContact CE2-CD1 4.25Å; F76-L89 HydrophobicContact CE2-CD2 4.24Å; F76-L89 HydrophobicContact CG-CD1 3.72Å; F76-L89 HydrophobicContact CZ-CD2 4.26Å; L84-L89 HydrophobicContact CB-CD2 4.26Å; L84-L89 HydrophobicContact CB-CG 4.29Å; L84-L89 HydrophobicContact CD1-CD2 4.23Å; H85-L89 PolarHBondContact O-N 3.18Å; E86-L89 WeakPolarHBondContact O-CB 3.46Å; E86-L89 PolarHBondContact O-N 3.45Å; E86-L89 VanDerWaalsContact O-N 3.15Å; T87-L89 VanDerWaalsContact C-N 3.31Å; T87-L89 PolarHBondContact O-N 2.88Å; L89-M91 PolarHBondContact O-N 3.22Å; L89-I92 HydrophobicContact CD2-CD1 4.47Å; L89-I92 WeakPolarHBondContact O-CB 3.34Å; L89-I92 PolarHBondContact O-N 3.05Å; L89-Y93 WeakPolarHBondContact O-CD2 3.41Å; L89-Y93 PolarHBondContact O-N 3.03Å; L89-Y93 VanDerWaalsContact O-N 3.07Å
90	A	82.1	Confident	75.7	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-54	-40.6	176.9	0	0	0	0	0	111.7	E86 T87 Y93 G94 F412 S413	E86-A90 PolarHBondContact O-N 2.95Å; T87-A90 PolarHBondContact O-N 3.15Å; A90-Y93 PolarHBondContact O-N 3.39Å; A90-G94 PolarHBondContact O-N 3.47Å; A90-F412 HydrophobicContact CB-CB 4.09Å; A90-S413 WeakPolarHBondContact O-CA 3.39Å; A90-S413 PolarHBondContact O-OG 3.41Å; A90-S413 VanDerWaalsContact O-OG 3.11Å
91	M	85.7	Confident	76.3	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.4	-37.9	176.7	-167.7	173.6	62.4	0	0	113.5	T87 L89 G94 L95 F412 G416 F505 V508 W509	T87-M91 PolarHBondContact O-N 3.03Å; T87-M91 VanDerWaalsContact O-N 3.16Å; L89-M91 PolarHBondContact O-N 3.22Å; M91-G94 PolarHBondContact O-N 3.46Å; M91-L95 WeakPolarHBondContact O-CB 3.08Å; M91-L95 PolarHBondContact O-N 2.93Å; M91-F412 WeakPolarHBondContact CA-O 3.29Å; M91-G416 WeakPolarHBondContact O-CA 3.38Å; M91-F505 HydrophobicContact CE-CB 4.34Å; M91-F505 HydrophobicContact CE-CD1 3.45Å; M91-F505 VanDerWaalsContact CE-CD1 3.45Å; M91-F505 HydrophobicContact CE-CE1 4.04Å; M91-F505 HydrophobicContact CE-CG 4.04Å; M91-F505 HydrophobicContact CG-CD1 3.81Å; M91-F505 HydrophobicContact CG-CE1 3.38Å; M91-F505 HydrophobicContact CG-CZ 3.84Å; M91-F505 HydrophobicContact SD-CB 4.45Å; M91-F505 HydrophobicContact SD-CD1 3.42Å; M91-F505 WeakPolarHBondContact SD-CD1 3.21Å; M91-F505 HydrophobicContact SD-CD2 4.2Å; M91-F505 HydrophobicContact SD-CE1 3.64Å; M91-F505 HydrophobicContact SD-CE2 4.38Å; M91-F505 HydrophobicContact SD-CG 3.75Å; M91-F505 HydrophobicContact SD-CZ 4.15Å; M91-V508 HydrophobicContact CE-CB 4.16Å; M91-V508 HydrophobicContact CE-CG1 4.18Å; M91-W509 VanDerWaalsContact CE-CD1 3.47Å; M91-W509 HydrophobicContact CE-CD2 4.12Å; M91-W509 HydrophobicContact CE-CG 4.05Å; M91-W509 HydrophobicContact CE-CZ2 4.12Å
92	I	84	Confident	77.1	Confident	62 Å²	62	49.3 Å²	49.3	32%	0.318	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-43.1	173.7	-68.6	164.7	0	0	0	110.8	G88 L89 L95 L96 W509	G88-I92 WeakPolarHBondContact O-CG1 3.44Å; G88-I92 PolarHBondContact O-N 3.17Å; L89-I92 HydrophobicContact CD2-CD1 4.47Å; L89-I92 WeakPolarHBondContact O-CB 3.34Å; L89-I92 PolarHBondContact O-N 3.05Å; I92-L95 WeakPolarHBondContact O-CB 3.29Å; I92-L95 PolarHBondContact O-N 3.07Å; I92-L96 PolarHBondContact O-N 3.08Å; I92-W509 HydrophobicContact CD1-CZ2 4.17Å; I92-W509 HydrophobicContact CG1-CH2 4.25Å; I92-W509 HydrophobicContact CG1-CZ2 3.32Å
93	Y	80.5	Confident	78	Confident	50 Å²	50	47.8 Å²	47.8	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-65.6	-42.7	177.7	-76.4	-66.7	0	0	0	112	L68 T72 L89 A90 L95 L96 V97	L68-Y93 HydrophobicContact CD2-CD1 3.82Å; L68-Y93 HydrophobicContact CD2-CE1 4.06Å; L68-Y93 HydrophobicContact CD2-CG 4.37Å; T72-Y93 WeakPolarHBondContact CB-OH 3.34Å; T72-Y93 HydrophobicContact CG2-CE1 4.29Å; T72-Y93 HydrophobicContact CG2-CE2 4.23Å; T72-Y93 WeakPolarHBondContact CG2-OH 3.11Å; T72-Y93 VanDerWaalsContact OG1-CE2 3.26Å; T72-Y93 WeakPolarHBondContact OG1-CE2 3.18Å; L89-Y93 WeakPolarHBondContact O-CD2 3.41Å; L89-Y93 PolarHBondContact O-N 3.03Å; L89-Y93 VanDerWaalsContact O-N 3.07Å; A90-Y93 PolarHBondContact O-N 3.39Å; Y93-L95 VanDerWaalsContact C-N 3.26Å; Y93-L95 PolarHBondContact O-N 2.97Å; Y93-L96 PolarHBondContact O-N 3.44Å; Y93-V97 WeakPolarHBondContact O-CG2 3.38Å; Y93-V97 PolarHBondContact O-N 2.96Å
94	G	83.8	Confident	78.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-54.1	-45.8	171.6	0	0	0	0	0	112	A90 M91 V97 G98 S413 G416 L417	A90-G94 PolarHBondContact O-N 3.47Å; M91-G94 PolarHBondContact O-N 3.46Å; G94-V97 PolarHBondContact O-N 3.45Å; G94-G98 PolarHBondContact O-N 3.41Å; G94-S413 WeakPolarHBondContact CA-O 3.37Å; G94-G416 CarbonylContact O-C 3.55Å; G94-L417 VanDerWaalsContact C-N 3.29Å; G94-L417 VanDerWaalsContact O-CA 3.26Å; G94-L417 WeakPolarHBondContact O-CA 3.47Å; G94-L417 PolarHBondContact O-N 3.36Å
95	L	86.3	Confident	78.2	Confident	45 Å²	45	41.5 Å²	41.5	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-46.5	177.4	-174.4	146.9	0	0	0	112.1	M91 I92 Y93 V97 G98 V99 G416 L419 F420 F505	M91-L95 WeakPolarHBondContact O-CB 3.08Å; M91-L95 PolarHBondContact O-N 2.93Å; I92-L95 WeakPolarHBondContact O-CB 3.29Å; I92-L95 PolarHBondContact O-N 3.07Å; Y93-L95 VanDerWaalsContact C-N 3.26Å; Y93-L95 PolarHBondContact O-N 2.97Å; L95-V97 VanDerWaalsContact C-N 3.33Å; L95-V97 PolarHBondContact O-N 3.17Å; L95-G98 PolarHBondContact O-N 2.94Å; L95-G98 VanDerWaalsContact O-N 3.17Å; L95-V99 HydrophobicContact CD2-CG2 4.3Å; L95-V99 WeakPolarHBondContact O-CG2 3.44Å; L95-V99 PolarHBondContact O-N 3.29Å; L95-G416 VanDerWaalsContact CA-O 3.31Å; L95-G416 WeakPolarHBondContact CA-O 3.41Å; L95-G416 VanDerWaalsContact N-C 3.33Å; L95-G416 PolarHBondContact N-O 3.44Å; L95-L419 HydrophobicContact CD1-CD2 3.72Å; L95-F420 HydrophobicContact CD1-CE2 4.06Å; L95-F420 HydrophobicContact CD2-CE2 4.03Å; L95-F420 HydrophobicContact CG-CD2 4.11Å; L95-F420 HydrophobicContact CG-CE2 3.7Å; L95-F505 HydrophobicContact CD1-CE1 3.81Å; L95-F505 HydrophobicContact CD1-CZ 4.19Å
96	L	83.4	Confident	77.3	Confident	91 Å²	91	44.6 Å²	44.6	48%	0.476	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-43.3	177.8	-178.2	136.1	0	0	0	111.4	I92 Y93 V99 I100	I92-L96 PolarHBondContact O-N 3.08Å; Y93-L96 PolarHBondContact O-N 3.44Å; L96-V99 PolarHBondContact O-N 2.99Å; L96-I100 HydrophobicContact CD2-CD1 3.52Å; L96-I100 HydrophobicContact CG-CD1 4.19Å; L96-I100 VanDerWaalsContact O-CG1 3.27Å; L96-I100 WeakPolarHBondContact O-CG1 3.33Å; L96-I100 PolarHBondContact O-N 3.5Å
97	V	78.3	Confident	76	Confident	28 Å²	28	44 Å²	44	17%	0.17	24%	0.237	C	C	.	.	H	α-helix	trans	-67.6	-39.2	175.1	177.7	0	0	0	0	110.9	L65 Y93 G94 L95 V99 I100 L101 L417	L65-V97 HydrophobicContact CD1-CB 3.57Å; L65-V97 HydrophobicContact CD1-CG1 3.54Å; L65-V97 HydrophobicContact CD1-CG2 3.59Å; L65-V97 HydrophobicContact CG-CG2 4.35Å; Y93-V97 WeakPolarHBondContact O-CG2 3.38Å; Y93-V97 PolarHBondContact O-N 2.96Å; G94-V97 PolarHBondContact O-N 3.45Å; L95-V97 VanDerWaalsContact C-N 3.33Å; L95-V97 PolarHBondContact O-N 3.17Å; V97-V99 VanDerWaalsContact C-N 3.29Å; V97-V99 PolarHBondContact O-N 2.89Å; V97-I100 CarbonylContact O-C 3.58Å; V97-I100 PolarHBondContact O-N 3.49Å; V97-I100 VanDerWaalsContact O-N 3.08Å; V97-L101 HydrophobicContact CG1-CD1 4.01Å; V97-L101 HydrophobicContact CG1-CG 3.92Å; V97-L101 WeakPolarHBondContact O-CG 3.24Å; V97-L101 PolarHBondContact O-N 3.45Å; V97-L417 HydrophobicContact CB-CD1 4.3Å; V97-L417 HydrophobicContact CG1-CD1 3.96Å
98	G	79.3	Confident	74.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.1	-42.6	176.1	0	0	0	0	0	112.1	G94 L95 R102 L417	G94-G98 PolarHBondContact O-N 3.41Å; L95-G98 PolarHBondContact O-N 2.94Å; L95-G98 VanDerWaalsContact O-N 3.17Å; G98-R102 VanDerWaalsContact O-CB 3.31Å; G98-R102 WeakPolarHBondContact O-CB 3.44Å; G98-R102 PolarHBondContact O-N 3.14Å; G98-L417 VanDerWaalsContact CA-CD1 3.46Å
99	V	83.4	Confident	72.3	Confident	49 Å²	49	49.8 Å²	49.8	30%	0.297	27%	0.274	S	S	.	.	H	α-helix	trans	-63.3	-46.3	173	173.3	0	0	0	0	110.9	L95 L96 V97 L101 R102 Y103 F420	L95-V99 HydrophobicContact CD2-CG2 4.3Å; L95-V99 WeakPolarHBondContact O-CG2 3.44Å; L95-V99 PolarHBondContact O-N 3.29Å; L96-V99 PolarHBondContact O-N 2.99Å; V97-V99 VanDerWaalsContact C-N 3.29Å; V97-V99 PolarHBondContact O-N 2.89Å; V99-L101 PolarHBondContact O-N 3.31Å; V99-R102 PolarHBondContact O-N 2.93Å; V99-Y103 HydrophobicContact CG1-CD2 3.85Å; V99-Y103 HydrophobicContact CG1-CE2 4.39Å; V99-Y103 WeakPolarHBondContact O-CB 3.48Å; V99-Y103 WeakPolarHBondContact O-CD2 3.27Å; V99-Y103 PolarHBondContact O-N 3.44Å; V99-F420 HydrophobicContact CG2-CD1 4.03Å; V99-F420 HydrophobicContact CG2-CD2 3.65Å; V99-F420 HydrophobicContact CG2-CE1 3.95Å; V99-F420 HydrophobicContact CG2-CE2 3.57Å; V99-F420 HydrophobicContact CG2-CG 3.89Å; V99-F420 HydrophobicContact CG2-CZ 3.72Å
100	I	79.1	Confident	70.4	Confident	77 Å²	77	53.4 Å²	53.4	40%	0.395	29%	0.288	S	S	.	.	H	α-helix	trans	-63.1	-41.4	178.5	-67.8	166.4	0	0	0	111.5	L96 V97 G104	L96-I100 HydrophobicContact CD2-CD1 3.52Å; L96-I100 HydrophobicContact CG-CD1 4.19Å; L96-I100 VanDerWaalsContact O-CG1 3.27Å; L96-I100 WeakPolarHBondContact O-CG1 3.33Å; L96-I100 PolarHBondContact O-N 3.5Å; V97-I100 CarbonylContact O-C 3.58Å; V97-I100 PolarHBondContact O-N 3.49Å; V97-I100 VanDerWaalsContact O-N 3.08Å; I100-G104 WeakPolarHBondContact O-CA 3.38Å; I100-G104 PolarHBondContact O-N 3.37Å
101	L	73.3	Confident	68.4	Low	18 Å²	18	59.8 Å²	59.8	9%	0.094	32%	0.317	C	S	.	.	H	α-helix	trans	-68.4	-37.7	177.9	-67.8	-176.6	0	0	0	111.4	V97 V99 I105 V162 L417	V97-L101 HydrophobicContact CG1-CD1 4.01Å; V97-L101 HydrophobicContact CG1-CG 3.92Å; V97-L101 WeakPolarHBondContact O-CG 3.24Å; V97-L101 PolarHBondContact O-N 3.45Å; V99-L101 PolarHBondContact O-N 3.31Å; L101-I105 HydrophobicContact CD2-CD1 3.48Å; L101-I105 VanDerWaalsContact CD2-CD1 3.48Å; L101-I105 HydrophobicContact CD2-CG1 4.4Å; L101-V162 HydrophobicContact CD1-CG1 3.82Å; L101-L417 HydrophobicContact CD1-CD1 3.75Å
102	R	75.9	Confident	66	Low	82 Å²	82	66.7 Å²	66.7	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-70	-40.8	179.4	-172.2	177.1	-171.5	156	-2.4	113	G98 V99 Q155 F420	G98-R102 VanDerWaalsContact O-CB 3.31Å; G98-R102 WeakPolarHBondContact O-CB 3.44Å; G98-R102 PolarHBondContact O-N 3.14Å; V99-R102 PolarHBondContact O-N 2.93Å; R102-Q155 PolarHBondContact O-NE2 3.34Å; R102-F420 WeakPolarHBondContact CD-O 3.31Å; R102-F420 PolarHBondContact NH1-O 3.24Å
103	Y	77.8	Confident	63.8	Low	161 Å²	161	71.7 Å²	71.7	63%	0.631	37%	0.373	S	S	*	.	H	α-helix	trans	-112.2	-17.4	-171.1	-63.2	-71.3	0	0	0	114.6	V99	V99-Y103 HydrophobicContact CG1-CD2 3.85Å; V99-Y103 HydrophobicContact CG1-CE2 4.39Å; V99-Y103 WeakPolarHBondContact O-CB 3.48Å; V99-Y103 WeakPolarHBondContact O-CD2 3.27Å; V99-Y103 PolarHBondContact O-N 3.44Å
104	G	63.4	Low	61.8	Low	48 Å²	48	74.8 Å²	74.8	50%	0.495	40%	0.398	S	S	.	.	H	α-helix	trans	-100.5	-18	-172.5	0	0	0	0	0	115.1	I100 P106	I100-G104 WeakPolarHBondContact O-CA 3.38Å; I100-G104 PolarHBondContact O-N 3.37Å; G104-P106 VanDerWaalsContact O-CD 3.23Å; G104-P106 WeakPolarHBondContact O-CD 3.4Å
105	I	61.7	Low	59.7	Low	53 Å²	53	80.1 Å²	80.1	27%	0.272	43%	0.432	S	S	.	.	S	Bend	trans	-97.5	102.5	171.1	-56.2	174.6	0	0	0	107.8	L101 A107 M158	L101-I105 HydrophobicContact CD2-CD1 3.48Å; L101-I105 VanDerWaalsContact CD2-CD1 3.48Å; L101-I105 HydrophobicContact CD2-CG1 4.4Å; I105-A107 PolarHBondContact O-N 2.94Å; I105-M158 HydrophobicContact CB-CE 3.9Å; I105-M158 HydrophobicContact CB-SD 4.38Å; I105-M158 HydrophobicContact CD1-CE 3.85Å; I105-M158 HydrophobicContact CD1-SD 3.86Å; I105-M158 HydrophobicContact CG1-CE 4.46Å; I105-M158 HydrophobicContact CG2-CE 3.86Å; I105-M158 HydrophobicContact CG2-SD 3.79Å
106	P	52.4	Low	57.6	Low	102 Å²	102	83.7 Å²	83.7	66%	0.662	46%	0.458	S	S	*	.			trans	-60.9	136.1	170.2	25.4	-31.2	0	0	0	108.5	G104 T108	G104-P106 VanDerWaalsContact O-CD 3.23Å; G104-P106 WeakPolarHBondContact O-CD 3.4Å; P106-T108 PolarHBondContact O-N 3.14Å
107	A	47.5	Very low	55.2	Low	35 Å²	35	85.3 Å²	85.3	29%	0.289	48%	0.477	S	S	.	.			trans	-51.5	105.5	176.7	0	0	0	0	0	109.1	I105 S109 Q155	I105-A107 PolarHBondContact O-N 2.94Å; A107-S109 PolarHBondContact O-N 2.95Å; A107-Q155 HydrophobicContact CB-CB 4.28Å
108	T	43.6	Very low	53.3	Low	81 Å²	81	89.8 Å²	89.8	50%	0.497	51%	0.508	S	S	.	.			trans	-71.2	101.4	176.1	46.3	0	0	0	0	106.8	P106 Y110	P106-T108 PolarHBondContact O-N 3.14Å; T108-Y110 PolarHBondContact O-N 3.41Å
109	S	37.4	Very low	51.1	Low	48 Å²	48	95.6 Å²	95.6	34%	0.336	55%	0.549	S	S	.	.			trans	-52.8	105	168.9	179.2	0	0	0	0	108.7	A107	A107-S109 PolarHBondContact O-N 2.95Å
110	Y	39.3	Very low	49.1	Very low	91 Å²	91	99.7 Å²	99.7	36%	0.357	57%	0.568	S	S	.	*			trans	-104.2	110.4	174.1	-99.2	-88.7	0	0	0	107.9	T108 E154	T108-Y110 PolarHBondContact O-N 3.41Å; Y110-E154 PolarHBondContact N-OE1 3.06Å
111	H	39.5	Very low	47.1	Very low	134 Å²	134	105.7 Å²	105.7	62%	0.62	59%	0.592	S	S	*	*			trans	58.8	90.4	177.7	-74.9	-64.6	0	0	0	117.6	K113	H111-K113 PolarHBondContact O-N 3.23Å
112	N	35.8	Very low	45.5	Very low	145 Å²	145	114.4 Å²	114.4	78%	0.775	63%	0.632	S	S	*	*			trans	-57.9	73	137.7	-78.5	-20.6	0	0	0	109.9
113	K	37.3	Very low	43.9	Very low	167 Å²	167	113.4 Å²	113.4	73%	0.726	65%	0.647	S	S	*	*			trans	-94.3	91.5	149.2	-81.6	-178.6	-179.6	169.9	0	105	H111 P115	H111-K113 PolarHBondContact O-N 3.23Å; K113-P115 WeakPolarHBondContact O-CD 3.28Å; K113-P115 VanDerWaalsContact O-N 3.14Å
114	T	39.8	Very low	42.6	Very low	116 Å²	116	112.1 Å²	112.1	71%	0.712	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-46.9	122.1	162.2	44.7	0	0	0	0	107.3
115	P	39.9	Very low	41.9	Very low	112 Å²	112	114.1 Å²	114.1	73%	0.727	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-57.9	135.1	169.8	23	-29.6	0	0	0	107.2	K113 S117	K113-P115 WeakPolarHBondContact O-CD 3.28Å; K113-P115 VanDerWaalsContact O-N 3.14Å; P115-S117 PolarHBondContact O-N 2.9Å; P115-S117 VanDerWaalsContact O-N 3.1Å
116	P	41.1	Very low	41.5	Very low	119 Å²	119	115.9 Å²	115.9	77%	0.773	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-54.3	125	172.8	22.7	-30.7	0	0	0	107.3	C118	P116-C118 PolarHBondContact O-N 3.21Å
117	S	32.5	Very low	41.6	Very low	126 Å²	126	113.5 Å²	113.5	88%	0.881	67%	0.665	S	S	*	*			trans	-51.1	107.3	-177.1	53.4	0	0	0	0	110	P115	P115-S117 PolarHBondContact O-N 2.9Å; P115-S117 VanDerWaalsContact O-N 3.1Å
118	C	39.2	Very low	42.4	Very low	122 Å²	122	115.8 Å²	115.8	82%	0.824	67%	0.672	S	S	*	*			trans	-106.1	108.2	177.5	-140.2	0	0	0	0	107.9	P116 L120	P116-C118 PolarHBondContact O-N 3.21Å; C118-L120 PolarHBondContact O-N 3.38Å
119	S	33.1	Very low	43.2	Very low	121 Å²	121	117.1 Å²	117.1	85%	0.846	68%	0.676	S	S	*	*			trans	-75	111.7	173.4	58	0	0	0	0	109.3
120	L	41.4	Very low	44.7	Very low	136 Å²	136	118.3 Å²	118.3	71%	0.712	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-93.2	124	172.5	-148.9	84.1	0	0	0	108.9	C118 L128	C118-L120 PolarHBondContact O-N 3.38Å; L120-L128 HydrophobicContact CD1-CD1 4.29Å
121	K	36.1	Very low	45.6	Very low	203 Å²	203	118.3 Å²	118.3	88%	0.883	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-76	127.2	165.4	-93.1	-179.9	173.2	177.7	0	108.2	G123	K121-G123 PolarHBondContact O-N 3.43Å
122	E	41.4	Very low	47	Very low	201 Å²	201	116.1 Å²	116.1	94%	0.939	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-54.4	129.8	-178.2	-71.3	176.8	153.6	0	0	112.5
123	G	40.5	Very low	48.2	Very low	61 Å²	61	115.3 Å²	115.3	63%	0.629	68%	0.682	S	S	*	*			trans	-151	149.8	168.6	0	0	0	0	0	109.5	K121 S125	K121-G123 PolarHBondContact O-N 3.43Å; G123-S125 PolarHBondContact O-N 3.16Å
124	P	51.9	Low	49.4	Very low	133 Å²	133	110.1 Å²	110.1	86%	0.864	68%	0.675	S	S	*	*	S	Bend	trans	-88	102.5	-165.8	33.5	-30	0	0	0	111
125	S	47.8	Very low	49.8	Very low	91 Å²	91	111.7 Å²	111.7	64%	0.636	67%	0.673	S	S	*	*			trans	172.9	128.8	145.1	46.4	0	0	0	0	109.1	G123 T127	G123-S125 PolarHBondContact O-N 3.16Å; S125-T127 PolarHBondContact O-N 2.86Å
126	S	53.8	Low	51	Low	90 Å²	90	113.2 Å²	113.2	63%	0.629	67%	0.668	S	S	*	*	S	Bend	trans	-63.9	24.8	-175.9	43.2	0	0	0	0	116.3	T140 L141	S126-T140 WeakPolarHBondContact O-CA 3.4Å; S126-L141 PolarHBondContact O-N 2.96Å
127	T	54.6	Low	51.8	Low	52 Å²	52	111.5 Å²	111.5	32%	0.319	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-140.8	119.2	-174.9	35	0	0	0	0	110.2	S125 E138 Y139 T140	S125-T127 PolarHBondContact O-N 2.86Å; T127-E138 HydrophobicContact CG2-CG 4.31Å; T127-E138 WeakPolarHBondContact CG2-OE1 3.42Å; T127-Y139 CarbonylContact C-O 3.56Å; T127-Y139 VanDerWaalsContact CA-O 3.3Å; T127-Y139 WeakPolarHBondContact CA-O 3.42Å; T127-T140 HydrophobicContact CG2-CG2 3.43Å; T127-T140 VanDerWaalsContact CG2-CG2 3.43Å
128	L	65	Low	53.5	Low	82 Å²	82	111.8 Å²	111.8	43%	0.429	64%	0.636	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.4	113.3	177.2	-161.6	147	0	0	0	108.4	L120 L130 Y139	L120-L128 HydrophobicContact CD1-CD1 4.29Å; L128-L130 HydrophobicContact CD2-CD1 3.41Å; L128-L130 VanDerWaalsContact CD2-CD1 3.41Å; L128-L130 HydrophobicContact CD2-CG 3.81Å; L128-Y139 PolarHBondContact N-O 2.93Å; L128-Y139 WeakPolarHBondContact O-CB 3.43Å; L128-Y139 PolarHBondContact O-N 3.4Å
129	L	60.3	Low	54.3	Low	110 Å²	110	111.6 Å²	111.6	58%	0.576	62%	0.618	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97	112.7	179.8	-110	141	0	0	0	109.3	F136 F137 E138	L129-F136 HydrophobicContact CD2-CB 3.82Å; L129-F136 HydrophobicContact CD2-CD1 4.05Å; L129-F136 HydrophobicContact CD2-CG 4.35Å; L129-F137 CarbonylContact C-O 3.55Å; L129-F137 WeakPolarHBondContact CA-O 3.36Å; L129-E138 HydrophobicContact CG-CB 4.37Å; L129-E138 HydrophobicContact CG-CG 4.48Å
130	L	67.1	Low	55.2	Low	73 Å²	73	109.9 Å²	109.9	38%	0.382	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.1	116.6	-178.9	-107	145.8	0	0	0	109.3	L128 I132 F137 Y139	L128-L130 HydrophobicContact CD2-CD1 3.41Å; L128-L130 VanDerWaalsContact CD2-CD1 3.41Å; L128-L130 HydrophobicContact CD2-CG 3.81Å; L130-I132 HydrophobicContact CD2-CD1 4.3Å; L130-I132 HydrophobicContact CD2-CG1 4.2Å; L130-F137 HydrophobicContact CB-CB 4.37Å; L130-F137 PolarHBondContact N-O 3.23Å; L130-F137 PolarHBondContact O-N 2.83Å; L130-Y139 HydrophobicContact CB-CD2 4.22Å; L130-Y139 HydrophobicContact CB-CE2 3.95Å; L130-Y139 HydrophobicContact CD1-CD2 3.93Å; L130-Y139 HydrophobicContact CD1-CE2 3.83Å
131	N	58.5	Low	55.8	Low	90 Å²	90	109.9 Å²	109.9	48%	0.481	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.6	112.1	171.7	-177.2	0.2	0	0	0	109.1	G134 K135 F136	N131-G134 WeakPolarHBondContact OD1-CA 3.25Å; N131-G134 PolarHBondContact OD1-N 3.32Å; N131-G134 VanDerWaalsContact OD1-N 3.14Å; N131-K135 WeakPolarHBondContact CA-O 3.28Å; N131-F136 HydrophobicContact CB-CD1 3.92Å; N131-F136 HydrophobicContact CB-CE1 3.85Å
132	I	70.4	Confident	56.5	Low	89 Å²	89	109.9 Å²	109.9	46%	0.456	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.7	116.3	175.3	-55.3	175.3	0	0	0	107.4	L130 G134 K135 F137	L130-I132 HydrophobicContact CD2-CD1 4.3Å; L130-I132 HydrophobicContact CD2-CG1 4.2Å; I132-G134 PolarHBondContact O-N 2.93Å; I132-G134 VanDerWaalsContact O-N 3.16Å; I132-K135 PolarHBondContact N-O 2.99Å; I132-K135 PolarHBondContact O-N 3.39Å; I132-F137 HydrophobicContact CB-CD2 4.42Å; I132-F137 HydrophobicContact CB-CE2 4.15Å; I132-F137 HydrophobicContact CD1-CD2 4.46Å; I132-F137 HydrophobicContact CG1-CD2 4.47Å
133	S	60	Low	56.9	Low	128 Å²	128	102.5 Å²	102.5	90%	0.895	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	51	38.8	178.3	-64.2	0	0	0	0	114.5	K135	S133-K135 VanDerWaalsContact C-N 3.34Å
134	G	61.9	Low	57.3	Low	57 Å²	57	108.7 Å²	108.7	59%	0.588	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	84	3.3	177.4	0	0	0	0	0	115	N131 I132	N131-G134 WeakPolarHBondContact OD1-CA 3.25Å; N131-G134 PolarHBondContact OD1-N 3.32Å; N131-G134 VanDerWaalsContact OD1-N 3.14Å; I132-G134 PolarHBondContact O-N 2.93Å; I132-G134 VanDerWaalsContact O-N 3.16Å
135	K	48.5	Very low	57.3	Low	150 Å²	150	108.4 Å²	108.4	65%	0.652	58%	0.584	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104	130.8	170.6	-66.7	-179.2	-178.8	176.8	0	109.8	N131 I132 S133 F137	N131-K135 WeakPolarHBondContact CA-O 3.28Å; I132-K135 PolarHBondContact N-O 2.99Å; I132-K135 PolarHBondContact O-N 3.39Å; S133-K135 VanDerWaalsContact C-N 3.34Å; K135-F137 HydrophobicContact CB-CE2 3.78Å; K135-F137 HydrophobicContact CB-CZ 4.18Å
136	F	65.8	Low	57.1	Low	144 Å²	144	109.2 Å²	109.2	63%	0.632	58%	0.581	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.9	120.5	178.5	-66	-84.7	0	0	0	109.8	L129 N131	L129-F136 HydrophobicContact CD2-CB 3.82Å; L129-F136 HydrophobicContact CD2-CD1 4.05Å; L129-F136 HydrophobicContact CD2-CG 4.35Å; N131-F136 HydrophobicContact CB-CD1 3.92Å; N131-F136 HydrophobicContact CB-CE1 3.85Å
137	F	57.3	Low	56.8	Low	83 Å²	83	112.9 Å²	112.9	36%	0.364	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.4	121.3	175.3	-63.6	-88.9	0	0	0	108.8	L129 L130 I132 K135 Y139	L129-F137 CarbonylContact C-O 3.55Å; L129-F137 WeakPolarHBondContact CA-O 3.36Å; L130-F137 HydrophobicContact CB-CB 4.37Å; L130-F137 PolarHBondContact N-O 3.23Å; L130-F137 PolarHBondContact O-N 2.83Å; I132-F137 HydrophobicContact CB-CD2 4.42Å; I132-F137 HydrophobicContact CB-CE2 4.15Å; I132-F137 HydrophobicContact CD1-CD2 4.46Å; I132-F137 HydrophobicContact CG1-CD2 4.47Å; K135-F137 HydrophobicContact CB-CE2 3.78Å; K135-F137 HydrophobicContact CB-CZ 4.18Å; F137-Y139 HydrophobicContact CB-CD2 4.2Å; F137-Y139 HydrophobicContact CB-CE2 3.43Å; F137-Y139 VanDerWaalsContact CB-CE2 3.43Å; F137-Y139 HydrophobicContact CG-CE2 4.45Å
138	E	69.4	Low	56.5	Low	131 Å²	131	120.4 Å²	120.4	61%	0.612	61%	0.608	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.6	118.9	177.9	-174.4	-178.4	178.1	0	0	109.8	T127 L129	T127-E138 HydrophobicContact CG2-CG 4.31Å; T127-E138 WeakPolarHBondContact CG2-OE1 3.42Å; L129-E138 HydrophobicContact CG-CB 4.37Å; L129-E138 HydrophobicContact CG-CG 4.48Å
139	Y	55.9	Low	55.7	Low	118 Å²	118	121.2 Å²	121.2	46%	0.463	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.6	117.2	178	-66.3	-84.2	0	0	0	109.9	T127 L128 L130 F137	T127-Y139 CarbonylContact C-O 3.56Å; T127-Y139 VanDerWaalsContact CA-O 3.3Å; T127-Y139 WeakPolarHBondContact CA-O 3.42Å; L128-Y139 PolarHBondContact N-O 2.93Å; L128-Y139 WeakPolarHBondContact O-CB 3.43Å; L128-Y139 PolarHBondContact O-N 3.4Å; L130-Y139 HydrophobicContact CB-CD2 4.22Å; L130-Y139 HydrophobicContact CB-CE2 3.95Å; L130-Y139 HydrophobicContact CD1-CD2 3.93Å; L130-Y139 HydrophobicContact CD1-CE2 3.83Å; F137-Y139 HydrophobicContact CB-CD2 4.2Å; F137-Y139 HydrophobicContact CB-CE2 3.43Å; F137-Y139 VanDerWaalsContact CB-CE2 3.43Å; F137-Y139 HydrophobicContact CG-CE2 4.45Å
140	T	52.4	Low	55.1	Low	85 Å²	85	119.1 Å²	119.1	52%	0.521	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.4	129	173.6	38.1	0	0	0	0	110.2	S126 T127 K142	S126-T140 WeakPolarHBondContact O-CA 3.4Å; T127-T140 HydrophobicContact CG2-CG2 3.43Å; T127-T140 VanDerWaalsContact CG2-CG2 3.43Å; T140-K142 PolarHBondContact O-N 2.93Å
141	L	53.8	Low	54.1	Low	136 Å²	136	120.3 Å²	120.3	71%	0.712	60%	0.602	S	S	*	*			trans	-70.8	104.2	174.5	-173.2	78.5	0	0	0	108.7	S126	S126-L141 PolarHBondContact O-N 2.96Å
142	K	49.8	Very low	53.6	Low	203 Å²	203	120.5 Å²	120.5	88%	0.883	60%	0.603	S	S	*	*			trans	-78	-21.7	179.5	-81.1	-171.5	173.9	178.2	0	114.2	T140	T140-K142 PolarHBondContact O-N 2.93Å
143	G	49.8	Very low	52.7	Low	47 Å²	47	119.7 Å²	119.7	49%	0.485	60%	0.602	S	S	.	*			trans	155.7	169.7	179.2	0	0	0	0	0	113
144	E	49.3	Very low	52.1	Low	191 Å²	191	116.1 Å²	116.1	89%	0.893	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-82.3	134.9	170.8	-69	-177.1	169.7	0	0	110.2
145	I	51.3	Low	51.6	Low	126 Å²	126	116.2 Å²	116.2	65%	0.646	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-97.6	118.6	-178.9	-56.3	169.9	0	0	0	108.6	I150	I145-I150 HydrophobicContact CG2-CD1 4.24Å; I145-I150 HydrophobicContact CG2-CG1 3.52Å
146	N	44.8	Very low	52	Low	108 Å²	108	111.8 Å²	111.8	58%	0.578	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-77.1	140.5	172.9	-154.9	-22.6	0	0	0	109.5	R148 E149 I150	N146-R148 PolarHBondContact O-N 3.43Å; N146-E149 HydrophobicContact CB-CG 4.22Å; N146-E149 PolarHBondContact N-OE2 3.43Å; N146-E149 WeakPolarHBondContact O-CA 3.28Å; N146-E149 WeakPolarHBondContact O-CB 3.49Å; N146-E149 PolarHBondContact O-N 3.25Å; N146-I150 PolarHBondContact O-N 2.93Å
147	F	47.6	Very low	51.7	Low	167 Å²	167	108.8 Å²	108.8	73%	0.732	53%	0.53	S	S	*	.	H	α-helix	trans	-58.5	-26.2	-177.6	-93.8	-88.2	0	0	0	113.6	E149 I150	F147-E149 VanDerWaalsContact C-N 3.35Å; F147-I150 HydrophobicContact CD1-CD1 3.89Å; F147-I150 HydrophobicContact CE1-CD1 4.23Å; F147-I150 HydrophobicContact CG-CD1 4.27Å
148	R	48.6	Very low	51.9	Low	210 Å²	210	106.6 Å²	106.6	79%	0.792	52%	0.522	S	S	*	.	H	α-helix	trans	-70.1	-27.1	171	-89.3	-178.8	168.5	171.9	-2.9	113.8	N146	N146-R148 PolarHBondContact O-N 3.43Å
149	E	47.7	Very low	51.6	Low	100 Å²	100	100.5 Å²	100.5	47%	0.467	49%	0.493	S	S	.	.	H	α-helix	trans	-78.2	-25.9	178.1	-72.2	174.4	149.6	0	0	112.2	N146 F147 H151 N152 V153	N146-E149 HydrophobicContact CB-CG 4.22Å; N146-E149 PolarHBondContact N-OE2 3.43Å; N146-E149 WeakPolarHBondContact O-CA 3.28Å; N146-E149 WeakPolarHBondContact O-CB 3.49Å; N146-E149 PolarHBondContact O-N 3.25Å; F147-E149 VanDerWaalsContact C-N 3.35Å; E149-H151 PolarHBondContact O-N 3.48Å; E149-N152 PolarHBondContact O-N 2.92Å; E149-N152 VanDerWaalsContact O-N 3.16Å; E149-V153 WeakPolarHBondContact O-CG2 3.36Å; E149-V153 PolarHBondContact O-N 2.68Å
150	I	46.8	Very low	52.1	Low	66 Å²	66	103.9 Å²	103.9	34%	0.338	51%	0.505	S	S	.	.	H	α-helix	trans	-59.3	-48.2	178.7	-58.3	175.1	0	0	0	111.1	I145 N146 F147 N152 V153 E154	I145-I150 HydrophobicContact CG2-CD1 4.24Å; I145-I150 HydrophobicContact CG2-CG1 3.52Å; N146-I150 PolarHBondContact O-N 2.93Å; F147-I150 HydrophobicContact CD1-CD1 3.89Å; F147-I150 HydrophobicContact CE1-CD1 4.23Å; F147-I150 HydrophobicContact CG-CD1 4.27Å; I150-N152 VanDerWaalsContact C-N 3.32Å; I150-N152 PolarHBondContact O-N 2.79Å; I150-V153 PolarHBondContact O-N 2.96Å; I150-E154 PolarHBondContact O-N 3.2Å
151	H	46.1	Very low	52.8	Low	98 Å²	98	104.6 Å²	104.6	45%	0.454	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-33.6	176.5	-73.1	-55.7	0	0	0	113.2	E149 E154 Q155	E149-H151 PolarHBondContact O-N 3.48Å; H151-E154 IonicContact ND1-OE2 2.99Å; H151-Q155 WeakPolarHBondContact O-CB 3.17Å; H151-Q155 PolarHBondContact O-N 3.35Å
152	N	48.7	Very low	53.3	Low	93 Å²	93	98.6 Å²	98.6	50%	0.497	47%	0.47	S	S	.	.	H	α-helix	trans	-68.9	-39	174.4	-70.9	-20.6	0	0	0	110.8	E149 I150 N156	E149-N152 PolarHBondContact O-N 2.92Å; E149-N152 VanDerWaalsContact O-N 3.16Å; I150-N152 VanDerWaalsContact C-N 3.32Å; I150-N152 PolarHBondContact O-N 2.79Å; N152-N156 VanDerWaalsContact O-CB 3.25Å; N152-N156 WeakPolarHBondContact O-CB 3.44Å; N152-N156 PolarHBondContact O-N 3.22Å; N152-N156 PolarHBondContact O-ND2 3.17Å; N152-N156 PolarHBondContact O-OD1 3.26Å
153	V	50.2	Low	54.3	Low	73 Å²	73	90.9 Å²	90.9	44%	0.442	44%	0.44	S	S	.	.	H	α-helix	trans	-65	-45.1	178.3	172.9	0	0	0	0	111.5	E149 I150 Q155 N156 D157	E149-V153 WeakPolarHBondContact O-CG2 3.36Å; E149-V153 PolarHBondContact O-N 2.68Å; I150-V153 PolarHBondContact O-N 2.96Å; V153-Q155 PolarHBondContact O-N 3.02Å; V153-N156 WeakPolarHBondContact O-CB 3.44Å; V153-N156 PolarHBondContact O-N 2.87Å; V153-D157 PolarHBondContact O-N 3.23Å
154	E	48.8	Very low	55.1	Low	52 Å²	52	89.7 Å²	89.7	24%	0.243	42%	0.422	C	S	.	.	H	α-helix	trans	-62.9	-43.6	177.1	-72.6	-178.9	151.4	0	0	112.5	Y110 I150 H151 N156 D157 M158	Y110-E154 PolarHBondContact N-OE1 3.06Å; I150-E154 PolarHBondContact O-N 3.2Å; H151-E154 IonicContact ND1-OE2 2.99Å; E154-N156 VanDerWaalsContact C-N 3.28Å; E154-N156 PolarHBondContact O-N 2.95Å; E154-D157 PolarHBondContact O-N 2.76Å; E154-M158 PolarHBondContact O-N 2.54Å
155	Q	50.5	Low	56.3	Low	59 Å²	59	84.9 Å²	84.9	28%	0.276	40%	0.402	S	S	.	.	H	α-helix	trans	-65.7	-34	175.5	-171.6	159	-2.5	0	0	111.7	R102 A107 H151 V153 L159	R102-Q155 PolarHBondContact O-NE2 3.34Å; A107-Q155 HydrophobicContact CB-CB 4.28Å; H151-Q155 WeakPolarHBondContact O-CB 3.17Å; H151-Q155 PolarHBondContact O-N 3.35Å; V153-Q155 PolarHBondContact O-N 3.02Å; Q155-L159 HydrophobicContact CG-CD1 3.93Å; Q155-L159 WeakPolarHBondContact O-CB 3.37Å; Q155-L159 WeakPolarHBondContact O-CD1 3.18Å; Q155-L159 WeakPolarHBondContact O-CG 3.02Å; Q155-L159 PolarHBondContact O-N 3.11Å
156	N	57.8	Low	57.6	Low	57 Å²	57	80.1 Å²	80.1	31%	0.305	38%	0.38	S	S	.	.	H	α-helix	trans	-67.1	-36.4	174.4	-70.6	-28.2	0	0	0	112.4	N152 V153 E154 L159 R160 Q423	N152-N156 VanDerWaalsContact O-CB 3.25Å; N152-N156 WeakPolarHBondContact O-CB 3.44Å; N152-N156 PolarHBondContact O-N 3.22Å; N152-N156 PolarHBondContact O-ND2 3.17Å; N152-N156 PolarHBondContact O-OD1 3.26Å; V153-N156 WeakPolarHBondContact O-CB 3.44Å; V153-N156 PolarHBondContact O-N 2.87Å; E154-N156 VanDerWaalsContact C-N 3.28Å; E154-N156 PolarHBondContact O-N 2.95Å; N156-L159 PolarHBondContact O-N 2.93Å; N156-R160 WeakPolarHBondContact O-CB 3.5Å; N156-R160 PolarHBondContact O-N 3.33Å; N156-Q423 PolarHBondContact OD1-NE2 3.41Å; N156-Q423 PolarHBondContact OD1-OE1 3.06Å
157	D	60.1	Low	59.4	Low	81 Å²	81	79.4 Å²	79.4	43%	0.433	37%	0.372	S	S	.	.	H	α-helix	trans	-69.6	-41.5	-178.1	-78.7	-19.6	0	0	0	112.4	V153 E154 R160 K161	V153-D157 PolarHBondContact O-N 3.23Å; E154-D157 PolarHBondContact O-N 2.76Å; D157-R160 PolarHBondContact O-N 3.12Å; D157-K161 WeakPolarHBondContact O-CG 3.44Å; D157-K161 PolarHBondContact O-N 3.02Å
158	M	60.8	Low	61.1	Low	38 Å²	38	73.9 Å²	73.9	19%	0.187	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-46.5	172.8	-175.9	-171	69	0	0	111.5	I105 E154 R160 K161 V162	I105-M158 HydrophobicContact CB-CE 3.9Å; I105-M158 HydrophobicContact CB-SD 4.38Å; I105-M158 HydrophobicContact CD1-CE 3.85Å; I105-M158 HydrophobicContact CD1-SD 3.86Å; I105-M158 HydrophobicContact CG1-CE 4.46Å; I105-M158 HydrophobicContact CG2-CE 3.86Å; I105-M158 HydrophobicContact CG2-SD 3.79Å; E154-M158 PolarHBondContact O-N 2.54Å; M158-R160 VanDerWaalsContact C-N 3.28Å; M158-R160 PolarHBondContact O-N 3.41Å; M158-K161 PolarHBondContact O-N 3.43Å; M158-V162 WeakPolarHBondContact O-CG2 3.37Å; M158-V162 PolarHBondContact O-N 3.37Å
159	L	63.7	Low	62.8	Low	3 Å²	3	64 Å²	64	2%	0.016	32%	0.315	C	S	.	.	H	α-helix	trans	-67.1	-30.4	179	-76.4	160.4	0	0	0	112.3	Q155 N156 V162 T163 T421	Q155-L159 HydrophobicContact CG-CD1 3.93Å; Q155-L159 WeakPolarHBondContact O-CB 3.37Å; Q155-L159 WeakPolarHBondContact O-CD1 3.18Å; Q155-L159 WeakPolarHBondContact O-CG 3.02Å; Q155-L159 PolarHBondContact O-N 3.11Å; N156-L159 PolarHBondContact O-N 2.93Å; L159-V162 PolarHBondContact O-N 3.36Å; L159-T163 PolarHBondContact O-N 2.93Å; L159-T163 PolarHBondContact O-OG1 3.3Å; L159-T421 HydrophobicContact CD2-CG2 3.95Å
160	R	66.2	Low	64.5	Low	188 Å²	188	60 Å²	60	71%	0.709	30%	0.296	S	S	*	.	H	α-helix	trans	-69.2	-40.2	171.7	-174.3	178	-178.7	-176.3	-1.2	111.8	N156 D157 M158 V162 T163	N156-R160 WeakPolarHBondContact O-CB 3.5Å; N156-R160 PolarHBondContact O-N 3.33Å; D157-R160 PolarHBondContact O-N 3.12Å; M158-R160 VanDerWaalsContact C-N 3.28Å; M158-R160 PolarHBondContact O-N 3.41Å; R160-V162 VanDerWaalsContact C-N 3.26Å; R160-V162 PolarHBondContact O-N 2.94Å; R160-T163 VanDerWaalsContact O-CB 3.28Å; R160-T163 WeakPolarHBondContact O-CB 3.2Å; R160-T163 PolarHBondContact O-N 3.44Å; R160-T163 VanDerWaalsContact O-N 3.1Å
161	K	65.7	Low	66.4	Low	100 Å²	100	59.3 Å²	59.3	44%	0.435	29%	0.293	S	S	.	.	H	α-helix	trans	-65.4	-28.4	173	-73.9	-174.6	176.3	-160.7	0	113.1	D157 M158 T163	D157-K161 WeakPolarHBondContact O-CG 3.44Å; D157-K161 PolarHBondContact O-N 3.02Å; M158-K161 PolarHBondContact O-N 3.43Å; K161-T163 VanDerWaalsContact C-N 3.34Å
162	V	66.1	Low	68.4	Low	11 Å²	11	58.9 Å²	58.9	7%	0.067	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-12.8	174.3	176.5	0	0	0	0	112.1	F62 L101 M158 L159 R160 F164 L417 T421	F62-V162 HydrophobicContact CE1-CG1 4.45Å; F62-V162 HydrophobicContact CZ-CG1 4.03Å; L101-V162 HydrophobicContact CD1-CG1 3.82Å; M158-V162 WeakPolarHBondContact O-CG2 3.37Å; M158-V162 PolarHBondContact O-N 3.37Å; L159-V162 PolarHBondContact O-N 3.36Å; R160-V162 VanDerWaalsContact C-N 3.26Å; R160-V162 PolarHBondContact O-N 2.94Å; V162-F164 PolarHBondContact O-N 2.96Å; V162-L417 HydrophobicContact CG1-CD2 3.76Å; V162-T421 HydrophobicContact CG1-CG2 4.04Å
163	T	69.1	Low	70.3	Confident	40 Å²	40	55.6 Å²	55.6	25%	0.245	28%	0.276	C	S	.	.	S	Bend	trans	-71.2	122.1	172	-55.8	0	0	0	0	108.2	L159 R160 K161	L159-T163 PolarHBondContact O-N 2.93Å; L159-T163 PolarHBondContact O-OG1 3.3Å; R160-T163 VanDerWaalsContact O-CB 3.28Å; R160-T163 WeakPolarHBondContact O-CB 3.2Å; R160-T163 PolarHBondContact O-N 3.44Å; R160-T163 VanDerWaalsContact O-N 3.1Å; K161-T163 VanDerWaalsContact C-N 3.34Å
164	F	68.3	Low	72	Confident	23 Å²	23	52.1 Å²	52.1	10%	0.101	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-65.8	135.6	-178.7	-175.8	-120.7	0	0	0	110.4	V162 P166 V168 F169 L173 F410 Y414	V162-F164 PolarHBondContact O-N 2.96Å; F164-P166 WeakPolarHBondContact O-CD 3.37Å; F164-V168 HydrophobicContact CE2-CB 3.76Å; F164-V168 HydrophobicContact CE2-CG1 3.5Å; F164-V168 HydrophobicContact CZ-CB 3.71Å; F164-V168 HydrophobicContact CZ-CG1 3.57Å; F164-F169 HydrophobicContact CD1-CB 4.48Å; F164-F169 HydrophobicContact CE1-CB 3.59Å; F164-F169 HydrophobicContact CE1-CD2 4.11Å; F164-F169 HydrophobicContact CE1-CG 4.36Å; F164-F169 HydrophobicContact CZ-CB 4.3Å; F164-L173 HydrophobicContact CE1-CD1 4.08Å; F164-L173 HydrophobicContact CE2-CD1 4.3Å; F164-L173 HydrophobicContact CZ-CD1 3.45Å; F164-L173 VanDerWaalsContact CZ-CD1 3.45Å; F164-L173 HydrophobicContact CZ-CG 4.32Å; F164-F410 HydrophobicContact CD2-CE1 4.11Å; F164-F410 HydrophobicContact CD2-CZ 4.2Å; F164-F410 AromaticContact CE2-CE1 3.62Å; F164-F410 HydrophobicContact CE2-CE1 3.62Å; F164-F410 AromaticContact CE2-CZ 3.97Å; F164-F410 HydrophobicContact CE2-CZ 3.97Å; F164-F410 AromaticContact CZ-CE1 3.92Å; F164-F410 HydrophobicContact CZ-CE1 3.92Å; F164-Y414 HydrophobicContact CB-CD1 3.89Å; F164-Y414 HydrophobicContact CB-CD2 3.89Å; F164-Y414 HydrophobicContact CB-CE1 3.29Å; F164-Y414 HydrophobicContact CB-CE2 3.35Å; F164-Y414 HydrophobicContact CB-CG 4.17Å; F164-Y414 WeakPolarHBondContact CB-OH 3.39Å; F164-Y414 HydrophobicContact CD1-CD1 4.05Å; F164-Y414 AromaticContact CD1-CE1 3.91Å; F164-Y414 HydrophobicContact CD1-CE1 3.91Å; F164-Y414 HydrophobicContact CG-CD1 4.18Å; F164-Y414 AromaticContact CG-CE1 3.96Å; F164-Y414 HydrophobicContact CG-CE1 3.96Å; F164-Y414 HydrophobicContact CG-CE2 4.43Å; F164-Y414 HydrophobicContact CG-CG 4.5Å; F164-Y414 PolarHBondContact N-OH 2.65Å
165	D	73.4	Confident	74	Confident	89 Å²	89	49.9 Å²	49.9	48%	0.476	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-70.2	118.9	172.3	-168.1	-23.3	0	0	0	109	E167 V168	D165-E167 PolarHBondContact O-N 2.8Å; D165-E167 VanDerWaalsContact O-N 3.12Å; D165-E167 WeakPolarHBondContact OD1-CB 3.35Å; D165-E167 PolarHBondContact OD1-N 2.94Å; D165-V168 HydrophobicContact CB-CG2 4.1Å; D165-V168 PolarHBondContact O-N 2.67Å; D165-V168 VanDerWaalsContact O-N 3.08Å
166	P	78.2	Confident	76	Confident	27 Å²	27	47.4 Å²	47.4	18%	0.175	23%	0.234	C	C	.	.	H	α-helix	trans	-55.5	-27.3	175.7	23.4	-34.4	0	0	0	112.6	F164 V168 F169 F170 I485 R486	F164-P166 WeakPolarHBondContact O-CD 3.37Å; P166-V168 VanDerWaalsContact C-N 3.3Å; P166-V168 PolarHBondContact O-N 3.2Å; P166-F169 WeakPolarHBondContact O-CB 3.32Å; P166-F169 PolarHBondContact O-N 2.77Å; P166-F169 VanDerWaalsContact O-N 3.1Å; P166-F170 WeakPolarHBondContact O-CD2 3.48Å; P166-F170 PolarHBondContact O-N 2.75Å; P166-I485 HydrophobicContact CB-CG2 4.18Å; P166-R486 HydrophobicContact CB-CB 4.4Å
167	E	82.6	Confident	77.5	Confident	92 Å²	92	45.9 Å²	45.9	43%	0.43	23%	0.225	S	C	.	.	H	α-helix	trans	-67.2	-31.9	179.2	-65.4	-58.8	153.3	0	0	112.6	D165 F169 F170 N171	D165-E167 PolarHBondContact O-N 2.8Å; D165-E167 VanDerWaalsContact O-N 3.12Å; D165-E167 WeakPolarHBondContact OD1-CB 3.35Å; D165-E167 PolarHBondContact OD1-N 2.94Å; E167-F169 VanDerWaalsContact C-N 3.27Å; E167-F169 PolarHBondContact O-N 3.45Å; E167-F170 PolarHBondContact O-N 3.43Å; E167-N171 VanDerWaalsContact O-CB 3.25Å; E167-N171 WeakPolarHBondContact O-CB 3.47Å; E167-N171 PolarHBondContact O-N 3.36Å; E167-N171 PolarHBondContact O-ND2 3.28Å; E167-N171 PolarHBondContact OE2-ND2 2.98Å; E167-N171 VanDerWaalsContact OE2-ND2 3.15Å
168	V	84.6	Confident	78.9	Confident	52 Å²	52	42.3 Å²	42.3	32%	0.315	21%	0.206	S	C	.	.	H	α-helix	trans	-66.9	-34.6	173.4	176.2	0	0	0	0	110.2	F164 D165 P166 I172 L173	F164-V168 HydrophobicContact CE2-CB 3.76Å; F164-V168 HydrophobicContact CE2-CG1 3.5Å; F164-V168 HydrophobicContact CZ-CB 3.71Å; F164-V168 HydrophobicContact CZ-CG1 3.57Å; D165-V168 HydrophobicContact CB-CG2 4.1Å; D165-V168 PolarHBondContact O-N 2.67Å; D165-V168 VanDerWaalsContact O-N 3.08Å; P166-V168 VanDerWaalsContact C-N 3.3Å; P166-V168 PolarHBondContact O-N 3.2Å; V168-I172 HydrophobicContact CG1-CB 4.33Å; V168-I172 HydrophobicContact CG1-CD1 4.14Å; V168-I172 WeakPolarHBondContact O-CB 3.36Å; V168-I172 PolarHBondContact O-N 2.87Å; V168-L173 PolarHBondContact O-N 2.78Å
169	F	83.8	Confident	80.4	Confident	3 Å²	3	40.6 Å²	40.6	1%	0.013	20%	0.198	C	C	.	.	I	π-helix	trans	-56.9	-59.4	173	-170.8	-93.6	0	0	0	111	F164 P166 E167 L173 L174 I411 A478 M479 A482	F164-F169 HydrophobicContact CD1-CB 4.48Å; F164-F169 HydrophobicContact CE1-CB 3.59Å; F164-F169 HydrophobicContact CE1-CD2 4.11Å; F164-F169 HydrophobicContact CE1-CG 4.36Å; F164-F169 HydrophobicContact CZ-CB 4.3Å; P166-F169 WeakPolarHBondContact O-CB 3.32Å; P166-F169 PolarHBondContact O-N 2.77Å; P166-F169 VanDerWaalsContact O-N 3.1Å; E167-F169 VanDerWaalsContact C-N 3.27Å; E167-F169 PolarHBondContact O-N 3.45Å; F169-L173 HydrophobicContact CD2-CD1 4.5Å; F169-L173 PolarHBondContact O-N 2.84Å; F169-L174 HydrophobicContact CE1-CB 4.43Å; F169-L174 HydrophobicContact CE1-CD1 4.24Å; F169-L174 HydrophobicContact CE1-CD2 4.46Å; F169-L174 WeakPolarHBondContact O-CB 3.49Å; F169-L174 PolarHBondContact O-N 3.17Å; F169-I411 HydrophobicContact CD2-CD1 4.11Å; F169-I411 HydrophobicContact CD2-CG1 4.05Å; F169-I411 HydrophobicContact CE2-CB 4.43Å; F169-I411 HydrophobicContact CE2-CD1 3.42Å; F169-I411 VanDerWaalsContact CE2-CD1 3.42Å; F169-I411 HydrophobicContact CE2-CG1 3.62Å; F169-I411 HydrophobicContact CE2-CG2 3.91Å; F169-I411 HydrophobicContact CZ-CD1 4.06Å; F169-A478 HydrophobicContact CZ-CB 4.27Å; F169-M479 HydrophobicContact CE1-CE 3.73Å; F169-M479 HydrophobicContact CE1-SD 3.79Å; F169-M479 HydrophobicContact CZ-CE 3.42Å; F169-M479 VanDerWaalsContact CZ-CE 3.42Å; F169-M479 HydrophobicContact CZ-SD 4.04Å; F169-A482 HydrophobicContact CD1-CB 3.31Å; F169-A482 HydrophobicContact CD2-CB 4.1Å; F169-A482 HydrophobicContact CE1-CB 3.1Å; F169-A482 HydrophobicContact CE2-CB 3.89Å; F169-A482 HydrophobicContact CG-CB 3.8Å; F169-A482 HydrophobicContact CZ-CB 3.39Å
170	F	82.8	Confident	81.6	Confident	15 Å²	15	41.8 Å²	41.8	7%	0.066	20%	0.203	C	C	.	.	I	π-helix	trans	-71.5	-39.5	-169.8	-72.4	-72.6	0	0	0	111.5	P166 E167 L174 P175 F359 A482 L483 R486	P166-F170 WeakPolarHBondContact O-CD2 3.48Å; P166-F170 PolarHBondContact O-N 2.75Å; E167-F170 PolarHBondContact O-N 3.43Å; F170-L174 HydrophobicContact CD1-CD2 3.76Å; F170-L174 HydrophobicContact CE1-CD2 4.35Å; F170-P175 WeakPolarHBondContact O-CD 3.24Å; F170-F359 WeakPolarHBondContact O-CZ 3.23Å; F170-A482 HydrophobicContact CE1-CB 4.36Å; F170-A482 HydrophobicContact CE2-CB 4.23Å; F170-A482 HydrophobicContact CZ-CB 3.77Å; F170-L483 HydrophobicContact CE1-CD2 4.37Å; F170-L483 HydrophobicContact CZ-CD2 4.06Å; F170-L483 HydrophobicContact CZ-CG 4.45Å; F170-R486 HydrophobicContact CE2-CB 4.19Å; F170-R486 HydrophobicContact CE2-CG 4.29Å
171	N	86.9	Confident	82.5	Confident	51 Å²	51	33.2 Å²	33.2	27%	0.273	17%	0.173	S	C	.	.	I	π-helix	trans	-88.8	-24.6	-173.4	-62.1	-50.6	0	0	0	114	E167 W356 F359	E167-N171 VanDerWaalsContact O-CB 3.25Å; E167-N171 WeakPolarHBondContact O-CB 3.47Å; E167-N171 PolarHBondContact O-N 3.36Å; E167-N171 PolarHBondContact O-ND2 3.28Å; E167-N171 PolarHBondContact OE2-ND2 2.98Å; E167-N171 VanDerWaalsContact OE2-ND2 3.15Å; N171-W356 WeakPolarHBondContact O-CZ2 3.27Å; N171-F359 WeakPolarHBondContact OD1-CE1 3.24Å
172	I	88.3	Confident	83.5	Confident	90 Å²	90	28.5 Å²	28.5	46%	0.462	15%	0.152	S	C	.	.	I	π-helix	trans	-117.2	-50.4	-173.3	-60.4	175.3	0	0	0	112.3	V168 P176 W356	V168-I172 HydrophobicContact CG1-CB 4.33Å; V168-I172 HydrophobicContact CG1-CD1 4.14Å; V168-I172 WeakPolarHBondContact O-CB 3.36Å; V168-I172 PolarHBondContact O-N 2.87Å; I172-P176 VanDerWaalsContact O-CD 3.29Å; I172-P176 WeakPolarHBondContact O-CD 3.26Å; I172-W356 HydrophobicContact CB-CH2 4.46Å; I172-W356 HydrophobicContact CG2-CH2 4.2Å; I172-W356 WeakPolarHBondContact O-CH2 3.24Å
173	L	88	Confident	84.6	Confident	24 Å²	24	29.1 Å²	29.1	13%	0.126	15%	0.153	C	C	.	.	I	π-helix	trans	-82.4	-37	-172.5	-59.7	-179.1	0	0	0	113	F164 V168 F169 I177 A407 F410 I411	F164-L173 HydrophobicContact CE1-CD1 4.08Å; F164-L173 HydrophobicContact CE2-CD1 4.3Å; F164-L173 HydrophobicContact CZ-CD1 3.45Å; F164-L173 VanDerWaalsContact CZ-CD1 3.45Å; F164-L173 HydrophobicContact CZ-CG 4.32Å; V168-L173 PolarHBondContact O-N 2.78Å; F169-L173 HydrophobicContact CD2-CD1 4.5Å; F169-L173 PolarHBondContact O-N 2.84Å; L173-I177 WeakPolarHBondContact O-CD1 3.43Å; L173-I177 WeakPolarHBondContact O-CG1 3.32Å; L173-A407 HydrophobicContact CB-CB 4.4Å; L173-A407 HydrophobicContact CD2-CB 4.26Å; L173-F410 HydrophobicContact CD1-CD1 3.48Å; L173-F410 VanDerWaalsContact CD1-CD1 3.48Å; L173-F410 HydrophobicContact CD1-CE1 3.68Å; L173-F410 HydrophobicContact CD2-CD1 4.44Å; L173-I411 HydrophobicContact CB-CD1 4.24Å; L173-I411 HydrophobicContact CD1-CD1 4.41Å; L173-I411 HydrophobicContact CD1-CG1 3.93Å
174	L	87.4	Confident	85.2	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-69.4	-45.1	-174.7	-174.4	63	0	0	0	114.4	F169 F170 I177 I178 V370 M479	F169-L174 HydrophobicContact CE1-CB 4.43Å; F169-L174 HydrophobicContact CE1-CD1 4.24Å; F169-L174 HydrophobicContact CE1-CD2 4.46Å; F169-L174 WeakPolarHBondContact O-CB 3.49Å; F169-L174 PolarHBondContact O-N 3.17Å; F170-L174 HydrophobicContact CD1-CD2 3.76Å; F170-L174 HydrophobicContact CE1-CD2 4.35Å; L174-I177 PolarHBondContact O-N 2.97Å; L174-I177 VanDerWaalsContact O-N 3.15Å; L174-I178 HydrophobicContact CD1-CD1 4.08Å; L174-I178 HydrophobicContact CD1-CG1 3.71Å; L174-I178 HydrophobicContact CG-CG1 4.02Å; L174-I178 WeakPolarHBondContact O-CG1 3.21Å; L174-I178 PolarHBondContact O-N 2.94Å; L174-I178 VanDerWaalsContact O-N 3.13Å; L174-V370 HydrophobicContact CD2-CG2 3.43Å; L174-V370 VanDerWaalsContact CD2-CG2 3.43Å; L174-V370 HydrophobicContact CG-CG2 4.33Å; L174-M479 HydrophobicContact CD1-CE 3.27Å; L174-M479 HydrophobicContact CD1-SD 3.39Å; L174-M479 WeakPolarHBondContact CD1-SD 3.44Å; L174-M479 HydrophobicContact CD2-SD 4.3Å
175	P	90.8	Very high	85.5	Confident	4 Å²	4	29.7 Å²	29.7	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-59.8	-44.2	-173.4	-20.8	31.7	0	0	0	113.7	F170 I177 I178 F179 F359	F170-P175 WeakPolarHBondContact O-CD 3.24Å; P175-I177 VanDerWaalsContact C-N 3.33Å; P175-I177 PolarHBondContact O-N 3.49Å; P175-I178 PolarHBondContact O-N 3.38Å; P175-F179 WeakPolarHBondContact O-CB 3.4Å; P175-F179 PolarHBondContact O-N 2.91Å; P175-F359 HydrophobicContact CB-CB 4.25Å; P175-F359 HydrophobicContact CB-CD2 4.15Å; P175-F359 HydrophobicContact CB-CG 4.11Å; P175-F359 HydrophobicContact CG-CB 4.27Å; P175-F359 HydrophobicContact CG-CD1 3.87Å; P175-F359 HydrophobicContact CG-CD2 3.74Å; P175-F359 HydrophobicContact CG-CE1 4.18Å; P175-F359 HydrophobicContact CG-CE2 4.03Å; P175-F359 HydrophobicContact CG-CG 3.66Å; P175-F359 HydrophobicContact CG-CZ 4.25Å
176	P	91.3	Very high	85.2	Confident	7 Å²	7	30.1 Å²	30.1	5%	0.045	16%	0.157	C	C	.	.	H	α-helix	trans	-61.1	-37.5	175.4	-27	37.3	0	0	0	114.2	I172 H180 W356 L403	I172-P176 VanDerWaalsContact O-CD 3.29Å; I172-P176 WeakPolarHBondContact O-CD 3.26Å; P176-H180 VanDerWaalsContact O-CB 3.27Å; P176-H180 WeakPolarHBondContact O-CB 3.27Å; P176-H180 PolarHBondContact O-N 3.37Å; P176-W356 HydrophobicContact CG-CE3 4.28Å; P176-W356 HydrophobicContact CG-CH2 4.23Å; P176-W356 HydrophobicContact CG-CZ3 3.49Å; P176-W356 VanDerWaalsContact CG-CZ3 3.49Å; P176-L403 HydrophobicContact CB-CB 3.95Å
177	I	89.4	Confident	84.8	Confident	25 Å²	25	32.2 Å²	32.2	13%	0.128	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-52.8	-179.7	-65.1	169.7	0	0	0	109.6	L173 L174 P175 H180 A181 A407 I411	L173-I177 WeakPolarHBondContact O-CD1 3.43Å; L173-I177 WeakPolarHBondContact O-CG1 3.32Å; L174-I177 PolarHBondContact O-N 2.97Å; L174-I177 VanDerWaalsContact O-N 3.15Å; P175-I177 VanDerWaalsContact C-N 3.33Å; P175-I177 PolarHBondContact O-N 3.49Å; I177-H180 PolarHBondContact O-N 3.43Å; I177-A181 WeakPolarHBondContact O-CB 3.14Å; I177-A181 PolarHBondContact O-N 3.18Å; I177-A407 HydrophobicContact CD1-CB 3.82Å; I177-A407 HydrophobicContact CG1-CB 3.85Å; I177-I411 HydrophobicContact CD1-CD1 3.55Å
178	I	89.6	Confident	84.2	Confident	7 Å²	7	34.1 Å²	34.1	4%	0.036	17%	0.167	C	C	.	.	H	α-helix	trans	-68.5	-37.7	-177.5	-58	-64.8	0	0	0	111.1	L174 P175 A181 G182 V370 V373 L374	L174-I178 HydrophobicContact CD1-CD1 4.08Å; L174-I178 HydrophobicContact CD1-CG1 3.71Å; L174-I178 HydrophobicContact CG-CG1 4.02Å; L174-I178 WeakPolarHBondContact O-CG1 3.21Å; L174-I178 PolarHBondContact O-N 2.94Å; L174-I178 VanDerWaalsContact O-N 3.13Å; P175-I178 PolarHBondContact O-N 3.38Å; I178-A181 WeakPolarHBondContact O-CB 3.4Å; I178-A181 PolarHBondContact O-N 3.09Å; I178-G182 PolarHBondContact O-N 3.29Å; I178-V370 HydrophobicContact CD1-CG1 4.31Å; I178-V370 HydrophobicContact CG1-CG1 4.17Å; I178-V370 HydrophobicContact CG2-CG1 4.4Å; I178-V373 HydrophobicContact CB-CG1 4.48Å; I178-V373 HydrophobicContact CG2-CG1 4.41Å; I178-L374 HydrophobicContact CG2-CB 3.76Å; I178-L374 HydrophobicContact CG2-CD1 4.26Å
179	F	91.6	Very high	83.6	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.009	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-48.3	175.9	-174.3	-89.6	0	0	0	111.7	P175 A181 G182 Y183 F351 S355 V373 F400	P175-F179 WeakPolarHBondContact O-CB 3.4Å; P175-F179 PolarHBondContact O-N 2.91Å; F179-A181 VanDerWaalsContact C-N 3.27Å; F179-A181 PolarHBondContact O-N 3.36Å; F179-G182 PolarHBondContact O-N 3.47Å; F179-G182 VanDerWaalsContact O-N 3.13Å; F179-Y183 HydrophobicContact CE1-CD2 4.11Å; F179-Y183 HydrophobicContact CE1-CG 4.08Å; F179-Y183 HydrophobicContact CZ-CD2 4.11Å; F179-Y183 VanDerWaalsContact O-CB 3.31Å; F179-Y183 WeakPolarHBondContact O-CB 3.25Å; F179-Y183 PolarHBondContact O-N 2.85Å; F179-F351 AromaticContact CE1-CE1 3.74Å; F179-F351 HydrophobicContact CE1-CE1 3.74Å; F179-F351 HydrophobicContact CE1-CZ 4.26Å; F179-F351 AromaticContact CZ-CE1 3.49Å; F179-F351 HydrophobicContact CZ-CE1 3.49Å; F179-F351 VanDerWaalsContact CZ-CE1 3.49Å; F179-F351 AromaticContact CZ-CZ 3.72Å; F179-F351 HydrophobicContact CZ-CZ 3.72Å; F179-S355 VanDerWaalsContact CE2-CB 3.41Å; F179-S355 VanDerWaalsContact CE2-OG 3.25Å; F179-S355 WeakPolarHBondContact CE2-OG 3.38Å; F179-S355 VanDerWaalsContact CZ-OG 3.29Å; F179-S355 WeakPolarHBondContact CZ-OG 3.28Å; F179-V373 HydrophobicContact CB-CG1 3.7Å; F179-V373 HydrophobicContact CD2-CG1 4.1Å; F179-V373 HydrophobicContact CG-CG1 4.43Å; F179-F400 HydrophobicContact CB-CD1 4.42Å; F179-F400 HydrophobicContact CB-CE1 4.2Å; F179-F400 AromaticContact CD1-CD1 3.41Å; F179-F400 HydrophobicContact CD1-CD1 3.41Å; F179-F400 VanDerWaalsContact CD1-CD1 3.41Å; F179-F400 AromaticContact CD1-CD2 3.82Å; F179-F400 HydrophobicContact CD1-CD2 3.82Å; F179-F400 AromaticContact CD1-CE1 3.27Å; F179-F400 HydrophobicContact CD1-CE1 3.27Å; F179-F400 AromaticContact CD1-CE2 3.71Å; F179-F400 HydrophobicContact CD1-CE2 3.71Å; F179-F400 AromaticContact CD1-CG 3.67Å; F179-F400 HydrophobicContact CD1-CG 3.67Å; F179-F400 AromaticContact CD1-CZ 3.42Å; F179-F400 HydrophobicContact CD1-CZ 3.42Å; F179-F400 VanDerWaalsContact CD1-CZ 3.42Å; F179-F400 HydrophobicContact CE1-CD1 4.09Å; F179-F400 AromaticContact CE1-CD2 3.63Å; F179-F400 HydrophobicContact CE1-CD2 3.63Å; F179-F400 AromaticContact CE1-CE1 3.86Å; F179-F400 HydrophobicContact CE1-CE1 3.86Å; F179-F400 AromaticContact CE1-CE2 3.38Å; F179-F400 HydrophobicContact CE1-CE2 3.38Å; F179-F400 AromaticContact CE1-CG 3.98Å; F179-F400 HydrophobicContact CE1-CG 3.98Å; F179-F400 AromaticContact CE1-CZ 3.48Å; F179-F400 HydrophobicContact CE1-CZ 3.48Å; F179-F400 VanDerWaalsContact CE1-CZ 3.48Å; F179-F400 HydrophobicContact CG-CD1 4.23Å; F179-F400 AromaticContact CG-CE1 3.84Å; F179-F400 HydrophobicContact CG-CE1 3.84Å; F179-F400 HydrophobicContact CG-CZ 4.13Å; F179-F400 HydrophobicContact CZ-CE2 4.24Å; F179-F400 HydrophobicContact CZ-CZ 4.24Å
180	H	90.1	Very high	83.1	Confident	28 Å²	28	33.2 Å²	33.2	13%	0.13	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-40.8	177	177.9	-103.9	0	0	0	111.3	P176 I177 Y183 S184 F400 H404	P176-H180 VanDerWaalsContact O-CB 3.27Å; P176-H180 WeakPolarHBondContact O-CB 3.27Å; P176-H180 PolarHBondContact O-N 3.37Å; I177-H180 PolarHBondContact O-N 3.43Å; H180-Y183 PolarHBondContact O-N 3.23Å; H180-S184 VanDerWaalsContact O-CB 3.28Å; H180-S184 WeakPolarHBondContact O-CB 3.34Å; H180-S184 PolarHBondContact O-N 3.47Å; H180-S184 PolarHBondContact O-OG 3.2Å; H180-F400 HydrophobicContact CB-CB 4.26Å; H180-H404 HydrophobicContact CB-CB 3.91Å; H180-H404 AromaticContact ND1-CD2 3.5Å; H180-H404 AromaticContact ND1-CG 3.57Å
181	A	85.1	Confident	82.7	Confident	8 Å²	8	35 Å²	35	7%	0.066	17%	0.167	C	C	.	.	H	α-helix	trans	-59.8	-47.3	173.4	0	0	0	0	0	111.9	I177 I178 F179 Y183 L185 F271 V275	I177-A181 WeakPolarHBondContact O-CB 3.14Å; I177-A181 PolarHBondContact O-N 3.18Å; I178-A181 WeakPolarHBondContact O-CB 3.4Å; I178-A181 PolarHBondContact O-N 3.09Å; F179-A181 VanDerWaalsContact C-N 3.27Å; F179-A181 PolarHBondContact O-N 3.36Å; A181-Y183 VanDerWaalsContact C-N 3.34Å; A181-Y183 PolarHBondContact O-N 2.8Å; A181-L185 WeakPolarHBondContact O-CG 3.41Å; A181-F271 HydrophobicContact CB-CE2 4.18Å; A181-F271 HydrophobicContact CB-CZ 3.72Å; A181-F271 WeakPolarHBondContact O-CZ 3.41Å; A181-V275 HydrophobicContact CB-CG1 4.28Å; A181-V275 HydrophobicContact CB-CG2 3.97Å
182	G	86.5	Confident	82.1	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-60.2	-40.5	174.7	0	0	0	0	0	113.5	I178 F179	I178-G182 PolarHBondContact O-N 3.29Å; F179-G182 PolarHBondContact O-N 3.47Å; F179-G182 VanDerWaalsContact O-N 3.13Å
183	Y	88.4	Confident	81.7	Confident	23 Å²	23	34.6 Å²	34.6	9%	0.09	16%	0.156	C	C	.	.	H	α-helix	trans	-81	-33.9	-172.3	-169.8	-100	0	0	0	113.8	F179 H180 A181 L185 F351 A381 S385 K397	F179-Y183 HydrophobicContact CE1-CD2 4.11Å; F179-Y183 HydrophobicContact CE1-CG 4.08Å; F179-Y183 HydrophobicContact CZ-CD2 4.11Å; F179-Y183 VanDerWaalsContact O-CB 3.31Å; F179-Y183 WeakPolarHBondContact O-CB 3.25Å; F179-Y183 PolarHBondContact O-N 2.85Å; H180-Y183 PolarHBondContact O-N 3.23Å; A181-Y183 VanDerWaalsContact C-N 3.34Å; A181-Y183 PolarHBondContact O-N 2.8Å; Y183-L185 VanDerWaalsContact C-N 3.31Å; Y183-L185 PolarHBondContact O-N 3.08Å; Y183-F351 HydrophobicContact CD2-CZ 4.03Å; Y183-F351 HydrophobicContact CE2-CE1 4.38Å; Y183-F351 HydrophobicContact CE2-CE2 4.32Å; Y183-F351 AromaticContact CE2-CZ 3.57Å; Y183-F351 HydrophobicContact CE2-CZ 3.57Å; Y183-A381 HydrophobicContact CD2-CB 3.61Å; Y183-A381 HydrophobicContact CE2-CB 3.96Å; Y183-A381 HydrophobicContact CG-CB 4.23Å; Y183-S385 PolarHBondContact OH-OG 3.06Å; Y183-K397 HydrophobicContact CE1-CB 4.39Å
184	S	81.7	Confident	81.4	Confident	50 Å²	50	36.1 Å²	36.1	35%	0.35	16%	0.164	S	C	.	.	S	Bend	trans	-86.3	2.5	-177.7	62	0	0	0	0	114.4	H180 K186	H180-S184 VanDerWaalsContact O-CB 3.28Å; H180-S184 WeakPolarHBondContact O-CB 3.34Å; H180-S184 PolarHBondContact O-N 3.47Å; H180-S184 PolarHBondContact O-OG 3.2Å; S184-K186 PolarHBondContact O-N 2.85Å
185	L	74.4	Confident	81.2	Confident	26 Å²	26	38.5 Å²	38.5	14%	0.136	19%	0.189	C	C	.	.			trans	-59.2	125.6	-178.3	-100.1	156.6	0	0	0	113.2	A181 Y183 K187 F190 F271 I378	A181-L185 WeakPolarHBondContact O-CG 3.41Å; Y183-L185 VanDerWaalsContact C-N 3.31Å; Y183-L185 PolarHBondContact O-N 3.08Å; L185-K187 PolarHBondContact O-N 3.49Å; L185-F190 HydrophobicContact CD1-CE2 4.38Å; L185-F190 HydrophobicContact CD1-CZ 4.38Å; L185-F190 HydrophobicContact CD2-CB 3.8Å; L185-F190 HydrophobicContact CD2-CD1 4.16Å; L185-F190 HydrophobicContact CD2-CD2 3.22Å; L185-F190 HydrophobicContact CD2-CE2 3.7Å; L185-F190 HydrophobicContact CD2-CG 3.47Å; L185-F190 VanDerWaalsContact CD2-CG 3.47Å; L185-F190 HydrophobicContact CD2-CZ 4.35Å; L185-F271 HydrophobicContact CD1-CE1 3.96Å; L185-F271 HydrophobicContact CD2-CD1 3.75Å; L185-F271 HydrophobicContact CD2-CE1 3.47Å; L185-F271 VanDerWaalsContact CD2-CE1 3.47Å; L185-F271 HydrophobicContact CG-CD1 4.26Å; L185-F271 HydrophobicContact CG-CE1 3.47Å; L185-F271 VanDerWaalsContact CG-CE1 3.47Å; L185-F271 HydrophobicContact CG-CZ 4.24Å; L185-I378 HydrophobicContact CD1-CD1 4.16Å; L185-I378 HydrophobicContact CD1-CG1 3.94Å
186	K	68.5	Low	80.9	Confident	97 Å²	97	38.9 Å²	38.9	42%	0.422	19%	0.191	S	C	.	.			trans	-69.9	91.9	169.1	-68.1	-174.6	-178.8	-179.2	0	109.7	S184 R188 H189 F190	S184-K186 PolarHBondContact O-N 2.85Å; K186-R188 VanDerWaalsContact C-N 3.33Å; K186-R188 PolarHBondContact O-N 3.31Å; K186-H189 PolarHBondContact O-N 3.11Å; K186-F190 WeakPolarHBondContact O-CB 3.28Å; K186-F190 PolarHBondContact O-N 3.44Å
187	K	69.8	Low	80.8	Confident	72 Å²	72	38.6 Å²	38.6	31%	0.313	19%	0.19	S	C	.	.	H	α-helix	trans	-45.3	-50	-173.1	-61.8	174.7	-177.2	170.2	0	112.9	L185 F190 F191 A381	L185-K187 PolarHBondContact O-N 3.49Å; K187-F190 PolarHBondContact O-N 3.17Å; K187-F191 HydrophobicContact CB-CD2 4.13Å; K187-F191 HydrophobicContact CB-CE2 4.17Å; K187-F191 HydrophobicContact CG-CE2 4.45Å; K187-F191 WeakPolarHBondContact O-CD2 3.32Å; K187-F191 PolarHBondContact O-N 3.33Å; K187-A381 WeakPolarHBondContact CE-O 3.31Å; K187-A381 PolarHBondContact NZ-O 2.98Å
188	R	69.4	Low	80.7	Confident	132 Å²	132	40.7 Å²	40.7	50%	0.498	20%	0.201	S	C	.	.	H	α-helix	trans	-58.6	-57.2	-174.3	-171.5	176.2	180	-173.4	-1.6	114.3	K186 F190 R192	K186-R188 VanDerWaalsContact C-N 3.33Å; K186-R188 PolarHBondContact O-N 3.31Å; R188-F190 VanDerWaalsContact C-N 3.32Å; R188-F190 PolarHBondContact O-N 2.89Å; R188-R192 WeakPolarHBondContact O-CB 3.35Å; R188-R192 PolarHBondContact O-N 3.38Å; R188-R192 VanDerWaalsContact O-N 3.17Å
189	H	71.8	Confident	80.7	Confident	24 Å²	24	42.1 Å²	42.1	11%	0.111	21%	0.21	C	C	.	.	H	α-helix	trans	-69.1	-32.7	-178.3	-66.9	-83	0	0	0	112.3	K186 R192 N193 D265 A268 D533	K186-H189 PolarHBondContact O-N 3.11Å; H189-R192 PolarHBondContact ND1-NH2 2.83Å; H189-N193 WeakPolarHBondContact O-CB 3.37Å; H189-N193 PolarHBondContact O-N 3.41Å; H189-N193 PolarHBondContact O-ND2 3.26Å; H189-D265 IonicContact CG-OD1 3.59Å; H189-D265 IonicContact ND1-OD1 3.48Å; H189-D265 PolarHBondContact ND1-OD1 2.85Å; H189-A268 HydrophobicContact CB-CB 3.78Å; H189-D533 IonicContact CE1-OD2 3.82Å
190	F	74.4	Confident	80.7	Confident	11 Å²	11	42.2 Å²	42.2	5%	0.048	21%	0.21	C	C	.	.	H	α-helix	trans	-67.7	-50.8	178.2	-177.2	-98.8	0	0	0	112	L185 K186 K187 R188 R192 N193 L194 I197	L185-F190 HydrophobicContact CD1-CE2 4.38Å; L185-F190 HydrophobicContact CD1-CZ 4.38Å; L185-F190 HydrophobicContact CD2-CB 3.8Å; L185-F190 HydrophobicContact CD2-CD1 4.16Å; L185-F190 HydrophobicContact CD2-CD2 3.22Å; L185-F190 HydrophobicContact CD2-CE2 3.7Å; L185-F190 HydrophobicContact CD2-CG 3.47Å; L185-F190 VanDerWaalsContact CD2-CG 3.47Å; L185-F190 HydrophobicContact CD2-CZ 4.35Å; K186-F190 WeakPolarHBondContact O-CB 3.28Å; K186-F190 PolarHBondContact O-N 3.44Å; K187-F190 PolarHBondContact O-N 3.17Å; R188-F190 VanDerWaalsContact C-N 3.32Å; R188-F190 PolarHBondContact O-N 2.89Å; F190-R192 VanDerWaalsContact C-N 3.35Å; F190-R192 PolarHBondContact O-N 3.2Å; F190-N193 CarbonylContact O-C 3.57Å; F190-N193 PolarHBondContact O-N 3.28Å; F190-L194 HydrophobicContact CD1-CD1 4.4Å; F190-L194 HydrophobicContact CE1-CD1 3.72Å; F190-L194 HydrophobicContact CZ-CD1 4.05Å; F190-L194 WeakPolarHBondContact O-CA 3.2Å; F190-L194 PolarHBondContact O-N 3.31Å; F190-I197 HydrophobicContact CD2-CD1 3.62Å; F190-I197 HydrophobicContact CE2-CD1 3.77Å; F190-I197 HydrophobicContact CE2-CG2 4.38Å; F190-I197 HydrophobicContact CG-CD1 4.39Å
191	F	72.6	Confident	80.6	Confident	54 Å²	54	40.9 Å²	40.9	24%	0.237	20%	0.204	C	C	.	.	H	α-helix	trans	-68.2	-33.2	-179.3	-75	-68.1	0	0	0	112.7	K187 N193 L194 I378 F565	K187-F191 HydrophobicContact CB-CD2 4.13Å; K187-F191 HydrophobicContact CB-CE2 4.17Å; K187-F191 HydrophobicContact CG-CE2 4.45Å; K187-F191 WeakPolarHBondContact O-CD2 3.32Å; K187-F191 PolarHBondContact O-N 3.33Å; F191-N193 VanDerWaalsContact C-N 3.28Å; F191-N193 PolarHBondContact O-N 2.89Å; F191-L194 HydrophobicContact CD1-CD2 4.2Å; F191-L194 WeakPolarHBondContact O-CB 3.32Å; F191-L194 PolarHBondContact O-N 3.12Å; F191-I378 HydrophobicContact CZ-CG2 4.46Å; F191-F565 HydrophobicContact CB-CE2 4.13Å
192	R	74.9	Confident	80.9	Confident	128 Å²	128	43 Å²	43	48%	0.483	21%	0.212	S	C	.	.	H	α-helix	trans	-61	-36.5	172.5	-175.5	168.5	71	177.3	1.1	112.5	R188 H189 F190 D265	R188-R192 WeakPolarHBondContact O-CB 3.35Å; R188-R192 PolarHBondContact O-N 3.38Å; R188-R192 VanDerWaalsContact O-N 3.17Å; H189-R192 PolarHBondContact ND1-NH2 2.83Å; F190-R192 VanDerWaalsContact C-N 3.35Å; F190-R192 PolarHBondContact O-N 3.2Å; R192-D265 IonicContact CZ-OD1 3.65Å; R192-D265 IonicContact CZ-OD2 3.23Å; R192-D265 IonicContact NE-OD1 3.62Å; R192-D265 IonicContact NH2-OD1 2.65Å; R192-D265 PolarHBondContact NH2-OD1 3.23Å; R192-D265 IonicContact NH2-OD2 3.81Å; R192-D265 PolarHBondContact NH2-OD2 3.18Å
193	N	78.9	Confident	81.1	Confident	3 Å²	3	47 Å²	47	2%	0.016	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	6.9	-177.5	-68.2	-68.5	0	0	0	113.9	H189 F190 F191 G195 S196 I197 D265 R458	H189-N193 WeakPolarHBondContact O-CB 3.37Å; H189-N193 PolarHBondContact O-N 3.41Å; H189-N193 PolarHBondContact O-ND2 3.26Å; F190-N193 CarbonylContact O-C 3.57Å; F190-N193 PolarHBondContact O-N 3.28Å; F191-N193 VanDerWaalsContact C-N 3.28Å; F191-N193 PolarHBondContact O-N 2.89Å; N193-G195 VanDerWaalsContact C-N 3.34Å; N193-G195 PolarHBondContact O-N 2.9Å; N193-S196 WeakPolarHBondContact O-CB 3.25Å; N193-S196 PolarHBondContact O-N 3.09Å; N193-I197 HydrophobicContact CB-CD1 4.21Å; N193-I197 PolarHBondContact O-N 2.85Å; N193-D265 PolarHBondContact ND2-OD1 3.43Å; N193-D265 VanDerWaalsContact ND2-OD1 3.12Å; N193-R458 VanDerWaalsContact OD1-CZ 3.27Å; N193-R458 PolarHBondContact OD1-NH1 3.34Å; N193-R458 PolarHBondContact OD1-NH2 2.91Å
194	L	81.8	Confident	81.3	Confident	56 Å²	56	45.9 Å²	45.9	29%	0.293	23%	0.228	S	C	.	.	H	α-helix	trans	-55.6	-43.7	-170	-176.6	67.5	0	0	0	113.1	F190 F191 S196 I197 I198	F190-L194 HydrophobicContact CD1-CD1 4.4Å; F190-L194 HydrophobicContact CE1-CD1 3.72Å; F190-L194 HydrophobicContact CZ-CD1 4.05Å; F190-L194 WeakPolarHBondContact O-CA 3.2Å; F190-L194 PolarHBondContact O-N 3.31Å; F191-L194 HydrophobicContact CD1-CD2 4.2Å; F191-L194 WeakPolarHBondContact O-CB 3.32Å; F191-L194 PolarHBondContact O-N 3.12Å; L194-S196 VanDerWaalsContact C-N 3.3Å; L194-S196 PolarHBondContact O-N 3.38Å; L194-I197 PolarHBondContact O-N 2.78Å; L194-I198 HydrophobicContact CD1-CD1 3.98Å; L194-I198 HydrophobicContact CD1-CG1 4.16Å; L194-I198 HydrophobicContact CD2-CD1 4.25Å; L194-I198 HydrophobicContact CG-CD1 3.73Å; L194-I198 HydrophobicContact CG-CG1 4.28Å; L194-I198 WeakPolarHBondContact O-CG1 3.48Å; L194-I198 PolarHBondContact O-N 3.49Å
195	G	83.5	Confident	81.8	Confident	50 Å²	50	43.6 Å²	43.6	52%	0.515	21%	0.212	S	C	.	.	H	α-helix	trans	-61.3	-37.2	179.2	0	0	0	0	0	113.2	N193 T199	N193-G195 VanDerWaalsContact C-N 3.34Å; N193-G195 PolarHBondContact O-N 2.9Å; G195-T199 WeakPolarHBondContact O-CB 3.25Å; G195-T199 PolarHBondContact O-N 3.05Å; G195-T199 VanDerWaalsContact O-N 3.11Å; G195-T199 PolarHBondContact O-OG1 3.27Å
196	S	86	Confident	82.7	Confident	12 Å²	12	43.8 Å²	43.8	8%	0.084	22%	0.217	C	C	.	.	H	α-helix	trans	-69.6	-44.1	175.1	-60.5	0	0	0	0	111	N193 L194 T199 Y200 R458	N193-S196 WeakPolarHBondContact O-CB 3.25Å; N193-S196 PolarHBondContact O-N 3.09Å; L194-S196 VanDerWaalsContact C-N 3.3Å; L194-S196 PolarHBondContact O-N 3.38Å; S196-T199 PolarHBondContact O-N 2.91Å; S196-Y200 WeakPolarHBondContact O-CD2 3.31Å; S196-Y200 PolarHBondContact O-N 3.49Å; S196-R458 PolarHBondContact OG-NH1 3.44Å
197	I	88.3	Confident	83.8	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-49.7	178.5	-68.2	165.5	0	0	0	110.8	F190 N193 L194 T199 Y200 A201 L269 G272 M276	F190-I197 HydrophobicContact CD2-CD1 3.62Å; F190-I197 HydrophobicContact CE2-CD1 3.77Å; F190-I197 HydrophobicContact CE2-CG2 4.38Å; F190-I197 HydrophobicContact CG-CD1 4.39Å; N193-I197 HydrophobicContact CB-CD1 4.21Å; N193-I197 PolarHBondContact O-N 2.85Å; L194-I197 PolarHBondContact O-N 2.78Å; I197-T199 VanDerWaalsContact C-N 3.3Å; I197-T199 PolarHBondContact O-N 3.28Å; I197-Y200 PolarHBondContact O-N 3.5Å; I197-A201 VanDerWaalsContact O-CB 3.25Å; I197-A201 WeakPolarHBondContact O-CB 3.34Å; I197-A201 PolarHBondContact O-N 3.3Å; I197-L269 HydrophobicContact CG1-CG 4.37Å; I197-G272 VanDerWaalsContact CG2-C 3.41Å; I197-G272 WeakPolarHBondContact CG2-O 3.44Å; I197-M276 HydrophobicContact CG2-CG 4.29Å
198	I	87.5	Confident	85	Confident	70 Å²	70	37.9 Å²	37.9	36%	0.359	20%	0.195	S	C	.	.	H	α-helix	trans	-60.5	-42.3	177.7	-68.2	173.2	0	0	0	110.5	L194 Y200 A201 F202	L194-I198 HydrophobicContact CD1-CD1 3.98Å; L194-I198 HydrophobicContact CD1-CG1 4.16Å; L194-I198 HydrophobicContact CD2-CD1 4.25Å; L194-I198 HydrophobicContact CG-CD1 3.73Å; L194-I198 HydrophobicContact CG-CG1 4.28Å; L194-I198 WeakPolarHBondContact O-CG1 3.48Å; L194-I198 PolarHBondContact O-N 3.49Å; I198-Y200 PolarHBondContact O-N 3.34Å; I198-A201 PolarHBondContact O-N 3.03Å; I198-F202 HydrophobicContact CG2-CD2 3.79Å; I198-F202 HydrophobicContact CG2-CE2 4.08Å; I198-F202 WeakPolarHBondContact O-CD2 3.43Å; I198-F202 PolarHBondContact O-N 3.13Å
199	T	89.9	Confident	86.1	Confident	37 Å²	37	31.7 Å²	31.7	23%	0.227	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-46.4	178.6	-56.9	0	0	0	0	111.4	G195 S196 I197 L203 G204 L450 L454	G195-T199 WeakPolarHBondContact O-CB 3.25Å; G195-T199 PolarHBondContact O-N 3.05Å; G195-T199 VanDerWaalsContact O-N 3.11Å; G195-T199 PolarHBondContact O-OG1 3.27Å; S196-T199 PolarHBondContact O-N 2.91Å; I197-T199 VanDerWaalsContact C-N 3.3Å; I197-T199 PolarHBondContact O-N 3.28Å; T199-L203 HydrophobicContact CG2-CB 4.47Å; T199-L203 HydrophobicContact CG2-CD2 4.38Å; T199-L203 WeakPolarHBondContact O-CA 3.48Å; T199-L203 VanDerWaalsContact O-CB 3.25Å; T199-L203 WeakPolarHBondContact O-CB 3.12Å; T199-L203 PolarHBondContact O-N 3.04Å; T199-G204 PolarHBondContact O-N 3.2Å; T199-L450 HydrophobicContact CG2-CD2 4.25Å; T199-L454 HydrophobicContact CG2-CD1 4.21Å; T199-L454 HydrophobicContact CG2-CD2 4.01Å; T199-L454 HydrophobicContact CG2-CG 4.23Å
200	Y	90.3	Very high	87.1	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.016	18%	0.184	C	C	.	.	I	π-helix	trans	-66.3	-41.9	176.1	-71.1	-61.9	0	0	0	112.7	S196 I197 I198 G204 T205 L269 L450 S451 L454 I462	S196-Y200 WeakPolarHBondContact O-CD2 3.31Å; S196-Y200 PolarHBondContact O-N 3.49Å; I197-Y200 PolarHBondContact O-N 3.5Å; I198-Y200 PolarHBondContact O-N 3.34Å; Y200-G204 CarbonylContact O-C 3.49Å; Y200-G204 WeakPolarHBondContact O-CA 3.32Å; Y200-G204 PolarHBondContact O-N 3.08Å; Y200-T205 PolarHBondContact O-N 3.37Å; Y200-L269 HydrophobicContact CD2-CD2 4.11Å; Y200-L269 HydrophobicContact CD2-CG 4.5Å; Y200-L269 HydrophobicContact CE2-CD1 4.19Å; Y200-L269 HydrophobicContact CE2-CD2 3.96Å; Y200-L269 HydrophobicContact CE2-CG 4.45Å; Y200-L450 HydrophobicContact CD1-CB 4.13Å; Y200-L450 HydrophobicContact CD1-CD2 4.03Å; Y200-L450 HydrophobicContact CE1-CB 3.78Å; Y200-S451 VanDerWaalsContact OH-CA 3.32Å; Y200-S451 WeakPolarHBondContact OH-CA 3.19Å; Y200-S451 WeakPolarHBondContact OH-CB 3.41Å; Y200-S451 PolarHBondContact OH-OG 2.83Å; Y200-L454 HydrophobicContact CD2-CD1 4.22Å; Y200-L454 HydrophobicContact CE1-CD1 4.25Å; Y200-L454 HydrophobicContact CE2-CD1 3.63Å; Y200-I462 HydrophobicContact CE2-CD1 4.22Å; Y200-I462 WeakPolarHBondContact OH-CD1 3.36Å
201	A	89.9	Confident	88.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.191	C	C	.	.	I	π-helix	trans	-67.3	-39.4	-176.6	0	0	0	0	0	113.1	I197 I198 T205 M276	I197-A201 VanDerWaalsContact O-CB 3.25Å; I197-A201 WeakPolarHBondContact O-CB 3.34Å; I197-A201 PolarHBondContact O-N 3.3Å; I198-A201 PolarHBondContact O-N 3.03Å; A201-T205 WeakPolarHBondContact O-CB 3.33Å; A201-T205 PolarHBondContact O-OG1 2.94Å; A201-M276 HydrophobicContact CB-CB 3.38Å; A201-M276 HydrophobicContact CB-CG 4.44Å
202	F	90	Very high	89.2	Confident	53 Å²	53	32.9 Å²	32.9	23%	0.232	18%	0.18	C	C	.	.	I	π-helix	trans	-90.4	-63.2	178.9	-77.5	-93.2	0	0	0	112.1	I198 A206 M276 V280 F313 F317	I198-F202 HydrophobicContact CG2-CD2 3.79Å; I198-F202 HydrophobicContact CG2-CE2 4.08Å; I198-F202 WeakPolarHBondContact O-CD2 3.43Å; I198-F202 PolarHBondContact O-N 3.13Å; F202-A206 VanDerWaalsContact O-CB 3.28Å; F202-A206 WeakPolarHBondContact O-CB 3.46Å; F202-A206 PolarHBondContact O-N 3.26Å; F202-M276 HydrophobicContact CE2-CE 4.22Å; F202-V280 HydrophobicContact CD1-CG2 4.07Å; F202-V280 HydrophobicContact CD2-CG2 4.45Å; F202-V280 HydrophobicContact CE1-CG2 4.09Å; F202-V280 HydrophobicContact CE2-CG2 4.47Å; F202-V280 HydrophobicContact CG-CG2 4.29Å; F202-V280 HydrophobicContact CZ-CG2 4.33Å; F202-F313 HydrophobicContact CD1-CE1 4.26Å; F202-F313 HydrophobicContact CD1-CZ 4.24Å; F202-F313 HydrophobicContact CE1-CE1 4.17Å; F202-F313 HydrophobicContact CE1-CZ 4.18Å; F202-F317 HydrophobicContact CE1-CD1 4.21Å; F202-F317 HydrophobicContact CE1-CD2 4.17Å; F202-F317 HydrophobicContact CE1-CE1 4.17Å; F202-F317 HydrophobicContact CE1-CE2 4.08Å; F202-F317 HydrophobicContact CE1-CG 4.25Å; F202-F317 HydrophobicContact CE1-CZ 4.1Å; F202-F317 HydrophobicContact CE2-CE1 4.38Å; F202-F317 HydrophobicContact CE2-CZ 4.03Å; F202-F317 AromaticContact CZ-CD1 3.9Å; F202-F317 HydrophobicContact CZ-CD1 3.9Å; F202-F317 HydrophobicContact CZ-CD2 4.16Å; F202-F317 AromaticContact CZ-CE1 3.42Å; F202-F317 HydrophobicContact CZ-CE1 3.42Å; F202-F317 VanDerWaalsContact CZ-CE1 3.42Å; F202-F317 AromaticContact CZ-CE2 3.66Å; F202-F317 HydrophobicContact CZ-CE2 3.66Å; F202-F317 HydrophobicContact CZ-CG 4.28Å; F202-F317 AromaticContact CZ-CZ 3.28Å; F202-F317 HydrophobicContact CZ-CZ 3.28Å
203	L	91.5	Very high	90.1	Very high	84 Å²	84	26.8 Å²	26.8	44%	0.44	16%	0.157	S	C	.	.	I	π-helix	trans	-70.2	-39.9	-173.6	-173.9	63.4	0	0	0	110.5	T199 A206 V207 L450	T199-L203 HydrophobicContact CG2-CB 4.47Å; T199-L203 HydrophobicContact CG2-CD2 4.38Å; T199-L203 WeakPolarHBondContact O-CA 3.48Å; T199-L203 VanDerWaalsContact O-CB 3.25Å; T199-L203 WeakPolarHBondContact O-CB 3.12Å; T199-L203 PolarHBondContact O-N 3.04Å; L203-A206 PolarHBondContact O-N 2.65Å; L203-V207 HydrophobicContact CD1-CG2 4.26Å; L203-V207 HydrophobicContact CG-CG2 4.38Å; L203-V207 WeakPolarHBondContact O-CB 3.44Å; L203-V207 WeakPolarHBondContact O-CG2 3.36Å; L203-V207 PolarHBondContact O-N 3.22Å; L203-L450 HydrophobicContact CB-CD2 4.1Å; L203-L450 HydrophobicContact CD2-CD1 4.36Å; L203-L450 HydrophobicContact CD2-CD2 4.35Å; L203-L450 HydrophobicContact CD2-CG 4.22Å; L203-L450 HydrophobicContact CG-CD1 4.41Å; L203-L450 HydrophobicContact CG-CD2 4.2Å; L203-L450 HydrophobicContact CG-CG 4.47Å
204	G	92.2	Very high	90.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.175	C	C	.	.	I	π-helix	trans	-64.8	-45.6	179.2	0	0	0	0	0	112.6	T199 Y200 V207 S208 N446 L450	T199-G204 PolarHBondContact O-N 3.2Å; Y200-G204 CarbonylContact O-C 3.49Å; Y200-G204 WeakPolarHBondContact O-CA 3.32Å; Y200-G204 PolarHBondContact O-N 3.08Å; G204-V207 PolarHBondContact O-N 3.29Å; G204-S208 VanDerWaalsContact O-CB 3.25Å; G204-S208 WeakPolarHBondContact O-CB 3.26Å; G204-S208 PolarHBondContact O-N 2.98Å; G204-N446 VanDerWaalsContact C-ND2 3.34Å; G204-N446 WeakPolarHBondContact CA-OD1 3.31Å; G204-N446 PolarHBondContact O-ND2 3.08Å; G204-L450 VanDerWaalsContact CA-CD2 3.49Å
205	T	92.6	Very high	91.3	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-64.6	-43.1	176.5	-49.8	0	0	0	0	111.7	Y200 A201 S208 C209 S246 N277 V280 A281	Y200-T205 PolarHBondContact O-N 3.37Å; A201-T205 WeakPolarHBondContact O-CB 3.33Å; A201-T205 PolarHBondContact O-OG1 2.94Å; T205-S208 PolarHBondContact O-N 3.01Å; T205-C209 VanDerWaalsContact O-CB 3.3Å; T205-C209 WeakPolarHBondContact O-CB 3.42Å; T205-C209 PolarHBondContact O-N 3.5Å; T205-S246 WeakPolarHBondContact CG2-OG 3.33Å; T205-N277 VanDerWaalsContact OG1-CB 3.32Å; T205-N277 WeakPolarHBondContact OG1-CB 3.4Å; T205-V280 HydrophobicContact CG2-CB 4.48Å; T205-V280 HydrophobicContact CG2-CG1 3.97Å; T205-A281 HydrophobicContact CG2-CB 4.38Å
206	A	92	Very high	91.8	Very high	30 Å²	30	28.3 Å²	28.3	25%	0.248	15%	0.153	C	C	.	.	H	α-helix	trans	-61.7	-49.2	175.9	0	0	0	0	0	111.8	F202 L203 S208 C209 F210	F202-A206 VanDerWaalsContact O-CB 3.28Å; F202-A206 WeakPolarHBondContact O-CB 3.46Å; F202-A206 PolarHBondContact O-N 3.26Å; L203-A206 PolarHBondContact O-N 2.65Å; A206-S208 PolarHBondContact O-N 2.99Å; A206-C209 WeakPolarHBondContact O-CB 3.29Å; A206-C209 PolarHBondContact O-N 3.42Å; A206-F210 WeakPolarHBondContact O-CD2 3.28Å; A206-F210 PolarHBondContact O-N 3.45Å
207	V	93.4	Very high	92.1	Very high	44 Å²	44	31.1 Å²	31.1	27%	0.267	16%	0.162	S	C	.	.	H	α-helix	trans	-60	-46.6	176.7	170.2	0	0	0	0	110.6	L203 G204 C209 F210 V211	L203-V207 HydrophobicContact CD1-CG2 4.26Å; L203-V207 HydrophobicContact CG-CG2 4.38Å; L203-V207 WeakPolarHBondContact O-CB 3.44Å; L203-V207 WeakPolarHBondContact O-CG2 3.36Å; L203-V207 PolarHBondContact O-N 3.22Å; G204-V207 PolarHBondContact O-N 3.29Å; V207-C209 VanDerWaalsContact C-N 3.34Å; V207-C209 PolarHBondContact O-N 3.02Å; V207-F210 PolarHBondContact O-N 3.03Å; V207-V211 HydrophobicContact CG1-CG2 4.22Å; V207-V211 WeakPolarHBondContact O-CB 3.44Å; V207-V211 VanDerWaalsContact O-CG2 3.27Å; V207-V211 WeakPolarHBondContact O-CG2 3.43Å; V207-V211 PolarHBondContact O-N 3.01Å
208	S	93.3	Very high	92.2	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.007	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-44.4	177.2	-174.8	0	0	0	0	111.6	G204 T205 A206 V211 I212	G204-S208 VanDerWaalsContact O-CB 3.25Å; G204-S208 WeakPolarHBondContact O-CB 3.26Å; G204-S208 PolarHBondContact O-N 2.98Å; T205-S208 PolarHBondContact O-N 3.01Å; A206-S208 PolarHBondContact O-N 2.99Å; S208-V211 PolarHBondContact O-N 3.49Å; S208-I212 WeakPolarHBondContact O-CB 3.24Å; S208-I212 WeakPolarHBondContact O-CD1 3.41Å; S208-I212 WeakPolarHBondContact O-CG1 3.28Å; S208-I212 PolarHBondContact O-N 3.43Å; S208-I212 WeakPolarHBondContact OG-CD1 3.49Å
209	C	93.7	Very high	92.4	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-60.3	-49.1	177.7	174	0	0	0	0	111.6	T205 A206 V207 G213 L239 A243 L284	T205-C209 VanDerWaalsContact O-CB 3.3Å; T205-C209 WeakPolarHBondContact O-CB 3.42Å; T205-C209 PolarHBondContact O-N 3.5Å; A206-C209 WeakPolarHBondContact O-CB 3.29Å; A206-C209 PolarHBondContact O-N 3.42Å; V207-C209 VanDerWaalsContact C-N 3.34Å; V207-C209 PolarHBondContact O-N 3.02Å; C209-G213 PolarHBondContact O-N 2.96Å; C209-L239 PolarHBondContact SG-O 2.69Å; C209-A243 PolarHBondContact SG-N 2.97Å; C209-A243 VanDerWaalsContact SG-N 3.37Å; C209-L284 HydrophobicContact CB-CD2 3.6Å
210	F	92.9	Very high	92.3	Very high	82 Å²	82	29.1 Å²	29.1	36%	0.36	16%	0.16	S	C	.	.	H	α-helix	trans	-64.3	-44.2	179	-80.5	-67.4	0	0	0	112.3	A206 V207 N214 L239 F306	A206-F210 WeakPolarHBondContact O-CD2 3.28Å; A206-F210 PolarHBondContact O-N 3.45Å; V207-F210 PolarHBondContact O-N 3.03Å; F210-N214 WeakPolarHBondContact O-CB 3.17Å; F210-N214 PolarHBondContact O-N 3.36Å; F210-N214 PolarHBondContact O-ND2 3.23Å; F210-L239 HydrophobicContact CD1-CD2 3.87Å; F210-L239 HydrophobicContact CE1-CD2 4.2Å; F210-F306 HydrophobicContact CZ-CE2 4.02Å; F210-F306 HydrophobicContact CZ-CZ 4.48Å
211	V	95.4	Very high	92.2	Very high	33 Å²	33	34.5 Å²	34.5	20%	0.2	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-50.9	179.5	169.6	0	0	0	0	110.7	V207 S208 G213 N214 L215 I441 L445	V207-V211 HydrophobicContact CG1-CG2 4.22Å; V207-V211 WeakPolarHBondContact O-CB 3.44Å; V207-V211 VanDerWaalsContact O-CG2 3.27Å; V207-V211 WeakPolarHBondContact O-CG2 3.43Å; V207-V211 PolarHBondContact O-N 3.01Å; S208-V211 PolarHBondContact O-N 3.49Å; V211-G213 PolarHBondContact O-N 3.46Å; V211-N214 PolarHBondContact O-N 2.75Å; V211-L215 WeakPolarHBondContact O-CB 3.44Å; V211-L215 PolarHBondContact O-N 3.08Å; V211-I441 HydrophobicContact CG1-CG2 4.16Å; V211-L445 HydrophobicContact CG1-CD1 3.91Å; V211-L445 HydrophobicContact CG2-CB 4.41Å; V211-L445 HydrophobicContact CG2-CD1 3.97Å
212	I	94.8	Very high	92	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.7	-45.5	-179.4	-66.1	168.5	0	0	0	110	S208 N214 L215 M216 F241 I245 A438	S208-I212 WeakPolarHBondContact O-CB 3.24Å; S208-I212 WeakPolarHBondContact O-CD1 3.41Å; S208-I212 WeakPolarHBondContact O-CG1 3.28Å; S208-I212 PolarHBondContact O-N 3.43Å; S208-I212 WeakPolarHBondContact OG-CD1 3.49Å; I212-N214 PolarHBondContact O-N 2.84Å; I212-L215 PolarHBondContact O-N 2.95Å; I212-M216 HydrophobicContact CG2-CG 4.3Å; I212-M216 WeakPolarHBondContact O-CB 3.33Å; I212-M216 WeakPolarHBondContact O-CG 3.47Å; I212-M216 PolarHBondContact O-N 2.76Å; I212-F241 HydrophobicContact CG2-CD1 4.22Å; I212-F241 HydrophobicContact CG2-CE1 4.49Å; I212-I245 HydrophobicContact CD1-CG2 4.05Å; I212-A438 HydrophobicContact CG2-CB 4.15Å
213	G	93.3	Very high	91.8	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-41.3	179.9	0	0	0	0	0	113.3	C209 V211 Y217 C238	C209-G213 PolarHBondContact O-N 2.96Å; V211-G213 PolarHBondContact O-N 3.46Å; G213-Y217 WeakPolarHBondContact O-CB 3.38Å; G213-Y217 PolarHBondContact O-N 2.9Å; G213-C238 VanDerWaalsContact CA-O 3.23Å; G213-C238 WeakPolarHBondContact CA-O 3.31Å; G213-C238 WeakPolarHBondContact O-CB 3.38Å
214	N	93	Very high	91.4	Very high	77 Å²	77	42.3 Å²	42.3	41%	0.412	21%	0.213	S	C	.	.	H	α-helix	trans	-68.2	-41.8	176	-82	-79.7	0	0	0	112.3	F210 V211 I212 M216 Y217 G218 Y235	F210-N214 WeakPolarHBondContact O-CB 3.17Å; F210-N214 PolarHBondContact O-N 3.36Å; F210-N214 PolarHBondContact O-ND2 3.23Å; V211-N214 PolarHBondContact O-N 2.75Å; I212-N214 PolarHBondContact O-N 2.84Å; N214-M216 VanDerWaalsContact C-N 3.34Å; N214-Y217 PolarHBondContact O-N 3.5Å; N214-G218 PolarHBondContact O-N 3.29Å; N214-Y235 PolarHBondContact ND2-OH 3.3Å; N214-Y235 PolarHBondContact OD1-OH 3.4Å
215	L	94.6	Very high	90.9	Very high	63 Å²	63	46.5 Å²	46.5	33%	0.33	25%	0.248	S	C	.	.	H	α-helix	trans	-64.8	-42.7	177.4	-166	68.1	0	0	0	110.9	V211 I212 Y217 G218 V219 V437 A438 I441	V211-L215 WeakPolarHBondContact O-CB 3.44Å; V211-L215 PolarHBondContact O-N 3.08Å; I212-L215 PolarHBondContact O-N 2.95Å; L215-Y217 VanDerWaalsContact C-N 3.33Å; L215-Y217 PolarHBondContact O-N 3Å; L215-G218 WeakPolarHBondContact O-CA 3.43Å; L215-G218 PolarHBondContact O-N 3.4Å; L215-G218 VanDerWaalsContact O-N 3.08Å; L215-V219 WeakPolarHBondContact O-CG2 2.92Å; L215-V219 PolarHBondContact O-N 2.99Å; L215-V437 HydrophobicContact CD2-CG1 4.4Å; L215-A438 HydrophobicContact CB-CB 4.2Å; L215-A438 HydrophobicContact CD2-CB 3.6Å; L215-A438 HydrophobicContact CG-CB 4.3Å; L215-I441 HydrophobicContact CD2-CD1 4.06Å
216	M	93.1	Very high	90.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-36.2	177	-73.2	-41.4	-50.5	0	0	113	I212 N214 G218 V219 V220 C238 F241 F431 G434 A435 A438	I212-M216 HydrophobicContact CG2-CG 4.3Å; I212-M216 WeakPolarHBondContact O-CB 3.33Å; I212-M216 WeakPolarHBondContact O-CG 3.47Å; I212-M216 PolarHBondContact O-N 2.76Å; N214-M216 VanDerWaalsContact C-N 3.34Å; M216-G218 VanDerWaalsContact C-N 3.27Å; M216-G218 PolarHBondContact O-N 3.4Å; M216-V219 HydrophobicContact CE-CB 3.73Å; M216-V219 HydrophobicContact CE-CG1 3.82Å; M216-V219 HydrophobicContact CE-CG2 4.13Å; M216-V219 PolarHBondContact O-N 3.48Å; M216-V219 VanDerWaalsContact O-N 3.17Å; M216-V219 HydrophobicContact SD-CG2 4.32Å; M216-V220 WeakPolarHBondContact O-CB 3.28Å; M216-V220 VanDerWaalsContact O-CG2 3.3Å; M216-V220 WeakPolarHBondContact O-CG2 3.38Å; M216-V220 PolarHBondContact O-N 3.17Å; M216-C238 HydrophobicContact CB-CB 4.43Å; M216-F241 HydrophobicContact CG-CD1 3.79Å; M216-F241 HydrophobicContact CG-CE1 4.02Å; M216-F431 HydrophobicContact CE-CD1 4.36Å; M216-F431 HydrophobicContact CE-CD2 3.51Å; M216-F431 HydrophobicContact CE-CE1 4.3Å; M216-F431 HydrophobicContact CE-CE2 3.44Å; M216-F431 VanDerWaalsContact CE-CE2 3.44Å; M216-F431 HydrophobicContact CE-CG 3.99Å; M216-F431 HydrophobicContact CE-CZ 3.86Å; M216-G434 VanDerWaalsContact SD-C 3.56Å; M216-A435 VanDerWaalsContact SD-CA 3.51Å; M216-A435 HydrophobicContact SD-CB 3.99Å; M216-A435 PolarHBondContact SD-N 2.91Å; M216-A435 VanDerWaalsContact SD-N 3.44Å; M216-A438 HydrophobicContact CG-CB 4.4Å; M216-A438 HydrophobicContact SD-CB 4.03Å
217	Y	91.5	Very high	89.3	Confident	72 Å²	72	52 Å²	52	28%	0.282	29%	0.29	S	S	.	.	H	α-helix	trans	-61.2	-38	171.4	-178.2	-113.8	0	0	0	112.1	G213 N214 L215 V220 K221 Y235	G213-Y217 WeakPolarHBondContact O-CB 3.38Å; G213-Y217 PolarHBondContact O-N 2.9Å; N214-Y217 PolarHBondContact O-N 3.5Å; L215-Y217 VanDerWaalsContact C-N 3.33Å; L215-Y217 PolarHBondContact O-N 3Å; Y217-V220 PolarHBondContact O-N 2.68Å; Y217-K221 HydrophobicContact CD1-CD 4.43Å; Y217-K221 HydrophobicContact CE1-CD 3.95Å; Y217-K221 VanDerWaalsContact CE1-NZ 3.34Å; Y217-K221 PolarHBondContact O-N 2.95Å; Y217-K221 WeakPolarHBondContact OH-CE 3.41Å; Y217-K221 PolarHBondContact OH-NZ 3.13Å; Y217-Y235 HydrophobicContact CD1-CD2 4.06Å; Y217-Y235 AromaticContact CD2-CD2 3.91Å; Y217-Y235 HydrophobicContact CD2-CD2 3.91Å; Y217-Y235 HydrophobicContact CE1-CD2 4.47Å; Y217-Y235 HydrophobicContact CE2-CD2 4.35Å; Y217-Y235 AromaticContact CG-CD2 3.75Å; Y217-Y235 HydrophobicContact CG-CD2 3.75Å; Y217-Y235 HydrophobicContact CG-CE2 4.4Å
218	G	91.5	Very high	88	Confident	37 Å²	37	55.4 Å²	55.4	38%	0.381	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-46	170.7	0	0	0	0	0	112.9	N214 L215 M216 K221 L222	N214-G218 PolarHBondContact O-N 3.29Å; L215-G218 WeakPolarHBondContact O-CA 3.43Å; L215-G218 PolarHBondContact O-N 3.4Å; L215-G218 VanDerWaalsContact O-N 3.08Å; M216-G218 VanDerWaalsContact C-N 3.27Å; M216-G218 PolarHBondContact O-N 3.4Å; G218-K221 WeakPolarHBondContact O-CB 3.2Å; G218-K221 PolarHBondContact O-N 3.34Å; G218-L222 PolarHBondContact O-N 3.44Å
219	V	90.9	Very high	86.7	Confident	19 Å²	19	56.7 Å²	56.7	12%	0.115	31%	0.31	C	S	.	.	H	α-helix	trans	-62.5	-43.2	176.8	174.9	0	0	0	0	111.3	L215 M216 K221 L222 M223 I430	L215-V219 WeakPolarHBondContact O-CG2 2.92Å; L215-V219 PolarHBondContact O-N 2.99Å; M216-V219 HydrophobicContact CE-CB 3.73Å; M216-V219 HydrophobicContact CE-CG1 3.82Å; M216-V219 HydrophobicContact CE-CG2 4.13Å; M216-V219 PolarHBondContact O-N 3.48Å; M216-V219 VanDerWaalsContact O-N 3.17Å; M216-V219 HydrophobicContact SD-CG2 4.32Å; V219-K221 PolarHBondContact O-N 3.26Å; V219-L222 WeakPolarHBondContact O-CB 3.16Å; V219-L222 PolarHBondContact O-N 3.22Å; V219-M223 HydrophobicContact CG1-CG 4.49Å; V219-M223 HydrophobicContact CG1-SD 4.23Å; V219-M223 WeakPolarHBondContact O-CG 3.46Å; V219-M223 PolarHBondContact O-N 2.91Å; V219-I430 HydrophobicContact CG1-CG2 4.06Å
220	V	88.6	Confident	84.8	Confident	10 Å²	10	63.5 Å²	63.5	6%	0.061	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-42.3	176.5	166.9	0	0	0	0	111.1	M216 Y217 L222 M223 R224 L229 F233 F431	M216-V220 WeakPolarHBondContact O-CB 3.28Å; M216-V220 VanDerWaalsContact O-CG2 3.3Å; M216-V220 WeakPolarHBondContact O-CG2 3.38Å; M216-V220 PolarHBondContact O-N 3.17Å; Y217-V220 PolarHBondContact O-N 2.68Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 2.96Å; V220-M223 PolarHBondContact O-N 3.13Å; V220-R224 PolarHBondContact O-N 3.46Å; V220-L229 HydrophobicContact CG1-CD1 4.16Å; V220-F233 HydrophobicContact CG1-CB 3.43Å; V220-F233 VanDerWaalsContact CG1-CB 3.43Å; V220-F233 HydrophobicContact CG1-CD1 4.26Å; V220-F233 HydrophobicContact CG1-CD2 4.4Å; V220-F233 HydrophobicContact CG1-CG 3.8Å; V220-F233 HydrophobicContact CG2-CD1 3.97Å; V220-F233 HydrophobicContact CG2-CE1 4.37Å; V220-F233 HydrophobicContact CG2-CG 4.31Å; V220-F431 HydrophobicContact CG2-CD2 4.13Å; V220-F431 HydrophobicContact CG2-CE2 3.91Å
221	K	87.2	Confident	83.3	Confident	117 Å²	117	65.4 Å²	65.4	51%	0.509	36%	0.362	S	S	.	.	H	α-helix	trans	-60.7	-42.3	173.1	-84.6	-174.3	170	173	0	112.1	Y217 G218 V219 R224 A225	Y217-K221 HydrophobicContact CD1-CD 4.43Å; Y217-K221 HydrophobicContact CE1-CD 3.95Å; Y217-K221 VanDerWaalsContact CE1-NZ 3.34Å; Y217-K221 PolarHBondContact O-N 2.95Å; Y217-K221 WeakPolarHBondContact OH-CE 3.41Å; Y217-K221 PolarHBondContact OH-NZ 3.13Å; G218-K221 WeakPolarHBondContact O-CB 3.2Å; G218-K221 PolarHBondContact O-N 3.34Å; V219-K221 PolarHBondContact O-N 3.26Å; K221-R224 PolarHBondContact O-N 3.18Å; K221-A225 PolarHBondContact O-N 3.47Å
222	L	86.7	Confident	81.9	Confident	104 Å²	104	71.7 Å²	71.7	55%	0.545	39%	0.386	S	S	.	.	H	α-helix	trans	-61.5	-47.8	176	178.3	64.9	0	0	0	110.9	G218 V219 V220 R224 A225 V226	G218-L222 PolarHBondContact O-N 3.44Å; V219-L222 WeakPolarHBondContact O-CB 3.16Å; V219-L222 PolarHBondContact O-N 3.22Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 2.96Å; L222-R224 VanDerWaalsContact C-N 3.26Å; L222-R224 PolarHBondContact O-N 3.12Å; L222-A225 WeakPolarHBondContact O-CB 3.5Å; L222-A225 PolarHBondContact O-N 2.88Å; L222-V226 HydrophobicContact CD1-CG2 4.38Å; L222-V226 VanDerWaalsContact O-CG2 3.32Å; L222-V226 WeakPolarHBondContact O-CG2 2.95Å; L222-V226 PolarHBondContact O-N 2.8Å
223	M	84.8	Confident	80.9	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.01	39%	0.393	C	S	.	.	H	α-helix	trans	-60.5	-35.6	177.3	-73.8	177.3	69.3	0	0	112.9	V219 V220 V226 G227 Q228 L229 S428 I430 F431	V219-M223 HydrophobicContact CG1-CG 4.49Å; V219-M223 HydrophobicContact CG1-SD 4.23Å; V219-M223 WeakPolarHBondContact O-CG 3.46Å; V219-M223 PolarHBondContact O-N 2.91Å; V220-M223 PolarHBondContact O-N 3.13Å; M223-V226 PolarHBondContact O-N 3.38Å; M223-G227 PolarHBondContact O-N 3.13Å; M223-Q228 PolarHBondContact O-N 3Å; M223-Q228 VanDerWaalsContact O-N 3.12Å; M223-L229 HydrophobicContact CB-CD1 3.31Å; M223-L229 HydrophobicContact CB-CG 3.99Å; M223-L229 HydrophobicContact CE-CD1 4.02Å; M223-L229 HydrophobicContact CE-CD2 4.33Å; M223-L229 HydrophobicContact CE-CG 3.99Å; M223-L229 HydrophobicContact CG-CD1 4.35Å; M223-L229 HydrophobicContact SD-CD1 4.21Å; M223-S428 WeakPolarHBondContact CE-OG 3.36Å; M223-I430 HydrophobicContact CE-CB 4.43Å; M223-I430 HydrophobicContact CG-CB 3.83Å; M223-I430 HydrophobicContact CG-CD1 4.23Å; M223-I430 HydrophobicContact CG-CG2 3.43Å; M223-I430 VanDerWaalsContact CG-CG2 3.43Å; M223-I430 HydrophobicContact SD-CB 3.98Å; M223-I430 HydrophobicContact SD-CG2 3.95Å; M223-F431 HydrophobicContact CE-CB 4.45Å; M223-F431 HydrophobicContact SD-CB 3.96Å; M223-F431 HydrophobicContact SD-CD2 4.44Å
224	R	83.8	Confident	80.4	Confident	195 Å²	195	76.7 Å²	76.7	74%	0.736	41%	0.407	S	S	*	.	H	α-helix	trans	-66.2	-40.8	173	-172	176.4	-177.6	177.4	0	111.8	V220 K221 L222 V226 G227	V220-R224 PolarHBondContact O-N 3.46Å; K221-R224 PolarHBondContact O-N 3.18Å; L222-R224 VanDerWaalsContact C-N 3.26Å; L222-R224 PolarHBondContact O-N 3.12Å; R224-V226 VanDerWaalsContact C-N 3.3Å; R224-V226 PolarHBondContact O-N 3.03Å; R224-G227 PolarHBondContact O-N 2.92Å; R224-G227 VanDerWaalsContact O-N 3.17Å
225	A	81.1	Confident	80	Confident	87 Å²	87	76.6 Å²	76.6	72%	0.719	40%	0.401	S	S	*	.	H	α-helix	trans	-65.6	-33.4	175.7	0	0	0	0	0	112.6	K221 L222 G227	K221-A225 PolarHBondContact O-N 3.47Å; L222-A225 WeakPolarHBondContact O-CB 3.5Å; L222-A225 PolarHBondContact O-N 2.88Å; A225-G227 PolarHBondContact O-N 2.84Å
226	V	79.8	Confident	79.6	Confident	86 Å²	86	74.5 Å²	74.5	52%	0.521	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-4.4	176	-179.2	0	0	0	0	112.3	L222 M223 R224 Q228	L222-V226 HydrophobicContact CD1-CG2 4.38Å; L222-V226 VanDerWaalsContact O-CG2 3.32Å; L222-V226 WeakPolarHBondContact O-CG2 2.95Å; L222-V226 PolarHBondContact O-N 2.8Å; M223-V226 PolarHBondContact O-N 3.38Å; R224-V226 VanDerWaalsContact C-N 3.3Å; R224-V226 PolarHBondContact O-N 3.03Å; V226-Q228 VanDerWaalsContact C-N 3.32Å; V226-Q228 HydrophobicContact CG1-CG 4.25Å; V226-Q228 PolarHBondContact O-N 2.87Å
227	G	71.8	Confident	79.4	Confident	61 Å²	61	75.1 Å²	75.1	63%	0.629	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	14.4	176.5	0	0	0	0	0	114.9	M223 R224 A225	M223-G227 PolarHBondContact O-N 3.13Å; R224-G227 PolarHBondContact O-N 2.92Å; R224-G227 VanDerWaalsContact O-N 3.17Å; A225-G227 PolarHBondContact O-N 2.84Å
228	Q	66.3	Low	79.3	Confident	115 Å²	115	71.8 Å²	71.8	54%	0.537	38%	0.381	S	S	.	.			trans	-90.2	-2.7	-179.1	-73.2	-162.1	-19.4	0	0	114.4	M223 V226	M223-Q228 PolarHBondContact O-N 3Å; M223-Q228 VanDerWaalsContact O-N 3.12Å; V226-Q228 VanDerWaalsContact C-N 3.32Å; V226-Q228 HydrophobicContact CG1-CG 4.25Å; V226-Q228 PolarHBondContact O-N 2.87Å
229	L	66	Low	79.3	Confident	29 Å²	29	71 Å²	71	15%	0.152	37%	0.368	C	S	.	.			trans	-118.8	112	179.5	-81.8	164.7	0	0	0	110.8	V220 M223 F233 M495	V220-L229 HydrophobicContact CG1-CD1 4.16Å; M223-L229 HydrophobicContact CB-CD1 3.31Å; M223-L229 HydrophobicContact CB-CG 3.99Å; M223-L229 HydrophobicContact CE-CD1 4.02Å; M223-L229 HydrophobicContact CE-CD2 4.33Å; M223-L229 HydrophobicContact CE-CG 3.99Å; M223-L229 HydrophobicContact CG-CD1 4.35Å; M223-L229 HydrophobicContact SD-CD1 4.21Å; L229-F233 HydrophobicContact CD1-CD2 4.46Å; L229-F233 HydrophobicContact CD2-CD2 3.79Å; L229-F233 HydrophobicContact CD2-CE2 3.45Å; L229-F233 VanDerWaalsContact CD2-CE2 3.45Å; L229-F233 HydrophobicContact CD2-CZ 4.45Å; L229-M495 HydrophobicContact CD2-CE 4.33Å
230	T	53	Low	79.3	Confident	145 Å²	145	70.5 Å²	70.5	89%	0.89	36%	0.364	S	S	*	.			trans	-86.2	-18.5	176.3	-40.7	0	0	0	0	112.2
231	E	62.3	Low	79.5	Confident	122 Å²	122	70 Å²	70	57%	0.57	36%	0.362	S	S	*	.	S	Bend	trans	-111	160.2	-172.3	-67	-160.8	165	0	0	115	F233 S491	E231-F233 PolarHBondContact O-N 3.26Å; E231-S491 WeakPolarHBondContact OE2-CB 3.18Å
232	K	65.9	Low	79.8	Confident	165 Å²	165	64.5 Å²	64.5	72%	0.717	34%	0.338	S	S	*	.			trans	-79.3	103.8	-177.9	-62.8	177.1	-177.1	175.2	0	110.5	Y234	K232-Y234 HydrophobicContact CB-CE2 4.45Å
233	F	74.2	Confident	80.1	Confident	32 Å²	32	59.5 Å²	59.5	14%	0.14	31%	0.312	C	S	.	.			trans	-85	130	163.8	-91	-102.6	0	0	0	110.5	V220 L229 E231 F431 A492 M495	V220-F233 HydrophobicContact CG1-CB 3.43Å; V220-F233 VanDerWaalsContact CG1-CB 3.43Å; V220-F233 HydrophobicContact CG1-CD1 4.26Å; V220-F233 HydrophobicContact CG1-CD2 4.4Å; V220-F233 HydrophobicContact CG1-CG 3.8Å; V220-F233 HydrophobicContact CG2-CD1 3.97Å; V220-F233 HydrophobicContact CG2-CE1 4.37Å; V220-F233 HydrophobicContact CG2-CG 4.31Å; L229-F233 HydrophobicContact CD1-CD2 4.46Å; L229-F233 HydrophobicContact CD2-CD2 3.79Å; L229-F233 HydrophobicContact CD2-CE2 3.45Å; L229-F233 VanDerWaalsContact CD2-CE2 3.45Å; L229-F233 HydrophobicContact CD2-CZ 4.45Å; E231-F233 PolarHBondContact O-N 3.26Å; F233-F431 HydrophobicContact CE1-CE2 4.31Å; F233-A492 HydrophobicContact CD1-CB 3.98Å; F233-A492 HydrophobicContact CD2-CB 4.4Å; F233-A492 HydrophobicContact CE1-CB 3.55Å; F233-A492 HydrophobicContact CE2-CB 4Å; F233-A492 HydrophobicContact CG-CB 4.39Å; F233-A492 HydrophobicContact CZ-CB 3.57Å; F233-M495 HydrophobicContact CE2-CE 4.24Å; F233-M495 HydrophobicContact CZ-CE 4.01Å; F233-M495 HydrophobicContact CZ-SD 3.83Å
234	Y	82.4	Confident	80.5	Confident	73 Å²	73	59.5 Å²	59.5	29%	0.286	31%	0.311	S	S	.	.			trans	-94.2	155.7	175.2	-58	-78	0	0	0	111.4	K232 T236 D237 C238 H299	K232-Y234 HydrophobicContact CB-CE2 4.45Å; Y234-T236 WeakPolarHBondContact CB-OG1 3.29Å; Y234-T236 PolarHBondContact O-N 3.29Å; Y234-D237 WeakPolarHBondContact CD2-OD2 3.33Å; Y234-D237 PolarHBondContact N-OD2 2.98Å; Y234-D237 PolarHBondContact O-N 3.03Å; Y234-C238 PolarHBondContact O-N 3.34Å; Y234-H299 AromaticContact CD1-CE1 3.49Å; Y234-H299 VanDerWaalsContact CD1-CE1 3.49Å; Y234-H299 WeakPolarHBondContact CD1-CE1 3.47Å; Y234-H299 AromaticContact CE1-CE1 3.37Å; Y234-H299 WeakPolarHBondContact CE1-CE1 3.29Å; Y234-H299 AromaticContact CE1-NE2 3.94Å
235	Y	84.4	Confident	80.9	Confident	75 Å²	75	50.2 Å²	50.2	29%	0.294	28%	0.276	S	S	.	.	H	α-helix	trans	-62.4	-34.4	175.1	176	-112.4	0	0	0	111.9	N214 Y217 D237 C238 L239	N214-Y235 PolarHBondContact ND2-OH 3.3Å; N214-Y235 PolarHBondContact OD1-OH 3.4Å; Y217-Y235 HydrophobicContact CD1-CD2 4.06Å; Y217-Y235 AromaticContact CD2-CD2 3.91Å; Y217-Y235 HydrophobicContact CD2-CD2 3.91Å; Y217-Y235 HydrophobicContact CE1-CD2 4.47Å; Y217-Y235 HydrophobicContact CE2-CD2 4.35Å; Y217-Y235 AromaticContact CG-CD2 3.75Å; Y217-Y235 HydrophobicContact CG-CD2 3.75Å; Y217-Y235 HydrophobicContact CG-CE2 4.4Å; Y235-D237 VanDerWaalsContact C-N 3.33Å; Y235-D237 PolarHBondContact O-N 2.97Å; Y235-C238 WeakPolarHBondContact O-CB 3.37Å; Y235-C238 PolarHBondContact O-N 2.79Å; Y235-C238 VanDerWaalsContact O-N 3.16Å; Y235-L239 HydrophobicContact CD1-CD1 3.88Å; Y235-L239 HydrophobicContact CD1-CG 4.35Å; Y235-L239 HydrophobicContact CE1-CD1 3.33Å; Y235-L239 HydrophobicContact CE1-CD2 4.46Å; Y235-L239 HydrophobicContact CE1-CG 3.87Å; Y235-L239 HydrophobicContact CE2-CG 4.35Å; Y235-L239 PolarHBondContact O-N 3.15Å
236	T	85.4	Confident	81.4	Confident	18 Å²	18	46.2 Å²	46.2	11%	0.11	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-37.1	175.1	44.8	0	0	0	0	112.6	Y234 C238 L239 F240 Y291 Q292	Y234-T236 WeakPolarHBondContact CB-OG1 3.29Å; Y234-T236 PolarHBondContact O-N 3.29Å; T236-C238 VanDerWaalsContact C-N 3.32Å; T236-C238 PolarHBondContact O-N 3.48Å; T236-L239 PolarHBondContact O-N 2.87Å; T236-F240 VanDerWaalsContact O-CB 3.26Å; T236-F240 WeakPolarHBondContact O-CB 3.43Å; T236-F240 PolarHBondContact O-N 3.37Å; T236-Y291 HydrophobicContact CG2-CD1 3.93Å; T236-Y291 HydrophobicContact CG2-CE1 4.26Å; T236-Q292 VanDerWaalsContact CB-OE1 3.24Å; T236-Q292 PolarHBondContact OG1-OE1 3.04Å
237	D	88.8	Confident	81.9	Confident	13 Å²	13	42.1 Å²	42.1	7%	0.07	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-37.6	174.4	-63.1	-48.4	0	0	0	111.5	Y234 Y235 F240 F241 R493 M496	Y234-D237 WeakPolarHBondContact CD2-OD2 3.33Å; Y234-D237 PolarHBondContact N-OD2 2.98Å; Y234-D237 PolarHBondContact O-N 3.03Å; Y235-D237 VanDerWaalsContact C-N 3.33Å; Y235-D237 PolarHBondContact O-N 2.97Å; D237-F240 PolarHBondContact O-N 2.91Å; D237-F241 PolarHBondContact O-N 3.33Å; D237-R493 IonicContact OD1-NE 3.68Å; D237-M496 HydrophobicContact CB-CE 4.06Å; D237-M496 VanDerWaalsContact O-SD 3.39Å
238	C	90.8	Very high	82.8	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.014	19%	0.189	C	C	.	.	H	α-helix	trans	-69	-41.1	176.8	-58.5	0	0	0	0	111.5	G213 M216 Y234 Y235 T236 F240 F241 G242	G213-C238 VanDerWaalsContact CA-O 3.23Å; G213-C238 WeakPolarHBondContact CA-O 3.31Å; G213-C238 WeakPolarHBondContact O-CB 3.38Å; M216-C238 HydrophobicContact CB-CB 4.43Å; Y234-C238 PolarHBondContact O-N 3.34Å; Y235-C238 WeakPolarHBondContact O-CB 3.37Å; Y235-C238 PolarHBondContact O-N 2.79Å; Y235-C238 VanDerWaalsContact O-N 3.16Å; T236-C238 VanDerWaalsContact C-N 3.32Å; T236-C238 PolarHBondContact O-N 3.48Å; C238-F240 VanDerWaalsContact C-N 3.35Å; C238-F241 WeakPolarHBondContact O-CB 3.33Å; C238-F241 PolarHBondContact O-N 3.19Å; C238-G242 PolarHBondContact O-N 2.82Å
239	L	90.8	Very high	83.7	Confident	21 Å²	21	34.8 Å²	34.8	11%	0.11	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-40.9	172.7	-75.3	177.5	0	0	0	111.7	C209 F210 Y235 T236 F241 G242 A243 I288	C209-L239 PolarHBondContact SG-O 2.69Å; F210-L239 HydrophobicContact CD1-CD2 3.87Å; F210-L239 HydrophobicContact CE1-CD2 4.2Å; Y235-L239 HydrophobicContact CD1-CD1 3.88Å; Y235-L239 HydrophobicContact CD1-CG 4.35Å; Y235-L239 HydrophobicContact CE1-CD1 3.33Å; Y235-L239 HydrophobicContact CE1-CD2 4.46Å; Y235-L239 HydrophobicContact CE1-CG 3.87Å; Y235-L239 HydrophobicContact CE2-CG 4.35Å; Y235-L239 PolarHBondContact O-N 3.15Å; T236-L239 PolarHBondContact O-N 2.87Å; L239-F241 VanDerWaalsContact C-N 3.33Å; L239-F241 PolarHBondContact O-N 3.44Å; L239-G242 CarbonylContact O-C 3.59Å; L239-G242 WeakPolarHBondContact O-CA 2.92Å; L239-G242 PolarHBondContact O-N 3.38Å; L239-G242 VanDerWaalsContact O-N 3.1Å; L239-A243 PolarHBondContact O-N 3.03Å; L239-I288 HydrophobicContact CB-CD1 4.14Å; L239-I288 HydrophobicContact CB-CG2 4.22Å
240	F	91	Very high	84.5	Confident	8 Å²	8	33.4 Å²	33.4	4%	0.035	16%	0.161	C	C	.	.	H	α-helix	trans	-60.6	-43.4	175.8	178.4	-104.5	0	0	0	111.2	T236 D237 C238 G242 A243 I244 I288 V289 M496	T236-F240 VanDerWaalsContact O-CB 3.26Å; T236-F240 WeakPolarHBondContact O-CB 3.43Å; T236-F240 PolarHBondContact O-N 3.37Å; D237-F240 PolarHBondContact O-N 2.91Å; C238-F240 VanDerWaalsContact C-N 3.35Å; F240-G242 VanDerWaalsContact C-N 3.32Å; F240-G242 PolarHBondContact O-N 2.92Å; F240-A243 PolarHBondContact O-N 3.43Å; F240-I244 HydrophobicContact CD1-CD1 3.71Å; F240-I244 HydrophobicContact CD1-CG1 4.49Å; F240-I244 HydrophobicContact CE1-CD1 3.17Å; F240-I244 HydrophobicContact CE1-CG1 4.15Å; F240-I244 HydrophobicContact CE2-CD1 4.28Å; F240-I244 HydrophobicContact CE2-CG1 4.49Å; F240-I244 HydrophobicContact CG-CD1 4.45Å; F240-I244 HydrophobicContact CZ-CD1 3.5Å; F240-I244 VanDerWaalsContact CZ-CD1 3.5Å; F240-I244 HydrophobicContact CZ-CG1 4.14Å; F240-I244 WeakPolarHBondContact O-CG1 3.44Å; F240-I244 PolarHBondContact O-N 3.12Å; F240-I288 HydrophobicContact CB-CG2 4.11Å; F240-V289 HydrophobicContact CD2-CG2 3.77Å; F240-V289 HydrophobicContact CE2-CG2 3.73Å; F240-M496 HydrophobicContact CD1-CE 4.45Å
241	F	92.9	Very high	85.7	Confident	1 Å²	1	28.2 Å²	28.2	0%	0.004	13%	0.129	C	C	.	.	H	α-helix	trans	-57.8	-45	170.8	-170.3	-112.5	0	0	0	112.4	I212 M216 D237 C238 L239 A243 I244 I245 F431 A435 M496 T499 I503	I212-F241 HydrophobicContact CG2-CD1 4.22Å; I212-F241 HydrophobicContact CG2-CE1 4.49Å; M216-F241 HydrophobicContact CG-CD1 3.79Å; M216-F241 HydrophobicContact CG-CE1 4.02Å; D237-F241 PolarHBondContact O-N 3.33Å; C238-F241 WeakPolarHBondContact O-CB 3.33Å; C238-F241 PolarHBondContact O-N 3.19Å; L239-F241 VanDerWaalsContact C-N 3.33Å; L239-F241 PolarHBondContact O-N 3.44Å; F241-A243 VanDerWaalsContact C-N 3.29Å; F241-A243 PolarHBondContact O-N 3.37Å; F241-I244 PolarHBondContact O-N 3.18Å; F241-I245 HydrophobicContact CD1-CG1 4.29Å; F241-I245 HydrophobicContact CD2-CG1 4.14Å; F241-I245 HydrophobicContact CE1-CG1 3.92Å; F241-I245 HydrophobicContact CE2-CD1 4.2Å; F241-I245 HydrophobicContact CE2-CG1 3.75Å; F241-I245 HydrophobicContact CG-CG1 4.41Å; F241-I245 HydrophobicContact CZ-CD1 4.15Å; F241-I245 HydrophobicContact CZ-CG1 3.63Å; F241-I245 WeakPolarHBondContact O-CB 3.25Å; F241-I245 WeakPolarHBondContact O-CG1 3.38Å; F241-I245 PolarHBondContact O-N 3.31Å; F241-F431 HydrophobicContact CE1-CE1 4.44Å; F241-F431 HydrophobicContact CE2-CE1 4.32Å; F241-F431 HydrophobicContact CZ-CE1 4.19Å; F241-A435 HydrophobicContact CE1-CB 3.81Å; F241-A435 HydrophobicContact CZ-CB 3.93Å; F241-M496 HydrophobicContact CB-CG 4.35Å; F241-M496 HydrophobicContact CB-SD 3.56Å; F241-M496 VanDerWaalsContact CB-SD 3.56Å; F241-M496 HydrophobicContact CD2-CB 3.71Å; F241-M496 HydrophobicContact CD2-CG 3.6Å; F241-M496 HydrophobicContact CD2-SD 3.89Å; F241-M496 HydrophobicContact CE2-CB 4.1Å; F241-M496 HydrophobicContact CE2-CG 4.23Å; F241-M496 HydrophobicContact CG-CG 4.19Å; F241-M496 HydrophobicContact CG-SD 4.05Å; F241-T499 HydrophobicContact CZ-CG2 4.02Å; F241-I503 HydrophobicContact CZ-CD1 4.24Å
242	G	93.7	Very high	86.6	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-57.6	-40.9	175.6	0	0	0	0	0	112.6	C238 L239 F240 S246	C238-G242 PolarHBondContact O-N 2.82Å; L239-G242 CarbonylContact O-C 3.59Å; L239-G242 WeakPolarHBondContact O-CA 2.92Å; L239-G242 PolarHBondContact O-N 3.38Å; L239-G242 VanDerWaalsContact O-N 3.1Å; F240-G242 VanDerWaalsContact C-N 3.32Å; F240-G242 PolarHBondContact O-N 2.92Å; G242-S246 VanDerWaalsContact O-CB 3.24Å; G242-S246 WeakPolarHBondContact O-CB 3.45Å; G242-S246 PolarHBondContact O-N 2.89Å
243	A	92.9	Very high	87.5	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-67.8	-48.3	177.2	0	0	0	0	0	111.8	C209 L239 F240 F241 I245 S246 L284 I288	C209-A243 PolarHBondContact SG-N 2.97Å; C209-A243 VanDerWaalsContact SG-N 3.37Å; L239-A243 PolarHBondContact O-N 3.03Å; F240-A243 PolarHBondContact O-N 3.43Å; F241-A243 VanDerWaalsContact C-N 3.29Å; F241-A243 PolarHBondContact O-N 3.37Å; A243-I245 VanDerWaalsContact C-N 3.34Å; A243-I245 PolarHBondContact O-N 2.95Å; A243-S246 PolarHBondContact O-N 3.37Å; A243-S246 VanDerWaalsContact O-N 3.15Å; A243-S246 PolarHBondContact O-OG 2.97Å; A243-L284 HydrophobicContact CB-CB 4.46Å; A243-L284 HydrophobicContact CB-CD2 4.13Å; A243-L284 HydrophobicContact CB-CG 4.13Å; A243-I288 HydrophobicContact CB-CD1 3.74Å
244	I	92.4	Very high	87.9	Confident	1 Å²	1	13.8 Å²	13.8	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-56.2	-51.7	177.3	-69.4	174.8	0	0	0	110.7	F240 F241 S246 A480 L483 A484 T500	F240-I244 HydrophobicContact CD1-CD1 3.71Å; F240-I244 HydrophobicContact CD1-CG1 4.49Å; F240-I244 HydrophobicContact CE1-CD1 3.17Å; F240-I244 HydrophobicContact CE1-CG1 4.15Å; F240-I244 HydrophobicContact CE2-CD1 4.28Å; F240-I244 HydrophobicContact CE2-CG1 4.49Å; F240-I244 HydrophobicContact CG-CD1 4.45Å; F240-I244 HydrophobicContact CZ-CD1 3.5Å; F240-I244 VanDerWaalsContact CZ-CD1 3.5Å; F240-I244 HydrophobicContact CZ-CG1 4.14Å; F240-I244 WeakPolarHBondContact O-CG1 3.44Å; F240-I244 PolarHBondContact O-N 3.12Å; F241-I244 PolarHBondContact O-N 3.18Å; I244-S246 PolarHBondContact O-N 2.79Å; I244-A480 HydrophobicContact CG2-CB 4.26Å; I244-A480 WeakPolarHBondContact CG2-O 3.5Å; I244-L483 HydrophobicContact CD1-CB 4.46Å; I244-L483 HydrophobicContact CG1-CB 3.96Å; I244-L483 HydrophobicContact CG2-CB 4.2Å; I244-A484 HydrophobicContact CD1-CB 4.42Å; I244-A484 HydrophobicContact CG2-CB 4.24Å; I244-T500 HydrophobicContact CG2-CG2 4.45Å
245	I	92.3	Very high	87.7	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-73	-17.8	-175.5	-67.9	-64.6	0	0	0	110.9	I212 F241 A243 A247 I439 R476 T500 I503	I212-I245 HydrophobicContact CD1-CG2 4.05Å; F241-I245 HydrophobicContact CD1-CG1 4.29Å; F241-I245 HydrophobicContact CD2-CG1 4.14Å; F241-I245 HydrophobicContact CE1-CG1 3.92Å; F241-I245 HydrophobicContact CE2-CD1 4.2Å; F241-I245 HydrophobicContact CE2-CG1 3.75Å; F241-I245 HydrophobicContact CG-CG1 4.41Å; F241-I245 HydrophobicContact CZ-CD1 4.15Å; F241-I245 HydrophobicContact CZ-CG1 3.63Å; F241-I245 WeakPolarHBondContact O-CB 3.25Å; F241-I245 WeakPolarHBondContact O-CG1 3.38Å; F241-I245 PolarHBondContact O-N 3.31Å; A243-I245 VanDerWaalsContact C-N 3.34Å; A243-I245 PolarHBondContact O-N 2.95Å; I245-A247 VanDerWaalsContact C-N 3.29Å; I245-A247 PolarHBondContact O-N 3.27Å; I245-I439 HydrophobicContact CG2-CD1 3.58Å; I245-I439 HydrophobicContact CG2-CG1 3.44Å; I245-I439 VanDerWaalsContact CG2-CG1 3.44Å; I245-R476 VanDerWaalsContact O-CD 3.3Å; I245-R476 WeakPolarHBondContact O-CD 3.28Å; I245-R476 PolarHBondContact O-NE 3.48Å; I245-R476 PolarHBondContact O-NH1 3.2Å; I245-R476 PolarHBondContact O-NH2 3.49Å; I245-T500 HydrophobicContact CD1-CG2 3.75Å; I245-I503 HydrophobicContact CD1-CD1 4.17Å
246	S	91.8	Very high	87.6	Confident	3 Å²	3	8.9 Å²	8.9	2%	0.021	5%	0.054	C	C	.	.	H	α-helix	trans	-68.4	-24.4	179.7	67.6	0	0	0	0	114.3	T205 G242 A243 I244 R476	T205-S246 WeakPolarHBondContact CG2-OG 3.33Å; G242-S246 VanDerWaalsContact O-CB 3.24Å; G242-S246 WeakPolarHBondContact O-CB 3.45Å; G242-S246 PolarHBondContact O-N 2.89Å; A243-S246 PolarHBondContact O-N 3.37Å; A243-S246 VanDerWaalsContact O-N 3.15Å; A243-S246 PolarHBondContact O-OG 2.97Å; I244-S246 PolarHBondContact O-N 2.79Å; S246-R476 PolarHBondContact O-NH1 3.38Å
247	A	90.3	Very high	87.4	Confident	1 Å²	1	8.1 Å²	8.1	1%	0.008	5%	0.049	C	C	.	.			trans	-61.1	131.3	172.4	0	0	0	0	0	111.6	I245 D278 A281 R476 M479	I245-A247 VanDerWaalsContact C-N 3.29Å; I245-A247 PolarHBondContact O-N 3.27Å; A247-D278 WeakPolarHBondContact CB-OD1 3.31Å; A247-A281 HydrophobicContact CB-CB 3.84Å; A247-R476 VanDerWaalsContact C-NH1 3.3Å; A247-R476 VanDerWaalsContact O-CD 3.26Å; A247-R476 WeakPolarHBondContact O-CD 3.34Å; A247-R476 PolarHBondContact O-NH1 3.3Å; A247-M479 HydrophobicContact CB-CB 4.21Å
248	T	90.4	Very high	86.9	Confident	1 Å²	1	12 Å²	12	1%	0.006	7%	0.07	C	C	.	.			trans	-119.7	146.5	177.5	60.6	0	0	0	0	111.6	S274 N277 L475	T248-S274 VanDerWaalsContact O-CB 3.32Å; T248-S274 WeakPolarHBondContact O-CB 3.45Å; T248-N277 PolarHBondContact N-OD1 2.83Å; T248-N277 PolarHBondContact OG1-ND2 3.22Å; T248-L475 CarbonylContact C-O 3.58Å; T248-L475 VanDerWaalsContact CA-O 3.25Å; T248-L475 WeakPolarHBondContact CA-O 3.41Å; T248-L475 WeakPolarHBondContact CB-O 3.36Å
249	D	86.1	Confident	86.4	Confident	20 Å²	20	18.7 Å²	18.7	11%	0.107	10%	0.101	C	C	.	.			trans	-132.2	83.7	-178	-176.9	4.3	0	0	0	110.7	V251 L475 G477 A478	D249-V251 PolarHBondContact O-N 3.39Å; D249-V251 WeakPolarHBondContact OD1-CG2 3.19Å; D249-V251 PolarHBondContact OD1-N 3.3Å; D249-L475 PolarHBondContact N-O 2.93Å; D249-L475 VanDerWaalsContact O-CB 3.22Å; D249-L475 WeakPolarHBondContact O-CB 3.47Å; D249-G477 WeakPolarHBondContact OD2-CA 3.35Å; D249-A478 PolarHBondContact OD2-N 3.43Å
250	P	81.9	Confident	85.8	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.111	C	C	.	.			trans	-81.9	22.5	-177	35.2	-35.2	0	0	0	112.8	T252 V253 L254 L270 S274 A473	P250-T252 PolarHBondContact O-N 3.48Å; P250-T252 VanDerWaalsContact O-N 3.15Å; P250-V253 HydrophobicContact CB-CB 4.33Å; P250-V253 WeakPolarHBondContact O-CA 3.25Å; P250-V253 WeakPolarHBondContact O-CB 3.37Å; P250-V253 PolarHBondContact O-N 3.47Å; P250-L254 HydrophobicContact CB-CD1 4.46Å; P250-L254 HydrophobicContact CB-CG 4.33Å; P250-L254 HydrophobicContact CG-CD1 3.83Å; P250-L254 HydrophobicContact CG-CG 4.18Å; P250-L254 WeakPolarHBondContact O-CG 3.35Å; P250-L254 PolarHBondContact O-N 2.78Å; P250-L270 HydrophobicContact CB-CD1 4Å; P250-L270 HydrophobicContact CB-CD2 3.94Å; P250-L270 HydrophobicContact CB-CG 3.89Å; P250-L270 HydrophobicContact CG-CD1 4.13Å; P250-L270 HydrophobicContact CG-CD2 4.42Å; P250-L270 HydrophobicContact CG-CG 3.9Å; P250-S274 WeakPolarHBondContact CD-OG 3.25Å; P250-S274 VanDerWaalsContact CG-CB 3.48Å; P250-S274 WeakPolarHBondContact CG-OG 3.49Å; P250-A473 WeakPolarHBondContact CB-O 3.3Å
251	V	80	Confident	85.2	Confident	36 Å²	36	24.7 Å²	24.7	22%	0.218	13%	0.129	C	C	.	.	H	α-helix	trans	-56.9	-39.2	-172	176	0	0	0	0	112.5	D249 V253 L254 A255 E408	D249-V251 PolarHBondContact O-N 3.39Å; D249-V251 WeakPolarHBondContact OD1-CG2 3.19Å; D249-V251 PolarHBondContact OD1-N 3.3Å; V251-V253 VanDerWaalsContact C-N 3.31Å; V251-V253 PolarHBondContact O-N 2.79Å; V251-L254 PolarHBondContact O-N 3.24Å; V251-A255 WeakPolarHBondContact O-CB 3.1Å; V251-A255 PolarHBondContact O-N 3.39Å; V251-E408 WeakPolarHBondContact CG1-OE1 3.47Å
252	T	80.8	Confident	84.4	Confident	3 Å²	3	25.2 Å²	25.2	2%	0.018	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-41	174.4	-59.4	0	0	0	0	112.6	H85 T87 P250 I256	H85-T252 HydrophobicContact CB-CG2 3.39Å; H85-T252 VanDerWaalsContact CG-CG2 3.47Å; H85-T252 PolarHBondContact ND1-OG1 3.48Å; T87-T252 PolarHBondContact OG1-OG1 3.07Å; P250-T252 PolarHBondContact O-N 3.48Å; P250-T252 VanDerWaalsContact O-N 3.15Å; T252-I256 HydrophobicContact CG2-CD1 4.27Å; T252-I256 WeakPolarHBondContact O-CD1 3.45Å; T252-I256 VanDerWaalsContact O-CG1 3.28Å; T252-I256 WeakPolarHBondContact O-CG1 3.5Å; T252-I256 PolarHBondContact O-N 3.32Å
253	V	84	Confident	83.8	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-70.6	-44.3	179	-177.5	0	0	0	0	110.5	P250 V251 A255 I256 F257 L270 A473 L475 T515	P250-V253 HydrophobicContact CB-CB 4.33Å; P250-V253 WeakPolarHBondContact O-CA 3.25Å; P250-V253 WeakPolarHBondContact O-CB 3.37Å; P250-V253 PolarHBondContact O-N 3.47Å; V251-V253 VanDerWaalsContact C-N 3.31Å; V251-V253 PolarHBondContact O-N 2.79Å; V253-A255 PolarHBondContact O-N 3.01Å; V253-I256 PolarHBondContact O-N 2.88Å; V253-F257 HydrophobicContact CG1-CD1 4.11Å; V253-F257 HydrophobicContact CG1-CD2 4.46Å; V253-F257 HydrophobicContact CG1-CE1 3.67Å; V253-F257 HydrophobicContact CG1-CE2 4.05Å; V253-F257 HydrophobicContact CG1-CG 4.49Å; V253-F257 HydrophobicContact CG1-CZ 3.64Å; V253-F257 WeakPolarHBondContact O-CD1 3.25Å; V253-F257 WeakPolarHBondContact O-CG 3.37Å; V253-F257 PolarHBondContact O-N 3.12Å; V253-L270 HydrophobicContact CB-CD2 4.32Å; V253-L270 HydrophobicContact CG1-CD2 3.84Å; V253-A473 HydrophobicContact CB-CB 4.35Å; V253-A473 HydrophobicContact CG1-CB 3.87Å; V253-A473 HydrophobicContact CG2-CB 4.07Å; V253-L475 HydrophobicContact CG2-CD1 3.69Å; V253-L475 HydrophobicContact CG2-CG 4.2Å; V253-T515 HydrophobicContact CB-CG2 4.34Å; V253-T515 HydrophobicContact CG1-CG2 3.82Å; V253-T515 HydrophobicContact CG2-CG2 4.37Å
254	L	83.4	Confident	83.1	Confident	13 Å²	13	27.7 Å²	27.7	7%	0.068	15%	0.151	C	C	.	.	H	α-helix	trans	-64.5	-39.5	-179	-70.7	171.5	0	0	0	112.1	P250 V251 F257 N258 Y267 L270 F271	P250-L254 HydrophobicContact CB-CD1 4.46Å; P250-L254 HydrophobicContact CB-CG 4.33Å; P250-L254 HydrophobicContact CG-CD1 3.83Å; P250-L254 HydrophobicContact CG-CG 4.18Å; P250-L254 WeakPolarHBondContact O-CG 3.35Å; P250-L254 PolarHBondContact O-N 2.78Å; V251-L254 PolarHBondContact O-N 3.24Å; L254-F257 PolarHBondContact O-N 3.3Å; L254-N258 WeakPolarHBondContact O-CB 3.42Å; L254-N258 PolarHBondContact O-N 2.82Å; L254-Y267 HydrophobicContact CB-CE2 4.21Å; L254-Y267 HydrophobicContact CD2-CD2 3.81Å; L254-Y267 HydrophobicContact CD2-CE2 3.82Å; L254-Y267 HydrophobicContact CD2-CG 4.43Å; L254-L270 HydrophobicContact CD2-CB 4.3Å; L254-L270 HydrophobicContact CD2-CD2 3.93Å; L254-L270 HydrophobicContact CD2-CG 4.17Å; L254-L270 HydrophobicContact CG-CD2 4.32Å; L254-F271 HydrophobicContact CD1-CB 4.16Å; L254-F271 HydrophobicContact CD1-CD2 3.84Å; L254-F271 HydrophobicContact CD2-CB 4.03Å
255	A	78	Confident	82.5	Confident	30 Å²	30	29 Å²	29	25%	0.248	16%	0.159	C	C	.	.	H	α-helix	trans	-61.7	-46	174	0	0	0	0	0	111.4	H85 V251 V253 F257 N258 E259	H85-A255 WeakPolarHBondContact NE2-CB 3.25Å; V251-A255 WeakPolarHBondContact O-CB 3.1Å; V251-A255 PolarHBondContact O-N 3.39Å; V253-A255 PolarHBondContact O-N 3.01Å; A255-F257 VanDerWaalsContact C-N 3.31Å; A255-F257 PolarHBondContact O-N 3.3Å; A255-N258 PolarHBondContact O-N 3.39Å; A255-E259 WeakPolarHBondContact O-CG 3.14Å; A255-E259 PolarHBondContact O-N 2.96Å
256	I	81.3	Confident	82.1	Confident	16 Å²	16	29.3 Å²	29.3	8%	0.082	16%	0.16	C	C	.	.	H	α-helix	trans	-61.9	-39.3	175.4	-67.3	166.7	0	0	0	111.1	T252 V253 E259 L260 T515 T516	T252-I256 HydrophobicContact CG2-CD1 4.27Å; T252-I256 WeakPolarHBondContact O-CD1 3.45Å; T252-I256 VanDerWaalsContact O-CG1 3.28Å; T252-I256 WeakPolarHBondContact O-CG1 3.5Å; T252-I256 PolarHBondContact O-N 3.32Å; V253-I256 PolarHBondContact O-N 2.88Å; I256-E259 PolarHBondContact O-N 2.86Å; I256-L260 HydrophobicContact CG2-CD1 3.68Å; I256-L260 HydrophobicContact CG2-CG 4.33Å; I256-L260 WeakPolarHBondContact O-CB 3.46Å; I256-L260 WeakPolarHBondContact O-CG 3.09Å; I256-L260 PolarHBondContact O-N 3.39Å; I256-T515 HydrophobicContact CB-CG2 4.34Å; I256-T515 HydrophobicContact CD1-CG2 4.04Å; I256-T515 HydrophobicContact CG2-CG2 4.09Å; I256-T516 HydrophobicContact CD1-CG2 4.41Å; I256-T516 HydrophobicContact CG2-CG2 3.79Å
257	F	82	Confident	81.9	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.009	17%	0.169	C	C	.	.	H	α-helix	trans	-66	-39	177.1	-78.4	13.1	0	0	0	112.2	V253 L254 A255 H261 A262 L266 Y267 L270 M469 T515 L519	V253-F257 HydrophobicContact CG1-CD1 4.11Å; V253-F257 HydrophobicContact CG1-CD2 4.46Å; V253-F257 HydrophobicContact CG1-CE1 3.67Å; V253-F257 HydrophobicContact CG1-CE2 4.05Å; V253-F257 HydrophobicContact CG1-CG 4.49Å; V253-F257 HydrophobicContact CG1-CZ 3.64Å; V253-F257 WeakPolarHBondContact O-CD1 3.25Å; V253-F257 WeakPolarHBondContact O-CG 3.37Å; V253-F257 PolarHBondContact O-N 3.12Å; L254-F257 PolarHBondContact O-N 3.3Å; A255-F257 VanDerWaalsContact C-N 3.31Å; A255-F257 PolarHBondContact O-N 3.3Å; F257-H261 PolarHBondContact O-N 3.39Å; F257-A262 HydrophobicContact CB-CB 3.98Å; F257-A262 HydrophobicContact CD1-CB 4.3Å; F257-A262 HydrophobicContact CD2-CB 4.38Å; F257-A262 HydrophobicContact CG-CB 3.97Å; F257-A262 PolarHBondContact O-N 2.91Å; F257-L266 HydrophobicContact CE2-CD2 3.75Å; F257-L266 HydrophobicContact CE2-CG 3.99Å; F257-L266 HydrophobicContact CZ-CD2 4.13Å; F257-Y267 HydrophobicContact CB-CD2 4.22Å; F257-L270 HydrophobicContact CE2-CD2 4.16Å; F257-M469 HydrophobicContact CE1-SD 4.43Å; F257-M469 HydrophobicContact CE2-CG 4.47Å; F257-M469 HydrophobicContact CZ-CE 4.34Å; F257-M469 HydrophobicContact CZ-CG 3.76Å; F257-M469 HydrophobicContact CZ-SD 3.9Å; F257-T515 HydrophobicContact CE1-CG2 4.09Å; F257-L519 HydrophobicContact CE1-CD1 3.85Å; F257-L519 HydrophobicContact CE1-CD2 4.39Å; F257-L519 HydrophobicContact CZ-CD1 4.25Å
258	N	79.3	Confident	81.6	Confident	95 Å²	95	32 Å²	32	51%	0.508	17%	0.171	S	C	.	.	H	α-helix	trans	-67.6	-40.1	176.1	-167.6	50.7	0	0	0	111.4	L254 A255 H261	L254-N258 WeakPolarHBondContact O-CB 3.42Å; L254-N258 PolarHBondContact O-N 2.82Å; A255-N258 PolarHBondContact O-N 3.39Å; N258-H261 PolarHBondContact O-N 3.07Å; N258-H261 PolarHBondContact O-ND1 3.07Å
259	E	78.6	Confident	81.4	Confident	142 Å²	142	32.3 Å²	32.3	66%	0.664	17%	0.173	S	C	*	.	H	α-helix	trans	-64.9	-43.1	174.5	-72.7	-171.8	168.2	0	0	112.4	A255 I256 H261	A255-E259 WeakPolarHBondContact O-CG 3.14Å; A255-E259 PolarHBondContact O-N 2.96Å; I256-E259 PolarHBondContact O-N 2.86Å; E259-H261 VanDerWaalsContact C-N 3.28Å; E259-H261 PolarHBondContact O-N 3.07Å; E259-H261 PolarHBondContact O-ND1 3.43Å; E259-H261 VanDerWaalsContact O-ND1 3.11Å
260	L	79.5	Confident	81.5	Confident	61 Å²	61	31.4 Å²	31.4	32%	0.319	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	0.1	-178	-64.4	176.7	0	0	0	113.9	I256 A262 L519 V526 G527	I256-L260 HydrophobicContact CG2-CD1 3.68Å; I256-L260 HydrophobicContact CG2-CG 4.33Å; I256-L260 WeakPolarHBondContact O-CB 3.46Å; I256-L260 WeakPolarHBondContact O-CG 3.09Å; I256-L260 PolarHBondContact O-N 3.39Å; L260-A262 VanDerWaalsContact C-N 3.3Å; L260-A262 PolarHBondContact O-N 3.44Å; L260-L519 HydrophobicContact CD1-CD2 3.55Å; L260-V526 HydrophobicContact CB-CG1 4.1Å; L260-G527 PolarHBondContact O-N 3.01Å
261	H	78.5	Confident	81.7	Confident	93 Å²	93	32.4 Å²	32.4	43%	0.431	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	54.6	-176.6	-63	63	0	0	0	110.9	F257 N258 E259 G527 V528	F257-H261 PolarHBondContact O-N 3.39Å; N258-H261 PolarHBondContact O-N 3.07Å; N258-H261 PolarHBondContact O-ND1 3.07Å; E259-H261 VanDerWaalsContact C-N 3.28Å; E259-H261 PolarHBondContact O-N 3.07Å; E259-H261 PolarHBondContact O-ND1 3.43Å; E259-H261 VanDerWaalsContact O-ND1 3.11Å; H261-G527 PolarHBondContact O-N 3.47Å; H261-G527 VanDerWaalsContact O-N 3.09Å; H261-V528 PolarHBondContact O-N 3.09Å; H261-V528 VanDerWaalsContact O-N 3.07Å
262	A	76.2	Confident	82	Confident	13 Å²	13	30.8 Å²	30.8	11%	0.107	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-74.6	168.9	177.7	0	0	0	0	0	111.6	F257 L260 G264	F257-A262 HydrophobicContact CB-CB 3.98Å; F257-A262 HydrophobicContact CD1-CB 4.3Å; F257-A262 HydrophobicContact CD2-CB 4.38Å; F257-A262 HydrophobicContact CG-CB 3.97Å; F257-A262 PolarHBondContact O-N 2.91Å; L260-A262 VanDerWaalsContact C-N 3.3Å; L260-A262 PolarHBondContact O-N 3.44Å; A262-G264 PolarHBondContact O-N 3.08Å
263	D	80	Confident	82.4	Confident	34 Å²	34	30.8 Å²	30.8	18%	0.182	16%	0.163	C	C	.	.			trans	-48.2	126	-178.1	-169.1	-60.9	0	0	0	113.8	D265 L266 Y267 F466	D263-D265 VanDerWaalsContact C-N 3.34Å; D263-D265 PolarHBondContact O-N 3.22Å; D263-D265 WeakPolarHBondContact OD1-CB 3.32Å; D263-D265 PolarHBondContact OD1-N 2.85Å; D263-L266 HydrophobicContact CB-CB 4.3Å; D263-L266 PolarHBondContact O-N 3.22Å; D263-L266 PolarHBondContact OD1-N 3.4Å; D263-Y267 PolarHBondContact O-N 2.92Å; D263-F466 HydrophobicContact CB-CZ 4.38Å
264	G	77.4	Confident	82.6	Confident	17 Å²	17	31.1 Å²	31.1	18%	0.175	17%	0.165	C	C	.	.	H	α-helix	trans	-66.6	-28.8	-176	0	0	0	0	0	114.5	A262 A268	A262-G264 PolarHBondContact O-N 3.08Å; G264-A268 VanDerWaalsContact O-CB 3.28Å; G264-A268 WeakPolarHBondContact O-CB 3.24Å; G264-A268 PolarHBondContact O-N 3.09Å
265	D	81.6	Confident	82.7	Confident	30 Å²	30	31.2 Å²	31.2	16%	0.16	17%	0.166	C	C	.	.	H	α-helix	trans	-75.2	-40.3	177.5	-76.2	-22.3	0	0	0	111.5	H189 R192 N193 D263 A268 L269	H189-D265 IonicContact CG-OD1 3.59Å; H189-D265 IonicContact ND1-OD1 3.48Å; H189-D265 PolarHBondContact ND1-OD1 2.85Å; R192-D265 IonicContact CZ-OD1 3.65Å; R192-D265 IonicContact CZ-OD2 3.23Å; R192-D265 IonicContact NE-OD1 3.62Å; R192-D265 IonicContact NH2-OD1 2.65Å; R192-D265 PolarHBondContact NH2-OD1 3.23Å; R192-D265 IonicContact NH2-OD2 3.81Å; R192-D265 PolarHBondContact NH2-OD2 3.18Å; N193-D265 PolarHBondContact ND2-OD1 3.43Å; N193-D265 VanDerWaalsContact ND2-OD1 3.12Å; D263-D265 VanDerWaalsContact C-N 3.34Å; D263-D265 PolarHBondContact O-N 3.22Å; D263-D265 WeakPolarHBondContact OD1-CB 3.32Å; D263-D265 PolarHBondContact OD1-N 2.85Å; D265-A268 PolarHBondContact O-N 3.39Å; D265-L269 VanDerWaalsContact O-CB 3.27Å; D265-L269 WeakPolarHBondContact O-CB 3.41Å; D265-L269 PolarHBondContact O-N 3.02Å
266	L	84.1	Confident	83.1	Confident	5 Å²	5	30.4 Å²	30.4	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-65.7	-42.5	174.5	-178.9	62.7	0	0	0	111	F257 D263 L269 L270 F466 M469 M470 I524	F257-L266 HydrophobicContact CE2-CD2 3.75Å; F257-L266 HydrophobicContact CE2-CG 3.99Å; F257-L266 HydrophobicContact CZ-CD2 4.13Å; D263-L266 HydrophobicContact CB-CB 4.3Å; D263-L266 PolarHBondContact O-N 3.22Å; D263-L266 PolarHBondContact OD1-N 3.4Å; L266-L269 PolarHBondContact O-N 3.31Å; L266-L270 WeakPolarHBondContact O-CB 3.28Å; L266-L270 PolarHBondContact O-N 3.42Å; L266-F466 HydrophobicContact CD1-CB 4.26Å; L266-F466 HydrophobicContact CD1-CG 4.43Å; L266-F466 HydrophobicContact CD2-CD1 4.29Å; L266-M469 HydrophobicContact CD2-CB 4.43Å; L266-M469 HydrophobicContact CD2-CG 3.99Å; L266-M470 HydrophobicContact CD1-CG 3.95Å; L266-I524 HydrophobicContact CD2-CD1 4.04Å
267	Y	86.4	Confident	83.5	Confident	55 Å²	55	29.7 Å²	29.7	22%	0.216	15%	0.153	C	C	.	.	H	α-helix	trans	-57.7	-51.6	173.9	180	-86.6	0	0	0	111.1	L254 F257 D263 L269 L270 F271	L254-Y267 HydrophobicContact CB-CE2 4.21Å; L254-Y267 HydrophobicContact CD2-CD2 3.81Å; L254-Y267 HydrophobicContact CD2-CE2 3.82Å; L254-Y267 HydrophobicContact CD2-CG 4.43Å; F257-Y267 HydrophobicContact CB-CD2 4.22Å; D263-Y267 PolarHBondContact O-N 2.92Å; Y267-L269 VanDerWaalsContact C-N 3.31Å; Y267-L269 PolarHBondContact O-N 3.46Å; Y267-L270 PolarHBondContact O-N 3.29Å; Y267-F271 HydrophobicContact CE1-CB 4.46Å; Y267-F271 WeakPolarHBondContact O-CB 3.28Å; Y267-F271 PolarHBondContact O-N 3.37Å
268	A	84.2	Confident	83.9	Confident	6 Å²	6	30.2 Å²	30.2	5%	0.05	16%	0.156	C	C	.	.	H	α-helix	trans	-62.8	-37.7	-178.5	0	0	0	0	0	112.6	H189 G264 D265 G272	H189-A268 HydrophobicContact CB-CB 3.78Å; G264-A268 VanDerWaalsContact O-CB 3.28Å; G264-A268 WeakPolarHBondContact O-CB 3.24Å; G264-A268 PolarHBondContact O-N 3.09Å; D265-A268 PolarHBondContact O-N 3.39Å; A268-G272 PolarHBondContact O-N 2.9Å
269	L	86.9	Confident	84.2	Confident	8 Å²	8	25.9 Å²	25.9	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-74.1	-43.6	-178.7	-168.3	143.9	0	0	0	112.2	I197 Y200 D265 L266 Y267 E273 I462 M470	I197-L269 HydrophobicContact CG1-CG 4.37Å; Y200-L269 HydrophobicContact CD2-CD2 4.11Å; Y200-L269 HydrophobicContact CD2-CG 4.5Å; Y200-L269 HydrophobicContact CE2-CD1 4.19Å; Y200-L269 HydrophobicContact CE2-CD2 3.96Å; Y200-L269 HydrophobicContact CE2-CG 4.45Å; D265-L269 VanDerWaalsContact O-CB 3.27Å; D265-L269 WeakPolarHBondContact O-CB 3.41Å; D265-L269 PolarHBondContact O-N 3.02Å; L266-L269 PolarHBondContact O-N 3.31Å; Y267-L269 VanDerWaalsContact C-N 3.31Å; Y267-L269 PolarHBondContact O-N 3.46Å; L269-E273 VanDerWaalsContact O-CB 3.24Å; L269-E273 WeakPolarHBondContact O-CB 3.39Å; L269-E273 PolarHBondContact O-N 2.98Å; L269-I462 HydrophobicContact CD1-CD1 4.23Å; L269-M470 HydrophobicContact CD2-CG 4.32Å; L269-M470 HydrophobicContact CD2-SD 3.14Å; L269-M470 WeakPolarHBondContact CD2-SD 3.26Å
270	L	88.3	Confident	84.8	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-65.6	-44.7	176.2	-178.2	65.6	0	0	0	111.6	P250 V253 L254 F257 L266 Y267 S274 A473	P250-L270 HydrophobicContact CB-CD1 4Å; P250-L270 HydrophobicContact CB-CD2 3.94Å; P250-L270 HydrophobicContact CB-CG 3.89Å; P250-L270 HydrophobicContact CG-CD1 4.13Å; P250-L270 HydrophobicContact CG-CD2 4.42Å; P250-L270 HydrophobicContact CG-CG 3.9Å; V253-L270 HydrophobicContact CB-CD2 4.32Å; V253-L270 HydrophobicContact CG1-CD2 3.84Å; L254-L270 HydrophobicContact CD2-CB 4.3Å; L254-L270 HydrophobicContact CD2-CD2 3.93Å; L254-L270 HydrophobicContact CD2-CG 4.17Å; L254-L270 HydrophobicContact CG-CD2 4.32Å; F257-L270 HydrophobicContact CE2-CD2 4.16Å; L266-L270 WeakPolarHBondContact O-CB 3.28Å; L266-L270 PolarHBondContact O-N 3.42Å; Y267-L270 PolarHBondContact O-N 3.29Å; L270-S274 PolarHBondContact O-N 2.6Å; L270-S274 VanDerWaalsContact O-N 3.13Å; L270-S274 PolarHBondContact O-OG 2.97Å; L270-A473 HydrophobicContact CD1-CB 3.69Å; L270-A473 HydrophobicContact CD2-CB 3.71Å; L270-A473 HydrophobicContact CG-CB 4.38Å
271	F	85.3	Confident	85.4	Confident	21 Å²	21	16.3 Å²	16.3	9%	0.092	9%	0.087	C	C	.	.	H	α-helix	trans	-63.1	-47.1	176.7	175.1	-89.4	0	0	0	112	A181 L185 L254 Y267 E273 S274 V275	A181-F271 HydrophobicContact CB-CE2 4.18Å; A181-F271 HydrophobicContact CB-CZ 3.72Å; A181-F271 WeakPolarHBondContact O-CZ 3.41Å; L185-F271 HydrophobicContact CD1-CE1 3.96Å; L185-F271 HydrophobicContact CD2-CD1 3.75Å; L185-F271 HydrophobicContact CD2-CE1 3.47Å; L185-F271 VanDerWaalsContact CD2-CE1 3.47Å; L185-F271 HydrophobicContact CG-CD1 4.26Å; L185-F271 HydrophobicContact CG-CE1 3.47Å; L185-F271 VanDerWaalsContact CG-CE1 3.47Å; L185-F271 HydrophobicContact CG-CZ 4.24Å; L254-F271 HydrophobicContact CD1-CB 4.16Å; L254-F271 HydrophobicContact CD1-CD2 3.84Å; L254-F271 HydrophobicContact CD2-CB 4.03Å; Y267-F271 HydrophobicContact CE1-CB 4.46Å; Y267-F271 WeakPolarHBondContact O-CB 3.28Å; Y267-F271 PolarHBondContact O-N 3.37Å; F271-E273 VanDerWaalsContact C-N 3.33Å; F271-E273 PolarHBondContact O-N 3.4Å; F271-S274 PolarHBondContact O-N 3.43Å; F271-S274 PolarHBondContact O-OG 3.37Å; F271-V275 HydrophobicContact CD1-CG2 4.47Å; F271-V275 HydrophobicContact CD2-CG2 4.37Å; F271-V275 HydrophobicContact CE1-CG2 4.04Å; F271-V275 HydrophobicContact CE2-CG2 3.99Å; F271-V275 HydrophobicContact CZ-CG2 3.82Å; F271-V275 WeakPolarHBondContact O-CG2 3.22Å; F271-V275 PolarHBondContact O-N 2.85Å; F271-V275 VanDerWaalsContact O-N 3.12Å
272	G	85.4	Confident	85.9	Confident	1 Å²	1	12.4 Å²	12.4	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-65.2	-38.8	179.9	0	0	0	0	0	112.3	I197 A268 M276	I197-G272 VanDerWaalsContact CG2-C 3.41Å; I197-G272 WeakPolarHBondContact CG2-O 3.44Å; A268-G272 PolarHBondContact O-N 2.9Å; G272-M276 VanDerWaalsContact O-CB 3.25Å; G272-M276 WeakPolarHBondContact O-CB 3.05Å; G272-M276 WeakPolarHBondContact O-CG 3.25Å; G272-M276 PolarHBondContact O-N 3.48Å
273	E	89.1	Confident	86.5	Confident	4 Å²	4	11.9 Å²	11.9	2%	0.019	7%	0.065	C	C	.	.	H	α-helix	trans	-60.3	-50.4	175.9	-171.4	-123.9	148.5	0	0	111.4	L269 F271 N277 R443	L269-E273 VanDerWaalsContact O-CB 3.24Å; L269-E273 WeakPolarHBondContact O-CB 3.39Å; L269-E273 PolarHBondContact O-N 2.98Å; F271-E273 VanDerWaalsContact C-N 3.33Å; F271-E273 PolarHBondContact O-N 3.4Å; E273-N277 WeakPolarHBondContact O-CB 3.31Å; E273-N277 PolarHBondContact O-N 3.47Å; E273-N277 PolarHBondContact O-ND2 2.77Å; E273-N277 PolarHBondContact OE1-ND2 3.24Å; E273-R443 IonicContact OE1-CZ 3.74Å; E273-R443 IonicContact OE1-NH1 3.92Å; E273-R443 PolarHBondContact OE1-NH1 3.27Å; E273-R443 IonicContact OE1-NH2 3.89Å; E273-R443 PolarHBondContact OE1-NH2 3.07Å; E273-R443 IonicContact OE2-CZ 3.68Å; E273-R443 IonicContact OE2-NH1 3.8Å; E273-R443 IonicContact OE2-NH2 3.15Å; E273-R443 PolarHBondContact OE2-NH2 3Å
274	S	88.7	Confident	86.9	Confident	7 Å²	7	11.7 Å²	11.7	5%	0.049	6%	0.064	C	C	.	.	H	α-helix	trans	-65.7	-45.2	-176.9	58.1	0	0	0	0	113.5	T248 P250 L270 F271 M276 N277 D278	T248-S274 VanDerWaalsContact O-CB 3.32Å; T248-S274 WeakPolarHBondContact O-CB 3.45Å; P250-S274 WeakPolarHBondContact CD-OG 3.25Å; P250-S274 VanDerWaalsContact CG-CB 3.48Å; P250-S274 WeakPolarHBondContact CG-OG 3.49Å; L270-S274 PolarHBondContact O-N 2.6Å; L270-S274 VanDerWaalsContact O-N 3.13Å; L270-S274 PolarHBondContact O-OG 2.97Å; F271-S274 PolarHBondContact O-N 3.43Å; F271-S274 PolarHBondContact O-OG 3.37Å; S274-M276 VanDerWaalsContact C-N 3.35Å; S274-M276 PolarHBondContact O-N 2.98Å; S274-N277 WeakPolarHBondContact CA-OD1 3.41Å; S274-N277 PolarHBondContact O-N 3.49Å; S274-N277 PolarHBondContact O-OD1 3.16Å; S274-D278 VanDerWaalsContact O-CG 3.31Å; S274-D278 PolarHBondContact O-N 3.48Å; S274-D278 VanDerWaalsContact O-N 3.16Å
275	V	85.4	Confident	87.5	Confident	15 Å²	15	10.9 Å²	10.9	9%	0.091	6%	0.056	C	C	.	.	H	α-helix	trans	-68.3	-38.7	-177.6	178.6	0	0	0	0	111	A181 F271 L374	A181-V275 HydrophobicContact CB-CG1 4.28Å; A181-V275 HydrophobicContact CB-CG2 3.97Å; F271-V275 HydrophobicContact CD1-CG2 4.47Å; F271-V275 HydrophobicContact CD2-CG2 4.37Å; F271-V275 HydrophobicContact CE1-CG2 4.04Å; F271-V275 HydrophobicContact CE2-CG2 3.99Å; F271-V275 HydrophobicContact CZ-CG2 3.82Å; F271-V275 WeakPolarHBondContact O-CG2 3.22Å; F271-V275 PolarHBondContact O-N 2.85Å; F271-V275 VanDerWaalsContact O-N 3.12Å; V275-L374 HydrophobicContact CG1-CD1 3.37Å; V275-L374 HydrophobicContact CG1-CD2 3.79Å; V275-L374 HydrophobicContact CG1-CG 4.2Å
276	M	86.1	Confident	87.6	Confident	13 Å²	13	12 Å²	12	6%	0.064	7%	0.066	C	C	.	.	H	α-helix	trans	-76.2	-37.1	178.7	-68	-70.6	-63.3	0	0	112.3	I197 A201 F202 G272 S274 D278 A279 V280 F317 L374 F375	I197-M276 HydrophobicContact CG2-CG 4.29Å; A201-M276 HydrophobicContact CB-CB 3.38Å; A201-M276 HydrophobicContact CB-CG 4.44Å; F202-M276 HydrophobicContact CE2-CE 4.22Å; G272-M276 VanDerWaalsContact O-CB 3.25Å; G272-M276 WeakPolarHBondContact O-CB 3.05Å; G272-M276 WeakPolarHBondContact O-CG 3.25Å; G272-M276 PolarHBondContact O-N 3.48Å; S274-M276 VanDerWaalsContact C-N 3.35Å; S274-M276 PolarHBondContact O-N 2.98Å; M276-D278 VanDerWaalsContact C-N 3.34Å; M276-A279 PolarHBondContact O-N 2.77Å; M276-V280 WeakPolarHBondContact O-CG2 3.49Å; M276-V280 PolarHBondContact O-N 3.45Å; M276-F317 HydrophobicContact CE-CZ 4.28Å; M276-L374 HydrophobicContact SD-CD2 3.61Å; M276-F375 HydrophobicContact CE-CZ 4.03Å; M276-F375 HydrophobicContact SD-CZ 4.17Å
277	N	90.8	Very high	87.7	Confident	0 Å²	0	12 Å²	12	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-69.8	-30.6	-178.9	75.1	22	0	0	0	112.8	T205 T248 E273 S274 A279 V280 A281	T205-N277 VanDerWaalsContact OG1-CB 3.32Å; T205-N277 WeakPolarHBondContact OG1-CB 3.4Å; T248-N277 PolarHBondContact N-OD1 2.83Å; T248-N277 PolarHBondContact OG1-ND2 3.22Å; E273-N277 WeakPolarHBondContact O-CB 3.31Å; E273-N277 PolarHBondContact O-N 3.47Å; E273-N277 PolarHBondContact O-ND2 2.77Å; E273-N277 PolarHBondContact OE1-ND2 3.24Å; S274-N277 WeakPolarHBondContact CA-OD1 3.41Å; S274-N277 PolarHBondContact O-N 3.49Å; S274-N277 PolarHBondContact O-OD1 3.16Å; N277-A279 VanDerWaalsContact C-N 3.33Å; N277-A279 PolarHBondContact O-N 3.07Å; N277-V280 PolarHBondContact O-N 2.88Å; N277-A281 VanDerWaalsContact O-CB 3.23Å; N277-A281 WeakPolarHBondContact O-CB 2.99Å; N277-A281 PolarHBondContact O-N 3.49Å
278	D	89.4	Confident	87.6	Confident	14 Å²	14	10.3 Å²	10.3	8%	0.075	6%	0.06	C	C	.	.	H	α-helix	trans	-58.7	-47.8	172.3	-80.6	-13.5	0	0	0	110.6	A247 S274 M276 V280 A281 I282 M479	A247-D278 WeakPolarHBondContact CB-OD1 3.31Å; S274-D278 VanDerWaalsContact O-CG 3.31Å; S274-D278 PolarHBondContact O-N 3.48Å; S274-D278 VanDerWaalsContact O-N 3.16Å; M276-D278 VanDerWaalsContact C-N 3.34Å; D278-V280 PolarHBondContact O-N 3.2Å; D278-A281 PolarHBondContact O-N 3.33Å; D278-I282 VanDerWaalsContact O-CG1 3.27Å; D278-I282 WeakPolarHBondContact O-CG1 3.37Å; D278-I282 PolarHBondContact O-N 3.06Å; D278-I282 VanDerWaalsContact O-N 3.1Å; D278-M479 HydrophobicContact CB-CG 3.91Å; D278-M479 VanDerWaalsContact OD2-CG 3.22Å; D278-M479 WeakPolarHBondContact OD2-CG 3.07Å
279	A	86.8	Confident	87.4	Confident	3 Å²	3	13 Å²	13	3%	0.025	8%	0.076	C	C	.	.	H	α-helix	trans	-63.7	-43.9	178.3	0	0	0	0	0	111.5	M276 N277 I282 V283 V370 V371	M276-A279 PolarHBondContact O-N 2.77Å; N277-A279 VanDerWaalsContact C-N 3.33Å; N277-A279 PolarHBondContact O-N 3.07Å; A279-I282 PolarHBondContact O-N 3.34Å; A279-V283 VanDerWaalsContact O-CG2 3.23Å; A279-V283 WeakPolarHBondContact O-CG2 3.29Å; A279-V283 PolarHBondContact O-N 3.44Å; A279-V370 HydrophobicContact CB-CG1 4.23Å; A279-V371 HydrophobicContact CB-CG2 3.48Å; A279-V371 VanDerWaalsContact CB-CG2 3.48Å
280	V	90.9	Very high	86.9	Confident	3 Å²	3	15.8 Å²	15.8	2%	0.018	10%	0.1	C	C	.	.	H	α-helix	trans	-64.1	-42.8	176.8	171.3	0	0	0	0	111.6	F202 T205 M276 N277 D278 I282 V283 L284 F313 F317	F202-V280 HydrophobicContact CD1-CG2 4.07Å; F202-V280 HydrophobicContact CD2-CG2 4.45Å; F202-V280 HydrophobicContact CE1-CG2 4.09Å; F202-V280 HydrophobicContact CE2-CG2 4.47Å; F202-V280 HydrophobicContact CG-CG2 4.29Å; F202-V280 HydrophobicContact CZ-CG2 4.33Å; T205-V280 HydrophobicContact CG2-CB 4.48Å; T205-V280 HydrophobicContact CG2-CG1 3.97Å; M276-V280 WeakPolarHBondContact O-CG2 3.49Å; M276-V280 PolarHBondContact O-N 3.45Å; N277-V280 PolarHBondContact O-N 2.88Å; D278-V280 PolarHBondContact O-N 3.2Å; V280-I282 PolarHBondContact O-N 2.79Å; V280-V283 PolarHBondContact O-N 2.99Å; V280-L284 WeakPolarHBondContact O-CB 3.22Å; V280-L284 PolarHBondContact O-N 2.92Å; V280-F313 HydrophobicContact CG1-CE2 4.27Å; V280-F313 HydrophobicContact CG1-CZ 4.06Å; V280-F317 HydrophobicContact CG2-CE2 4.21Å
281	A	91.2	Very high	86.3	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.5	-39.8	-179.8	0	0	0	0	0	112.1	T205 A247 N277 D278 L284 S285	T205-A281 HydrophobicContact CG2-CB 4.38Å; A247-A281 HydrophobicContact CB-CB 3.84Å; N277-A281 VanDerWaalsContact O-CB 3.23Å; N277-A281 WeakPolarHBondContact O-CB 2.99Å; N277-A281 PolarHBondContact O-N 3.49Å; D278-A281 PolarHBondContact O-N 3.33Å; A281-L284 PolarHBondContact O-N 3.14Å; A281-S285 VanDerWaalsContact O-CB 3.31Å; A281-S285 WeakPolarHBondContact O-CB 3.42Å; A281-S285 PolarHBondContact O-N 2.87Å; A281-S285 PolarHBondContact O-OG 3.15Å
282	I	88.6	Confident	85.4	Confident	11 Å²	11	21.7 Å²	21.7	6%	0.056	13%	0.126	C	C	.	.	H	α-helix	trans	-61.5	-52.3	174.7	-66	169.4	0	0	0	110.3	D278 A279 V280 L284 S285 S286 V370 L483	D278-I282 VanDerWaalsContact O-CG1 3.27Å; D278-I282 WeakPolarHBondContact O-CG1 3.37Å; D278-I282 PolarHBondContact O-N 3.06Å; D278-I282 VanDerWaalsContact O-N 3.1Å; A279-I282 PolarHBondContact O-N 3.34Å; V280-I282 PolarHBondContact O-N 2.79Å; I282-L284 VanDerWaalsContact C-N 3.3Å; I282-L284 PolarHBondContact O-N 3.29Å; I282-S285 PolarHBondContact O-N 3.39Å; I282-S285 PolarHBondContact O-OG 3.38Å; I282-S286 PolarHBondContact O-N 3.49Å; I282-V370 HydrophobicContact CD1-CB 4.23Å; I282-V370 HydrophobicContact CD1-CG1 4.18Å; I282-V370 HydrophobicContact CD1-CG2 3.73Å; I282-L483 HydrophobicContact CG1-CD1 3.92Å; I282-L483 HydrophobicContact CG1-CD2 4.08Å; I282-L483 HydrophobicContact CG1-CG 4.32Å
283	V	89.2	Confident	83.8	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-62.9	-39.6	-179.7	-173.2	0	0	0	0	110.5	A279 V280 S286 S287 F313 I316 F317 T368 V371	A279-V283 VanDerWaalsContact O-CG2 3.23Å; A279-V283 WeakPolarHBondContact O-CG2 3.29Å; A279-V283 PolarHBondContact O-N 3.44Å; V280-V283 PolarHBondContact O-N 2.99Å; V283-S286 PolarHBondContact O-N 3.24Å; V283-S287 WeakPolarHBondContact O-CB 3.16Å; V283-S287 PolarHBondContact O-N 3.08Å; V283-S287 PolarHBondContact O-OG 3.23Å; V283-F313 HydrophobicContact CB-CD2 3.86Å; V283-F313 HydrophobicContact CB-CE2 3.73Å; V283-F313 HydrophobicContact CG1-CB 4.46Å; V283-F313 HydrophobicContact CG1-CD2 3.33Å; V283-F313 HydrophobicContact CG1-CE2 3.68Å; V283-F313 HydrophobicContact CG1-CG 4.07Å; V283-I316 HydrophobicContact CG1-CB 4.33Å; V283-I316 HydrophobicContact CG1-CG2 4.18Å; V283-F317 HydrophobicContact CG2-CD2 4.48Å; V283-T368 HydrophobicContact CG2-CG2 3.64Å; V283-V371 HydrophobicContact CG2-CG2 4.39Å
284	L	89.4	Confident	81.8	Confident	30 Å²	30	30.9 Å²	30.9	16%	0.157	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-45.1	178.5	-173.1	64.2	0	0	0	111.6	C209 A243 V280 A281 I282 S286 S287 I288 F313	C209-L284 HydrophobicContact CB-CD2 3.6Å; A243-L284 HydrophobicContact CB-CB 4.46Å; A243-L284 HydrophobicContact CB-CD2 4.13Å; A243-L284 HydrophobicContact CB-CG 4.13Å; V280-L284 WeakPolarHBondContact O-CB 3.22Å; V280-L284 PolarHBondContact O-N 2.92Å; A281-L284 PolarHBondContact O-N 3.14Å; I282-L284 VanDerWaalsContact C-N 3.3Å; I282-L284 PolarHBondContact O-N 3.29Å; L284-S286 PolarHBondContact O-N 2.98Å; L284-S287 PolarHBondContact O-N 3.48Å; L284-I288 HydrophobicContact CG-CD1 4.16Å; L284-I288 VanDerWaalsContact O-CG1 3.31Å; L284-I288 WeakPolarHBondContact O-CG1 3.25Å; L284-I288 PolarHBondContact O-N 3.42Å; L284-F313 HydrophobicContact CB-CE2 4.36Å
285	S	88.5	Confident	79.7	Confident	0 Å²	0	34 Å²	34	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-42.2	177.2	74.2	0	0	0	0	112	A281 I282 I288 V289	A281-S285 VanDerWaalsContact O-CB 3.31Å; A281-S285 WeakPolarHBondContact O-CB 3.42Å; A281-S285 PolarHBondContact O-N 2.87Å; A281-S285 PolarHBondContact O-OG 3.15Å; I282-S285 PolarHBondContact O-N 3.39Å; I282-S285 PolarHBondContact O-OG 3.38Å; S285-I288 PolarHBondContact O-N 2.8Å; S285-V289 WeakPolarHBondContact O-CG2 3.35Å; S285-V289 PolarHBondContact O-N 3.22Å; S285-V289 VanDerWaalsContact O-N 3.08Å
286	S	84.3	Confident	77.7	Confident	53 Å²	53	35.8 Å²	35.8	37%	0.371	25%	0.245	S	C	.	.	H	α-helix	trans	-62.6	-42.4	174.7	-174.7	0	0	0	0	111.7	I282 V283 L284 I288 V289 A290	I282-S286 PolarHBondContact O-N 3.49Å; V283-S286 PolarHBondContact O-N 3.24Å; L284-S286 PolarHBondContact O-N 2.98Å; S286-I288 VanDerWaalsContact C-N 3.33Å; S286-I288 PolarHBondContact O-N 2.7Å; S286-V289 PolarHBondContact O-N 2.79Å; S286-A290 WeakPolarHBondContact O-CB 3.37Å; S286-A290 PolarHBondContact O-N 2.94Å
287	S	85.7	Confident	75.7	Confident	4 Å²	4	41.9 Å²	41.9	3%	0.028	28%	0.278	C	S	.	.	H	α-helix	trans	-65.6	-34.2	179	-56.6	0	0	0	0	112.8	V283 L284 Y291 S309	V283-S287 WeakPolarHBondContact O-CB 3.16Å; V283-S287 PolarHBondContact O-N 3.08Å; V283-S287 PolarHBondContact O-OG 3.23Å; L284-S287 PolarHBondContact O-N 3.48Å; S287-Y291 PolarHBondContact O-N 3.31Å; S287-Y291 VanDerWaalsContact O-N 3.09Å; S287-S309 PolarHBondContact O-OG 3.26Å
288	I	85.1	Confident	73.6	Confident	20 Å²	20	47.2 Å²	47.2	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-70.6	-40	174.4	-67.3	161.3	0	0	0	110.9	L239 F240 A243 L284 S285 S286 Y291	L239-I288 HydrophobicContact CB-CD1 4.14Å; L239-I288 HydrophobicContact CB-CG2 4.22Å; F240-I288 HydrophobicContact CB-CG2 4.11Å; A243-I288 HydrophobicContact CB-CD1 3.74Å; L284-I288 HydrophobicContact CG-CD1 4.16Å; L284-I288 VanDerWaalsContact O-CG1 3.31Å; L284-I288 WeakPolarHBondContact O-CG1 3.25Å; L284-I288 PolarHBondContact O-N 3.42Å; S285-I288 PolarHBondContact O-N 2.8Å; S286-I288 VanDerWaalsContact C-N 3.33Å; S286-I288 PolarHBondContact O-N 2.7Å; I288-Y291 WeakPolarHBondContact O-CB 3.29Å; I288-Y291 PolarHBondContact O-N 3.22Å
289	V	80.9	Confident	71.7	Confident	63 Å²	63	53.3 Å²	53.3	38%	0.382	34%	0.338	S	S	.	.	H	α-helix	trans	-65.7	-43.4	175.3	173.3	0	0	0	0	110.6	F240 S285 S286 Y291 Q292	F240-V289 HydrophobicContact CD2-CG2 3.77Å; F240-V289 HydrophobicContact CE2-CG2 3.73Å; S285-V289 WeakPolarHBondContact O-CG2 3.35Å; S285-V289 PolarHBondContact O-N 3.22Å; S285-V289 VanDerWaalsContact O-N 3.08Å; S286-V289 PolarHBondContact O-N 2.79Å; V289-Y291 PolarHBondContact O-N 3.18Å; V289-Q292 WeakPolarHBondContact O-CB 3.49Å; V289-Q292 PolarHBondContact O-N 2.82Å; V289-Q292 VanDerWaalsContact O-N 3.09Å
290	A	76.1	Confident	70.1	Confident	66 Å²	66	60.9 Å²	60.9	55%	0.545	38%	0.375	S	S	.	.	H	α-helix	trans	-64.8	-23.9	176.5	0	0	0	0	0	113.5	S286 Q292	S286-A290 WeakPolarHBondContact O-CB 3.37Å; S286-A290 PolarHBondContact O-N 2.94Å; A290-Q292 PolarHBondContact O-N 3.35Å
291	Y	74.4	Confident	68.7	Low	61 Å²	61	67.2 Å²	67.2	24%	0.239	40%	0.403	C	S	.	.	H	α-helix	trans	-67.3	-23.7	174.1	177.5	-91.6	0	0	0	112.5	T236 S287 I288 V289 P293 D302 A305	T236-Y291 HydrophobicContact CG2-CD1 3.93Å; T236-Y291 HydrophobicContact CG2-CE1 4.26Å; S287-Y291 PolarHBondContact O-N 3.31Å; S287-Y291 VanDerWaalsContact O-N 3.09Å; I288-Y291 WeakPolarHBondContact O-CB 3.29Å; I288-Y291 PolarHBondContact O-N 3.22Å; V289-Y291 PolarHBondContact O-N 3.18Å; Y291-P293 WeakPolarHBondContact O-CD 3.34Å; Y291-D302 PolarHBondContact OH-N 2.92Å; Y291-A305 HydrophobicContact CD2-CB 3.94Å; Y291-A305 HydrophobicContact CE2-CB 3.43Å; Y291-A305 VanDerWaalsContact CE2-CB 3.43Å
292	Q	66.4	Low	67.8	Low	85 Å²	85	70.9 Å²	70.9	40%	0.397	42%	0.422	S	S	.	.	S	Bend	trans	-82	99.6	179.7	-168	125.5	-2.2	0	0	110.3	T236 V289 A290 A294	T236-Q292 VanDerWaalsContact CB-OE1 3.24Å; T236-Q292 PolarHBondContact OG1-OE1 3.04Å; V289-Q292 WeakPolarHBondContact O-CB 3.49Å; V289-Q292 PolarHBondContact O-N 2.82Å; V289-Q292 VanDerWaalsContact O-N 3.09Å; A290-Q292 PolarHBondContact O-N 3.35Å; Q292-A294 PolarHBondContact O-N 2.75Å
293	P	53.3	Low	67.1	Low	84 Å²	84	72.7 Å²	72.7	55%	0.545	44%	0.439	S	S	.	.			trans	-74.2	133	-177.8	-6	26.3	0	0	0	108.4	Y291 G295 A296	Y291-P293 WeakPolarHBondContact O-CD 3.34Å; P293-G295 PolarHBondContact O-N 3.45Å; P293-A296 HydrophobicContact CB-CB 4.46Å
294	A	46.7	Very low	66.6	Low	114 Å²	114	76.3 Å²	76.3	94%	0.942	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	97.5	167.5	0	0	0	0	0	109.1	Q292	Q292-A294 PolarHBondContact O-N 2.75Å
295	G	45.1	Very low	66.1	Low	72 Å²	72	76.1 Å²	76.1	74%	0.742	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.8	-1.9	166.3	0	0	0	0	0	118.3	P293	P293-G295 PolarHBondContact O-N 3.45Å
296	A	42.7	Very low	65.6	Low	54 Å²	54	79.1 Å²	79.1	45%	0.446	48%	0.48	S	S	.	.			trans	-105.7	93.7	177.2	0	0	0	0	0	111.6	P293 T298	P293-A296 HydrophobicContact CB-CB 4.46Å; A296-T298 PolarHBondContact O-N 3Å
297	N	44.5	Very low	65.6	Low	140 Å²	140	83.5 Å²	83.5	75%	0.749	49%	0.493	S	S	*	.			trans	-71.1	38.3	174.7	-68.3	-46	0	0	0	113.5
298	T	45.7	Very low	65.4	Low	112 Å²	112	90.4 Å²	90.4	69%	0.687	52%	0.522	S	S	*	.			trans	-101.9	91	174.1	44	0	0	0	0	108.9	A296 M300	A296-T298 PolarHBondContact O-N 3Å; T298-M300 PolarHBondContact O-N 3.22Å
299	H	50.5	Low	65.2	Low	142 Å²	142	90.3 Å²	90.3	66%	0.657	52%	0.524	S	S	*	.			trans	-72.2	38	179.1	-65.9	-68.1	0	0	0	114.1	Y234	Y234-H299 AromaticContact CD1-CE1 3.49Å; Y234-H299 VanDerWaalsContact CD1-CE1 3.49Å; Y234-H299 WeakPolarHBondContact CD1-CE1 3.47Å; Y234-H299 AromaticContact CE1-CE1 3.37Å; Y234-H299 WeakPolarHBondContact CE1-CE1 3.29Å; Y234-H299 AromaticContact CE1-NE2 3.94Å
300	M	53.5	Low	65.4	Low	162 Å²	162	89.9 Å²	89.9	80%	0.798	52%	0.521	S	S	*	.	S	Bend	trans	-104.7	144.6	171.9	-75.9	-174	67.3	0	0	110.2	T298 D302	T298-M300 PolarHBondContact O-N 3.22Å; M300-D302 PolarHBondContact O-N 2.98Å
301	F	60.8	Low	65.8	Low	136 Å²	136	88.8 Å²	88.8	60%	0.596	52%	0.516	S	S	*	.			trans	-64.8	104	172.9	-175.7	-94.9	0	0	0	108.4	A303 F306	F301-A303 PolarHBondContact O-N 3.44Å; F301-F306 HydrophobicContact CE1-CB 4.39Å; F301-F306 HydrophobicContact CE2-CB 4.36Å; F301-F306 HydrophobicContact CE2-CD2 4.19Å; F301-F306 HydrophobicContact CE2-CG 4.37Å; F301-F306 HydrophobicContact CZ-CB 3.85Å; F301-F306 HydrophobicContact CZ-CD1 4.32Å; F301-F306 AromaticContact CZ-CD2 3.97Å; F301-F306 HydrophobicContact CZ-CD2 3.97Å; F301-F306 AromaticContact CZ-CG 3.77Å; F301-F306 HydrophobicContact CZ-CG 3.77Å
302	D	72.1	Confident	66.3	Low	78 Å²	78	89.1 Å²	89.1	42%	0.417	52%	0.521	S	S	.	.			trans	-88.9	107.3	174.8	178.4	11.1	0	0	0	108.2	Y291 M300 S304 A305 F306	Y291-D302 PolarHBondContact OH-N 2.92Å; M300-D302 PolarHBondContact O-N 2.98Å; D302-S304 PolarHBondContact O-N 2.81Å; D302-S304 WeakPolarHBondContact OD1-CB 3.36Å; D302-S304 PolarHBondContact OD1-N 3.11Å; D302-S304 PolarHBondContact OD1-OG 2.8Å; D302-S304 PolarHBondContact OD2-OG 3.07Å; D302-A305 HydrophobicContact CB-CB 3.93Å; D302-A305 PolarHBondContact O-N 3.13Å; D302-A305 VanDerWaalsContact O-N 3.16Å; D302-F306 PolarHBondContact O-N 2.94Å
303	A	74.8	Confident	67.3	Low	48 Å²	48	86.2 Å²	86.2	40%	0.397	51%	0.507	S	S	.	.	H	α-helix	trans	-57.5	-31.8	178.2	0	0	0	0	0	111.5	F301 F306 F307	F301-A303 PolarHBondContact O-N 3.44Å; A303-F306 PolarHBondContact O-N 2.92Å; A303-F307 WeakPolarHBondContact O-CD2 3.49Å; A303-F307 PolarHBondContact O-N 3.46Å
304	S	78.9	Confident	69	Low	78 Å²	78	86.9 Å²	86.9	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-69	-42.7	178.4	78.8	0	0	0	0	111.9	D302 F306 F307 K308	D302-S304 PolarHBondContact O-N 2.81Å; D302-S304 WeakPolarHBondContact OD1-CB 3.36Å; D302-S304 PolarHBondContact OD1-N 3.11Å; D302-S304 PolarHBondContact OD1-OG 2.8Å; D302-S304 PolarHBondContact OD2-OG 3.07Å; S304-F306 VanDerWaalsContact C-N 3.33Å; S304-F306 PolarHBondContact O-N 3.07Å; S304-F307 PolarHBondContact O-N 3.25Å; S304-K308 WeakPolarHBondContact O-CB 3.18Å; S304-K308 PolarHBondContact O-N 3.24Å
305	A	77.3	Confident	71	Confident	26 Å²	26	83.1 Å²	83.1	22%	0.215	48%	0.478	C	S	.	.	H	α-helix	trans	-66	-34.7	173.2	0	0	0	0	0	112.3	Y291 D302 K308 S309	Y291-A305 HydrophobicContact CD2-CB 3.94Å; Y291-A305 HydrophobicContact CE2-CB 3.43Å; Y291-A305 VanDerWaalsContact CE2-CB 3.43Å; D302-A305 HydrophobicContact CB-CB 3.93Å; D302-A305 PolarHBondContact O-N 3.13Å; D302-A305 VanDerWaalsContact O-N 3.16Å; A305-K308 PolarHBondContact O-N 3.47Å; A305-S309 WeakPolarHBondContact O-CB 3.27Å; A305-S309 PolarHBondContact O-N 3.41Å
306	F	79.4	Confident	73.2	Confident	64 Å²	64	81.4 Å²	81.4	28%	0.281	45%	0.451	S	S	.	.	H	α-helix	trans	-63	-53.3	173.3	176.3	-101.1	0	0	0	111.8	F210 F301 D302 A303 S304 K308 S309 V310	F210-F306 HydrophobicContact CZ-CE2 4.02Å; F210-F306 HydrophobicContact CZ-CZ 4.48Å; F301-F306 HydrophobicContact CE1-CB 4.39Å; F301-F306 HydrophobicContact CE2-CB 4.36Å; F301-F306 HydrophobicContact CE2-CD2 4.19Å; F301-F306 HydrophobicContact CE2-CG 4.37Å; F301-F306 HydrophobicContact CZ-CB 3.85Å; F301-F306 HydrophobicContact CZ-CD1 4.32Å; F301-F306 AromaticContact CZ-CD2 3.97Å; F301-F306 HydrophobicContact CZ-CD2 3.97Å; F301-F306 AromaticContact CZ-CG 3.77Å; F301-F306 HydrophobicContact CZ-CG 3.77Å; D302-F306 PolarHBondContact O-N 2.94Å; A303-F306 PolarHBondContact O-N 2.92Å; S304-F306 VanDerWaalsContact C-N 3.33Å; S304-F306 PolarHBondContact O-N 3.07Å; F306-K308 VanDerWaalsContact C-N 3.26Å; F306-K308 PolarHBondContact O-N 2.87Å; F306-S309 WeakPolarHBondContact O-CB 3.5Å; F306-S309 PolarHBondContact O-N 2.71Å; F306-S309 VanDerWaalsContact O-N 3.09Å; F306-V310 HydrophobicContact CD1-CG2 4.38Å; F306-V310 HydrophobicContact CE1-CG2 3.92Å; F306-V310 HydrophobicContact CE2-CG2 4.22Å; F306-V310 HydrophobicContact CZ-CG2 3.83Å; F306-V310 WeakPolarHBondContact O-CG2 3.28Å; F306-V310 PolarHBondContact O-N 3.4Å
307	F	83.6	Confident	75.4	Confident	144 Å²	144	79.9 Å²	79.9	63%	0.632	43%	0.434	S	S	*	.	H	α-helix	trans	-62.5	-34	177.6	-77.7	-66.1	0	0	0	112.3	A303 S304 V310 G311	A303-F307 WeakPolarHBondContact O-CD2 3.49Å; A303-F307 PolarHBondContact O-N 3.46Å; S304-F307 PolarHBondContact O-N 3.25Å; F307-V310 PolarHBondContact O-N 3.46Å; F307-G311 PolarHBondContact O-N 2.92Å
308	K	82.4	Confident	77.6	Confident	149 Å²	149	76.1 Å²	76.1	65%	0.648	42%	0.419	S	S	*	.	H	α-helix	trans	-62	-45	171.9	-174	-179.2	178.7	-175.3	0	111.7	S304 A305 F306 G311 I312	S304-K308 WeakPolarHBondContact O-CB 3.18Å; S304-K308 PolarHBondContact O-N 3.24Å; A305-K308 PolarHBondContact O-N 3.47Å; F306-K308 VanDerWaalsContact C-N 3.26Å; F306-K308 PolarHBondContact O-N 2.87Å; K308-G311 PolarHBondContact O-N 3.39Å; K308-I312 HydrophobicContact CG-CD1 4.13Å; K308-I312 VanDerWaalsContact O-CG1 3.31Å; K308-I312 WeakPolarHBondContact O-CG1 3.4Å; K308-I312 PolarHBondContact O-N 2.91Å
309	S	80.9	Confident	79.8	Confident	19 Å²	19	71.5 Å²	71.5	13%	0.133	39%	0.394	C	S	.	.	H	α-helix	trans	-62.6	-41.8	176.3	-175.5	0	0	0	0	111.6	S287 A305 F306 G311 I312 F313	S287-S309 PolarHBondContact O-OG 3.26Å; A305-S309 WeakPolarHBondContact O-CB 3.27Å; A305-S309 PolarHBondContact O-N 3.41Å; F306-S309 WeakPolarHBondContact O-CB 3.5Å; F306-S309 PolarHBondContact O-N 2.71Å; F306-S309 VanDerWaalsContact O-N 3.09Å; S309-G311 PolarHBondContact O-N 3.19Å; S309-I312 PolarHBondContact O-N 3.01Å; S309-F313 WeakPolarHBondContact O-CB 3.43Å; S309-F313 PolarHBondContact O-N 3.09Å
310	V	84.1	Confident	81.8	Confident	54 Å²	54	64.7 Å²	64.7	33%	0.327	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-41	173.6	175	0	0	0	0	111.9	F306 F307 F313 L314	F306-V310 HydrophobicContact CD1-CG2 4.38Å; F306-V310 HydrophobicContact CE1-CG2 3.92Å; F306-V310 HydrophobicContact CE2-CG2 4.22Å; F306-V310 HydrophobicContact CZ-CG2 3.83Å; F306-V310 WeakPolarHBondContact O-CG2 3.28Å; F306-V310 PolarHBondContact O-N 3.4Å; F307-V310 PolarHBondContact O-N 3.46Å; V310-F313 WeakPolarHBondContact O-CB 3.4Å; V310-F313 PolarHBondContact O-N 3.45Å; V310-L314 HydrophobicContact CG1-CD1 4.15Å; V310-L314 WeakPolarHBondContact O-CG 3.12Å; V310-L314 PolarHBondContact O-N 2.97Å
311	G	85.4	Confident	83.6	Confident	42 Å²	42	61.4 Å²	61.4	43%	0.433	34%	0.344	S	S	.	.	H	α-helix	trans	-63.9	-42	175.8	0	0	0	0	0	112.8	F307 K308 S309 L314 G315	F307-G311 PolarHBondContact O-N 2.92Å; K308-G311 PolarHBondContact O-N 3.39Å; S309-G311 PolarHBondContact O-N 3.19Å; G311-L314 PolarHBondContact O-N 2.92Å; G311-G315 PolarHBondContact O-N 3.23Å
312	I	85.1	Confident	85.1	Confident	68 Å²	68	59.2 Å²	59.2	35%	0.349	34%	0.342	S	S	.	.	H	α-helix	trans	-63	-45.9	174.2	-68.5	164.8	0	0	0	110.3	K308 S309 L314 G315 I316	K308-I312 HydrophobicContact CG-CD1 4.13Å; K308-I312 VanDerWaalsContact O-CG1 3.31Å; K308-I312 WeakPolarHBondContact O-CG1 3.4Å; K308-I312 PolarHBondContact O-N 2.91Å; S309-I312 PolarHBondContact O-N 3.01Å; I312-L314 PolarHBondContact O-N 3Å; I312-G315 PolarHBondContact O-N 2.96Å; I312-I316 HydrophobicContact CG2-CD1 3.55Å; I312-I316 HydrophobicContact CG2-CG1 4.24Å; I312-I316 WeakPolarHBondContact O-CB 3.35Å; I312-I316 WeakPolarHBondContact O-CG1 3.33Å; I312-I316 PolarHBondContact O-N 3.37Å
313	F	87.3	Confident	86.2	Confident	25 Å²	25	56.6 Å²	56.6	11%	0.11	33%	0.327	C	S	.	.	H	α-helix	trans	-55	-51.9	175.8	171.6	-88.2	0	0	0	111.4	F202 V280 V283 L284 S309 V310 G315 I316 F317	F202-F313 HydrophobicContact CD1-CE1 4.26Å; F202-F313 HydrophobicContact CD1-CZ 4.24Å; F202-F313 HydrophobicContact CE1-CE1 4.17Å; F202-F313 HydrophobicContact CE1-CZ 4.18Å; V280-F313 HydrophobicContact CG1-CE2 4.27Å; V280-F313 HydrophobicContact CG1-CZ 4.06Å; V283-F313 HydrophobicContact CB-CD2 3.86Å; V283-F313 HydrophobicContact CB-CE2 3.73Å; V283-F313 HydrophobicContact CG1-CB 4.46Å; V283-F313 HydrophobicContact CG1-CD2 3.33Å; V283-F313 HydrophobicContact CG1-CE2 3.68Å; V283-F313 HydrophobicContact CG1-CG 4.07Å; L284-F313 HydrophobicContact CB-CE2 4.36Å; S309-F313 WeakPolarHBondContact O-CB 3.43Å; S309-F313 PolarHBondContact O-N 3.09Å; V310-F313 WeakPolarHBondContact O-CB 3.4Å; V310-F313 PolarHBondContact O-N 3.45Å; F313-G315 VanDerWaalsContact C-N 3.35Å; F313-G315 PolarHBondContact O-N 3.46Å; F313-I316 PolarHBondContact O-N 3.45Å; F313-F317 VanDerWaalsContact O-CB 3.27Å; F313-F317 WeakPolarHBondContact O-CB 3.4Å; F313-F317 PolarHBondContact O-N 2.88Å
314	L	88	Confident	87.1	Confident	98 Å²	98	54.3 Å²	54.3	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-63.7	-39.7	179.4	-74.9	170.3	0	0	0	112	V310 G311 I312 S318	V310-L314 HydrophobicContact CG1-CD1 4.15Å; V310-L314 WeakPolarHBondContact O-CG 3.12Å; V310-L314 PolarHBondContact O-N 2.97Å; G311-L314 PolarHBondContact O-N 2.92Å; I312-L314 PolarHBondContact O-N 3Å; L314-S318 VanDerWaalsContact O-CB 3.25Å; L314-S318 WeakPolarHBondContact O-CB 3.15Å; L314-S318 PolarHBondContact O-N 2.92Å; L314-S318 PolarHBondContact O-OG 3.39Å
315	G	89.8	Confident	87.7	Confident	35 Å²	35	51.8 Å²	51.8	36%	0.361	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-48.5	177.5	0	0	0	0	0	112.7	G311 I312 F313 S318 G319	G311-G315 PolarHBondContact O-N 3.23Å; I312-G315 PolarHBondContact O-N 2.96Å; F313-G315 VanDerWaalsContact C-N 3.35Å; F313-G315 PolarHBondContact O-N 3.46Å; G315-S318 PolarHBondContact O-OG 3Å; G315-G319 PolarHBondContact O-N 3.49Å
316	I	89.8	Confident	88.4	Confident	35 Å²	35	52.9 Å²	52.9	18%	0.179	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-45.3	178.9	-67.5	171.5	0	0	0	110.3	V283 I312 F313 S320 T368	V283-I316 HydrophobicContact CG1-CB 4.33Å; V283-I316 HydrophobicContact CG1-CG2 4.18Å; I312-I316 HydrophobicContact CG2-CD1 3.55Å; I312-I316 HydrophobicContact CG2-CG1 4.24Å; I312-I316 WeakPolarHBondContact O-CB 3.35Å; I312-I316 WeakPolarHBondContact O-CG1 3.33Å; I312-I316 PolarHBondContact O-N 3.37Å; F313-I316 PolarHBondContact O-N 3.45Å; I316-S320 WeakPolarHBondContact O-CB 3.48Å; I316-S320 PolarHBondContact O-N 3.39Å; I316-S320 PolarHBondContact O-OG 3.33Å; I316-T368 HydrophobicContact CG2-CG2 3.74Å
317	F	88.8	Confident	89	Confident	22 Å²	22	50.6 Å²	50.6	10%	0.096	29%	0.292	C	S	.	.	H	α-helix	trans	-63.6	-51.3	-179.8	-173.7	-80.4	0	0	0	111.9	F202 M276 V280 V283 F313 S320 F321 V371 F375	F202-F317 HydrophobicContact CE1-CD1 4.21Å; F202-F317 HydrophobicContact CE1-CD2 4.17Å; F202-F317 HydrophobicContact CE1-CE1 4.17Å; F202-F317 HydrophobicContact CE1-CE2 4.08Å; F202-F317 HydrophobicContact CE1-CG 4.25Å; F202-F317 HydrophobicContact CE1-CZ 4.1Å; F202-F317 HydrophobicContact CE2-CE1 4.38Å; F202-F317 HydrophobicContact CE2-CZ 4.03Å; F202-F317 AromaticContact CZ-CD1 3.9Å; F202-F317 HydrophobicContact CZ-CD1 3.9Å; F202-F317 HydrophobicContact CZ-CD2 4.16Å; F202-F317 AromaticContact CZ-CE1 3.42Å; F202-F317 HydrophobicContact CZ-CE1 3.42Å; F202-F317 VanDerWaalsContact CZ-CE1 3.42Å; F202-F317 AromaticContact CZ-CE2 3.66Å; F202-F317 HydrophobicContact CZ-CE2 3.66Å; F202-F317 HydrophobicContact CZ-CG 4.28Å; F202-F317 AromaticContact CZ-CZ 3.28Å; F202-F317 HydrophobicContact CZ-CZ 3.28Å; M276-F317 HydrophobicContact CE-CZ 4.28Å; V280-F317 HydrophobicContact CG2-CE2 4.21Å; V283-F317 HydrophobicContact CG2-CD2 4.48Å; F313-F317 VanDerWaalsContact O-CB 3.27Å; F313-F317 WeakPolarHBondContact O-CB 3.4Å; F313-F317 PolarHBondContact O-N 2.88Å; F317-S320 PolarHBondContact O-N 3.16Å; F317-F321 PolarHBondContact O-N 2.98Å; F317-V371 HydrophobicContact CD2-CG1 4.43Å; F317-V371 HydrophobicContact CD2-CG2 4.1Å; F317-V371 HydrophobicContact CE2-CG1 4.09Å; F317-V371 HydrophobicContact CE2-CG2 3.99Å; F317-V371 HydrophobicContact CZ-CG1 4.18Å; F317-F375 HydrophobicContact CZ-CE2 4.3Å
318	S	90.4	Very high	89.3	Confident	61 Å²	61	43.8 Å²	43.8	43%	0.427	26%	0.262	S	S	.	.	H	α-helix	trans	-66.5	-38.7	-179.2	59.9	0	0	0	0	112.5	L314 G315 S320 F321 V322	L314-S318 VanDerWaalsContact O-CB 3.25Å; L314-S318 WeakPolarHBondContact O-CB 3.15Å; L314-S318 PolarHBondContact O-N 2.92Å; L314-S318 PolarHBondContact O-OG 3.39Å; G315-S318 PolarHBondContact O-OG 3Å; S318-S320 VanDerWaalsContact C-N 3.35Å; S318-S320 PolarHBondContact O-N 3.37Å; S318-F321 WeakPolarHBondContact O-CB 3.22Å; S318-F321 PolarHBondContact O-N 3.45Å; S318-V322 WeakPolarHBondContact O-CG2 3.35Å; S318-V322 PolarHBondContact O-N 3.37Å
319	G	92.8	Very high	89.6	Confident	15 Å²	15	38.6 Å²	38.6	16%	0.155	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-42.9	173.8	0	0	0	0	0	112.2	G315 V322 M323	G315-G319 PolarHBondContact O-N 3.49Å; G319-V322 PolarHBondContact O-N 3.06Å; G319-M323 VanDerWaalsContact O-CB 3.28Å; G319-M323 WeakPolarHBondContact O-CB 3.49Å; G319-M323 PolarHBondContact O-N 3.22Å
320	S	93.1	Very high	90.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-42.2	176.1	-52.2	0	0	0	0	112.2	I316 F317 S318 G324 T368 A372	I316-S320 WeakPolarHBondContact O-CB 3.48Å; I316-S320 PolarHBondContact O-N 3.39Å; I316-S320 PolarHBondContact O-OG 3.33Å; F317-S320 PolarHBondContact O-N 3.16Å; S318-S320 VanDerWaalsContact C-N 3.35Å; S318-S320 PolarHBondContact O-N 3.37Å; S320-G324 PolarHBondContact O-N 3.45Å; S320-T368 PolarHBondContact OG-N 3.27Å; S320-T368 PolarHBondContact OG-O 3.14Å; S320-T368 PolarHBondContact OG-OG1 3.35Å; S320-A372 WeakPolarHBondContact O-CA 3.15Å
321	F	90.7	Very high	90.3	Very high	92 Å²	92	38.5 Å²	38.5	40%	0.404	24%	0.242	S	C	.	.	H	α-helix	trans	-59.2	-52.6	175.3	168.3	-96.5	0	0	0	111.9	F317 S318 M323 G324 A325 F375	F317-F321 PolarHBondContact O-N 2.98Å; S318-F321 WeakPolarHBondContact O-CB 3.22Å; S318-F321 PolarHBondContact O-N 3.45Å; F321-M323 VanDerWaalsContact C-N 3.33Å; F321-M323 PolarHBondContact O-N 3.38Å; F321-G324 PolarHBondContact O-N 2.94Å; F321-A325 WeakPolarHBondContact O-CB 3.23Å; F321-A325 PolarHBondContact O-N 3.29Å; F321-F375 HydrophobicContact CB-CD2 4.22Å; F321-F375 HydrophobicContact CB-CE2 4.33Å; F321-F375 HydrophobicContact CD2-CB 4.35Å; F321-F375 AromaticContact CD2-CD1 3.45Å; F321-F375 HydrophobicContact CD2-CD1 3.45Å; F321-F375 VanDerWaalsContact CD2-CD1 3.45Å; F321-F375 AromaticContact CD2-CD2 3.58Å; F321-F375 HydrophobicContact CD2-CD2 3.58Å; F321-F375 AromaticContact CD2-CE1 3.47Å; F321-F375 HydrophobicContact CD2-CE1 3.47Å; F321-F375 VanDerWaalsContact CD2-CE1 3.47Å; F321-F375 AromaticContact CD2-CE2 3.61Å; F321-F375 HydrophobicContact CD2-CE2 3.61Å; F321-F375 AromaticContact CD2-CG 3.51Å; F321-F375 HydrophobicContact CD2-CG 3.51Å; F321-F375 AromaticContact CD2-CZ 3.54Å; F321-F375 HydrophobicContact CD2-CZ 3.54Å; F321-F375 AromaticContact CE2-CD1 3.48Å; F321-F375 HydrophobicContact CE2-CD1 3.48Å; F321-F375 VanDerWaalsContact CE2-CD1 3.48Å; F321-F375 HydrophobicContact CE2-CD2 4.45Å; F321-F375 AromaticContact CE2-CE1 3.49Å; F321-F375 HydrophobicContact CE2-CE1 3.49Å; F321-F375 VanDerWaalsContact CE2-CE1 3.49Å; F321-F375 HydrophobicContact CE2-CE2 4.46Å; F321-F375 AromaticContact CE2-CG 3.99Å; F321-F375 HydrophobicContact CE2-CG 3.99Å; F321-F375 HydrophobicContact CE2-CZ 4.01Å; F321-F375 HydrophobicContact CG-CD2 4.38Å; F321-F375 HydrophobicContact CG-CE2 4.46Å
322	V	93.4	Very high	90.4	Very high	91 Å²	91	36.5 Å²	36.5	55%	0.552	22%	0.221	S	C	*	.	H	α-helix	trans	-61.5	-44.4	-177.6	171	0	0	0	0	110.8	S318 G319 A325 A326	S318-V322 WeakPolarHBondContact O-CG2 3.35Å; S318-V322 PolarHBondContact O-N 3.37Å; G319-V322 PolarHBondContact O-N 3.06Å; V322-A325 PolarHBondContact O-N 2.93Å; V322-A326 VanDerWaalsContact O-CB 3.24Å; V322-A326 WeakPolarHBondContact O-CB 3.12Å; V322-A326 PolarHBondContact O-N 3Å
323	M	93.9	Very high	90.3	Very high	23 Å²	23	35.7 Å²	35.7	11%	0.113	22%	0.217	C	C	.	.	H	α-helix	trans	-66.4	-43.5	179.9	-179.6	173.7	44.2	0	0	112.4	G319 F321 A326 T327 L361 A362 C365 F367 A372	G319-M323 VanDerWaalsContact O-CB 3.28Å; G319-M323 WeakPolarHBondContact O-CB 3.49Å; G319-M323 PolarHBondContact O-N 3.22Å; F321-M323 VanDerWaalsContact C-N 3.33Å; F321-M323 PolarHBondContact O-N 3.38Å; M323-A326 PolarHBondContact O-N 3.15Å; M323-T327 WeakPolarHBondContact O-CG2 3.4Å; M323-T327 PolarHBondContact O-N 3.38Å; M323-T327 PolarHBondContact O-OG1 2.89Å; M323-L361 HydrophobicContact SD-CG 4.25Å; M323-A362 HydrophobicContact CE-CB 3.21Å; M323-A362 HydrophobicContact SD-CB 4.05Å; M323-C365 HydrophobicContact SD-CB 4.44Å; M323-F367 HydrophobicContact CE-CB 3.54Å; M323-F367 HydrophobicContact CE-CD2 3.34Å; M323-F367 HydrophobicContact CE-CE2 4.35Å; M323-F367 HydrophobicContact CE-CG 3.82Å; M323-F367 HydrophobicContact SD-CD2 3.96Å; M323-A372 HydrophobicContact CE-CB 4.22Å
324	G	93.8	Very high	90.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-42.3	175.7	0	0	0	0	0	112.9	S320 F321 T327 G328 A372 C376	S320-G324 PolarHBondContact O-N 3.45Å; F321-G324 PolarHBondContact O-N 2.94Å; G324-T327 PolarHBondContact O-OG1 2.82Å; G324-T327 VanDerWaalsContact O-OG1 3.08Å; G324-G328 PolarHBondContact O-N 3Å; G324-G328 VanDerWaalsContact O-N 3.14Å; G324-A372 WeakPolarHBondContact CA-O 3.43Å; G324-C376 VanDerWaalsContact O-CA 3.28Å; G324-C376 WeakPolarHBondContact O-CA 3.5Å; G324-C376 WeakPolarHBondContact O-CB 3.26Å
325	A	91.4	Very high	90.1	Very high	24 Å²	24	32.4 Å²	32.4	20%	0.198	20%	0.203	C	C	.	.	H	α-helix	trans	-65	-41.4	173.9	0	0	0	0	0	111.8	F321 V322 G328 V329 T379	F321-A325 WeakPolarHBondContact O-CB 3.23Å; F321-A325 PolarHBondContact O-N 3.29Å; V322-A325 PolarHBondContact O-N 2.93Å; A325-G328 PolarHBondContact O-N 2.83Å; A325-V329 VanDerWaalsContact O-CG2 3.31Å; A325-V329 WeakPolarHBondContact O-CG2 3.42Å; A325-V329 PolarHBondContact O-N 3.35Å; A325-T379 HydrophobicContact CB-CG2 4.16Å
326	A	92.2	Very high	89.7	Confident	49 Å²	49	31.2 Å²	31.2	41%	0.405	19%	0.188	S	C	.	.	H	α-helix	trans	-63.9	-45.5	178.9	0	0	0	0	0	112.2	V322 M323 G328 V329 V330	V322-A326 VanDerWaalsContact O-CB 3.24Å; V322-A326 WeakPolarHBondContact O-CB 3.12Å; V322-A326 PolarHBondContact O-N 3Å; M323-A326 PolarHBondContact O-N 3.15Å; A326-G328 VanDerWaalsContact C-N 3.34Å; A326-G328 PolarHBondContact O-N 2.82Å; A326-V329 PolarHBondContact O-N 3.4Å; A326-V330 VanDerWaalsContact O-CG2 3.28Å; A326-V330 WeakPolarHBondContact O-CG2 3.42Å; A326-V330 PolarHBondContact O-N 3.3Å
327	T	91.4	Very high	89.1	Confident	17 Å²	17	34.7 Å²	34.7	10%	0.104	20%	0.202	C	C	.	.	H	α-helix	trans	-66.4	-35.8	177.9	56.6	0	0	0	0	112.1	M323 G324 V330 T331 T358 L361	M323-T327 WeakPolarHBondContact O-CG2 3.4Å; M323-T327 PolarHBondContact O-N 3.38Å; M323-T327 PolarHBondContact O-OG1 2.89Å; G324-T327 PolarHBondContact O-OG1 2.82Å; G324-T327 VanDerWaalsContact O-OG1 3.08Å; T327-V330 PolarHBondContact O-N 3.02Å; T327-T331 PolarHBondContact O-N 2.84Å; T327-T331 PolarHBondContact O-OG1 3.24Å; T327-T358 VanDerWaalsContact CB-OG1 3.27Å; T327-T358 WeakPolarHBondContact CB-OG1 3.41Å; T327-T358 HydrophobicContact CG2-CG2 4.26Å; T327-T358 WeakPolarHBondContact OG1-CG2 3.5Å; T327-T358 PolarHBondContact OG1-OG1 3.4Å; T327-L361 HydrophobicContact CG2-CD2 3.97Å
328	G	91.1	Very high	88.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-44.2	172.2	0	0	0	0	0	112.8	G324 A325 A326 T331 A332	G324-G328 PolarHBondContact O-N 3Å; G324-G328 VanDerWaalsContact O-N 3.14Å; A325-G328 PolarHBondContact O-N 2.83Å; A326-G328 VanDerWaalsContact C-N 3.34Å; A326-G328 PolarHBondContact O-N 2.82Å; G328-T331 WeakPolarHBondContact O-CB 3.45Å; G328-T331 PolarHBondContact O-N 3.18Å; G328-A332 PolarHBondContact O-N 3.06Å
329	V	89	Confident	87.5	Confident	41 Å²	41	42 Å²	42	25%	0.248	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-43.8	173.6	167.1	0	0	0	0	111.7	A325 A326 T331 A332 L333 L580	A325-V329 VanDerWaalsContact O-CG2 3.31Å; A325-V329 WeakPolarHBondContact O-CG2 3.42Å; A325-V329 PolarHBondContact O-N 3.35Å; A326-V329 PolarHBondContact O-N 3.4Å; V329-T331 VanDerWaalsContact C-N 3.27Å; V329-T331 PolarHBondContact O-N 2.92Å; V329-A332 WeakPolarHBondContact O-CB 3.45Å; V329-A332 PolarHBondContact O-N 3.37Å; V329-A332 VanDerWaalsContact O-N 3.15Å; V329-L333 HydrophobicContact CG1-CD1 4.19Å; V329-L333 WeakPolarHBondContact O-CG 3.28Å; V329-L333 PolarHBondContact O-N 2.97Å; V329-L580 HydrophobicContact CG1-CD1 4.28Å; V329-L580 HydrophobicContact CG1-CD2 3.7Å; V329-L580 HydrophobicContact CG2-CD1 4.09Å
330	V	90.3	Very high	86.6	Confident	71 Å²	71	42 Å²	42	43%	0.43	23%	0.229	S	C	.	.	H	α-helix	trans	-58.9	-41.7	174.8	168.8	0	0	0	0	110.5	A326 T327 A332 L333 V334 M354	A326-V330 VanDerWaalsContact O-CG2 3.28Å; A326-V330 WeakPolarHBondContact O-CG2 3.42Å; A326-V330 PolarHBondContact O-N 3.3Å; T327-V330 PolarHBondContact O-N 3.02Å; V330-A332 VanDerWaalsContact C-N 3.34Å; V330-A332 PolarHBondContact O-N 2.87Å; V330-L333 PolarHBondContact O-N 3.5Å; V330-V334 HydrophobicContact CG1-CG2 4.35Å; V330-V334 VanDerWaalsContact O-CG2 3.31Å; V330-V334 WeakPolarHBondContact O-CG2 3.25Å; V330-V334 PolarHBondContact O-N 2.91Å; V330-M354 HydrophobicContact CG1-CE 4.06Å
331	T	88.1	Confident	85.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.4	-42	176.4	-48	0	0	0	0	111.4	T327 G328 V329 V334 T335 M354 Q380 T384	T327-T331 PolarHBondContact O-N 2.84Å; T327-T331 PolarHBondContact O-OG1 3.24Å; G328-T331 WeakPolarHBondContact O-CB 3.45Å; G328-T331 PolarHBondContact O-N 3.18Å; V329-T331 VanDerWaalsContact C-N 3.27Å; V329-T331 PolarHBondContact O-N 2.92Å; T331-V334 PolarHBondContact O-N 3.44Å; T331-T335 WeakPolarHBondContact O-CG2 3.3Å; T331-T335 PolarHBondContact O-N 2.83Å; T331-T335 PolarHBondContact O-OG1 2.91Å; T331-M354 HydrophobicContact CG2-CB 3.91Å; T331-M354 HydrophobicContact CG2-CG 4.27Å; T331-Q380 PolarHBondContact OG1-NE2 3.37Å; T331-T384 HydrophobicContact CG2-CG2 3.99Å
332	A	87.3	Confident	84.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-41.9	176	0	0	0	0	0	111.9	G328 V329 V330 T335 K336 T384 N387 L580	G328-A332 PolarHBondContact O-N 3.06Å; V329-A332 WeakPolarHBondContact O-CB 3.45Å; V329-A332 PolarHBondContact O-N 3.37Å; V329-A332 VanDerWaalsContact O-N 3.15Å; V330-A332 VanDerWaalsContact C-N 3.34Å; V330-A332 PolarHBondContact O-N 2.87Å; A332-T335 WeakPolarHBondContact CA-OG1 3.39Å; A332-T335 PolarHBondContact O-OG1 2.91Å; A332-K336 VanDerWaalsContact O-CB 3.29Å; A332-K336 WeakPolarHBondContact O-CB 3.18Å; A332-K336 PolarHBondContact O-N 3.3Å; A332-T384 PolarHBondContact N-OG1 3.25Å; A332-N387 PolarHBondContact O-ND2 3.24Å; A332-N387 VanDerWaalsContact O-ND2 3.13Å; A332-L580 HydrophobicContact CB-CB 4.48Å
333	L	84.4	Confident	84.6	Confident	50 Å²	50	48 Å²	48	26%	0.262	26%	0.259	S	S	.	.	H	α-helix	trans	-65.6	-45.3	177	-69	171.4	0	0	0	112.1	V329 V330 K336 F337 L580	V329-L333 HydrophobicContact CG1-CD1 4.19Å; V329-L333 WeakPolarHBondContact O-CG 3.28Å; V329-L333 PolarHBondContact O-N 2.97Å; V330-L333 PolarHBondContact O-N 3.5Å; L333-K336 PolarHBondContact O-N 2.69Å; L333-F337 HydrophobicContact CB-CD2 4.43Å; L333-F337 HydrophobicContact CB-CE2 4.44Å; L333-F337 HydrophobicContact CD2-CE2 4Å; L333-F337 WeakPolarHBondContact O-CD2 3.49Å; L333-F337 PolarHBondContact O-N 2.96Å; L333-L580 HydrophobicContact CD1-CD2 4.45Å; L333-L580 HydrophobicContact CD2-CD2 3.64Å; L333-L580 HydrophobicContact CG-CD2 3.85Å
334	V	86.8	Confident	84.3	Confident	48 Å²	48	48.3 Å²	48.3	29%	0.291	26%	0.262	S	S	.	.	H	α-helix	trans	-59.9	-49.9	177.5	170.8	0	0	0	0	110.2	V330 T331 K336 F337 T338 L350	V330-V334 HydrophobicContact CG1-CG2 4.35Å; V330-V334 VanDerWaalsContact O-CG2 3.31Å; V330-V334 WeakPolarHBondContact O-CG2 3.25Å; V330-V334 PolarHBondContact O-N 2.91Å; T331-V334 PolarHBondContact O-N 3.44Å; V334-K336 VanDerWaalsContact C-N 3.3Å; V334-K336 PolarHBondContact O-N 2.93Å; V334-F337 PolarHBondContact O-N 3.41Å; V334-T338 WeakPolarHBondContact O-CB 3.46Å; V334-T338 PolarHBondContact O-N 2.94Å; V334-T338 PolarHBondContact O-OG1 3.16Å; V334-L350 HydrophobicContact CG1-CD1 4.26Å; V334-L350 HydrophobicContact CG1-CD2 4Å
335	T	84.3	Confident	84	Confident	6 Å²	6	54.4 Å²	54.4	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-37.1	178.6	49.3	0	0	0	0	112.6	T331 A332 L350 T384 L388	T331-T335 WeakPolarHBondContact O-CG2 3.3Å; T331-T335 PolarHBondContact O-N 2.83Å; T331-T335 PolarHBondContact O-OG1 2.91Å; A332-T335 WeakPolarHBondContact CA-OG1 3.39Å; A332-T335 PolarHBondContact O-OG1 2.91Å; T335-L350 HydrophobicContact CG2-CD2 4.32Å; T335-T384 HydrophobicContact CG2-CG2 3.97Å; T335-L388 HydrophobicContact CG2-CD2 4.32Å
336	K	80.8	Confident	83.8	Confident	10 Å²	10	57.9 Å²	57.9	4%	0.043	31%	0.309	C	S	.	.	H	α-helix	trans	-64.7	-45.9	175.5	-168.1	-173.7	-172.3	-173.6	0	113.1	A332 L333 V334 P578 I579 T581 H582 L602	A332-K336 VanDerWaalsContact O-CB 3.29Å; A332-K336 WeakPolarHBondContact O-CB 3.18Å; A332-K336 PolarHBondContact O-N 3.3Å; L333-K336 PolarHBondContact O-N 2.69Å; V334-K336 VanDerWaalsContact C-N 3.3Å; V334-K336 PolarHBondContact O-N 2.93Å; K336-P578 PolarHBondContact NZ-O 2.87Å; K336-I579 WeakPolarHBondContact CD-O 3.34Å; K336-I579 VanDerWaalsContact NZ-C 3.32Å; K336-I579 PolarHBondContact NZ-O 3.33Å; K336-T581 VanDerWaalsContact CE-O 3.29Å; K336-T581 WeakPolarHBondContact CE-O 3.44Å; K336-T581 PolarHBondContact NZ-O 2.89Å; K336-H582 PolarHBondContact O-NE2 3.28Å; K336-L602 PolarHBondContact NZ-O 2.94Å
337	F	78.1	Confident	83.7	Confident	108 Å²	108	55.6 Å²	55.6	47%	0.474	29%	0.29	S	S	.	.	H	α-helix	trans	-84.3	-28.1	-172.7	-72.1	-61.9	0	0	0	114.2	L333 V334 K339 L602	L333-F337 HydrophobicContact CB-CD2 4.43Å; L333-F337 HydrophobicContact CB-CE2 4.44Å; L333-F337 HydrophobicContact CD2-CE2 4Å; L333-F337 WeakPolarHBondContact O-CD2 3.49Å; L333-F337 PolarHBondContact O-N 2.96Å; V334-F337 PolarHBondContact O-N 3.41Å; F337-K339 PolarHBondContact O-N 3.48Å; F337-L602 HydrophobicContact CZ-CD2 3.95Å
338	T	73.8	Confident	83.7	Confident	77 Å²	77	55.1 Å²	55.1	47%	0.472	29%	0.287	S	S	.	.	S	Bend	trans	-86.8	6.5	-167.3	-43.7	0	0	0	0	114.8	V334 L340	V334-T338 WeakPolarHBondContact O-CB 3.46Å; V334-T338 PolarHBondContact O-N 2.94Å; V334-T338 PolarHBondContact O-OG1 3.16Å; T338-L340 HydrophobicContact CG2-CD1 3.61Å; T338-L340 HydrophobicContact CG2-CG 3.74Å; T338-L340 PolarHBondContact O-N 3.49Å
339	K	71.5	Confident	83.7	Confident	161 Å²	161	57.2 Å²	57.2	70%	0.7	30%	0.304	S	S	*	.			trans	43.4	32.9	-176.2	-68.1	-169.6	179.7	179.7	0	113.4	F337 H341	F337-K339 PolarHBondContact O-N 3.48Å; K339-H341 PolarHBondContact O-N 3.32Å
340	L	72.6	Confident	83.8	Confident	15 Å²	15	57.2 Å²	57.2	8%	0.079	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-71.6	-17.7	-174.7	-87.1	158.5	0	0	0	113.3	T338 C342 F343 L346 L350	T338-L340 HydrophobicContact CG2-CD1 3.61Å; T338-L340 HydrophobicContact CG2-CG 3.74Å; T338-L340 PolarHBondContact O-N 3.49Å; L340-C342 PolarHBondContact O-N 3Å; L340-F343 CarbonylContact O-C 3.48Å; L340-F343 PolarHBondContact O-N 2.91Å; L340-L346 HydrophobicContact CD2-CB 4.28Å; L340-L346 HydrophobicContact CD2-CD2 3.38Å; L340-L346 HydrophobicContact CD2-CG 3.62Å; L340-L350 HydrophobicContact CD1-CD1 4.08Å
341	H	72.8	Confident	83.8	Confident	86 Å²	86	53.9 Å²	53.9	40%	0.398	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-53	-24	177.4	-179	-62.8	0	0	0	113.6	K339 F343 S389	K339-H341 PolarHBondContact O-N 3.32Å; H341-F343 PolarHBondContact O-N 3.42Å; H341-S389 WeakPolarHBondContact CD2-CA 3.38Å; H341-S389 WeakPolarHBondContact CD2-CB 3.29Å; H341-S389 PolarHBondContact CD2-N 2.99Å; H341-S389 VanDerWaalsContact CD2-N 3.34Å; H341-S389 VanDerWaalsContact CE1-CB 3.5Å; H341-S389 WeakPolarHBondContact CE1-CB 3.31Å; H341-S389 WeakPolarHBondContact NE2-CA 3.38Å; H341-S389 WeakPolarHBondContact NE2-CB 3.47Å
342	C	76.8	Confident	84	Confident	85 Å²	85	56.3 Å²	56.3	57%	0.574	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-68.2	-16.6	175.2	-61.1	0	0	0	0	113.5	L340	L340-C342 PolarHBondContact O-N 3Å
343	F	86.3	Confident	84.2	Confident	138 Å²	138	61.6 Å²	61.6	61%	0.605	32%	0.321	S	S	*	.			trans	-128.6	83.4	-179	-59	-74	0	0	0	110.5	L340 H341 L345 L346 E347	L340-F343 CarbonylContact O-C 3.48Å; L340-F343 PolarHBondContact O-N 2.91Å; H341-F343 PolarHBondContact O-N 3.42Å; F343-L345 PolarHBondContact O-N 2.83Å; F343-L346 HydrophobicContact CB-CB 4.09Å; F343-L346 PolarHBondContact O-N 3.27Å; F343-E347 PolarHBondContact O-N 3.35Å
344	P	86.7	Confident	84.5	Confident	28 Å²	28	61.5 Å²	61.5	18%	0.182	32%	0.319	C	S	.	.	H	α-helix	trans	-55.6	-32.5	-174	-28.2	34.9	0	0	0	114.2	T348 R395	P344-T348 WeakPolarHBondContact O-CG2 3.44Å; P344-T348 PolarHBondContact O-N 3.32Å; P344-T348 PolarHBondContact O-OG1 2.86Å; P344-T348 VanDerWaalsContact O-OG1 3.07Å; P344-R395 VanDerWaalsContact C-NH1 3.29Å; P344-R395 PolarHBondContact O-NH1 2.89Å
345	L	88.5	Confident	84.8	Confident	128 Å²	128	59.3 Å²	59.3	67%	0.67	31%	0.306	S	S	*	.	H	α-helix	trans	-66.4	-47.3	177.7	-175.5	65.8	0	0	0	112.4	F343 E347 T348 A349 R395	F343-L345 PolarHBondContact O-N 2.83Å; L345-E347 VanDerWaalsContact C-N 3.3Å; L345-E347 PolarHBondContact O-N 3.47Å; L345-T348 PolarHBondContact O-N 3.01Å; L345-T348 PolarHBondContact O-OG1 3.49Å; L345-A349 WeakPolarHBondContact O-CB 3.47Å; L345-A349 PolarHBondContact O-N 3.31Å; L345-R395 VanDerWaalsContact N-NH1 3.11Å
346	L	88.1	Confident	85.1	Confident	97 Å²	97	61.8 Å²	61.8	51%	0.508	32%	0.315	S	S	.	.	H	α-helix	trans	-66.3	-39	179.7	-174.9	60.7	0	0	0	110.8	L340 F343 A349 L350	L340-L346 HydrophobicContact CD2-CB 4.28Å; L340-L346 HydrophobicContact CD2-CD2 3.38Å; L340-L346 HydrophobicContact CD2-CG 3.62Å; F343-L346 HydrophobicContact CB-CB 4.09Å; F343-L346 PolarHBondContact O-N 3.27Å; L346-A349 PolarHBondContact O-N 3Å; L346-L350 WeakPolarHBondContact O-CB 3.18Å; L346-L350 PolarHBondContact O-N 3.44Å
347	E	89.8	Confident	85.6	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-59.4	-49.7	174.4	-176.4	176.9	-131.9	0	0	111.7	F343 L345 A349 L350 F351 L388 S389 S392	F343-E347 PolarHBondContact O-N 3.35Å; L345-E347 VanDerWaalsContact C-N 3.3Å; L345-E347 PolarHBondContact O-N 3.47Å; E347-A349 PolarHBondContact O-N 3.01Å; E347-L350 PolarHBondContact O-N 2.99Å; E347-F351 WeakPolarHBondContact O-CB 3.32Å; E347-F351 PolarHBondContact O-N 3.47Å; E347-L388 VanDerWaalsContact CD-CD2 3.42Å; E347-L388 HydrophobicContact CG-CD2 3.32Å; E347-L388 WeakPolarHBondContact OE1-CA 3.36Å; E347-L388 WeakPolarHBondContact OE1-CD2 3.26Å; E347-S389 PolarHBondContact OE1-N 2.64Å; E347-S389 PolarHBondContact OE2-N 3.49Å; E347-S389 PolarHBondContact OE2-OG 3.41Å; E347-S392 WeakPolarHBondContact CG-OG 3.41Å; E347-S392 WeakPolarHBondContact OE2-CB 3.36Å; E347-S392 PolarHBondContact OE2-OG 3.47Å
348	T	90.6	Very high	86.4	Confident	8 Å²	8	58.4 Å²	58.4	5%	0.049	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-38.7	175.8	49.7	0	0	0	0	113.6	P344 L345 F351 F352 S392 R395 T396	P344-T348 WeakPolarHBondContact O-CG2 3.44Å; P344-T348 PolarHBondContact O-N 3.32Å; P344-T348 PolarHBondContact O-OG1 2.86Å; P344-T348 VanDerWaalsContact O-OG1 3.07Å; L345-T348 PolarHBondContact O-N 3.01Å; L345-T348 PolarHBondContact O-OG1 3.49Å; T348-F351 PolarHBondContact O-N 3.35Å; T348-F352 WeakPolarHBondContact O-CB 3.27Å; T348-F352 PolarHBondContact O-N 3.44Å; T348-S392 WeakPolarHBondContact CG2-O 3.3Å; T348-S392 WeakPolarHBondContact CG2-OG 3.43Å; T348-R395 HydrophobicContact CG2-CB 3.94Å; T348-R395 HydrophobicContact CG2-CG 4.06Å; T348-T396 WeakPolarHBondContact CG2-OG1 3.33Å
349	A	90.9	Very high	87.3	Confident	43 Å²	43	54.9 Å²	54.9	36%	0.355	28%	0.284	S	S	.	.	H	α-helix	trans	-67.5	-43.2	179.6	0	0	0	0	0	111.4	L345 L346 E347 F352 L353	L345-A349 WeakPolarHBondContact O-CB 3.47Å; L345-A349 PolarHBondContact O-N 3.31Å; L346-A349 PolarHBondContact O-N 3Å; E347-A349 PolarHBondContact O-N 3.01Å; A349-F352 PolarHBondContact O-N 3.25Å; A349-L353 WeakPolarHBondContact O-CB 3.5Å; A349-L353 VanDerWaalsContact O-CG 3.31Å; A349-L353 WeakPolarHBondContact O-CG 3.3Å; A349-L353 PolarHBondContact O-N 2.83Å
350	L	90.4	Very high	88.2	Confident	42 Å²	42	51.3 Å²	51.3	22%	0.22	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-42.2	176.1	-175.9	137.2	0	0	0	111.2	V334 T335 L340 L346 E347 L353 M354	V334-L350 HydrophobicContact CG1-CD1 4.26Å; V334-L350 HydrophobicContact CG1-CD2 4Å; T335-L350 HydrophobicContact CG2-CD2 4.32Å; L340-L350 HydrophobicContact CD1-CD1 4.08Å; L346-L350 WeakPolarHBondContact O-CB 3.18Å; L346-L350 PolarHBondContact O-N 3.44Å; E347-L350 PolarHBondContact O-N 2.99Å; L350-L353 PolarHBondContact O-N 2.87Å; L350-M354 HydrophobicContact CD2-CG 4.15Å; L350-M354 HydrophobicContact CG-CG 4.31Å; L350-M354 WeakPolarHBondContact O-CB 3.4Å; L350-M354 WeakPolarHBondContact O-CG 3.17Å; L350-M354 PolarHBondContact O-N 3.33Å
351	F	91.6	Very high	89.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-55.7	-53.7	174.1	-174.8	-81.3	0	0	0	110.9	F179 Y183 E347 T348 L353 M354 S355 Q380 T384 L388 T396 F400	F179-F351 AromaticContact CE1-CE1 3.74Å; F179-F351 HydrophobicContact CE1-CE1 3.74Å; F179-F351 HydrophobicContact CE1-CZ 4.26Å; F179-F351 AromaticContact CZ-CE1 3.49Å; F179-F351 HydrophobicContact CZ-CE1 3.49Å; F179-F351 VanDerWaalsContact CZ-CE1 3.49Å; F179-F351 AromaticContact CZ-CZ 3.72Å; F179-F351 HydrophobicContact CZ-CZ 3.72Å; Y183-F351 HydrophobicContact CD2-CZ 4.03Å; Y183-F351 HydrophobicContact CE2-CE1 4.38Å; Y183-F351 HydrophobicContact CE2-CE2 4.32Å; Y183-F351 AromaticContact CE2-CZ 3.57Å; Y183-F351 HydrophobicContact CE2-CZ 3.57Å; E347-F351 WeakPolarHBondContact O-CB 3.32Å; E347-F351 PolarHBondContact O-N 3.47Å; T348-F351 PolarHBondContact O-N 3.35Å; F351-L353 PolarHBondContact O-N 3.29Å; F351-M354 PolarHBondContact O-N 2.95Å; F351-S355 PolarHBondContact O-N 2.86Å; F351-S355 PolarHBondContact O-OG 3.15Å; F351-Q380 HydrophobicContact CE2-CB 3.96Å; F351-Q380 HydrophobicContact CE2-CG 4.4Å; F351-Q380 HydrophobicContact CZ-CB 3.92Å; F351-T384 HydrophobicContact CD2-CG2 3.66Å; F351-T384 HydrophobicContact CE2-CG2 3.66Å; F351-L388 HydrophobicContact CD2-CD1 3.85Å; F351-L388 HydrophobicContact CD2-CD2 4.44Å; F351-L388 HydrophobicContact CE2-CD1 4.01Å; F351-T396 HydrophobicContact CD1-CG2 3.37Å; F351-T396 HydrophobicContact CE1-CG2 3.3Å; F351-T396 HydrophobicContact CG-CG2 4.13Å; F351-T396 HydrophobicContact CZ-CG2 3.99Å; F351-F400 AromaticContact CD1-CE2 3.89Å; F351-F400 HydrophobicContact CD1-CE2 3.89Å; F351-F400 HydrophobicContact CE1-CD2 4.46Å; F351-F400 AromaticContact CE1-CE2 3.71Å; F351-F400 HydrophobicContact CE1-CE2 3.71Å; F351-F400 HydrophobicContact CE1-CZ 4.47Å
352	F	92.4	Very high	90.1	Very high	51 Å²	51	50.4 Å²	50.4	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-57.1	-47.4	179.1	176.2	-97.6	0	0	0	112.8	T348 A349 M354 S355 W356 L399 F400 L403	T348-F352 WeakPolarHBondContact O-CB 3.27Å; T348-F352 PolarHBondContact O-N 3.44Å; A349-F352 PolarHBondContact O-N 3.25Å; F352-M354 PolarHBondContact O-N 3.34Å; F352-S355 PolarHBondContact O-N 2.64Å; F352-W356 HydrophobicContact CE1-CE3 4.47Å; F352-W356 HydrophobicContact CE2-CE3 4.22Å; F352-W356 AromaticContact CZ-CE3 3.74Å; F352-W356 HydrophobicContact CZ-CE3 3.74Å; F352-W356 HydrophobicContact CZ-CZ3 4.13Å; F352-W356 PolarHBondContact O-N 2.79Å; F352-L399 HydrophobicContact CB-CD2 4.37Å; F352-L399 HydrophobicContact CD2-CD2 4.06Å; F352-L399 HydrophobicContact CG-CD2 4.36Å; F352-F400 AromaticContact CD2-CE1 3.93Å; F352-F400 HydrophobicContact CD2-CE1 3.93Å; F352-F400 HydrophobicContact CD2-CE2 4.28Å; F352-F400 AromaticContact CD2-CZ 3.63Å; F352-F400 HydrophobicContact CD2-CZ 3.63Å; F352-F400 HydrophobicContact CE2-CE1 4.15Å; F352-F400 HydrophobicContact CE2-CZ 4.3Å; F352-L403 HydrophobicContact CD2-CD1 4.31Å; F352-L403 HydrophobicContact CE2-CD1 3.53Å; F352-L403 HydrophobicContact CZ-CD1 4.28Å
353	L	91.8	Very high	90.7	Very high	112 Å²	112	50.5 Å²	50.5	59%	0.586	26%	0.262	S	S	*	.	H	α-helix	trans	-64.2	-38.3	-179.8	-72.5	171.1	0	0	0	112.4	A349 L350 F351 W356 S357	A349-L353 WeakPolarHBondContact O-CB 3.5Å; A349-L353 VanDerWaalsContact O-CG 3.31Å; A349-L353 WeakPolarHBondContact O-CG 3.3Å; A349-L353 PolarHBondContact O-N 2.83Å; L350-L353 PolarHBondContact O-N 2.87Å; F351-L353 PolarHBondContact O-N 3.29Å; L353-W356 PolarHBondContact O-N 3.37Å; L353-S357 VanDerWaalsContact O-CB 3.28Å; L353-S357 WeakPolarHBondContact O-CB 3.31Å; L353-S357 PolarHBondContact O-N 2.99Å; L353-S357 PolarHBondContact O-OG 3.31Å
354	M	90.8	Very high	90.9	Very high	47 Å²	47	48 Å²	48	23%	0.232	27%	0.267	C	S	.	.	H	α-helix	trans	-71.1	-36.3	178.3	-70	-63.5	-68.5	0	0	112.4	V330 T331 L350 F351 F352 S357 T358	V330-M354 HydrophobicContact CG1-CE 4.06Å; T331-M354 HydrophobicContact CG2-CB 3.91Å; T331-M354 HydrophobicContact CG2-CG 4.27Å; L350-M354 HydrophobicContact CD2-CG 4.15Å; L350-M354 HydrophobicContact CG-CG 4.31Å; L350-M354 WeakPolarHBondContact O-CB 3.4Å; L350-M354 WeakPolarHBondContact O-CG 3.17Å; L350-M354 PolarHBondContact O-N 3.33Å; F351-M354 PolarHBondContact O-N 2.95Å; F352-M354 PolarHBondContact O-N 3.34Å; M354-S357 WeakPolarHBondContact CA-OG 3.48Å; M354-S357 PolarHBondContact O-OG 3.49Å; M354-T358 PolarHBondContact O-N 3.5Å; M354-T358 PolarHBondContact O-OG1 3.1Å
355	S	91.8	Very high	91	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.014	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-45.6	172.3	-50.6	0	0	0	0	111.1	F179 F351 F352 T358 Q380	F179-S355 VanDerWaalsContact CE2-CB 3.41Å; F179-S355 VanDerWaalsContact CE2-OG 3.25Å; F179-S355 WeakPolarHBondContact CE2-OG 3.38Å; F179-S355 VanDerWaalsContact CZ-OG 3.29Å; F179-S355 WeakPolarHBondContact CZ-OG 3.28Å; F351-S355 PolarHBondContact O-N 2.86Å; F351-S355 PolarHBondContact O-OG 3.15Å; F352-S355 PolarHBondContact O-N 2.64Å; S355-T358 WeakPolarHBondContact O-CB 3.39Å; S355-T358 PolarHBondContact O-N 3.21Å; S355-Q380 PolarHBondContact OG-NE2 3.06Å; S355-Q380 PolarHBondContact OG-OE1 3.22Å
356	W	90.9	Very high	90.9	Very high	59 Å²	59	46.7 Å²	46.7	22%	0.223	28%	0.277	C	S	.	.	H	α-helix	trans	-68	-40.6	179	-165.2	-74.6	0	0	0	112.8	N171 I172 P176 F352 L353 T358 F359 L360	N171-W356 WeakPolarHBondContact O-CZ2 3.27Å; I172-W356 HydrophobicContact CB-CH2 4.46Å; I172-W356 HydrophobicContact CG2-CH2 4.2Å; I172-W356 WeakPolarHBondContact O-CH2 3.24Å; P176-W356 HydrophobicContact CG-CE3 4.28Å; P176-W356 HydrophobicContact CG-CH2 4.23Å; P176-W356 HydrophobicContact CG-CZ3 3.49Å; P176-W356 VanDerWaalsContact CG-CZ3 3.49Å; F352-W356 HydrophobicContact CE1-CE3 4.47Å; F352-W356 HydrophobicContact CE2-CE3 4.22Å; F352-W356 AromaticContact CZ-CE3 3.74Å; F352-W356 HydrophobicContact CZ-CE3 3.74Å; F352-W356 HydrophobicContact CZ-CZ3 4.13Å; F352-W356 PolarHBondContact O-N 2.79Å; L353-W356 PolarHBondContact O-N 3.37Å; W356-T358 PolarHBondContact O-N 3.49Å; W356-F359 WeakPolarHBondContact O-CB 3.19Å; W356-F359 PolarHBondContact O-N 3.38Å; W356-F359 VanDerWaalsContact O-N 3.12Å; W356-L360 PolarHBondContact O-N 3.47Å
357	S	91.7	Very high	91	Very high	47 Å²	47	45.3 Å²	45.3	33%	0.329	27%	0.267	S	S	.	.	H	α-helix	trans	-62.6	-28.7	179.7	70.5	0	0	0	0	112.3	L353 M354 F359 L360 L361	L353-S357 VanDerWaalsContact O-CB 3.28Å; L353-S357 WeakPolarHBondContact O-CB 3.31Å; L353-S357 PolarHBondContact O-N 2.99Å; L353-S357 PolarHBondContact O-OG 3.31Å; M354-S357 WeakPolarHBondContact CA-OG 3.48Å; M354-S357 PolarHBondContact O-OG 3.49Å; S357-F359 VanDerWaalsContact C-N 3.3Å; S357-F359 PolarHBondContact O-N 3.28Å; S357-L360 PolarHBondContact O-N 3.33Å; S357-L361 WeakPolarHBondContact O-CB 3.27Å; S357-L361 PolarHBondContact O-N 2.97Å
358	T	93.9	Very high	91	Very high	0 Å²	0	46 Å²	46	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.4	-41.2	175.1	-59.5	0	0	0	0	111.9	T327 M354 S355 W356 A362 A372 C376	T327-T358 VanDerWaalsContact CB-OG1 3.27Å; T327-T358 WeakPolarHBondContact CB-OG1 3.41Å; T327-T358 HydrophobicContact CG2-CG2 4.26Å; T327-T358 WeakPolarHBondContact OG1-CG2 3.5Å; T327-T358 PolarHBondContact OG1-OG1 3.4Å; M354-T358 PolarHBondContact O-N 3.5Å; M354-T358 PolarHBondContact O-OG1 3.1Å; S355-T358 WeakPolarHBondContact O-CB 3.39Å; S355-T358 PolarHBondContact O-N 3.21Å; W356-T358 PolarHBondContact O-N 3.49Å; T358-A362 WeakPolarHBondContact O-CB 3.31Å; T358-A362 PolarHBondContact O-N 3.25Å; T358-A362 VanDerWaalsContact O-N 3.13Å; T358-A372 HydrophobicContact CG2-CB 3.95Å; T358-C376 HydrophobicContact CG2-CB 3.8Å; T358-C376 PolarHBondContact OG1-SG 3.45Å; T358-C376 VanDerWaalsContact OG1-SG 3.35Å
359	F	92.9	Very high	91	Very high	3 Å²	3	45.6 Å²	45.6	1%	0.013	27%	0.269	C	S	.	.	H	α-helix	trans	-60.9	-53.8	176.9	-175.1	-97	0	0	0	111.1	F170 N171 P175 W356 S357 L361 A362 E363 V370 V373	F170-F359 WeakPolarHBondContact O-CZ 3.23Å; N171-F359 WeakPolarHBondContact OD1-CE1 3.24Å; P175-F359 HydrophobicContact CB-CB 4.25Å; P175-F359 HydrophobicContact CB-CD2 4.15Å; P175-F359 HydrophobicContact CB-CG 4.11Å; P175-F359 HydrophobicContact CG-CB 4.27Å; P175-F359 HydrophobicContact CG-CD1 3.87Å; P175-F359 HydrophobicContact CG-CD2 3.74Å; P175-F359 HydrophobicContact CG-CE1 4.18Å; P175-F359 HydrophobicContact CG-CE2 4.03Å; P175-F359 HydrophobicContact CG-CG 3.66Å; P175-F359 HydrophobicContact CG-CZ 4.25Å; W356-F359 WeakPolarHBondContact O-CB 3.19Å; W356-F359 PolarHBondContact O-N 3.38Å; W356-F359 VanDerWaalsContact O-N 3.12Å; S357-F359 VanDerWaalsContact C-N 3.3Å; S357-F359 PolarHBondContact O-N 3.28Å; F359-L361 VanDerWaalsContact C-N 3.35Å; F359-L361 PolarHBondContact O-N 3.32Å; F359-A362 WeakPolarHBondContact O-CB 3.23Å; F359-A362 PolarHBondContact O-N 2.82Å; F359-E363 HydrophobicContact CD1-CG 4.45Å; F359-E363 HydrophobicContact CE1-CG 3.92Å; F359-E363 HydrophobicContact CZ-CG 4.04Å; F359-E363 PolarHBondContact O-N 3.3Å; F359-E363 VanDerWaalsContact O-N 3.14Å; F359-V370 HydrophobicContact CE2-CG2 4.27Å; F359-V373 HydrophobicContact CB-CG2 3.39Å; F359-V373 HydrophobicContact CD2-CG2 3.73Å; F359-V373 HydrophobicContact CG-CG2 4.03Å
360	L	91.3	Very high	90.9	Very high	85 Å²	85	43.9 Å²	43.9	45%	0.445	25%	0.254	S	S	.	.	H	α-helix	trans	-66.4	-38	-175.5	-64	176.1	0	0	0	111.8	W356 S357 A362 A364	W356-L360 PolarHBondContact O-N 3.47Å; S357-L360 PolarHBondContact O-N 3.33Å; L360-A362 VanDerWaalsContact C-N 3.29Å; L360-A362 PolarHBondContact O-N 2.91Å; L360-A364 VanDerWaalsContact O-CB 3.28Å; L360-A364 WeakPolarHBondContact O-CB 3.18Å; L360-A364 PolarHBondContact O-N 2.95Å
361	L	91.9	Very high	90.9	Very high	83 Å²	83	42 Å²	42	44%	0.435	24%	0.244	S	C	.	.	H	α-helix	trans	-61.7	-41.1	175.6	-178.4	63.6	0	0	0	110.9	M323 T327 S357 F359 A364 C365	M323-L361 HydrophobicContact SD-CG 4.25Å; T327-L361 HydrophobicContact CG2-CD2 3.97Å; S357-L361 WeakPolarHBondContact O-CB 3.27Å; S357-L361 PolarHBondContact O-N 2.97Å; F359-L361 VanDerWaalsContact C-N 3.35Å; F359-L361 PolarHBondContact O-N 3.32Å; L361-A364 PolarHBondContact O-N 2.97Å; L361-C365 PolarHBondContact O-N 3.38Å; L361-C365 PolarHBondContact O-SG 2.91Å; L361-C365 VanDerWaalsContact O-SG 3.33Å
362	A	93	Very high	91	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-46.9	-179.4	0	0	0	0	0	112.9	M323 T358 F359 L360 A364 C365 G366 F367 A372	M323-A362 HydrophobicContact CE-CB 3.21Å; M323-A362 HydrophobicContact SD-CB 4.05Å; T358-A362 WeakPolarHBondContact O-CB 3.31Å; T358-A362 PolarHBondContact O-N 3.25Å; T358-A362 VanDerWaalsContact O-N 3.13Å; F359-A362 WeakPolarHBondContact O-CB 3.23Å; F359-A362 PolarHBondContact O-N 2.82Å; L360-A362 VanDerWaalsContact C-N 3.29Å; L360-A362 PolarHBondContact O-N 2.91Å; A362-A364 VanDerWaalsContact C-N 3.31Å; A362-A364 PolarHBondContact O-N 3.41Å; A362-C365 PolarHBondContact O-N 3.09Å; A362-C365 VanDerWaalsContact O-N 3.16Å; A362-G366 PolarHBondContact O-N 3.01Å; A362-F367 CarbonylContact C-O 3.56Å; A362-F367 HydrophobicContact CB-CB 4.46Å; A362-F367 CarbonylContact O-C 3.51Å; A362-F367 PolarHBondContact O-N 3.44Å; A362-F367 VanDerWaalsContact O-O 3.12Å; A362-A372 HydrophobicContact CB-CB 3.65Å
363	E	89.1	Confident	91.1	Very high	86 Å²	86	39.6 Å²	39.6	40%	0.402	23%	0.233	S	C	.	.	H	α-helix	trans	-61.6	-40.3	174.9	-68.5	-63.1	147.9	0	0	111.2	F359 C365 G366 G369	F359-E363 HydrophobicContact CD1-CG 4.45Å; F359-E363 HydrophobicContact CE1-CG 3.92Å; F359-E363 HydrophobicContact CZ-CG 4.04Å; F359-E363 PolarHBondContact O-N 3.3Å; F359-E363 VanDerWaalsContact O-N 3.14Å; E363-C365 VanDerWaalsContact C-N 3.26Å; E363-C365 PolarHBondContact O-N 3.48Å; E363-G366 PolarHBondContact O-N 3.24Å; E363-G369 PolarHBondContact OE1-N 3.01Å
364	A	90.3	Very high	91	Very high	86 Å²	86	34.4 Å²	34.4	71%	0.711	21%	0.206	S	C	*	.	H	α-helix	trans	-63.1	-31	175.8	0	0	0	0	0	113.2	L360 L361 A362 G366	L360-A364 VanDerWaalsContact O-CB 3.28Å; L360-A364 WeakPolarHBondContact O-CB 3.18Å; L360-A364 PolarHBondContact O-N 2.95Å; L361-A364 PolarHBondContact O-N 2.97Å; A362-A364 VanDerWaalsContact C-N 3.31Å; A362-A364 PolarHBondContact O-N 3.41Å; A364-G366 VanDerWaalsContact C-N 3.32Å
365	C	90.1	Very high	90.9	Very high	73 Å²	73	33.6 Å²	33.6	49%	0.493	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-1.4	175	-69.2	0	0	0	0	114	M323 L361 A362 E363 F367	M323-C365 HydrophobicContact SD-CB 4.44Å; L361-C365 PolarHBondContact O-N 3.38Å; L361-C365 PolarHBondContact O-SG 2.91Å; L361-C365 VanDerWaalsContact O-SG 3.33Å; A362-C365 PolarHBondContact O-N 3.09Å; A362-C365 VanDerWaalsContact O-N 3.16Å; E363-C365 VanDerWaalsContact C-N 3.26Å; E363-C365 PolarHBondContact O-N 3.48Å; C365-F367 VanDerWaalsContact C-N 3.28Å; C365-F367 HydrophobicContact CB-CD2 3.68Å; C365-F367 HydrophobicContact CB-CE2 4.14Å
366	G	86.1	Confident	91	Very high	55 Å²	55	33.5 Å²	33.5	57%	0.567	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.3	17.8	-175.5	0	0	0	0	0	114.1	A362 E363 A364	A362-G366 PolarHBondContact O-N 3.01Å; E363-G366 PolarHBondContact O-N 3.24Å; A364-G366 VanDerWaalsContact C-N 3.32Å
367	F	90.3	Very high	91.1	Very high	68 Å²	68	30.7 Å²	30.7	30%	0.298	19%	0.19	S	C	.	.	S	Bend	trans	-97.2	171.1	171	-67.6	-46.9	0	0	0	110	M323 A362 C365	M323-F367 HydrophobicContact CE-CB 3.54Å; M323-F367 HydrophobicContact CE-CD2 3.34Å; M323-F367 HydrophobicContact CE-CE2 4.35Å; M323-F367 HydrophobicContact CE-CG 3.82Å; M323-F367 HydrophobicContact SD-CD2 3.96Å; A362-F367 CarbonylContact C-O 3.56Å; A362-F367 HydrophobicContact CB-CB 4.46Å; A362-F367 CarbonylContact O-C 3.51Å; A362-F367 PolarHBondContact O-N 3.44Å; A362-F367 VanDerWaalsContact O-O 3.12Å; C365-F367 VanDerWaalsContact C-N 3.28Å; C365-F367 HydrophobicContact CB-CD2 3.68Å; C365-F367 HydrophobicContact CB-CE2 4.14Å
368	T	89.8	Confident	90.9	Very high	16 Å²	16	29.8 Å²	29.8	10%	0.098	18%	0.181	C	C	.	.			trans	-86.1	116	178.8	49.9	0	0	0	0	111.8	V283 I316 S320 V370 V371 A372	V283-T368 HydrophobicContact CG2-CG2 3.64Å; I316-T368 HydrophobicContact CG2-CG2 3.74Å; S320-T368 PolarHBondContact OG-N 3.27Å; S320-T368 PolarHBondContact OG-O 3.14Å; S320-T368 PolarHBondContact OG-OG1 3.35Å; T368-V370 PolarHBondContact O-N 3.36Å; T368-V371 PolarHBondContact O-N 3.32Å; T368-V371 VanDerWaalsContact OG1-CG2 3.31Å; T368-V371 WeakPolarHBondContact OG1-CG2 3.4Å; T368-A372 PolarHBondContact O-N 3.25Å
369	G	89.9	Confident	90.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.4	-32.5	178.8	0	0	0	0	0	113.7	E363 A372 V373	E363-G369 PolarHBondContact OE1-N 3.01Å; G369-A372 PolarHBondContact O-N 3.44Å; G369-V373 WeakPolarHBondContact O-CB 3.45Å; G369-V373 VanDerWaalsContact O-CG2 3.29Å; G369-V373 WeakPolarHBondContact O-CG2 3.45Å; G369-V373 PolarHBondContact O-N 2.83Å
370	V	89.2	Confident	90.6	Very high	7 Å²	7	30.6 Å²	30.6	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-60	-50.6	179.3	-177.8	0	0	0	0	112.1	L174 I178 A279 I282 F359 T368 L374	L174-V370 HydrophobicContact CD2-CG2 3.43Å; L174-V370 VanDerWaalsContact CD2-CG2 3.43Å; L174-V370 HydrophobicContact CG-CG2 4.33Å; I178-V370 HydrophobicContact CD1-CG1 4.31Å; I178-V370 HydrophobicContact CG1-CG1 4.17Å; I178-V370 HydrophobicContact CG2-CG1 4.4Å; A279-V370 HydrophobicContact CB-CG1 4.23Å; I282-V370 HydrophobicContact CD1-CB 4.23Å; I282-V370 HydrophobicContact CD1-CG1 4.18Å; I282-V370 HydrophobicContact CD1-CG2 3.73Å; F359-V370 HydrophobicContact CE2-CG2 4.27Å; T368-V370 PolarHBondContact O-N 3.36Å; V370-L374 PolarHBondContact O-N 3.25Å
371	V	90	Very high	90.5	Very high	1 Å²	1	27 Å²	27	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-64.6	-44	178.5	177.7	0	0	0	0	109.9	A279 V283 F317 T368 V373 L374 F375	A279-V371 HydrophobicContact CB-CG2 3.48Å; A279-V371 VanDerWaalsContact CB-CG2 3.48Å; V283-V371 HydrophobicContact CG2-CG2 4.39Å; F317-V371 HydrophobicContact CD2-CG1 4.43Å; F317-V371 HydrophobicContact CD2-CG2 4.1Å; F317-V371 HydrophobicContact CE2-CG1 4.09Å; F317-V371 HydrophobicContact CE2-CG2 3.99Å; F317-V371 HydrophobicContact CZ-CG1 4.18Å; T368-V371 PolarHBondContact O-N 3.32Å; T368-V371 VanDerWaalsContact OG1-CG2 3.31Å; T368-V371 WeakPolarHBondContact OG1-CG2 3.4Å; V371-V373 PolarHBondContact O-N 2.93Å; V371-L374 PolarHBondContact O-N 3.17Å; V371-F375 HydrophobicContact CG1-CD2 3.74Å; V371-F375 HydrophobicContact CG1-CE2 3.72Å; V371-F375 VanDerWaalsContact O-CD2 3.24Å; V371-F375 WeakPolarHBondContact O-CD2 3.24Å; V371-F375 PolarHBondContact O-N 3.15Å
372	A	93.7	Very high	90.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.2	-44.2	-178.5	0	0	0	0	0	112.4	S320 M323 G324 T358 A362 T368 G369 C376	S320-A372 WeakPolarHBondContact O-CA 3.15Å; M323-A372 HydrophobicContact CE-CB 4.22Å; G324-A372 WeakPolarHBondContact CA-O 3.43Å; T358-A372 HydrophobicContact CG2-CB 3.95Å; A362-A372 HydrophobicContact CB-CB 3.65Å; T368-A372 PolarHBondContact O-N 3.25Å; G369-A372 PolarHBondContact O-N 3.44Å; A372-C376 VanDerWaalsContact O-CB 3.23Å; A372-C376 WeakPolarHBondContact O-CB 3.27Å; A372-C376 PolarHBondContact O-N 2.99Å
373	V	93.8	Very high	89.7	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-40.9	177.4	170.9	0	0	0	0	112	I178 F179 F359 G369 V371 C376 G377	I178-V373 HydrophobicContact CB-CG1 4.48Å; I178-V373 HydrophobicContact CG2-CG1 4.41Å; F179-V373 HydrophobicContact CB-CG1 3.7Å; F179-V373 HydrophobicContact CD2-CG1 4.1Å; F179-V373 HydrophobicContact CG-CG1 4.43Å; F359-V373 HydrophobicContact CB-CG2 3.39Å; F359-V373 HydrophobicContact CD2-CG2 3.73Å; F359-V373 HydrophobicContact CG-CG2 4.03Å; G369-V373 WeakPolarHBondContact O-CB 3.45Å; G369-V373 VanDerWaalsContact O-CG2 3.29Å; G369-V373 WeakPolarHBondContact O-CG2 3.45Å; G369-V373 PolarHBondContact O-N 2.83Å; V371-V373 PolarHBondContact O-N 2.93Å; V373-C376 PolarHBondContact O-N 3.46Å; V373-G377 PolarHBondContact O-N 3.32Å
374	L	90	Very high	89.5	Confident	3 Å²	3	20.5 Å²	20.5	2%	0.016	14%	0.136	C	C	.	.	H	α-helix	trans	-58.5	-52.1	178.5	178.4	62	0	0	0	111.3	I178 V275 M276 V370 V371 C376 G377 I378	I178-L374 HydrophobicContact CG2-CB 3.76Å; I178-L374 HydrophobicContact CG2-CD1 4.26Å; V275-L374 HydrophobicContact CG1-CD1 3.37Å; V275-L374 HydrophobicContact CG1-CD2 3.79Å; V275-L374 HydrophobicContact CG1-CG 4.2Å; M276-L374 HydrophobicContact SD-CD2 3.61Å; V370-L374 PolarHBondContact O-N 3.25Å; V371-L374 PolarHBondContact O-N 3.17Å; L374-C376 VanDerWaalsContact C-N 3.33Å; L374-C376 PolarHBondContact O-N 3.37Å; L374-G377 PolarHBondContact O-N 3.33Å; L374-I378 HydrophobicContact CD1-CD1 4.31Å; L374-I378 HydrophobicContact CG-CD1 4.16Å; L374-I378 WeakPolarHBondContact O-CG1 3.3Å; L374-I378 PolarHBondContact O-N 2.97Å
375	F	90.2	Very high	89.2	Confident	30 Å²	30	17.6 Å²	17.6	13%	0.132	11%	0.111	C	C	.	.	H	α-helix	trans	-70.3	-30.6	-179.8	-73.4	-70.6	0	0	0	112.6	M276 F317 F321 V371 I378 T379	M276-F375 HydrophobicContact CE-CZ 4.03Å; M276-F375 HydrophobicContact SD-CZ 4.17Å; F317-F375 HydrophobicContact CZ-CE2 4.3Å; F321-F375 HydrophobicContact CB-CD2 4.22Å; F321-F375 HydrophobicContact CB-CE2 4.33Å; F321-F375 HydrophobicContact CD2-CB 4.35Å; F321-F375 AromaticContact CD2-CD1 3.45Å; F321-F375 HydrophobicContact CD2-CD1 3.45Å; F321-F375 VanDerWaalsContact CD2-CD1 3.45Å; F321-F375 AromaticContact CD2-CD2 3.58Å; F321-F375 HydrophobicContact CD2-CD2 3.58Å; F321-F375 AromaticContact CD2-CE1 3.47Å; F321-F375 HydrophobicContact CD2-CE1 3.47Å; F321-F375 VanDerWaalsContact CD2-CE1 3.47Å; F321-F375 AromaticContact CD2-CE2 3.61Å; F321-F375 HydrophobicContact CD2-CE2 3.61Å; F321-F375 AromaticContact CD2-CG 3.51Å; F321-F375 HydrophobicContact CD2-CG 3.51Å; F321-F375 AromaticContact CD2-CZ 3.54Å; F321-F375 HydrophobicContact CD2-CZ 3.54Å; F321-F375 AromaticContact CE2-CD1 3.48Å; F321-F375 HydrophobicContact CE2-CD1 3.48Å; F321-F375 VanDerWaalsContact CE2-CD1 3.48Å; F321-F375 HydrophobicContact CE2-CD2 4.45Å; F321-F375 AromaticContact CE2-CE1 3.49Å; F321-F375 HydrophobicContact CE2-CE1 3.49Å; F321-F375 VanDerWaalsContact CE2-CE1 3.49Å; F321-F375 HydrophobicContact CE2-CE2 4.46Å; F321-F375 AromaticContact CE2-CG 3.99Å; F321-F375 HydrophobicContact CE2-CG 3.99Å; F321-F375 HydrophobicContact CE2-CZ 4.01Å; F321-F375 HydrophobicContact CG-CD2 4.38Å; F321-F375 HydrophobicContact CG-CE2 4.46Å; V371-F375 HydrophobicContact CG1-CD2 3.74Å; V371-F375 HydrophobicContact CG1-CE2 3.72Å; V371-F375 VanDerWaalsContact O-CD2 3.24Å; V371-F375 WeakPolarHBondContact O-CD2 3.24Å; V371-F375 PolarHBondContact O-N 3.15Å; F375-I378 HydrophobicContact CD1-CD1 4.17Å; F375-I378 HydrophobicContact CE1-CD1 4.41Å; F375-I378 PolarHBondContact O-N 3.4Å; F375-T379 WeakPolarHBondContact O-CB 3.44Å; F375-T379 WeakPolarHBondContact O-CG2 3.29Å; F375-T379 PolarHBondContact O-N 3.41Å; F375-T379 PolarHBondContact O-OG1 3.01Å
376	C	93.4	Very high	88.9	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-62.3	-45.5	168.6	-179.1	0	0	0	0	111.7	G324 T358 A372 V373 L374 I378 T379 Q380	G324-C376 VanDerWaalsContact O-CA 3.28Å; G324-C376 WeakPolarHBondContact O-CA 3.5Å; G324-C376 WeakPolarHBondContact O-CB 3.26Å; T358-C376 HydrophobicContact CG2-CB 3.8Å; T358-C376 PolarHBondContact OG1-SG 3.45Å; T358-C376 VanDerWaalsContact OG1-SG 3.35Å; A372-C376 VanDerWaalsContact O-CB 3.23Å; A372-C376 WeakPolarHBondContact O-CB 3.27Å; A372-C376 PolarHBondContact O-N 2.99Å; V373-C376 PolarHBondContact O-N 3.46Å; L374-C376 VanDerWaalsContact C-N 3.33Å; L374-C376 PolarHBondContact O-N 3.37Å; C376-I378 PolarHBondContact O-N 2.86Å; C376-T379 WeakPolarHBondContact CA-OG1 3.48Å; C376-T379 PolarHBondContact O-N 3.37Å; C376-T379 PolarHBondContact O-OG1 3.03Å; C376-Q380 VanDerWaalsContact O-CB 3.24Å; C376-Q380 WeakPolarHBondContact O-CB 3.43Å; C376-Q380 VanDerWaalsContact O-CG 3.25Å; C376-Q380 WeakPolarHBondContact O-CG 3.26Å; C376-Q380 PolarHBondContact O-N 2.97Å; C376-Q380 VanDerWaalsContact SG-CD 3.56Å
377	G	91.8	Very high	88.7	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60	-44.2	175	0	0	0	0	0	113.2	V373 L374 A381	V373-G377 PolarHBondContact O-N 3.32Å; L374-G377 PolarHBondContact O-N 3.33Å; G377-A381 VanDerWaalsContact O-CB 3.26Å; G377-A381 WeakPolarHBondContact O-CB 3.48Å; G377-A381 PolarHBondContact O-N 3Å
378	I	88.2	Confident	88.4	Confident	28 Å²	28	12 Å²	12	14%	0.144	7%	0.066	C	C	.	.	H	α-helix	trans	-62.6	-47.4	177	-65.9	166.8	0	0	0	110.9	L185 F191 L374 F375 C376 A381 H382	L185-I378 HydrophobicContact CD1-CD1 4.16Å; L185-I378 HydrophobicContact CD1-CG1 3.94Å; F191-I378 HydrophobicContact CZ-CG2 4.46Å; L374-I378 HydrophobicContact CD1-CD1 4.31Å; L374-I378 HydrophobicContact CG-CD1 4.16Å; L374-I378 WeakPolarHBondContact O-CG1 3.3Å; L374-I378 PolarHBondContact O-N 2.97Å; F375-I378 HydrophobicContact CD1-CD1 4.17Å; F375-I378 HydrophobicContact CE1-CD1 4.41Å; F375-I378 PolarHBondContact O-N 3.4Å; C376-I378 PolarHBondContact O-N 2.86Å; I378-A381 PolarHBondContact O-N 3.15Å; I378-H382 WeakPolarHBondContact O-CB 3.34Å; I378-H382 PolarHBondContact O-N 3.39Å; I378-H382 VanDerWaalsContact O-N 3.09Å
379	T	89.6	Confident	88.3	Confident	21 Å²	21	11.5 Å²	11.5	13%	0.129	6%	0.063	C	C	.	.	H	α-helix	trans	-69.3	-39	-179.7	50.4	0	0	0	0	112.3	A325 F375 C376 H382 Y383	A325-T379 HydrophobicContact CB-CG2 4.16Å; F375-T379 WeakPolarHBondContact O-CB 3.44Å; F375-T379 WeakPolarHBondContact O-CG2 3.29Å; F375-T379 PolarHBondContact O-N 3.41Å; F375-T379 PolarHBondContact O-OG1 3.01Å; C376-T379 WeakPolarHBondContact CA-OG1 3.48Å; C376-T379 PolarHBondContact O-N 3.37Å; C376-T379 PolarHBondContact O-OG1 3.03Å; T379-H382 PolarHBondContact O-N 3.41Å; T379-Y383 VanDerWaalsContact O-CD2 3.25Å; T379-Y383 WeakPolarHBondContact O-CD2 3.39Å; T379-Y383 PolarHBondContact O-N 2.94Å
380	Q	90.9	Very high	88.1	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-67.3	-38.1	175.2	-73.9	-177.8	-17.5	0	0	112	T331 F351 S355 C376 H382 T384 S385	T331-Q380 PolarHBondContact OG1-NE2 3.37Å; F351-Q380 HydrophobicContact CE2-CB 3.96Å; F351-Q380 HydrophobicContact CE2-CG 4.4Å; F351-Q380 HydrophobicContact CZ-CB 3.92Å; S355-Q380 PolarHBondContact OG-NE2 3.06Å; S355-Q380 PolarHBondContact OG-OE1 3.22Å; C376-Q380 VanDerWaalsContact O-CB 3.24Å; C376-Q380 WeakPolarHBondContact O-CB 3.43Å; C376-Q380 VanDerWaalsContact O-CG 3.25Å; C376-Q380 WeakPolarHBondContact O-CG 3.26Å; C376-Q380 PolarHBondContact O-N 2.97Å; C376-Q380 VanDerWaalsContact SG-CD 3.56Å; Q380-H382 PolarHBondContact O-N 2.99Å; Q380-T384 CarbonylContact O-C 3.58Å; Q380-T384 WeakPolarHBondContact O-CA 3.19Å; Q380-T384 VanDerWaalsContact O-CB 3.28Å; Q380-T384 WeakPolarHBondContact O-CB 3.38Å; Q380-T384 PolarHBondContact O-N 2.9Å; Q380-S385 PolarHBondContact O-N 3.44Å
381	A	88.4	Confident	88	Confident	9 Å²	9	23.3 Å²	23.3	7%	0.074	12%	0.118	C	C	.	.	H	α-helix	trans	-64.4	-28.5	172.2	0	0	0	0	0	112.6	Y183 K187 G377 I378	Y183-A381 HydrophobicContact CD2-CB 3.61Å; Y183-A381 HydrophobicContact CE2-CB 3.96Å; Y183-A381 HydrophobicContact CG-CB 4.23Å; K187-A381 WeakPolarHBondContact CE-O 3.31Å; K187-A381 PolarHBondContact NZ-O 2.98Å; G377-A381 VanDerWaalsContact O-CB 3.26Å; G377-A381 WeakPolarHBondContact O-CB 3.48Å; G377-A381 PolarHBondContact O-N 3Å; I378-A381 PolarHBondContact O-N 3.15Å
382	H	83.4	Confident	87.9	Confident	22 Å²	22	23.3 Å²	23.3	10%	0.102	12%	0.118	C	C	.	.	H	α-helix	trans	-83	-50	179.6	-168.9	-92.9	0	0	0	113.4	I378 T379 Q380 D572	I378-H382 WeakPolarHBondContact O-CB 3.34Å; I378-H382 PolarHBondContact O-N 3.39Å; I378-H382 VanDerWaalsContact O-N 3.09Å; T379-H382 PolarHBondContact O-N 3.41Å; Q380-H382 PolarHBondContact O-N 2.99Å; H382-D572 IonicContact CE1-OD1 3.09Å; H382-D572 IonicContact CE1-OD2 3.4Å; H382-D572 PolarHBondContact CE1-OD2 3.04Å; H382-D572 VanDerWaalsContact CE1-OD2 3.23Å; H382-D572 IonicContact NE2-OD2 2.68Å
383	Y	84.9	Confident	87.7	Confident	10 Å²	10	25 Å²	25	4%	0.039	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-53	-173.3	-57.4	-67.1	0	0	0	112.3	T379 S385 N386 D572 L576 L580 T581	T379-Y383 VanDerWaalsContact O-CD2 3.25Å; T379-Y383 WeakPolarHBondContact O-CD2 3.39Å; T379-Y383 PolarHBondContact O-N 2.94Å; Y383-S385 PolarHBondContact O-N 3.07Å; Y383-N386 PolarHBondContact O-N 3.39Å; Y383-D572 WeakPolarHBondContact CE1-OD1 3.47Å; Y383-D572 PolarHBondContact OH-OD1 3.41Å; Y383-L576 HydrophobicContact CE1-CB 3.98Å; Y383-L576 HydrophobicContact CE1-CD2 4.08Å; Y383-L576 HydrophobicContact CE2-CD2 4.28Å; Y383-L576 WeakPolarHBondContact OH-CD2 3.44Å; Y383-L580 HydrophobicContact CD1-CB 4.1Å; Y383-L580 HydrophobicContact CD1-CD1 3.87Å; Y383-L580 HydrophobicContact CD2-CD1 4.2Å; Y383-L580 HydrophobicContact CE1-CD1 3.99Å; Y383-L580 HydrophobicContact CE2-CD1 4.33Å; Y383-L580 HydrophobicContact CG-CB 4.37Å; Y383-L580 HydrophobicContact CG-CD1 3.98Å; Y383-T581 HydrophobicContact CD1-CG2 4.25Å; Y383-T581 WeakPolarHBondContact O-CG2 3.21Å
384	T	86.3	Confident	87.5	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-66.8	-40.7	-173.1	-50.6	0	0	0	0	111.5	T331 A332 T335 F351 Q380 N386 N387 L388	T331-T384 HydrophobicContact CG2-CG2 3.99Å; A332-T384 PolarHBondContact N-OG1 3.25Å; T335-T384 HydrophobicContact CG2-CG2 3.97Å; F351-T384 HydrophobicContact CD2-CG2 3.66Å; F351-T384 HydrophobicContact CE2-CG2 3.66Å; Q380-T384 CarbonylContact O-C 3.58Å; Q380-T384 WeakPolarHBondContact O-CA 3.19Å; Q380-T384 VanDerWaalsContact O-CB 3.28Å; Q380-T384 WeakPolarHBondContact O-CB 3.38Å; Q380-T384 PolarHBondContact O-N 2.9Å; T384-N386 PolarHBondContact O-N 2.95Å; T384-N386 VanDerWaalsContact O-N 3.11Å; T384-N387 WeakPolarHBondContact O-CB 3.4Å; T384-N387 PolarHBondContact O-N 3.4Å; T384-L388 HydrophobicContact CG2-CD2 4.49Å; T384-L388 HydrophobicContact CG2-CG 4.37Å; T384-L388 WeakPolarHBondContact O-CG 3.19Å; T384-L388 PolarHBondContact O-N 3.11Å; T384-L388 VanDerWaalsContact O-N 3.17Å
385	S	83.5	Confident	87.5	Confident	25 Å²	25	34.7 Å²	34.7	18%	0.175	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-58.5	-27	179.3	-170.2	0	0	0	0	113.5	Y183 Q380 Y383 N387	Y183-S385 PolarHBondContact OH-OG 3.06Å; Q380-S385 PolarHBondContact O-N 3.44Å; Y383-S385 PolarHBondContact O-N 3.07Å; S385-N387 VanDerWaalsContact C-N 3.33Å
386	N	83.1	Confident	87.5	Confident	57 Å²	57	33.3 Å²	33.3	31%	0.305	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-82.3	-13.3	177.6	-71.3	28.9	0	0	0	112.7	Y383 T384 T581	Y383-N386 PolarHBondContact O-N 3.39Å; T384-N386 PolarHBondContact O-N 2.95Å; T384-N386 VanDerWaalsContact O-N 3.11Å; N386-T581 HydrophobicContact CB-CG2 4.29Å
387	N	82.8	Confident	87.3	Confident	9 Å²	9	38.8 Å²	38.8	5%	0.048	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-22.4	174.4	-66.8	-19	0	0	0	112.9	A332 T384 S385 L580 T581 H582	A332-N387 PolarHBondContact O-ND2 3.24Å; A332-N387 VanDerWaalsContact O-ND2 3.13Å; T384-N387 WeakPolarHBondContact O-CB 3.4Å; T384-N387 PolarHBondContact O-N 3.4Å; S385-N387 VanDerWaalsContact C-N 3.33Å; N387-L580 PolarHBondContact ND2-O 3.47Å; N387-T581 WeakPolarHBondContact OD1-CA 3.38Å; N387-T581 WeakPolarHBondContact OD1-CB 3.22Å; N387-H582 PolarHBondContact OD1-N 3.41Å
388	L	83.6	Confident	87.3	Confident	13 Å²	13	44.8 Å²	44.8	7%	0.068	21%	0.214	C	C	.	.	S	Bend	trans	-71.5	152.4	-178.1	-66.3	175.7	0	0	0	111.5	T335 E347 F351 T384 T393	T335-L388 HydrophobicContact CG2-CD2 4.32Å; E347-L388 VanDerWaalsContact CD-CD2 3.42Å; E347-L388 HydrophobicContact CG-CD2 3.32Å; E347-L388 WeakPolarHBondContact OE1-CA 3.36Å; E347-L388 WeakPolarHBondContact OE1-CD2 3.26Å; F351-L388 HydrophobicContact CD2-CD1 3.85Å; F351-L388 HydrophobicContact CD2-CD2 4.44Å; F351-L388 HydrophobicContact CE2-CD1 4.01Å; T384-L388 HydrophobicContact CG2-CD2 4.49Å; T384-L388 HydrophobicContact CG2-CG 4.37Å; T384-L388 WeakPolarHBondContact O-CG 3.19Å; T384-L388 PolarHBondContact O-N 3.11Å; T384-L388 VanDerWaalsContact O-N 3.17Å; L388-T393 WeakPolarHBondContact CB-OG1 3.4Å
389	S	86.7	Confident	87.6	Confident	6 Å²	6	46.8 Å²	46.8	4%	0.042	22%	0.224	C	C	.	.			trans	-61.1	152.2	165.3	61	0	0	0	0	111.9	H341 E347 E391 S392 T393	H341-S389 WeakPolarHBondContact CD2-CA 3.38Å; H341-S389 WeakPolarHBondContact CD2-CB 3.29Å; H341-S389 PolarHBondContact CD2-N 2.99Å; H341-S389 VanDerWaalsContact CD2-N 3.34Å; H341-S389 VanDerWaalsContact CE1-CB 3.5Å; H341-S389 WeakPolarHBondContact CE1-CB 3.31Å; H341-S389 WeakPolarHBondContact NE2-CA 3.38Å; H341-S389 WeakPolarHBondContact NE2-CB 3.47Å; E347-S389 PolarHBondContact OE1-N 2.64Å; E347-S389 PolarHBondContact OE2-N 3.49Å; E347-S389 PolarHBondContact OE2-OG 3.41Å; S389-E391 PolarHBondContact O-N 3.23Å; S389-S392 PolarHBondContact O-N 2.87Å; S389-S392 WeakPolarHBondContact OG-CB 3.42Å; S389-S392 PolarHBondContact OG-N 3.26Å; S389-S392 VanDerWaalsContact OG-N 3.13Å; S389-T393 WeakPolarHBondContact O-CB 3.49Å; S389-T393 PolarHBondContact O-N 2.84Å; S389-T393 PolarHBondContact O-OG1 3.48Å
390	E	85.8	Confident	87.7	Confident	146 Å²	146	46 Å²	46	68%	0.682	22%	0.219	S	C	*	.	H	α-helix	trans	-58	-37.4	175.3	-69.4	-169.6	-176.7	0	0	112	K394	E390-K394 WeakPolarHBondContact O-CG 3.42Å; E390-K394 PolarHBondContact O-N 3.39Å; E390-K394 VanDerWaalsContact O-N 3.09Å
391	E	88.4	Confident	87.6	Confident	109 Å²	109	50.9 Å²	50.9	51%	0.509	24%	0.242	S	C	.	.	H	α-helix	trans	-65.3	-47.3	177	-167.3	-172.4	162.8	0	0	111.4	S389 T393 K394 R395	S389-E391 PolarHBondContact O-N 3.23Å; E391-T393 VanDerWaalsContact C-N 3.34Å; E391-T393 PolarHBondContact O-N 2.92Å; E391-K394 PolarHBondContact O-N 2.87Å; E391-R395 WeakPolarHBondContact O-CB 3.36Å; E391-R395 PolarHBondContact O-N 3.01Å; E391-R395 IonicContact OE1-CZ 2.86Å; E391-R395 IonicContact OE1-NH2 3.87Å; E391-R395 PolarHBondContact OE1-NH2 2.9Å
392	S	88.3	Confident	87.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.9	-37.5	177.5	179.7	0	0	0	0	112.3	E347 T348 S389 R395 T396	E347-S392 WeakPolarHBondContact CG-OG 3.41Å; E347-S392 WeakPolarHBondContact OE2-CB 3.36Å; E347-S392 PolarHBondContact OE2-OG 3.47Å; T348-S392 WeakPolarHBondContact CG2-O 3.3Å; T348-S392 WeakPolarHBondContact CG2-OG 3.43Å; S389-S392 PolarHBondContact O-N 2.87Å; S389-S392 WeakPolarHBondContact OG-CB 3.42Å; S389-S392 PolarHBondContact OG-N 3.26Å; S389-S392 VanDerWaalsContact OG-N 3.13Å; S392-R395 PolarHBondContact O-N 2.87Å; S392-T396 WeakPolarHBondContact O-CB 3.17Å; S392-T396 PolarHBondContact O-N 3.26Å; S392-T396 PolarHBondContact O-OG1 2.9Å
393	T	88.2	Confident	88.1	Confident	35 Å²	35	55.7 Å²	55.7	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-47.9	175.7	-60.1	0	0	0	0	111.1	L388 S389 E391 K397	L388-T393 WeakPolarHBondContact CB-OG1 3.4Å; S389-T393 WeakPolarHBondContact O-CB 3.49Å; S389-T393 PolarHBondContact O-N 2.84Å; S389-T393 PolarHBondContact O-OG1 3.48Å; E391-T393 VanDerWaalsContact C-N 3.34Å; E391-T393 PolarHBondContact O-N 2.92Å; T393-K397 WeakPolarHBondContact O-CB 3.43Å; T393-K397 PolarHBondContact O-N 3.41Å
394	K	89.4	Confident	88.2	Confident	134 Å²	134	56.9 Å²	56.9	58%	0.583	28%	0.276	S	S	*	.	H	α-helix	trans	-62.4	-46.1	176.4	-72.5	171.8	-174.9	166.8	0	111.3	E390 E391 K397 Q398	E390-K394 WeakPolarHBondContact O-CG 3.42Å; E390-K394 PolarHBondContact O-N 3.39Å; E390-K394 VanDerWaalsContact O-N 3.09Å; E391-K394 PolarHBondContact O-N 2.87Å; K394-K397 PolarHBondContact O-N 3.44Å; K394-Q398 WeakPolarHBondContact O-CG 3.37Å; K394-Q398 PolarHBondContact O-N 3.21Å
395	R	90.5	Very high	88.1	Confident	75 Å²	75	60.5 Å²	60.5	28%	0.283	29%	0.291	S	S	.	.	H	α-helix	trans	-65.5	-42.8	-179.2	-173	-174.4	-55.9	162.2	-3.7	112.4	P344 L345 T348 E391 S392 Q398 L399	P344-R395 VanDerWaalsContact C-NH1 3.29Å; P344-R395 PolarHBondContact O-NH1 2.89Å; L345-R395 VanDerWaalsContact N-NH1 3.11Å; T348-R395 HydrophobicContact CG2-CB 3.94Å; T348-R395 HydrophobicContact CG2-CG 4.06Å; E391-R395 WeakPolarHBondContact O-CB 3.36Å; E391-R395 PolarHBondContact O-N 3.01Å; E391-R395 IonicContact OE1-CZ 2.86Å; E391-R395 IonicContact OE1-NH2 3.87Å; E391-R395 PolarHBondContact OE1-NH2 2.9Å; S392-R395 PolarHBondContact O-N 2.87Å; R395-Q398 PolarHBondContact O-N 2.79Å; R395-L399 WeakPolarHBondContact O-CB 3.44Å; R395-L399 PolarHBondContact O-N 2.88Å
396	T	90.7	Very high	88.3	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-60.7	-46.4	175.8	-63.2	0	0	0	0	110.9	T348 F351 S392 Q398 L399 F400	T348-T396 WeakPolarHBondContact CG2-OG1 3.33Å; F351-T396 HydrophobicContact CD1-CG2 3.37Å; F351-T396 HydrophobicContact CE1-CG2 3.3Å; F351-T396 HydrophobicContact CG-CG2 4.13Å; F351-T396 HydrophobicContact CZ-CG2 3.99Å; S392-T396 WeakPolarHBondContact O-CB 3.17Å; S392-T396 PolarHBondContact O-N 3.26Å; S392-T396 PolarHBondContact O-OG1 2.9Å; T396-Q398 PolarHBondContact O-N 3.48Å; T396-L399 PolarHBondContact O-N 3.4Å; T396-F400 HydrophobicContact CG2-CD2 3.85Å; T396-F400 HydrophobicContact CG2-CE2 3.94Å; T396-F400 WeakPolarHBondContact O-CD2 3.46Å; T396-F400 PolarHBondContact O-N 2.95Å; T396-F400 VanDerWaalsContact O-N 3.07Å
397	K	89.9	Confident	88.5	Confident	115 Å²	115	59.8 Å²	59.8	50%	0.5	29%	0.287	S	S	.	.	H	α-helix	trans	-58.8	-49.1	177.2	-173.3	176.5	179.5	178.4	0	111.5	Y183 T393 K394 L399 F400 E401	Y183-K397 HydrophobicContact CE1-CB 4.39Å; T393-K397 WeakPolarHBondContact O-CB 3.43Å; T393-K397 PolarHBondContact O-N 3.41Å; K394-K397 PolarHBondContact O-N 3.44Å; K397-L399 PolarHBondContact O-N 3.44Å; K397-F400 PolarHBondContact O-N 3.33Å; K397-E401 VanDerWaalsContact O-CB 3.28Å; K397-E401 WeakPolarHBondContact O-CB 3.21Å; K397-E401 PolarHBondContact O-N 3.47Å
398	Q	91.8	Very high	88.5	Confident	125 Å²	125	60.5 Å²	60.5	58%	0.584	29%	0.29	S	S	*	.	H	α-helix	trans	-63	-39.8	178	-72.4	176.9	-25.2	0	0	112.7	K394 R395 T396 E401 V402	K394-Q398 WeakPolarHBondContact O-CG 3.37Å; K394-Q398 PolarHBondContact O-N 3.21Å; R395-Q398 PolarHBondContact O-N 2.79Å; T396-Q398 PolarHBondContact O-N 3.48Å; Q398-E401 PolarHBondContact O-N 2.88Å; Q398-V402 VanDerWaalsContact O-CG2 3.29Å; Q398-V402 WeakPolarHBondContact O-CG2 3.3Å; Q398-V402 PolarHBondContact O-N 3.38Å
399	L	92.6	Very high	88.5	Confident	70 Å²	70	60.1 Å²	60.1	37%	0.366	29%	0.287	S	S	.	.	H	α-helix	trans	-60.6	-51.3	178.5	176.8	64.2	0	0	0	111.2	F352 R395 T396 K397 V402 L403	F352-L399 HydrophobicContact CB-CD2 4.37Å; F352-L399 HydrophobicContact CD2-CD2 4.06Å; F352-L399 HydrophobicContact CG-CD2 4.36Å; R395-L399 WeakPolarHBondContact O-CB 3.44Å; R395-L399 PolarHBondContact O-N 2.88Å; T396-L399 PolarHBondContact O-N 3.4Å; K397-L399 PolarHBondContact O-N 3.44Å; L399-V402 PolarHBondContact O-N 3.46Å; L399-L403 HydrophobicContact CD1-CD1 4.24Å; L399-L403 HydrophobicContact CD1-CG 4.45Å; L399-L403 HydrophobicContact CG-CD1 4.19Å; L399-L403 WeakPolarHBondContact O-CG 3.39Å; L399-L403 PolarHBondContact O-N 3.26Å
400	F	91.7	Very high	88.4	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.018	29%	0.292	C	S	.	.	H	α-helix	trans	-68.9	-33.7	179.5	-80.3	-72	0	0	0	112.7	F179 H180 F351 F352 T396 K397 L403 H404	F179-F400 HydrophobicContact CB-CD1 4.42Å; F179-F400 HydrophobicContact CB-CE1 4.2Å; F179-F400 AromaticContact CD1-CD1 3.41Å; F179-F400 HydrophobicContact CD1-CD1 3.41Å; F179-F400 VanDerWaalsContact CD1-CD1 3.41Å; F179-F400 AromaticContact CD1-CD2 3.82Å; F179-F400 HydrophobicContact CD1-CD2 3.82Å; F179-F400 AromaticContact CD1-CE1 3.27Å; F179-F400 HydrophobicContact CD1-CE1 3.27Å; F179-F400 AromaticContact CD1-CE2 3.71Å; F179-F400 HydrophobicContact CD1-CE2 3.71Å; F179-F400 AromaticContact CD1-CG 3.67Å; F179-F400 HydrophobicContact CD1-CG 3.67Å; F179-F400 AromaticContact CD1-CZ 3.42Å; F179-F400 HydrophobicContact CD1-CZ 3.42Å; F179-F400 VanDerWaalsContact CD1-CZ 3.42Å; F179-F400 HydrophobicContact CE1-CD1 4.09Å; F179-F400 AromaticContact CE1-CD2 3.63Å; F179-F400 HydrophobicContact CE1-CD2 3.63Å; F179-F400 AromaticContact CE1-CE1 3.86Å; F179-F400 HydrophobicContact CE1-CE1 3.86Å; F179-F400 AromaticContact CE1-CE2 3.38Å; F179-F400 HydrophobicContact CE1-CE2 3.38Å; F179-F400 AromaticContact CE1-CG 3.98Å; F179-F400 HydrophobicContact CE1-CG 3.98Å; F179-F400 AromaticContact CE1-CZ 3.48Å; F179-F400 HydrophobicContact CE1-CZ 3.48Å; F179-F400 VanDerWaalsContact CE1-CZ 3.48Å; F179-F400 HydrophobicContact CG-CD1 4.23Å; F179-F400 AromaticContact CG-CE1 3.84Å; F179-F400 HydrophobicContact CG-CE1 3.84Å; F179-F400 HydrophobicContact CG-CZ 4.13Å; F179-F400 HydrophobicContact CZ-CE2 4.24Å; F179-F400 HydrophobicContact CZ-CZ 4.24Å; H180-F400 HydrophobicContact CB-CB 4.26Å; F351-F400 AromaticContact CD1-CE2 3.89Å; F351-F400 HydrophobicContact CD1-CE2 3.89Å; F351-F400 HydrophobicContact CE1-CD2 4.46Å; F351-F400 AromaticContact CE1-CE2 3.71Å; F351-F400 HydrophobicContact CE1-CE2 3.71Å; F351-F400 HydrophobicContact CE1-CZ 4.47Å; F352-F400 AromaticContact CD2-CE1 3.93Å; F352-F400 HydrophobicContact CD2-CE1 3.93Å; F352-F400 HydrophobicContact CD2-CE2 4.28Å; F352-F400 AromaticContact CD2-CZ 3.63Å; F352-F400 HydrophobicContact CD2-CZ 3.63Å; F352-F400 HydrophobicContact CE2-CE1 4.15Å; F352-F400 HydrophobicContact CE2-CZ 4.3Å; T396-F400 HydrophobicContact CG2-CD2 3.85Å; T396-F400 HydrophobicContact CG2-CE2 3.94Å; T396-F400 WeakPolarHBondContact O-CD2 3.46Å; T396-F400 PolarHBondContact O-N 2.95Å; T396-F400 VanDerWaalsContact O-N 3.07Å; K397-F400 PolarHBondContact O-N 3.33Å; F400-L403 PolarHBondContact O-N 2.95Å; F400-H404 WeakPolarHBondContact O-CB 3.28Å; F400-H404 PolarHBondContact O-N 3.32Å
401	E	89.3	Confident	88.4	Confident	103 Å²	103	54.5 Å²	54.5	48%	0.481	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-45	173.4	-175.2	177.3	179.6	0	0	111.5	K397 Q398 F405	K397-E401 VanDerWaalsContact O-CB 3.28Å; K397-E401 WeakPolarHBondContact O-CB 3.21Å; K397-E401 PolarHBondContact O-N 3.47Å; Q398-E401 PolarHBondContact O-N 2.88Å; E401-F405 VanDerWaalsContact O-CB 3.28Å; E401-F405 WeakPolarHBondContact O-CB 3.44Å; E401-F405 PolarHBondContact O-N 2.88Å
402	V	90.6	Very high	88.3	Confident	82 Å²	82	49.4 Å²	49.4	50%	0.497	24%	0.236	S	C	.	.	H	α-helix	trans	-65.8	-44.2	176.6	170.6	0	0	0	0	111.6	Q398 L399 F405 L406	Q398-V402 VanDerWaalsContact O-CG2 3.29Å; Q398-V402 WeakPolarHBondContact O-CG2 3.3Å; Q398-V402 PolarHBondContact O-N 3.38Å; L399-V402 PolarHBondContact O-N 3.46Å; V402-F405 PolarHBondContact O-N 3.08Å; V402-L406 HydrophobicContact CG1-CD1 3.96Å; V402-L406 HydrophobicContact CG1-CG 4.46Å; V402-L406 WeakPolarHBondContact O-CG 3.42Å; V402-L406 PolarHBondContact O-N 3.35Å
403	L	91.2	Very high	88.1	Confident	51 Å²	51	49.4 Å²	49.4	27%	0.267	24%	0.236	S	C	.	.	H	α-helix	trans	-63.5	-44.4	178.5	-72	173.5	0	0	0	111.9	P176 F352 L399 F400 L406 A407	P176-L403 HydrophobicContact CB-CB 3.95Å; F352-L403 HydrophobicContact CD2-CD1 4.31Å; F352-L403 HydrophobicContact CE2-CD1 3.53Å; F352-L403 HydrophobicContact CZ-CD1 4.28Å; L399-L403 HydrophobicContact CD1-CD1 4.24Å; L399-L403 HydrophobicContact CD1-CG 4.45Å; L399-L403 HydrophobicContact CG-CD1 4.19Å; L399-L403 WeakPolarHBondContact O-CG 3.39Å; L399-L403 PolarHBondContact O-N 3.26Å; F400-L403 PolarHBondContact O-N 2.95Å; L403-L406 PolarHBondContact O-N 3.06Å; L403-A407 VanDerWaalsContact O-CB 3.26Å; L403-A407 WeakPolarHBondContact O-CB 3.38Å; L403-A407 PolarHBondContact O-N 3.46Å
404	H	88.3	Confident	87.9	Confident	34 Å²	34	48.2 Å²	48.2	16%	0.157	23%	0.228	C	C	.	.	H	α-helix	trans	-57.4	-52	173.7	170	-77.3	0	0	0	110.9	H180 F400 L406 A407 E408	H180-H404 HydrophobicContact CB-CB 3.91Å; H180-H404 AromaticContact ND1-CD2 3.5Å; H180-H404 AromaticContact ND1-CG 3.57Å; F400-H404 WeakPolarHBondContact O-CB 3.28Å; F400-H404 PolarHBondContact O-N 3.32Å; H404-L406 VanDerWaalsContact C-N 3.33Å; H404-L406 PolarHBondContact O-N 3.35Å; H404-A407 PolarHBondContact O-N 3.46Å; H404-E408 IonicContact CE1-OE2 3.62Å; H404-E408 PolarHBondContact CE1-OE2 2.93Å; H404-E408 IonicContact ND1-OE2 3.99Å; H404-E408 IonicContact NE2-OE2 2.58Å; H404-E408 WeakPolarHBondContact O-CB 3.12Å; H404-E408 PolarHBondContact O-N 2.95Å
405	F	84.7	Confident	87.8	Confident	76 Å²	76	41.8 Å²	41.8	33%	0.333	20%	0.2	S	C	.	.	H	α-helix	trans	-57.6	-42.3	-179.9	176.5	-96.5	0	0	0	113.1	E86 E401 V402 N409	E86-F405 WeakPolarHBondContact OE1-CE2 3.35Å; E86-F405 WeakPolarHBondContact OE1-CZ 3.36Å; E401-F405 VanDerWaalsContact O-CB 3.28Å; E401-F405 WeakPolarHBondContact O-CB 3.44Å; E401-F405 PolarHBondContact O-N 2.88Å; V402-F405 PolarHBondContact O-N 3.08Å; F405-N409 WeakPolarHBondContact CE2-ND2 3.5Å; F405-N409 WeakPolarHBondContact CZ-ND2 3.46Å; F405-N409 WeakPolarHBondContact O-CB 3.46Å; F405-N409 PolarHBondContact O-N 3.46Å; F405-N409 PolarHBondContact O-ND2 2.96Å; F405-N409 VanDerWaalsContact O-ND2 3.14Å
406	L	86.2	Confident	87.6	Confident	61 Å²	61	38.2 Å²	38.2	32%	0.319	19%	0.187	S	C	.	.	H	α-helix	trans	-69.9	-45.6	177.8	-72.2	172.8	0	0	0	112.1	I70 V402 L403 H404 F410	I70-L406 HydrophobicContact CD1-CD2 3.62Å; V402-L406 HydrophobicContact CG1-CD1 3.96Å; V402-L406 HydrophobicContact CG1-CG 4.46Å; V402-L406 WeakPolarHBondContact O-CG 3.42Å; V402-L406 PolarHBondContact O-N 3.35Å; L403-L406 PolarHBondContact O-N 3.06Å; H404-L406 VanDerWaalsContact C-N 3.33Å; H404-L406 PolarHBondContact O-N 3.35Å; L406-F410 VanDerWaalsContact O-CB 3.3Å; L406-F410 WeakPolarHBondContact O-CB 3.27Å; L406-F410 PolarHBondContact O-N 3.44Å
407	A	87.6	Confident	87.3	Confident	7 Å²	7	38.3 Å²	38.3	6%	0.058	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-44.4	-178.6	0	0	0	0	0	111.3	L173 I177 L403 H404 F410 I411	L173-A407 HydrophobicContact CB-CB 4.4Å; L173-A407 HydrophobicContact CD2-CB 4.26Å; I177-A407 HydrophobicContact CD1-CB 3.82Å; I177-A407 HydrophobicContact CG1-CB 3.85Å; L403-A407 VanDerWaalsContact O-CB 3.26Å; L403-A407 WeakPolarHBondContact O-CB 3.38Å; L403-A407 PolarHBondContact O-N 3.46Å; H404-A407 PolarHBondContact O-N 3.46Å; A407-F410 PolarHBondContact O-N 3.48Å; A407-I411 WeakPolarHBondContact O-CD1 3.48Å; A407-I411 WeakPolarHBondContact O-CG1 3.34Å; A407-I411 PolarHBondContact O-N 3.1Å
408	E	83.3	Confident	87	Confident	24 Å²	24	32.9 Å²	32.9	11%	0.112	16%	0.163	C	C	.	.	H	α-helix	trans	-63.7	-48.6	179.5	-167.5	-171.8	158.6	0	0	112.1	T87 V251 H404 F410 I411 F412	T87-E408 VanDerWaalsContact CG2-OE1 3.29Å; T87-E408 WeakPolarHBondContact CG2-OE1 3.46Å; V251-E408 WeakPolarHBondContact CG1-OE1 3.47Å; H404-E408 IonicContact CE1-OE2 3.62Å; H404-E408 PolarHBondContact CE1-OE2 2.93Å; H404-E408 IonicContact ND1-OE2 3.99Å; H404-E408 IonicContact NE2-OE2 2.58Å; H404-E408 WeakPolarHBondContact O-CB 3.12Å; H404-E408 PolarHBondContact O-N 2.95Å; E408-F410 VanDerWaalsContact C-N 3.31Å; E408-F410 PolarHBondContact O-N 2.88Å; E408-I411 PolarHBondContact O-N 3.37Å; E408-I411 VanDerWaalsContact O-N 3.15Å; E408-F412 HydrophobicContact CG-CD2 3.83Å; E408-F412 HydrophobicContact CG-CE2 3.67Å; E408-F412 WeakPolarHBondContact O-CD2 3.41Å; E408-F412 PolarHBondContact O-N 2.99Å; E408-F412 WeakPolarHBondContact OE1-CE2 3.45Å
409	N	82.6	Confident	86.7	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-39.6	177.9	-86.1	-42.8	0	0	0	112.5	I73 E86 F405 S413	I73-N409 WeakPolarHBondContact CD1-OD1 3.42Å; E86-N409 PolarHBondContact OE1-ND2 2.93Å; E86-N409 PolarHBondContact OE1-OD1 2.9Å; F405-N409 WeakPolarHBondContact CE2-ND2 3.5Å; F405-N409 WeakPolarHBondContact CZ-ND2 3.46Å; F405-N409 WeakPolarHBondContact O-CB 3.46Å; F405-N409 PolarHBondContact O-N 3.46Å; F405-N409 PolarHBondContact O-ND2 2.96Å; F405-N409 VanDerWaalsContact O-ND2 3.14Å; N409-S413 WeakPolarHBondContact O-CB 3.35Å; N409-S413 PolarHBondContact O-N 3.47Å
410	F	85.1	Confident	86.2	Confident	32 Å²	32	27.1 Å²	27.1	14%	0.14	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-46.2	173.9	178.4	-92.6	0	0	0	111.4	F62 L66 F164 L173 L406 A407 E408 S413 Y414	F62-F410 HydrophobicContact CD1-CE2 4.41Å; L66-F410 HydrophobicContact CD1-CB 3.93Å; L66-F410 HydrophobicContact CD1-CD2 4.36Å; F164-F410 HydrophobicContact CD2-CE1 4.11Å; F164-F410 HydrophobicContact CD2-CZ 4.2Å; F164-F410 AromaticContact CE2-CE1 3.62Å; F164-F410 HydrophobicContact CE2-CE1 3.62Å; F164-F410 AromaticContact CE2-CZ 3.97Å; F164-F410 HydrophobicContact CE2-CZ 3.97Å; F164-F410 AromaticContact CZ-CE1 3.92Å; F164-F410 HydrophobicContact CZ-CE1 3.92Å; L173-F410 HydrophobicContact CD1-CD1 3.48Å; L173-F410 VanDerWaalsContact CD1-CD1 3.48Å; L173-F410 HydrophobicContact CD1-CE1 3.68Å; L173-F410 HydrophobicContact CD2-CD1 4.44Å; L406-F410 VanDerWaalsContact O-CB 3.3Å; L406-F410 WeakPolarHBondContact O-CB 3.27Å; L406-F410 PolarHBondContact O-N 3.44Å; A407-F410 PolarHBondContact O-N 3.48Å; E408-F410 VanDerWaalsContact C-N 3.31Å; E408-F410 PolarHBondContact O-N 2.88Å; F410-S413 PolarHBondContact O-N 2.73Å; F410-Y414 WeakPolarHBondContact O-CB 3.36Å; F410-Y414 PolarHBondContact O-N 3.45Å
411	I	87	Confident	85.4	Confident	3 Å²	3	27 Å²	27	2%	0.015	13%	0.134	C	C	.	.	H	α-helix	trans	-62.6	-48	-179.4	-70.5	163.1	0	0	0	111.6	F169 L173 I177 A407 E408 S413 Y414 M415 A478	F169-I411 HydrophobicContact CD2-CD1 4.11Å; F169-I411 HydrophobicContact CD2-CG1 4.05Å; F169-I411 HydrophobicContact CE2-CB 4.43Å; F169-I411 HydrophobicContact CE2-CD1 3.42Å; F169-I411 VanDerWaalsContact CE2-CD1 3.42Å; F169-I411 HydrophobicContact CE2-CG1 3.62Å; F169-I411 HydrophobicContact CE2-CG2 3.91Å; F169-I411 HydrophobicContact CZ-CD1 4.06Å; L173-I411 HydrophobicContact CB-CD1 4.24Å; L173-I411 HydrophobicContact CD1-CD1 4.41Å; L173-I411 HydrophobicContact CD1-CG1 3.93Å; I177-I411 HydrophobicContact CD1-CD1 3.55Å; A407-I411 WeakPolarHBondContact O-CD1 3.48Å; A407-I411 WeakPolarHBondContact O-CG1 3.34Å; A407-I411 PolarHBondContact O-N 3.1Å; E408-I411 PolarHBondContact O-N 3.37Å; E408-I411 VanDerWaalsContact O-N 3.15Å; I411-S413 VanDerWaalsContact C-N 3.33Å; I411-S413 PolarHBondContact O-N 3.4Å; I411-Y414 PolarHBondContact O-N 2.95Å; I411-M415 HydrophobicContact CG2-CE 3.58Å; I411-M415 WeakPolarHBondContact O-CG 3.23Å; I411-M415 PolarHBondContact O-N 3.37Å; I411-A478 HydrophobicContact CG2-CB 3.54Å
412	F	85.4	Confident	84.7	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.009	12%	0.116	C	C	.	.	H	α-helix	trans	-63.8	-38.1	178.2	-80	-70.1	0	0	0	112.7	T87 A90 M91 E408 M415 G416 V508	T87-F412 HydrophobicContact CG2-CD2 3.6Å; T87-F412 HydrophobicContact CG2-CE2 3.53Å; T87-F412 HydrophobicContact CG2-CG 4.33Å; T87-F412 HydrophobicContact CG2-CZ 4.21Å; A90-F412 HydrophobicContact CB-CB 4.09Å; M91-F412 WeakPolarHBondContact CA-O 3.29Å; E408-F412 HydrophobicContact CG-CD2 3.83Å; E408-F412 HydrophobicContact CG-CE2 3.67Å; E408-F412 WeakPolarHBondContact O-CD2 3.41Å; E408-F412 PolarHBondContact O-N 2.99Å; E408-F412 WeakPolarHBondContact OE1-CE2 3.45Å; F412-M415 HydrophobicContact CD1-CE 3.44Å; F412-M415 VanDerWaalsContact CD1-CE 3.44Å; F412-M415 HydrophobicContact CE1-CE 3.61Å; F412-M415 HydrophobicContact CG-CE 4.03Å; F412-M415 HydrophobicContact CZ-CE 4.32Å; F412-G416 PolarHBondContact O-N 3.23Å; F412-V508 HydrophobicContact CE1-CG2 4.1Å
413	S	83.7	Confident	83.4	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.2	-38.5	174.2	-151.3	0	0	0	0	112.3	L65 T69 A90 G94 N409 F410 I411 G416 L417	L65-S413 WeakPolarHBondContact CD2-OG 3.23Å; T69-S413 WeakPolarHBondContact CG2-OG 3.46Å; A90-S413 WeakPolarHBondContact O-CA 3.39Å; A90-S413 PolarHBondContact O-OG 3.41Å; A90-S413 VanDerWaalsContact O-OG 3.11Å; G94-S413 WeakPolarHBondContact CA-O 3.37Å; N409-S413 WeakPolarHBondContact O-CB 3.35Å; N409-S413 PolarHBondContact O-N 3.47Å; F410-S413 PolarHBondContact O-N 2.73Å; I411-S413 VanDerWaalsContact C-N 3.33Å; I411-S413 PolarHBondContact O-N 3.4Å; S413-G416 WeakPolarHBondContact O-CA 3.42Å; S413-G416 PolarHBondContact O-N 2.89Å; S413-L417 PolarHBondContact O-N 2.97Å
414	Y	85.3	Confident	82.5	Confident	9 Å²	9	27.2 Å²	27.2	4%	0.035	13%	0.126	C	C	.	.	H	α-helix	trans	-65.6	-39.7	175.7	178.3	-108.4	0	0	0	112.8	F164 F410 I411 G416 L417 A418 F481 I485	F164-Y414 HydrophobicContact CB-CD1 3.89Å; F164-Y414 HydrophobicContact CB-CD2 3.89Å; F164-Y414 HydrophobicContact CB-CE1 3.29Å; F164-Y414 HydrophobicContact CB-CE2 3.35Å; F164-Y414 HydrophobicContact CB-CG 4.17Å; F164-Y414 WeakPolarHBondContact CB-OH 3.39Å; F164-Y414 HydrophobicContact CD1-CD1 4.05Å; F164-Y414 AromaticContact CD1-CE1 3.91Å; F164-Y414 HydrophobicContact CD1-CE1 3.91Å; F164-Y414 HydrophobicContact CG-CD1 4.18Å; F164-Y414 AromaticContact CG-CE1 3.96Å; F164-Y414 HydrophobicContact CG-CE1 3.96Å; F164-Y414 HydrophobicContact CG-CE2 4.43Å; F164-Y414 HydrophobicContact CG-CG 4.5Å; F164-Y414 PolarHBondContact N-OH 2.65Å; F410-Y414 WeakPolarHBondContact O-CB 3.36Å; F410-Y414 PolarHBondContact O-N 3.45Å; I411-Y414 PolarHBondContact O-N 2.95Å; Y414-G416 PolarHBondContact O-N 3.42Å; Y414-L417 HydrophobicContact CD2-CB 4.42Å; Y414-L417 HydrophobicContact CD2-CD2 3.92Å; Y414-L417 HydrophobicContact CE2-CD2 4.09Å; Y414-L417 WeakPolarHBondContact O-CA 3.38Å; Y414-L417 WeakPolarHBondContact O-CB 3.43Å; Y414-L417 PolarHBondContact O-N 3.4Å; Y414-A418 HydrophobicContact CE1-CB 4.3Å; Y414-A418 WeakPolarHBondContact O-CB 3.31Å; Y414-A418 PolarHBondContact O-N 3.45Å; Y414-F481 AromaticContact CD1-CE1 3.65Å; Y414-F481 HydrophobicContact CD1-CE1 3.65Å; Y414-F481 AromaticContact CD1-CZ 3.8Å; Y414-F481 HydrophobicContact CD1-CZ 3.8Å; Y414-F481 AromaticContact CE1-CE1 3.58Å; Y414-F481 HydrophobicContact CE1-CE1 3.58Å; Y414-F481 AromaticContact CE1-CZ 3.41Å; Y414-F481 HydrophobicContact CE1-CZ 3.41Å; Y414-F481 VanDerWaalsContact CE1-CZ 3.41Å; Y414-I485 HydrophobicContact CE1-CD1 4.46Å
415	M	86.9	Confident	82.1	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58	-40.4	172.6	-75	-168.6	-94.9	0	0	111.9	I411 F412 L417 A418 A478 F481 L501 V504	I411-M415 HydrophobicContact CG2-CE 3.58Å; I411-M415 WeakPolarHBondContact O-CG 3.23Å; I411-M415 PolarHBondContact O-N 3.37Å; F412-M415 HydrophobicContact CD1-CE 3.44Å; F412-M415 VanDerWaalsContact CD1-CE 3.44Å; F412-M415 HydrophobicContact CE1-CE 3.61Å; F412-M415 HydrophobicContact CG-CE 4.03Å; F412-M415 HydrophobicContact CZ-CE 4.32Å; M415-L417 PolarHBondContact O-N 3.19Å; M415-A418 PolarHBondContact O-N 2.94Å; M415-A478 HydrophobicContact CE-CB 4.16Å; M415-F481 HydrophobicContact CG-CB 4.12Å; M415-F481 HydrophobicContact CG-CD1 3.6Å; M415-F481 HydrophobicContact CG-CD2 3.87Å; M415-F481 HydrophobicContact CG-CE1 3.91Å; M415-F481 HydrophobicContact CG-CE2 4.15Å; M415-F481 HydrophobicContact CG-CG 3.57Å; M415-F481 HydrophobicContact CG-CZ 4.17Å; M415-F481 HydrophobicContact SD-CB 3.62Å; M415-F481 HydrophobicContact SD-CD1 4.16Å; M415-F481 HydrophobicContact SD-CD2 4.33Å; M415-F481 HydrophobicContact SD-CG 3.78Å; M415-L501 HydrophobicContact CB-CD1 4.48Å; M415-V504 HydrophobicContact SD-CG1 3.75Å
416	G	86.2	Confident	82	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-50.9	-53.6	169.4	0	0	0	0	0	112.6	M91 G94 L95 F412 S413 Y414	M91-G416 WeakPolarHBondContact O-CA 3.38Å; G94-G416 CarbonylContact O-C 3.55Å; L95-G416 VanDerWaalsContact CA-O 3.31Å; L95-G416 WeakPolarHBondContact CA-O 3.41Å; L95-G416 VanDerWaalsContact N-C 3.33Å; L95-G416 PolarHBondContact N-O 3.44Å; F412-G416 PolarHBondContact O-N 3.23Å; S413-G416 WeakPolarHBondContact O-CA 3.42Å; S413-G416 PolarHBondContact O-N 2.89Å; Y414-G416 PolarHBondContact O-N 3.42Å
417	L	83.4	Confident	81.9	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-63.1	-45.2	-178.5	-175.4	75.3	0	0	0	112.3	F62 G94 V97 G98 L101 V162 S413 Y414 M415 L419 F420 T421	F62-L417 HydrophobicContact CE1-CD2 3.87Å; G94-L417 VanDerWaalsContact C-N 3.29Å; G94-L417 VanDerWaalsContact O-CA 3.26Å; G94-L417 WeakPolarHBondContact O-CA 3.47Å; G94-L417 PolarHBondContact O-N 3.36Å; V97-L417 HydrophobicContact CB-CD1 4.3Å; V97-L417 HydrophobicContact CG1-CD1 3.96Å; G98-L417 VanDerWaalsContact CA-CD1 3.46Å; L101-L417 HydrophobicContact CD1-CD1 3.75Å; V162-L417 HydrophobicContact CG1-CD2 3.76Å; S413-L417 PolarHBondContact O-N 2.97Å; Y414-L417 HydrophobicContact CD2-CB 4.42Å; Y414-L417 HydrophobicContact CD2-CD2 3.92Å; Y414-L417 HydrophobicContact CE2-CD2 4.09Å; Y414-L417 WeakPolarHBondContact O-CA 3.38Å; Y414-L417 WeakPolarHBondContact O-CB 3.43Å; Y414-L417 PolarHBondContact O-N 3.4Å; M415-L417 PolarHBondContact O-N 3.19Å; L417-L419 PolarHBondContact O-N 2.94Å; L417-L419 VanDerWaalsContact O-N 3.12Å; L417-F420 PolarHBondContact O-N 3.34Å; L417-F420 VanDerWaalsContact O-N 3.07Å; L417-T421 HydrophobicContact CD1-CG2 3.83Å; L417-T421 HydrophobicContact CD2-CG2 4.39Å; L417-T421 HydrophobicContact CG-CG2 3.69Å; L417-T421 PolarHBondContact O-N 3.45Å; L417-T421 VanDerWaalsContact O-N 3.09Å; L417-T421 PolarHBondContact O-OG1 2.86Å
418	A	83.9	Confident	81.8	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-57.6	-28.7	-174.1	0	0	0	0	0	113.6	Y414 M415 F420 T421 F422 F481	Y414-A418 HydrophobicContact CE1-CB 4.3Å; Y414-A418 WeakPolarHBondContact O-CB 3.31Å; Y414-A418 PolarHBondContact O-N 3.45Å; M415-A418 PolarHBondContact O-N 2.94Å; A418-F420 PolarHBondContact O-N 2.79Å; A418-T421 WeakPolarHBondContact CA-OG1 3.48Å; A418-F422 VanDerWaalsContact O-CB 3.31Å; A418-F422 WeakPolarHBondContact O-CB 3.37Å; A418-F422 PolarHBondContact O-N 2.99Å; A418-F481 HydrophobicContact CB-CE2 3.96Å; A418-F481 HydrophobicContact CB-CZ 3.92Å
419	L	85.6	Confident	82	Confident	25 Å²	25	31.8 Å²	31.8	13%	0.131	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-28.7	178.2	-172.9	67.3	0	0	0	113.5	L95 L417 H425 L501 L502 F505	L95-L419 HydrophobicContact CD1-CD2 3.72Å; L417-L419 PolarHBondContact O-N 2.94Å; L417-L419 VanDerWaalsContact O-N 3.12Å; L419-H425 PolarHBondContact O-NE2 3.28Å; L419-H425 VanDerWaalsContact O-NE2 3.15Å; L419-L501 HydrophobicContact CB-CD2 3.86Å; L419-L501 HydrophobicContact CD1-CD2 3.57Å; L419-L501 HydrophobicContact CD1-CG 4.11Å; L419-L501 HydrophobicContact CG-CD2 4.34Å; L419-L502 HydrophobicContact CD1-CD2 4.19Å; L419-F505 HydrophobicContact CB-CE2 4.03Å; L419-F505 HydrophobicContact CB-CZ 4.09Å; L419-F505 HydrophobicContact CD1-CE2 4.48Å; L419-F505 HydrophobicContact CD2-CE1 4.42Å; L419-F505 HydrophobicContact CD2-CE2 4.03Å; L419-F505 HydrophobicContact CD2-CZ 3.88Å; L419-F505 HydrophobicContact CG-CE2 4.41Å
420	F	81.8	Confident	82.4	Confident	50 Å²	50	34 Å²	34	22%	0.219	17%	0.165	C	C	.	.	H	α-helix	trans	-111.6	-23.5	-179.2	-75.7	-80.8	0	0	0	113.3	L95 V99 R102 L417 A418	L95-F420 HydrophobicContact CD1-CE2 4.06Å; L95-F420 HydrophobicContact CD2-CE2 4.03Å; L95-F420 HydrophobicContact CG-CD2 4.11Å; L95-F420 HydrophobicContact CG-CE2 3.7Å; V99-F420 HydrophobicContact CG2-CD1 4.03Å; V99-F420 HydrophobicContact CG2-CD2 3.65Å; V99-F420 HydrophobicContact CG2-CE1 3.95Å; V99-F420 HydrophobicContact CG2-CE2 3.57Å; V99-F420 HydrophobicContact CG2-CG 3.89Å; V99-F420 HydrophobicContact CG2-CZ 3.72Å; R102-F420 WeakPolarHBondContact CD-O 3.31Å; R102-F420 PolarHBondContact NH1-O 3.24Å; L417-F420 PolarHBondContact O-N 3.34Å; L417-F420 VanDerWaalsContact O-N 3.07Å; A418-F420 PolarHBondContact O-N 2.79Å
421	T	74.6	Confident	82.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-83.3	-25.1	179.9	56.3	0	0	0	0	113.8	L159 V162 L417 A418 Q423	L159-T421 HydrophobicContact CD2-CG2 3.95Å; V162-T421 HydrophobicContact CG1-CG2 4.04Å; L417-T421 HydrophobicContact CD1-CG2 3.83Å; L417-T421 HydrophobicContact CD2-CG2 4.39Å; L417-T421 HydrophobicContact CG-CG2 3.69Å; L417-T421 PolarHBondContact O-N 3.45Å; L417-T421 VanDerWaalsContact O-N 3.09Å; L417-T421 PolarHBondContact O-OG1 2.86Å; A418-T421 WeakPolarHBondContact CA-OG1 3.48Å; T421-Q423 PolarHBondContact O-N 3.33Å
422	F	74.9	Confident	82.8	Confident	25 Å²	25	33.6 Å²	33.6	11%	0.11	16%	0.164	C	C	.	.			trans	-73.5	124.7	179	-168.8	-98	0	0	0	111.7	A418 K424 H425 T488 F497	A418-F422 VanDerWaalsContact O-CB 3.31Å; A418-F422 WeakPolarHBondContact O-CB 3.37Å; A418-F422 PolarHBondContact O-N 2.99Å; F422-K424 HydrophobicContact CE1-CB 4.36Å; F422-K424 WeakPolarHBondContact CE1-O 3.46Å; F422-H425 AromaticContact CD1-CE1 3.86Å; F422-H425 AromaticContact CD1-ND1 3.91Å; F422-H425 PolarHBondContact O-CD2 2.88Å; F422-T488 HydrophobicContact CZ-CG2 4.25Å; F422-F497 HydrophobicContact CB-CE1 4.16Å; F422-F497 HydrophobicContact CD1-CD1 4.06Å; F422-F497 AromaticContact CD1-CE1 3.76Å; F422-F497 HydrophobicContact CD1-CE1 3.76Å; F422-F497 AromaticContact CD2-CE1 3.89Å; F422-F497 HydrophobicContact CD2-CE1 3.89Å; F422-F497 HydrophobicContact CD2-CZ 4.46Å; F422-F497 AromaticContact CE1-CD1 3.92Å; F422-F497 HydrophobicContact CE1-CD1 3.92Å; F422-F497 HydrophobicContact CE1-CE1 4.04Å; F422-F497 HydrophobicContact CE2-CD1 4.45Å; F422-F497 HydrophobicContact CE2-CE1 4.16Å; F422-F497 HydrophobicContact CG-CD1 4.39Å; F422-F497 AromaticContact CG-CE1 3.67Å; F422-F497 HydrophobicContact CG-CE1 3.67Å; F422-F497 HydrophobicContact CZ-CD1 4.13Å; F422-F497 HydrophobicContact CZ-CE1 4.23Å
423	Q	64.6	Low	83.2	Confident	74 Å²	74	38.8 Å²	38.8	35%	0.346	19%	0.19	S	C	.	.	S	Bend	trans	-75.8	-30.5	-166.9	-71.1	-65.2	-13.4	0	0	114.8	N156 T421	N156-Q423 PolarHBondContact OD1-NE2 3.41Å; N156-Q423 PolarHBondContact OD1-OE1 3.06Å; T421-Q423 PolarHBondContact O-N 3.33Å
424	K	70.5	Confident	83.6	Confident	143 Å²	143	39.3 Å²	39.3	62%	0.622	20%	0.196	S	C	*	.			trans	-120	62.1	-170.7	-66.2	-172.9	-178.2	-179.1	0	112.2	F422 I426	F422-K424 HydrophobicContact CE1-CB 4.36Å; F422-K424 WeakPolarHBondContact CE1-O 3.46Å; K424-I426 PolarHBondContact O-N 3.46Å
425	H	80.7	Confident	84	Confident	30 Å²	30	38.9 Å²	38.9	14%	0.139	19%	0.194	C	C	.	.			trans	-74.1	119.3	169.4	-75	-63.9	0	0	0	111.1	L419 F422 F427 F497 T498	L419-H425 PolarHBondContact O-NE2 3.28Å; L419-H425 VanDerWaalsContact O-NE2 3.15Å; F422-H425 AromaticContact CD1-CE1 3.86Å; F422-H425 AromaticContact CD1-ND1 3.91Å; F422-H425 PolarHBondContact O-CD2 2.88Å; H425-F427 HydrophobicContact CB-CD2 3.89Å; H425-F427 HydrophobicContact CB-CE1 4.49Å; H425-F427 HydrophobicContact CB-CE2 3.26Å; H425-F427 HydrophobicContact CB-CZ 3.61Å; H425-F427 AromaticContact CG-CZ 3.92Å; H425-F497 AromaticContact CE1-CE1 3.84Å; H425-T498 HydrophobicContact CB-CG2 4.05Å; H425-T498 PolarHBondContact ND1-OG1 3.34Å
426	I	83.4	Confident	84.4	Confident	57 Å²	57	41.1 Å²	41.1	29%	0.292	20%	0.204	S	C	.	.			trans	-99.5	95.2	172.8	-57.7	176.4	0	0	0	107.4	K424 S428 Q494 M495	K424-I426 PolarHBondContact O-N 3.46Å; I426-S428 PolarHBondContact O-N 3.13Å; I426-Q494 HydrophobicContact CD1-CB 4.07Å; I426-Q494 HydrophobicContact CG1-CB 4.44Å; I426-M495 HydrophobicContact CB-CB 4.39Å; I426-M495 HydrophobicContact CG2-CB 4.42Å; I426-M495 HydrophobicContact CG2-CE 3.94Å
427	F	84	Confident	84.7	Confident	119 Å²	119	44.7 Å²	44.7	52%	0.522	23%	0.226	S	C	.	.			trans	-81.7	109.1	178.3	-66.2	-79.8	0	0	0	110.3	H425 I432 T498 L502	H425-F427 HydrophobicContact CB-CD2 3.89Å; H425-F427 HydrophobicContact CB-CE1 4.49Å; H425-F427 HydrophobicContact CB-CE2 3.26Å; H425-F427 HydrophobicContact CB-CZ 3.61Å; H425-F427 AromaticContact CG-CZ 3.92Å; F427-I432 HydrophobicContact CD1-CD1 4.47Å; F427-T498 HydrophobicContact CD1-CG2 3.51Å; F427-T498 HydrophobicContact CE1-CG2 3.33Å; F427-T498 HydrophobicContact CG-CG2 4.18Å; F427-T498 HydrophobicContact CZ-CG2 3.88Å; F427-L502 HydrophobicContact CD1-CD1 4.2Å; F427-L502 HydrophobicContact CE1-CD1 4.11Å
428	S	85.1	Confident	85.2	Confident	11 Å²	11	44.6 Å²	44.6	8%	0.077	23%	0.225	C	C	.	.			trans	-112.6	106.2	170	-175.6	0	0	0	0	110.6	M223 I426 I430 F431 I432	M223-S428 WeakPolarHBondContact CE-OG 3.36Å; I426-S428 PolarHBondContact O-N 3.13Å; S428-I430 VanDerWaalsContact C-N 3.31Å; S428-I430 PolarHBondContact O-N 3.2Å; S428-F431 PolarHBondContact O-N 2.91Å; S428-I432 WeakPolarHBondContact O-CD1 3.31Å; S428-I432 VanDerWaalsContact O-CG1 3.27Å; S428-I432 WeakPolarHBondContact O-CG1 3.29Å; S428-I432 PolarHBondContact O-N 3.48Å
429	P	87.8	Confident	85.7	Confident	81 Å²	81	45.1 Å²	45.1	53%	0.526	23%	0.228	S	C	.	.	H	α-helix	trans	-64.3	-35.8	-173.4	24.3	-33	0	0	0	112.5	I432 I433	P429-I432 PolarHBondContact O-N 3.44Å; P429-I433 WeakPolarHBondContact O-CB 3.04Å; P429-I433 VanDerWaalsContact O-CG1 3.26Å; P429-I433 WeakPolarHBondContact O-CG1 3.48Å; P429-I433 PolarHBondContact O-N 2.94Å
430	I	89.7	Confident	86	Confident	50 Å²	50	48 Å²	48	26%	0.256	24%	0.239	S	C	.	.	H	α-helix	trans	-65.2	-43.6	177.9	-57.9	177.5	0	0	0	110.4	V219 M223 S428 G434	V219-I430 HydrophobicContact CG1-CG2 4.06Å; M223-I430 HydrophobicContact CE-CB 4.43Å; M223-I430 HydrophobicContact CG-CB 3.83Å; M223-I430 HydrophobicContact CG-CD1 4.23Å; M223-I430 HydrophobicContact CG-CG2 3.43Å; M223-I430 VanDerWaalsContact CG-CG2 3.43Å; M223-I430 HydrophobicContact SD-CB 3.98Å; M223-I430 HydrophobicContact SD-CG2 3.95Å; S428-I430 VanDerWaalsContact C-N 3.31Å; S428-I430 PolarHBondContact O-N 3.2Å; I430-G434 PolarHBondContact O-N 3.39Å
431	F	90.1	Very high	86.6	Confident	3 Å²	3	48.9 Å²	48.9	1%	0.013	25%	0.246	C	C	.	.	H	α-helix	trans	-64.5	-42.6	177.5	-168.5	-91.2	0	0	0	111.4	M216 V220 M223 F233 F241 S428 G434 A435 M495 M496 T499	M216-F431 HydrophobicContact CE-CD1 4.36Å; M216-F431 HydrophobicContact CE-CD2 3.51Å; M216-F431 HydrophobicContact CE-CE1 4.3Å; M216-F431 HydrophobicContact CE-CE2 3.44Å; M216-F431 VanDerWaalsContact CE-CE2 3.44Å; M216-F431 HydrophobicContact CE-CG 3.99Å; M216-F431 HydrophobicContact CE-CZ 3.86Å; V220-F431 HydrophobicContact CG2-CD2 4.13Å; V220-F431 HydrophobicContact CG2-CE2 3.91Å; M223-F431 HydrophobicContact CE-CB 4.45Å; M223-F431 HydrophobicContact SD-CB 3.96Å; M223-F431 HydrophobicContact SD-CD2 4.44Å; F233-F431 HydrophobicContact CE1-CE2 4.31Å; F241-F431 HydrophobicContact CE1-CE1 4.44Å; F241-F431 HydrophobicContact CE2-CE1 4.32Å; F241-F431 HydrophobicContact CZ-CE1 4.19Å; S428-F431 PolarHBondContact O-N 2.91Å; F431-G434 PolarHBondContact O-N 3.01Å; F431-A435 VanDerWaalsContact O-CB 3.29Å; F431-A435 WeakPolarHBondContact O-CB 3.37Å; F431-A435 PolarHBondContact O-N 3.33Å; F431-M495 HydrophobicContact CB-SD 3.88Å; F431-M495 HydrophobicContact CD1-CG 4.14Å; F431-M495 HydrophobicContact CD1-SD 4.19Å; F431-M495 HydrophobicContact CD2-SD 4.01Å; F431-M495 HydrophobicContact CG-CG 4.3Å; F431-M495 HydrophobicContact CG-SD 3.76Å; F431-M496 HydrophobicContact CE1-CG 4.16Å; F431-M496 HydrophobicContact CZ-CG 3.89Å; F431-T499 HydrophobicContact CD1-CG2 3.97Å; F431-T499 WeakPolarHBondContact CD1-OG1 3.2Å; F431-T499 HydrophobicContact CE1-CG2 4.1Å
432	I	92.3	Very high	87.4	Confident	23 Å²	23	48.9 Å²	48.9	12%	0.118	25%	0.246	C	C	.	.	H	α-helix	trans	-63.3	-49.8	178.7	-66.3	160.2	0	0	0	111.3	F427 S428 P429 G434 A435 F436 T499 L502	F427-I432 HydrophobicContact CD1-CD1 4.47Å; S428-I432 WeakPolarHBondContact O-CD1 3.31Å; S428-I432 VanDerWaalsContact O-CG1 3.27Å; S428-I432 WeakPolarHBondContact O-CG1 3.29Å; S428-I432 PolarHBondContact O-N 3.48Å; P429-I432 PolarHBondContact O-N 3.44Å; I432-G434 VanDerWaalsContact C-N 3.33Å; I432-G434 PolarHBondContact O-N 3.46Å; I432-A435 PolarHBondContact O-N 3.49Å; I432-F436 HydrophobicContact CG2-CD2 3.84Å; I432-F436 HydrophobicContact CG2-CE2 3.7Å; I432-F436 VanDerWaalsContact O-CD2 3.31Å; I432-F436 WeakPolarHBondContact O-CD2 3.49Å; I432-F436 PolarHBondContact O-N 3.4Å; I432-T499 HydrophobicContact CB-CG2 4.39Å; I432-T499 HydrophobicContact CG1-CG2 3.99Å; I432-L502 HydrophobicContact CD1-CD1 3.65Å; I432-L502 HydrophobicContact CG1-CD1 4.29Å; I432-L502 HydrophobicContact CG2-CD1 4.44Å
433	I	92.6	Very high	88.2	Confident	112 Å²	112	48 Å²	48	57%	0.574	24%	0.242	S	C	*	.	H	α-helix	trans	-63.4	-43.1	178.9	-66.4	165.9	0	0	0	110.2	P429 A435 F436 V437	P429-I433 WeakPolarHBondContact O-CB 3.04Å; P429-I433 VanDerWaalsContact O-CG1 3.26Å; P429-I433 WeakPolarHBondContact O-CG1 3.48Å; P429-I433 PolarHBondContact O-N 2.94Å; I433-A435 VanDerWaalsContact C-N 3.3Å; I433-A435 PolarHBondContact O-N 3.21Å; I433-F436 PolarHBondContact O-N 2.85Å; I433-V437 WeakPolarHBondContact O-CG2 3.26Å; I433-V437 PolarHBondContact O-N 2.99Å; I433-V437 VanDerWaalsContact O-N 3.09Å
434	G	93.3	Very high	89.5	Confident	11 Å²	11	45.8 Å²	45.8	11%	0.113	24%	0.236	C	C	.	.	H	α-helix	trans	-57.4	-43.1	174.2	0	0	0	0	0	112.4	M216 I430 F431 I432 V437 A438	M216-G434 VanDerWaalsContact SD-C 3.56Å; I430-G434 PolarHBondContact O-N 3.39Å; F431-G434 PolarHBondContact O-N 3.01Å; I432-G434 VanDerWaalsContact C-N 3.33Å; I432-G434 PolarHBondContact O-N 3.46Å; G434-V437 PolarHBondContact O-N 2.83Å; G434-A438 VanDerWaalsContact O-CB 3.31Å; G434-A438 WeakPolarHBondContact O-CB 3.5Å; G434-A438 PolarHBondContact O-N 2.97Å
435	A	93.6	Very high	90.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.8	-41	178	0	0	0	0	0	112.5	M216 F241 F431 I432 I433 V437 A438 I439 T499 I503	M216-A435 VanDerWaalsContact SD-CA 3.51Å; M216-A435 HydrophobicContact SD-CB 3.99Å; M216-A435 PolarHBondContact SD-N 2.91Å; M216-A435 VanDerWaalsContact SD-N 3.44Å; F241-A435 HydrophobicContact CE1-CB 3.81Å; F241-A435 HydrophobicContact CZ-CB 3.93Å; F431-A435 VanDerWaalsContact O-CB 3.29Å; F431-A435 WeakPolarHBondContact O-CB 3.37Å; F431-A435 PolarHBondContact O-N 3.33Å; I432-A435 PolarHBondContact O-N 3.49Å; I433-A435 VanDerWaalsContact C-N 3.3Å; I433-A435 PolarHBondContact O-N 3.21Å; A435-V437 PolarHBondContact O-N 3.12Å; A435-A438 WeakPolarHBondContact O-CB 3.35Å; A435-A438 PolarHBondContact O-N 3.31Å; A435-I439 WeakPolarHBondContact O-CD1 3.28Å; A435-I439 VanDerWaalsContact O-CG1 3.24Å; A435-I439 WeakPolarHBondContact O-CG1 3.19Å; A435-I439 PolarHBondContact O-N 2.96Å; A435-T499 HydrophobicContact CB-CG2 3.63Å; A435-I503 HydrophobicContact CB-CD1 4.01Å
436	F	93.6	Very high	91	Very high	46 Å²	46	41.5 Å²	41.5	20%	0.202	22%	0.221	C	C	.	.	H	α-helix	trans	-57.3	-50.1	173.5	-88.9	-67.2	0	0	0	111.5	I432 I433 A438 I439 F440 I503 F506	I432-F436 HydrophobicContact CG2-CD2 3.84Å; I432-F436 HydrophobicContact CG2-CE2 3.7Å; I432-F436 VanDerWaalsContact O-CD2 3.31Å; I432-F436 WeakPolarHBondContact O-CD2 3.49Å; I432-F436 PolarHBondContact O-N 3.4Å; I433-F436 PolarHBondContact O-N 2.85Å; F436-A438 VanDerWaalsContact C-N 3.32Å; F436-A438 PolarHBondContact O-N 3.39Å; F436-I439 PolarHBondContact O-N 3.29Å; F436-F440 WeakPolarHBondContact O-CD2 3.46Å; F436-F440 PolarHBondContact O-N 3.27Å; F436-I503 HydrophobicContact CD1-CG1 4.47Å; F436-I503 HydrophobicContact CE1-CG1 4.12Å; F436-I503 HydrophobicContact CE2-CG1 4.38Å; F436-I503 HydrophobicContact CZ-CG1 4.08Å; F436-F506 HydrophobicContact CD1-CD1 4.23Å; F436-F506 HydrophobicContact CE1-CB 3.79Å; F436-F506 AromaticContact CE1-CD1 3.41Å; F436-F506 HydrophobicContact CE1-CD1 3.41Å; F436-F506 VanDerWaalsContact CE1-CD1 3.41Å; F436-F506 HydrophobicContact CE1-CD2 4.49Å; F436-F506 HydrophobicContact CE1-CE1 4.09Å; F436-F506 AromaticContact CE1-CG 3.64Å; F436-F506 HydrophobicContact CE1-CG 3.64Å; F436-F506 HydrophobicContact CZ-CB 3.7Å; F436-F506 HydrophobicContact CZ-CD1 4.13Å; F436-F506 HydrophobicContact CZ-CD2 4.49Å; F436-F506 AromaticContact CZ-CG 3.86Å; F436-F506 HydrophobicContact CZ-CG 3.86Å
437	V	93.9	Very high	91.4	Very high	76 Å²	76	39 Å²	39	46%	0.461	21%	0.207	S	C	.	.	H	α-helix	trans	-62	-42.3	177.5	175.7	0	0	0	0	110.9	L215 I433 G434 A435 I439 F440 I441	L215-V437 HydrophobicContact CD2-CG1 4.4Å; I433-V437 WeakPolarHBondContact O-CG2 3.26Å; I433-V437 PolarHBondContact O-N 2.99Å; I433-V437 VanDerWaalsContact O-N 3.09Å; G434-V437 PolarHBondContact O-N 2.83Å; A435-V437 PolarHBondContact O-N 3.12Å; V437-I439 VanDerWaalsContact C-N 3.29Å; V437-I439 PolarHBondContact O-N 2.84Å; V437-F440 PolarHBondContact O-N 3.28Å; V437-I441 HydrophobicContact CG1-CD1 3.64Å; V437-I441 HydrophobicContact CG1-CG1 4.38Å; V437-I441 WeakPolarHBondContact O-CG1 3.48Å; V437-I441 PolarHBondContact O-N 3.01Å
438	A	94.4	Very high	91.8	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.7	-39.9	177.9	0	0	0	0	0	112.9	I212 L215 M216 G434 A435 F436 I441 G442	I212-A438 HydrophobicContact CG2-CB 4.15Å; L215-A438 HydrophobicContact CB-CB 4.2Å; L215-A438 HydrophobicContact CD2-CB 3.6Å; L215-A438 HydrophobicContact CG-CB 4.3Å; M216-A438 HydrophobicContact CG-CB 4.4Å; M216-A438 HydrophobicContact SD-CB 4.03Å; G434-A438 VanDerWaalsContact O-CB 3.31Å; G434-A438 WeakPolarHBondContact O-CB 3.5Å; G434-A438 PolarHBondContact O-N 2.97Å; A435-A438 WeakPolarHBondContact O-CB 3.35Å; A435-A438 PolarHBondContact O-N 3.31Å; F436-A438 VanDerWaalsContact C-N 3.32Å; F436-A438 PolarHBondContact O-N 3.39Å; A438-I441 PolarHBondContact O-N 3.38Å; A438-G442 WeakPolarHBondContact O-CA 3.2Å; A438-G442 PolarHBondContact O-N 3.4Å
439	I	93.1	Very high	92.1	Very high	12 Å²	12	39.4 Å²	39.4	6%	0.062	21%	0.213	C	C	.	.	H	α-helix	trans	-66.9	-45.2	-179.4	-71.6	164.7	0	0	0	111.4	I245 A435 F436 V437 G442 R443 I503	I245-I439 HydrophobicContact CG2-CD1 3.58Å; I245-I439 HydrophobicContact CG2-CG1 3.44Å; I245-I439 VanDerWaalsContact CG2-CG1 3.44Å; A435-I439 WeakPolarHBondContact O-CD1 3.28Å; A435-I439 VanDerWaalsContact O-CG1 3.24Å; A435-I439 WeakPolarHBondContact O-CG1 3.19Å; A435-I439 PolarHBondContact O-N 2.96Å; F436-I439 PolarHBondContact O-N 3.29Å; V437-I439 VanDerWaalsContact C-N 3.29Å; V437-I439 PolarHBondContact O-N 2.84Å; I439-G442 PolarHBondContact O-N 3.4Å; I439-R443 VanDerWaalsContact O-CB 3.25Å; I439-R443 WeakPolarHBondContact O-CB 3.45Å; I439-R443 PolarHBondContact O-N 2.92Å; I439-I503 HydrophobicContact CD1-CB 4.32Å; I439-I503 HydrophobicContact CD1-CD1 3.46Å; I439-I503 VanDerWaalsContact CD1-CD1 3.46Å; I439-I503 HydrophobicContact CD1-CG1 3.87Å; I439-I503 HydrophobicContact CD1-CG2 3.51Å
440	F	92.1	Very high	92.1	Very high	84 Å²	84	36.1 Å²	36.1	37%	0.368	19%	0.191	S	C	.	.	H	α-helix	trans	-62.9	-44.4	177.5	-71.8	-67.1	0	0	0	111.6	F436 V437 A444 M471 F511	F436-F440 WeakPolarHBondContact O-CD2 3.46Å; F436-F440 PolarHBondContact O-N 3.27Å; V437-F440 PolarHBondContact O-N 3.28Å; F440-A444 WeakPolarHBondContact O-CB 3.21Å; F440-A444 PolarHBondContact O-N 3.44Å; F440-M471 HydrophobicContact CD1-CE 4.25Å; F440-M471 VanDerWaalsContact O-CE 3.28Å; F440-M471 WeakPolarHBondContact O-CE 3.41Å; F440-F511 HydrophobicContact CE1-CE1 4.33Å; F440-F511 AromaticContact CE1-CE2 3.86Å; F440-F511 HydrophobicContact CE1-CE2 3.86Å; F440-F511 AromaticContact CE1-CZ 3.38Å; F440-F511 HydrophobicContact CE1-CZ 3.38Å; F440-F511 AromaticContact CZ-CE2 3.76Å; F440-F511 HydrophobicContact CZ-CE2 3.76Å; F440-F511 AromaticContact CZ-CZ 3.46Å; F440-F511 HydrophobicContact CZ-CZ 3.46Å; F440-F511 VanDerWaalsContact CZ-CZ 3.46Å
441	I	94	Very high	92	Very high	70 Å²	70	33.8 Å²	33.8	36%	0.359	18%	0.178	S	C	.	.	H	α-helix	trans	-67.1	-45.7	178.5	-64.4	173.1	0	0	0	110.6	V211 L215 V437 A438 R443 A444 L445	V211-I441 HydrophobicContact CG1-CG2 4.16Å; L215-I441 HydrophobicContact CD2-CD1 4.06Å; V437-I441 HydrophobicContact CG1-CD1 3.64Å; V437-I441 HydrophobicContact CG1-CG1 4.38Å; V437-I441 WeakPolarHBondContact O-CG1 3.48Å; V437-I441 PolarHBondContact O-N 3.01Å; A438-I441 PolarHBondContact O-N 3.38Å; I441-R443 VanDerWaalsContact C-N 3.34Å; I441-R443 PolarHBondContact O-N 3.32Å; I441-A444 PolarHBondContact O-N 2.97Å; I441-L445 HydrophobicContact CG2-CD1 3.83Å; I441-L445 HydrophobicContact CG2-CG 4.28Å; I441-L445 WeakPolarHBondContact O-CB 3.36Å; I441-L445 WeakPolarHBondContact O-CG 3.32Å; I441-L445 PolarHBondContact O-N 3.21Å
442	G	92.3	Very high	91.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-43.2	178.5	0	0	0	0	0	112.5	A438 I439 N446	A438-G442 WeakPolarHBondContact O-CA 3.2Å; A438-G442 PolarHBondContact O-N 3.4Å; I439-G442 PolarHBondContact O-N 3.4Å; G442-N446 WeakPolarHBondContact O-CB 3.28Å; G442-N446 PolarHBondContact O-N 3.19Å
443	R	91.7	Very high	91.7	Very high	6 Å²	6	44.9 Å²	44.9	2%	0.023	23%	0.231	C	C	.	.	H	α-helix	trans	-69.7	-40.3	177.6	-169.2	73.1	176.2	164	3.5	111.8	E273 I439 I441 N446 I447 M470 M471	E273-R443 IonicContact OE1-CZ 3.74Å; E273-R443 IonicContact OE1-NH1 3.92Å; E273-R443 PolarHBondContact OE1-NH1 3.27Å; E273-R443 IonicContact OE1-NH2 3.89Å; E273-R443 PolarHBondContact OE1-NH2 3.07Å; E273-R443 IonicContact OE2-CZ 3.68Å; E273-R443 IonicContact OE2-NH1 3.8Å; E273-R443 IonicContact OE2-NH2 3.15Å; E273-R443 PolarHBondContact OE2-NH2 3Å; I439-R443 VanDerWaalsContact O-CB 3.25Å; I439-R443 WeakPolarHBondContact O-CB 3.45Å; I439-R443 PolarHBondContact O-N 2.92Å; I441-R443 VanDerWaalsContact C-N 3.34Å; I441-R443 PolarHBondContact O-N 3.32Å; R443-N446 PolarHBondContact O-N 3.24Å; R443-I447 HydrophobicContact CG-CD1 3.99Å; R443-I447 PolarHBondContact O-N 3.05Å; R443-M470 PolarHBondContact NH2-O 3.48Å; R443-M471 VanDerWaalsContact C-SD 3.5Å; R443-M471 HydrophobicContact CB-CE 3.81Å; R443-M471 HydrophobicContact CB-SD 3.66Å; R443-M471 HydrophobicContact CG-CE 4.03Å; R443-M471 HydrophobicContact CG-SD 3.35Å; R443-M471 WeakPolarHBondContact CG-SD 3.4Å
444	A	92.4	Very high	91.3	Very high	28 Å²	28	40.7 Å²	40.7	23%	0.231	21%	0.209	C	C	.	.	H	α-helix	trans	-63.9	-43.4	176.3	0	0	0	0	0	111.9	F440 I441 N446 I447 Y448 P449 M471	F440-A444 WeakPolarHBondContact O-CB 3.21Å; F440-A444 PolarHBondContact O-N 3.44Å; I441-A444 PolarHBondContact O-N 2.97Å; A444-N446 VanDerWaalsContact C-N 3.34Å; A444-I447 PolarHBondContact O-N 3.49Å; A444-Y448 HydrophobicContact CB-CD2 4.02Å; A444-Y448 HydrophobicContact CB-CE2 4.01Å; A444-Y448 VanDerWaalsContact O-CD2 3.23Å; A444-Y448 WeakPolarHBondContact O-CD2 3.33Å; A444-Y448 PolarHBondContact O-N 3.07Å; A444-Y448 VanDerWaalsContact O-N 3.08Å; A444-P449 WeakPolarHBondContact O-CD 3.5Å; A444-M471 HydrophobicContact CB-CE 4.14Å; A444-M471 HydrophobicContact CB-SD 4.17Å; A444-M471 PolarHBondContact N-SD 3.41Å; A444-M471 VanDerWaalsContact N-SD 3.4Å
445	L	91.6	Very high	91	Very high	80 Å²	80	41.6 Å²	41.6	42%	0.419	21%	0.212	S	C	.	.	H	α-helix	trans	-73.7	-23.3	178.7	-68.9	-178.8	0	0	0	113.7	V211 I441 P449	V211-L445 HydrophobicContact CG1-CD1 3.91Å; V211-L445 HydrophobicContact CG2-CB 4.41Å; V211-L445 HydrophobicContact CG2-CD1 3.97Å; I441-L445 HydrophobicContact CG2-CD1 3.83Å; I441-L445 HydrophobicContact CG2-CG 4.28Å; I441-L445 WeakPolarHBondContact O-CB 3.36Å; I441-L445 WeakPolarHBondContact O-CG 3.32Å; I441-L445 PolarHBondContact O-N 3.21Å; L445-P449 WeakPolarHBondContact O-CD 3.34Å; L445-P449 VanDerWaalsContact O-CG 3.26Å; L445-P449 WeakPolarHBondContact O-CG 3.4Å
446	N	90.6	Very high	90.4	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-70	-57.3	166.5	167.8	-4.9	0	0	0	109.8	G204 G442 R443 A444 L450	G204-N446 VanDerWaalsContact C-ND2 3.34Å; G204-N446 WeakPolarHBondContact CA-OD1 3.31Å; G204-N446 PolarHBondContact O-ND2 3.08Å; G442-N446 WeakPolarHBondContact O-CB 3.28Å; G442-N446 PolarHBondContact O-N 3.19Å; R443-N446 PolarHBondContact O-N 3.24Å; A444-N446 VanDerWaalsContact C-N 3.34Å; N446-L450 VanDerWaalsContact O-CB 3.27Å; N446-L450 WeakPolarHBondContact O-CB 3.13Å; N446-L450 VanDerWaalsContact O-CD1 3.32Å; N446-L450 WeakPolarHBondContact O-CD1 3.4Å; N446-L450 PolarHBondContact O-N 3.21Å
447	I	91.1	Very high	89.2	Confident	3 Å²	3	49 Å²	49	2%	0.015	26%	0.264	C	S	.	.	H	α-helix	trans	-75.8	-55.5	-165.3	-68.3	172.6	0	0	0	112.8	R443 A444 L450 S451 Q467 M470 M471	R443-I447 HydrophobicContact CG-CD1 3.99Å; R443-I447 PolarHBondContact O-N 3.05Å; A444-I447 PolarHBondContact O-N 3.49Å; I447-L450 PolarHBondContact O-N 3.44Å; I447-S451 WeakPolarHBondContact O-CB 3.34Å; I447-S451 PolarHBondContact O-N 3.27Å; I447-S451 PolarHBondContact O-OG 3.06Å; I447-Q467 HydrophobicContact CG2-CB 4.4Å; I447-M470 VanDerWaalsContact CD1-C 3.45Å; I447-M470 HydrophobicContact CD1-CB 4.01Å; I447-M470 WeakPolarHBondContact CD1-O 3.45Å; I447-M470 HydrophobicContact CG2-CB 4.41Å; I447-M470 HydrophobicContact CG2-CE 4.14Å; I447-M471 VanDerWaalsContact CD1-CA 3.48Å; I447-M471 HydrophobicContact CD1-CB 4.15Å
448	Y	92.4	Very high	88.1	Confident	78 Å²	78	47.9 Å²	47.9	31%	0.306	25%	0.252	S	S	.	.	H	α-helix	trans	-65.4	-46.1	-169.8	-60.8	-71.3	0	0	0	113.4	A444 S451 F452 Q467 H468 M471	A444-Y448 HydrophobicContact CB-CD2 4.02Å; A444-Y448 HydrophobicContact CB-CE2 4.01Å; A444-Y448 VanDerWaalsContact O-CD2 3.23Å; A444-Y448 WeakPolarHBondContact O-CD2 3.33Å; A444-Y448 PolarHBondContact O-N 3.07Å; A444-Y448 VanDerWaalsContact O-N 3.08Å; Y448-S451 PolarHBondContact O-N 3.47Å; Y448-F452 WeakPolarHBondContact O-CB 3.49Å; Y448-F452 PolarHBondContact O-N 3.22Å; Y448-Q467 HydrophobicContact CD1-CB 4.28Å; Y448-Q467 HydrophobicContact CE1-CB 4.12Å; Y448-H468 PolarHBondContact OH-CD2 2.97Å; Y448-M471 HydrophobicContact CE2-CG 4.46Å
449	P	91.4	Very high	86.2	Confident	62 Å²	62	55.2 Å²	55.2	40%	0.403	28%	0.28	S	S	.	.	H	α-helix	trans	-66	-41.5	178	-22.4	36.4	0	0	0	112.8	A444 L445 F452 L453	A444-P449 WeakPolarHBondContact O-CD 3.5Å; L445-P449 WeakPolarHBondContact O-CD 3.34Å; L445-P449 VanDerWaalsContact O-CG 3.26Å; L445-P449 WeakPolarHBondContact O-CG 3.4Å; P449-F452 WeakPolarHBondContact O-CB 3.27Å; P449-F452 PolarHBondContact O-N 2.84Å; P449-L453 PolarHBondContact O-N 3.34Å
450	L	88.2	Confident	84.8	Confident	12 Å²	12	59.8 Å²	59.8	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-68.9	-40.6	177.1	-86.3	63	0	0	0	111.3	T199 Y200 L203 G204 N446 I447 F452 L453 L454	T199-L450 HydrophobicContact CG2-CD2 4.25Å; Y200-L450 HydrophobicContact CD1-CB 4.13Å; Y200-L450 HydrophobicContact CD1-CD2 4.03Å; Y200-L450 HydrophobicContact CE1-CB 3.78Å; L203-L450 HydrophobicContact CB-CD2 4.1Å; L203-L450 HydrophobicContact CD2-CD1 4.36Å; L203-L450 HydrophobicContact CD2-CD2 4.35Å; L203-L450 HydrophobicContact CD2-CG 4.22Å; L203-L450 HydrophobicContact CG-CD1 4.41Å; L203-L450 HydrophobicContact CG-CD2 4.2Å; L203-L450 HydrophobicContact CG-CG 4.47Å; G204-L450 VanDerWaalsContact CA-CD2 3.49Å; N446-L450 VanDerWaalsContact O-CB 3.27Å; N446-L450 WeakPolarHBondContact O-CB 3.13Å; N446-L450 VanDerWaalsContact O-CD1 3.32Å; N446-L450 WeakPolarHBondContact O-CD1 3.4Å; N446-L450 PolarHBondContact O-N 3.21Å; I447-L450 PolarHBondContact O-N 3.44Å; L450-F452 VanDerWaalsContact C-N 3.27Å; L450-F452 PolarHBondContact O-N 2.93Å; L450-L453 PolarHBondContact O-N 3.45Å; L450-L454 WeakPolarHBondContact O-CB 3.35Å; L450-L454 VanDerWaalsContact O-CG 3.27Å; L450-L454 WeakPolarHBondContact O-CG 3.26Å; L450-L454 PolarHBondContact O-N 3.23Å
451	S	88.1	Confident	83.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-57.3	-42	172.5	-73.6	0	0	0	0	111.3	Y200 I447 Y448 N455 Q467	Y200-S451 VanDerWaalsContact OH-CA 3.32Å; Y200-S451 WeakPolarHBondContact OH-CA 3.19Å; Y200-S451 WeakPolarHBondContact OH-CB 3.41Å; Y200-S451 PolarHBondContact OH-OG 2.83Å; I447-S451 WeakPolarHBondContact O-CB 3.34Å; I447-S451 PolarHBondContact O-N 3.27Å; I447-S451 PolarHBondContact O-OG 3.06Å; Y448-S451 PolarHBondContact O-N 3.47Å; S451-N455 WeakPolarHBondContact O-CB 3.29Å; S451-N455 PolarHBondContact O-N 3.37Å; S451-N455 PolarHBondContact O-ND2 2.89Å; S451-Q467 VanDerWaalsContact CB-CD 3.5Å
452	F	87.8	Confident	83.1	Confident	151 Å²	151	60.2 Å²	60.2	66%	0.662	30%	0.303	S	S	*	.	H	α-helix	trans	-63.2	-46.6	176.1	177.2	-99.1	0	0	0	111.8	Y448 P449 L450 L454 N455 L456	Y448-F452 WeakPolarHBondContact O-CB 3.49Å; Y448-F452 PolarHBondContact O-N 3.22Å; P449-F452 WeakPolarHBondContact O-CB 3.27Å; P449-F452 PolarHBondContact O-N 2.84Å; L450-F452 VanDerWaalsContact C-N 3.27Å; L450-F452 PolarHBondContact O-N 2.93Å; F452-L454 PolarHBondContact O-N 3.17Å; F452-N455 PolarHBondContact O-N 2.81Å; F452-L456 PolarHBondContact O-N 3.38Å
453	L	86.8	Confident	82.5	Confident	109 Å²	109	68.4 Å²	68.4	57%	0.571	33%	0.334	S	S	*	.	H	α-helix	trans	-63.4	-41.9	178.4	-172.6	140.2	0	0	0	112	P449 L450 L456	P449-L453 PolarHBondContact O-N 3.34Å; L450-L453 PolarHBondContact O-N 3.45Å; L453-L456 WeakPolarHBondContact O-CB 3.34Å; L453-L456 PolarHBondContact O-N 2.89Å
454	L	85.1	Confident	82.1	Confident	23 Å²	23	69.5 Å²	69.5	12%	0.12	35%	0.348	C	S	.	.	H	α-helix	trans	-67.6	-38.4	175.5	-71.8	171	0	0	0	111.9	T199 Y200 L450 F452 L456 G457 R458	T199-L454 HydrophobicContact CG2-CD1 4.21Å; T199-L454 HydrophobicContact CG2-CD2 4.01Å; T199-L454 HydrophobicContact CG2-CG 4.23Å; Y200-L454 HydrophobicContact CD2-CD1 4.22Å; Y200-L454 HydrophobicContact CE1-CD1 4.25Å; Y200-L454 HydrophobicContact CE2-CD1 3.63Å; L450-L454 WeakPolarHBondContact O-CB 3.35Å; L450-L454 VanDerWaalsContact O-CG 3.27Å; L450-L454 WeakPolarHBondContact O-CG 3.26Å; L450-L454 PolarHBondContact O-N 3.23Å; F452-L454 PolarHBondContact O-N 3.17Å; L454-L456 PolarHBondContact O-N 2.88Å; L454-G457 PolarHBondContact O-N 3.35Å; L454-G457 VanDerWaalsContact O-N 3.15Å; L454-R458 WeakPolarHBondContact O-CB 3.27Å; L454-R458 PolarHBondContact O-N 3Å
455	N	85.8	Confident	81.8	Confident	31 Å²	31	70.7 Å²	70.7	17%	0.166	35%	0.35	C	S	.	.	H	α-helix	trans	-67	-19.1	177.6	-80.5	-15.2	0	0	0	113.4	S451 F452 I462 Q467	S451-N455 WeakPolarHBondContact O-CB 3.29Å; S451-N455 PolarHBondContact O-N 3.37Å; S451-N455 PolarHBondContact O-ND2 2.89Å; F452-N455 PolarHBondContact O-N 2.81Å; N455-I462 PolarHBondContact ND2-O 2.95Å; N455-I462 VanDerWaalsContact ND2-O 3.14Å; N455-I462 PolarHBondContact OD1-N 3.37Å; N455-Q467 PolarHBondContact ND2-NE2 3.5Å
456	L	81.7	Confident	81.5	Confident	151 Å²	151	69.2 Å²	69.2	79%	0.791	34%	0.34	S	S	*	.	H	α-helix	trans	-72.1	-31.5	173.7	-169.4	61.3	0	0	0	112	F452 L453 L454	F452-L456 PolarHBondContact O-N 3.38Å; L453-L456 WeakPolarHBondContact O-CB 3.34Å; L453-L456 PolarHBondContact O-N 2.89Å; L454-L456 PolarHBondContact O-N 2.88Å
457	G	69.7	Low	81.5	Confident	50 Å²	50	70.2 Å²	70.2	52%	0.515	35%	0.345	S	S	.	.	H	α-helix	trans	-100.7	-11.2	-178.9	0	0	0	0	0	115.3	L454	L454-G457 PolarHBondContact O-N 3.35Å; L454-G457 VanDerWaalsContact O-N 3.15Å
458	R	69.2	Low	81.5	Confident	52 Å²	52	74.1 Å²	74.1	20%	0.196	36%	0.363	C	S	.	.			trans	-101.9	133.9	-171.1	-169.3	173.1	161.4	157.1	-1.3	112	N193 S196 L454 D460	N193-R458 VanDerWaalsContact OD1-CZ 3.27Å; N193-R458 PolarHBondContact OD1-NH1 3.34Å; N193-R458 PolarHBondContact OD1-NH2 2.91Å; S196-R458 PolarHBondContact OG-NH1 3.44Å; L454-R458 WeakPolarHBondContact O-CB 3.27Å; L454-R458 PolarHBondContact O-N 3Å; R458-D460 VanDerWaalsContact CD-O 3.25Å; R458-D460 WeakPolarHBondContact CD-O 3.47Å; R458-D460 WeakPolarHBondContact CG-O 3.28Å; R458-D460 PolarHBondContact NE-O 2.83Å
459	R	54.8	Low	81.3	Confident	155 Å²	155	70.4 Å²	70.4	59%	0.585	35%	0.349	S	S	*	.	S	Bend	trans	-71.7	-48.2	174.1	-70.4	-170.1	179.4	-160.3	-0.8	111.8	K461 K558	R459-K461 PolarHBondContact O-N 3.39Å; R459-K461 VanDerWaalsContact O-N 3.17Å; R459-K558 VanDerWaalsContact NH1-CE 3.3Å; R459-K558 VanDerWaalsContact NH1-NZ 3.17Å
460	D	64.5	Low	81.1	Confident	108 Å²	108	67.7 Å²	67.7	58%	0.578	33%	0.331	S	S	*	.	S	Bend	trans	-84.2	86	174.3	-63.6	-34.9	0	0	0	110.6	R458 I462	R458-D460 VanDerWaalsContact CD-O 3.25Å; R458-D460 WeakPolarHBondContact CD-O 3.47Å; R458-D460 WeakPolarHBondContact CG-O 3.28Å; R458-D460 PolarHBondContact NE-O 2.83Å; D460-I462 PolarHBondContact O-N 3.45Å
461	K	72.6	Confident	81.2	Confident	153 Å²	153	68.8 Å²	68.8	67%	0.665	34%	0.336	S	S	*	.			trans	-60.2	136.4	-174.4	-64.3	177.7	-177.4	176.4	0	111.7	R459 R463	R459-K461 PolarHBondContact O-N 3.39Å; R459-K461 VanDerWaalsContact O-N 3.17Å; K461-R463 PolarHBondContact O-N 2.89Å
462	I	77.8	Confident	81.3	Confident	9 Å²	9	70.3 Å²	70.3	5%	0.046	34%	0.342	C	S	.	.			trans	-68.8	104.3	170.3	-55.9	174.6	0	0	0	107.2	Y200 L269 N455 D460 F466 Q467 M470	Y200-I462 HydrophobicContact CE2-CD1 4.22Å; Y200-I462 WeakPolarHBondContact OH-CD1 3.36Å; L269-I462 HydrophobicContact CD1-CD1 4.23Å; N455-I462 PolarHBondContact ND2-O 2.95Å; N455-I462 VanDerWaalsContact ND2-O 3.14Å; N455-I462 PolarHBondContact OD1-N 3.37Å; D460-I462 PolarHBondContact O-N 3.45Å; I462-F466 HydrophobicContact CG2-CB 3.9Å; I462-Q467 HydrophobicContact CG2-CG 3.86Å; I462-Q467 PolarHBondContact O-NE2 2.94Å; I462-M470 HydrophobicContact CG2-CE 3.65Å
463	R	80.1	Confident	81.1	Confident	172 Å²	172	63.1 Å²	63.1	65%	0.649	31%	0.311	S	S	*	.			trans	-58.1	147.8	-177.8	-161.5	173.6	-169.7	-172.6	3.6	110.4	K461 N465 F466 Q467	K461-R463 PolarHBondContact O-N 2.89Å; R463-N465 PolarHBondContact O-N 2.85Å; R463-N465 VanDerWaalsContact O-N 3.15Å; R463-F466 WeakPolarHBondContact O-CA 3.27Å; R463-F466 WeakPolarHBondContact O-CB 3.33Å; R463-F466 PolarHBondContact O-N 3.04Å; R463-Q467 PolarHBondContact O-N 3.29Å
464	G	82.6	Confident	80.9	Confident	30 Å²	30	58.4 Å²	58.4	31%	0.309	29%	0.289	S	S	.	.	H	α-helix	trans	-51.3	-40.3	177.2	0	0	0	0	0	112.6	F466 Q467 H468	G464-F466 VanDerWaalsContact C-N 3.33Å; G464-F466 PolarHBondContact O-N 2.88Å; G464-Q467 WeakPolarHBondContact O-CB 3.44Å; G464-Q467 PolarHBondContact O-N 2.82Å; G464-H468 PolarHBondContact O-N 3.49Å; G464-H468 PolarHBondContact O-ND1 3.37Å
465	N	86.1	Confident	80.7	Confident	53 Å²	53	57.3 Å²	57.3	28%	0.283	28%	0.283	S	S	.	.	H	α-helix	trans	-56.1	-44.2	174.4	-66.8	25.1	0	0	0	112	R463 Q467 H468 M469 L522	R463-N465 PolarHBondContact O-N 2.85Å; R463-N465 VanDerWaalsContact O-N 3.15Å; N465-Q467 VanDerWaalsContact C-N 3.3Å; N465-Q467 PolarHBondContact O-N 3.27Å; N465-H468 PolarHBondContact O-N 2.97Å; N465-M469 PolarHBondContact O-N 2.81Å; N465-M469 VanDerWaalsContact O-N 3.08Å; N465-L522 HydrophobicContact CB-CD1 4.42Å; N465-L522 HydrophobicContact CB-CD2 4.37Å; N465-L522 HydrophobicContact CB-CG 3.85Å; N465-L522 PolarHBondContact ND2-O 3.49Å; N465-L522 WeakPolarHBondContact O-CD2 3.42Å
466	F	86	Confident	80.8	Confident	48 Å²	48	55.8 Å²	55.8	21%	0.211	28%	0.275	C	S	.	.	H	α-helix	trans	-65.1	-35.8	176.6	-68.2	-3.6	0	0	0	111.8	D263 L266 I462 R463 G464 M469 M470 I524	D263-F466 HydrophobicContact CB-CZ 4.38Å; L266-F466 HydrophobicContact CD1-CB 4.26Å; L266-F466 HydrophobicContact CD1-CG 4.43Å; L266-F466 HydrophobicContact CD2-CD1 4.29Å; I462-F466 HydrophobicContact CG2-CB 3.9Å; R463-F466 WeakPolarHBondContact O-CA 3.27Å; R463-F466 WeakPolarHBondContact O-CB 3.33Å; R463-F466 PolarHBondContact O-N 3.04Å; G464-F466 VanDerWaalsContact C-N 3.33Å; G464-F466 PolarHBondContact O-N 2.88Å; F466-M469 PolarHBondContact O-N 3.09Å; F466-M470 VanDerWaalsContact O-CG 3.26Å; F466-M470 WeakPolarHBondContact O-CG 3.45Å; F466-M470 PolarHBondContact O-N 2.94Å; F466-I524 HydrophobicContact CD1-CD1 4.42Å; F466-I524 HydrophobicContact CD1-CG1 4.31Å; F466-I524 HydrophobicContact CE1-CG1 4.19Å; F466-I524 HydrophobicContact CE1-CG2 4.3Å
467	Q	89.8	Confident	80.9	Confident	25 Å²	25	48.7 Å²	48.7	12%	0.117	24%	0.238	C	C	.	.	H	α-helix	trans	-64.2	-44.1	176.7	-57.4	176.1	12.6	0	0	112.9	I447 Y448 S451 N455 I462 R463 G464 N465 M469 M470 M471	I447-Q467 HydrophobicContact CG2-CB 4.4Å; Y448-Q467 HydrophobicContact CD1-CB 4.28Å; Y448-Q467 HydrophobicContact CE1-CB 4.12Å; S451-Q467 VanDerWaalsContact CB-CD 3.5Å; N455-Q467 PolarHBondContact ND2-NE2 3.5Å; I462-Q467 HydrophobicContact CG2-CG 3.86Å; I462-Q467 PolarHBondContact O-NE2 2.94Å; R463-Q467 PolarHBondContact O-N 3.29Å; G464-Q467 WeakPolarHBondContact O-CB 3.44Å; G464-Q467 PolarHBondContact O-N 2.82Å; N465-Q467 VanDerWaalsContact C-N 3.3Å; N465-Q467 PolarHBondContact O-N 3.27Å; Q467-M469 VanDerWaalsContact C-N 3.29Å; Q467-M469 PolarHBondContact O-N 2.76Å; Q467-M470 HydrophobicContact CB-CE 4.18Å; Q467-M470 HydrophobicContact CG-CE 3.94Å; Q467-M470 PolarHBondContact O-N 3.5Å; Q467-M471 WeakPolarHBondContact O-CB 3.46Å; Q467-M471 PolarHBondContact O-N 3.47Å
468	H	90.3	Very high	81.5	Confident	84 Å²	84	46.6 Å²	46.6	39%	0.389	22%	0.216	S	C	.	.	H	α-helix	trans	-64.2	-37.3	176	-67	87.9	0	0	0	111.3	Y448 G464 N465 M471 F472 L522	Y448-H468 PolarHBondContact OH-CD2 2.97Å; G464-H468 PolarHBondContact O-N 3.49Å; G464-H468 PolarHBondContact O-ND1 3.37Å; N465-H468 PolarHBondContact O-N 2.97Å; H468-M471 PolarHBondContact O-N 3.16Å; H468-F472 WeakPolarHBondContact O-CB 3.31Å; H468-F472 PolarHBondContact O-N 3.21Å; H468-L522 HydrophobicContact CB-CD1 4.11Å; H468-L522 HydrophobicContact CB-CD2 4.08Å
469	M	88.9	Confident	82.4	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-66.7	-44.1	174.4	-175.4	55.2	78.7	0	0	112	F257 L266 N465 F466 Q467 M471 F472 A473 M518 L519 L522 I524	F257-M469 HydrophobicContact CE1-SD 4.43Å; F257-M469 HydrophobicContact CE2-CG 4.47Å; F257-M469 HydrophobicContact CZ-CE 4.34Å; F257-M469 HydrophobicContact CZ-CG 3.76Å; F257-M469 HydrophobicContact CZ-SD 3.9Å; L266-M469 HydrophobicContact CD2-CB 4.43Å; L266-M469 HydrophobicContact CD2-CG 3.99Å; N465-M469 PolarHBondContact O-N 2.81Å; N465-M469 VanDerWaalsContact O-N 3.08Å; F466-M469 PolarHBondContact O-N 3.09Å; Q467-M469 VanDerWaalsContact C-N 3.29Å; Q467-M469 PolarHBondContact O-N 2.76Å; M469-M471 VanDerWaalsContact C-N 3.27Å; M469-M471 PolarHBondContact O-N 2.93Å; M469-F472 PolarHBondContact O-N 3.33Å; M469-F472 VanDerWaalsContact O-N 3.17Å; M469-F472 HydrophobicContact SD-CD1 4.41Å; M469-A473 WeakPolarHBondContact O-CB 3.5Å; M469-A473 PolarHBondContact O-N 2.95Å; M469-M518 HydrophobicContact CE-CB 4.35Å; M469-M518 HydrophobicContact CE-CG 3.81Å; M469-M518 HydrophobicContact SD-CG 4.26Å; M469-L519 HydrophobicContact CE-CB 4.02Å; M469-L519 HydrophobicContact CE-CD1 3.67Å; M469-L519 HydrophobicContact CE-CG 4.48Å; M469-L522 HydrophobicContact CB-CD2 3.78Å; M469-L522 HydrophobicContact CE-CD2 4.32Å; M469-I524 HydrophobicContact CB-CD1 3.84Å; M469-I524 HydrophobicContact CE-CD1 3.69Å; M469-I524 HydrophobicContact CG-CD1 3.94Å
470	M	88.3	Confident	84.1	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.025	18%	0.181	C	C	.	.	H	α-helix	trans	-61.8	-36	175.9	-69.8	-176.9	-62.3	0	0	112.6	L266 L269 R443 I447 I462 F466 Q467	L266-M470 HydrophobicContact CD1-CG 3.95Å; L269-M470 HydrophobicContact CD2-CG 4.32Å; L269-M470 HydrophobicContact CD2-SD 3.14Å; L269-M470 WeakPolarHBondContact CD2-SD 3.26Å; R443-M470 PolarHBondContact NH2-O 3.48Å; I447-M470 VanDerWaalsContact CD1-C 3.45Å; I447-M470 HydrophobicContact CD1-CB 4.01Å; I447-M470 WeakPolarHBondContact CD1-O 3.45Å; I447-M470 HydrophobicContact CG2-CB 4.41Å; I447-M470 HydrophobicContact CG2-CE 4.14Å; I462-M470 HydrophobicContact CG2-CE 3.65Å; F466-M470 VanDerWaalsContact O-CG 3.26Å; F466-M470 WeakPolarHBondContact O-CG 3.45Å; F466-M470 PolarHBondContact O-N 2.94Å; Q467-M470 HydrophobicContact CB-CE 4.18Å; Q467-M470 HydrophobicContact CG-CE 3.94Å; Q467-M470 PolarHBondContact O-N 3.5Å
471	M	90.1	Very high	85.2	Confident	35 Å²	35	32.2 Å²	32.2	17%	0.172	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-45.8	173.8	176.2	64.9	-163.8	0	0	111.1	F440 R443 A444 I447 Y448 Q467 H468 M469	F440-M471 HydrophobicContact CD1-CE 4.25Å; F440-M471 VanDerWaalsContact O-CE 3.28Å; F440-M471 WeakPolarHBondContact O-CE 3.41Å; R443-M471 VanDerWaalsContact C-SD 3.5Å; R443-M471 HydrophobicContact CB-CE 3.81Å; R443-M471 HydrophobicContact CB-SD 3.66Å; R443-M471 HydrophobicContact CG-CE 4.03Å; R443-M471 HydrophobicContact CG-SD 3.35Å; R443-M471 WeakPolarHBondContact CG-SD 3.4Å; A444-M471 HydrophobicContact CB-CE 4.14Å; A444-M471 HydrophobicContact CB-SD 4.17Å; A444-M471 PolarHBondContact N-SD 3.41Å; A444-M471 VanDerWaalsContact N-SD 3.4Å; I447-M471 VanDerWaalsContact CD1-CA 3.48Å; I447-M471 HydrophobicContact CD1-CB 4.15Å; Y448-M471 HydrophobicContact CE2-CG 4.46Å; Q467-M471 WeakPolarHBondContact O-CB 3.46Å; Q467-M471 PolarHBondContact O-N 3.47Å; H468-M471 PolarHBondContact O-N 3.16Å; M469-M471 VanDerWaalsContact C-N 3.27Å; M469-M471 PolarHBondContact O-N 2.93Å
472	F	88.8	Confident	85.9	Confident	31 Å²	31	25 Å²	25	14%	0.136	12%	0.123	C	C	.	.	H	α-helix	trans	-69.5	-37.7	179.2	-174.9	-91.9	0	0	0	113.1	H468 M469 G474 F511 G514 M518	H468-F472 WeakPolarHBondContact O-CB 3.31Å; H468-F472 PolarHBondContact O-N 3.21Å; M469-F472 PolarHBondContact O-N 3.33Å; M469-F472 VanDerWaalsContact O-N 3.17Å; M469-F472 HydrophobicContact SD-CD1 4.41Å; F472-G474 PolarHBondContact O-N 3.09Å; F472-F511 AromaticContact CD2-CD1 3.7Å; F472-F511 HydrophobicContact CD2-CD1 3.7Å; F472-F511 HydrophobicContact CD2-CE1 4.12Å; F472-F511 HydrophobicContact CE1-CB 4.35Å; F472-F511 HydrophobicContact CE1-CD1 4.41Å; F472-F511 VanDerWaalsContact CE1-O 3.24Å; F472-F511 WeakPolarHBondContact CE1-O 3.39Å; F472-F511 AromaticContact CE2-CD1 3.42Å; F472-F511 HydrophobicContact CE2-CD1 3.42Å; F472-F511 VanDerWaalsContact CE2-CD1 3.42Å; F472-F511 AromaticContact CE2-CE1 3.97Å; F472-F511 HydrophobicContact CE2-CE1 3.97Å; F472-F511 HydrophobicContact CG-CD1 4.38Å; F472-F511 HydrophobicContact CZ-CB 4.3Å; F472-F511 AromaticContact CZ-CD1 3.79Å; F472-F511 HydrophobicContact CZ-CD1 3.79Å; F472-G514 WeakPolarHBondContact CZ-O 3.35Å; F472-M518 HydrophobicContact CB-CE 3.98Å; F472-M518 HydrophobicContact CB-CG 4.36Å; F472-M518 HydrophobicContact CD1-CB 4.13Å; F472-M518 HydrophobicContact CD1-CG 3.88Å; F472-M518 HydrophobicContact CD2-CE 3.16Å; F472-M518 HydrophobicContact CD2-CG 4.12Å; F472-M518 HydrophobicContact CD2-SD 4.47Å; F472-M518 HydrophobicContact CE1-CB 3.9Å; F472-M518 HydrophobicContact CE1-CG 4.16Å; F472-M518 HydrophobicContact CE2-CB 4.3Å; F472-M518 HydrophobicContact CE2-CE 3.65Å; F472-M518 HydrophobicContact CE2-CG 4.31Å; F472-M518 HydrophobicContact CG-CB 4.46Å; F472-M518 HydrophobicContact CG-CE 3.66Å; F472-M518 HydrophobicContact CG-CG 3.85Å; F472-M518 HydrophobicContact CZ-CB 3.97Å; F472-M518 HydrophobicContact CZ-CG 4.36Å
473	A	85.4	Confident	86.3	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-3.5	-175.6	0	0	0	0	0	114.3	P250 V253 L270 M469 L475	P250-A473 WeakPolarHBondContact CB-O 3.3Å; V253-A473 HydrophobicContact CB-CB 4.35Å; V253-A473 HydrophobicContact CG1-CB 3.87Å; V253-A473 HydrophobicContact CG2-CB 4.07Å; L270-A473 HydrophobicContact CD1-CB 3.69Å; L270-A473 HydrophobicContact CD2-CB 3.71Å; L270-A473 HydrophobicContact CG-CB 4.38Å; M469-A473 WeakPolarHBondContact O-CB 3.5Å; M469-A473 PolarHBondContact O-N 2.95Å; A473-L475 PolarHBondContact O-N 3Å
474	G	81.1	Confident	86.8	Confident	10 Å²	10	16.6 Å²	16.6	10%	0.103	9%	0.092	C	C	.	.			trans	-72.3	54	179.2	0	0	0	0	0	114.3	F472	F472-G474 PolarHBondContact O-N 3.09Å
475	L	82.7	Confident	87	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.08	C	C	.	.			trans	-58.6	143.6	175.1	-67	178.7	0	0	0	110.7	T248 D249 V253 A473 T507 F511	T248-L475 CarbonylContact C-O 3.58Å; T248-L475 VanDerWaalsContact CA-O 3.25Å; T248-L475 WeakPolarHBondContact CA-O 3.41Å; T248-L475 WeakPolarHBondContact CB-O 3.36Å; D249-L475 PolarHBondContact N-O 2.93Å; D249-L475 VanDerWaalsContact O-CB 3.22Å; D249-L475 WeakPolarHBondContact O-CB 3.47Å; V253-L475 HydrophobicContact CG2-CD1 3.69Å; V253-L475 HydrophobicContact CG2-CG 4.2Å; A473-L475 PolarHBondContact O-N 3Å; L475-T507 WeakPolarHBondContact CD2-O 3.43Å; L475-F511 HydrophobicContact CD2-CB 3.39Å; L475-F511 HydrophobicContact CD2-CG 4.45Å
476	R	87.1	Confident	86.9	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.085	C	C	.	.			trans	-96.1	136.7	167.8	-55.6	-54.9	177.8	-177	3.5	107.3	I245 S246 A247 I503 V504 T507	I245-R476 VanDerWaalsContact O-CD 3.3Å; I245-R476 WeakPolarHBondContact O-CD 3.28Å; I245-R476 PolarHBondContact O-NE 3.48Å; I245-R476 PolarHBondContact O-NH1 3.2Å; I245-R476 PolarHBondContact O-NH2 3.49Å; S246-R476 PolarHBondContact O-NH1 3.38Å; A247-R476 VanDerWaalsContact C-NH1 3.3Å; A247-R476 VanDerWaalsContact O-CD 3.26Å; A247-R476 WeakPolarHBondContact O-CD 3.34Å; A247-R476 PolarHBondContact O-NH1 3.3Å; R476-I503 HydrophobicContact CB-CG2 4.13Å; R476-I503 HydrophobicContact CG-CG2 3.84Å; R476-V504 HydrophobicContact CB-CG2 3.93Å; R476-T507 HydrophobicContact CG-CG2 4.47Å; R476-T507 PolarHBondContact N-OG1 3.12Å; R476-T507 PolarHBondContact O-OG1 3.15Å
477	G	83.4	Confident	86.6	Confident	2 Å²	2	18.3 Å²	18.3	2%	0.021	9%	0.088	C	C	.	.			trans	-146.5	-139.8	-174.4	0	0	0	0	0	113.5	D249 M479 A480 F481	D249-G477 WeakPolarHBondContact OD2-CA 3.35Å; G477-M479 VanDerWaalsContact C-N 3.34Å; G477-M479 PolarHBondContact O-N 3.17Å; G477-A480 PolarHBondContact O-N 3.4Å; G477-F481 PolarHBondContact O-N 2.96Å
478	A	83	Confident	86.2	Confident	6 Å²	6	18.9 Å²	18.9	5%	0.05	9%	0.094	C	C	.	.	H	α-helix	trans	-56.3	-41.5	-165.4	0	0	0	0	0	114.3	F169 D249 I411 M415 F481 A482	F169-A478 HydrophobicContact CZ-CB 4.27Å; D249-A478 PolarHBondContact OD2-N 3.43Å; I411-A478 HydrophobicContact CG2-CB 3.54Å; M415-A478 HydrophobicContact CE-CB 4.16Å; A478-F481 WeakPolarHBondContact O-CB 3.38Å; A478-F481 PolarHBondContact O-N 3.48Å; A478-A482 WeakPolarHBondContact O-CB 3.35Å; A478-A482 PolarHBondContact O-N 3.36Å
479	M	87.4	Confident	85.6	Confident	8 Å²	8	19.1 Å²	19.1	4%	0.039	11%	0.11	C	C	.	.	H	α-helix	trans	-69.3	-41.6	-176.5	-70.8	-41.9	112.1	0	0	113.4	F169 L174 A247 D278 G477 F481 A482 L483	F169-M479 HydrophobicContact CE1-CE 3.73Å; F169-M479 HydrophobicContact CE1-SD 3.79Å; F169-M479 HydrophobicContact CZ-CE 3.42Å; F169-M479 VanDerWaalsContact CZ-CE 3.42Å; F169-M479 HydrophobicContact CZ-SD 4.04Å; L174-M479 HydrophobicContact CD1-CE 3.27Å; L174-M479 HydrophobicContact CD1-SD 3.39Å; L174-M479 WeakPolarHBondContact CD1-SD 3.44Å; L174-M479 HydrophobicContact CD2-SD 4.3Å; A247-M479 HydrophobicContact CB-CB 4.21Å; D278-M479 HydrophobicContact CB-CG 3.91Å; D278-M479 VanDerWaalsContact OD2-CG 3.22Å; D278-M479 WeakPolarHBondContact OD2-CG 3.07Å; G477-M479 VanDerWaalsContact C-N 3.34Å; G477-M479 PolarHBondContact O-N 3.17Å; M479-F481 VanDerWaalsContact C-N 3.27Å; M479-F481 PolarHBondContact O-N 3Å; M479-A482 PolarHBondContact O-N 3.16Å; M479-L483 WeakPolarHBondContact O-CG 3.46Å; M479-L483 PolarHBondContact O-N 3.45Å
480	A	90	Very high	85.3	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-61.9	-40.1	177	0	0	0	0	0	110.8	I244 G477 A484 T500	I244-A480 HydrophobicContact CG2-CB 4.26Å; I244-A480 WeakPolarHBondContact CG2-O 3.5Å; G477-A480 PolarHBondContact O-N 3.4Å; A480-A484 WeakPolarHBondContact O-CB 3.27Å; A480-A484 PolarHBondContact O-N 3.45Å; A480-T500 HydrophobicContact CB-CG2 3.99Å
481	F	88.6	Confident	85	Confident	3 Å²	3	24.1 Å²	24.1	1%	0.013	14%	0.143	C	C	.	.	H	α-helix	trans	-62.3	-52	174.4	170.5	-101.9	0	0	0	112.2	Y414 M415 A418 G477 A478 M479 L483 A484 I485 F497 L501	Y414-F481 AromaticContact CD1-CE1 3.65Å; Y414-F481 HydrophobicContact CD1-CE1 3.65Å; Y414-F481 AromaticContact CD1-CZ 3.8Å; Y414-F481 HydrophobicContact CD1-CZ 3.8Å; Y414-F481 AromaticContact CE1-CE1 3.58Å; Y414-F481 HydrophobicContact CE1-CE1 3.58Å; Y414-F481 AromaticContact CE1-CZ 3.41Å; Y414-F481 HydrophobicContact CE1-CZ 3.41Å; Y414-F481 VanDerWaalsContact CE1-CZ 3.41Å; M415-F481 HydrophobicContact CG-CB 4.12Å; M415-F481 HydrophobicContact CG-CD1 3.6Å; M415-F481 HydrophobicContact CG-CD2 3.87Å; M415-F481 HydrophobicContact CG-CE1 3.91Å; M415-F481 HydrophobicContact CG-CE2 4.15Å; M415-F481 HydrophobicContact CG-CG 3.57Å; M415-F481 HydrophobicContact CG-CZ 4.17Å; M415-F481 HydrophobicContact SD-CB 3.62Å; M415-F481 HydrophobicContact SD-CD1 4.16Å; M415-F481 HydrophobicContact SD-CD2 4.33Å; M415-F481 HydrophobicContact SD-CG 3.78Å; A418-F481 HydrophobicContact CB-CE2 3.96Å; A418-F481 HydrophobicContact CB-CZ 3.92Å; G477-F481 PolarHBondContact O-N 2.96Å; A478-F481 WeakPolarHBondContact O-CB 3.38Å; A478-F481 PolarHBondContact O-N 3.48Å; M479-F481 VanDerWaalsContact C-N 3.27Å; M479-F481 PolarHBondContact O-N 3Å; F481-L483 VanDerWaalsContact C-N 3.34Å; F481-L483 PolarHBondContact O-N 3.47Å; F481-A484 PolarHBondContact O-N 2.82Å; F481-A484 VanDerWaalsContact O-N 3.11Å; F481-I485 HydrophobicContact CZ-CD1 4.18Å; F481-I485 PolarHBondContact O-N 3.08Å; F481-F497 AromaticContact CD2-CE2 4Å; F481-F497 HydrophobicContact CD2-CE2 4Å; F481-F497 AromaticContact CE2-CE2 3.6Å; F481-F497 HydrophobicContact CE2-CE2 3.6Å; F481-F497 AromaticContact CE2-CZ 3.93Å; F481-F497 HydrophobicContact CE2-CZ 3.93Å; F481-F497 HydrophobicContact CZ-CE2 4.43Å; F481-L501 HydrophobicContact CD2-CD1 3.84Å; F481-L501 HydrophobicContact CE2-CD1 3.9Å
482	A	86.7	Confident	84.6	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-61.3	-40.3	-177	0	0	0	0	0	113.2	F169 F170 A478 M479 A484 I485 R486	F169-A482 HydrophobicContact CD1-CB 3.31Å; F169-A482 HydrophobicContact CD2-CB 4.1Å; F169-A482 HydrophobicContact CE1-CB 3.1Å; F169-A482 HydrophobicContact CE2-CB 3.89Å; F169-A482 HydrophobicContact CG-CB 3.8Å; F169-A482 HydrophobicContact CZ-CB 3.39Å; F170-A482 HydrophobicContact CE1-CB 4.36Å; F170-A482 HydrophobicContact CE2-CB 4.23Å; F170-A482 HydrophobicContact CZ-CB 3.77Å; A478-A482 WeakPolarHBondContact O-CB 3.35Å; A478-A482 PolarHBondContact O-N 3.36Å; M479-A482 PolarHBondContact O-N 3.16Å; A482-A484 VanDerWaalsContact C-N 3.33Å; A482-A484 PolarHBondContact O-N 3.39Å; A482-I485 VanDerWaalsContact O-CG2 3.24Å; A482-I485 WeakPolarHBondContact O-CG2 3.49Å; A482-R486 PolarHBondContact O-N 3.23Å
483	L	87.3	Confident	84.5	Confident	2 Å²	2	22.4 Å²	22.4	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-68.6	-32.6	176.2	-74.4	173.6	0	0	0	112.8	F170 I244 I282 M479 F481	F170-L483 HydrophobicContact CE1-CD2 4.37Å; F170-L483 HydrophobicContact CZ-CD2 4.06Å; F170-L483 HydrophobicContact CZ-CG 4.45Å; I244-L483 HydrophobicContact CD1-CB 4.46Å; I244-L483 HydrophobicContact CG1-CB 3.96Å; I244-L483 HydrophobicContact CG2-CB 4.2Å; I282-L483 HydrophobicContact CG1-CD1 3.92Å; I282-L483 HydrophobicContact CG1-CD2 4.08Å; I282-L483 HydrophobicContact CG1-CG 4.32Å; M479-L483 WeakPolarHBondContact O-CG 3.46Å; M479-L483 PolarHBondContact O-N 3.45Å; F481-L483 VanDerWaalsContact C-N 3.34Å; F481-L483 PolarHBondContact O-N 3.47Å
484	A	89.3	Confident	84.6	Confident	3 Å²	3	23.8 Å²	23.8	3%	0.025	14%	0.141	C	C	.	.	H	α-helix	trans	-74.7	-34.7	179.3	0	0	0	0	0	113	I244 A480 F481 A482 F497 T500	I244-A484 HydrophobicContact CD1-CB 4.42Å; I244-A484 HydrophobicContact CG2-CB 4.24Å; A480-A484 WeakPolarHBondContact O-CB 3.27Å; A480-A484 PolarHBondContact O-N 3.45Å; F481-A484 PolarHBondContact O-N 2.82Å; F481-A484 VanDerWaalsContact O-N 3.11Å; A482-A484 VanDerWaalsContact C-N 3.33Å; A482-A484 PolarHBondContact O-N 3.39Å; A484-F497 HydrophobicContact CB-CB 4.4Å; A484-F497 HydrophobicContact CB-CD2 3.96Å; A484-T500 HydrophobicContact CB-CG2 4.16Å
485	I	86.8	Confident	85	Confident	14 Å²	14	24 Å²	24	7%	0.072	14%	0.14	C	C	.	.	H	α-helix	trans	-77.1	-26.4	177.7	-167.9	166.8	0	0	0	112.7	P166 Y414 F481 A482 D487 F497	P166-I485 HydrophobicContact CB-CG2 4.18Å; Y414-I485 HydrophobicContact CE1-CD1 4.46Å; F481-I485 HydrophobicContact CZ-CD1 4.18Å; F481-I485 PolarHBondContact O-N 3.08Å; A482-I485 VanDerWaalsContact O-CG2 3.24Å; A482-I485 WeakPolarHBondContact O-CG2 3.49Å; I485-D487 PolarHBondContact O-N 3.36Å; I485-F497 HydrophobicContact CB-CD2 4.06Å; I485-F497 HydrophobicContact CB-CE2 3.71Å; I485-F497 HydrophobicContact CD1-CE2 4.3Å; I485-F497 HydrophobicContact CD1-CZ 4.37Å; I485-F497 HydrophobicContact CG1-CE2 4.12Å
486	R	84.5	Confident	85.3	Confident	101 Å²	101	24.2 Å²	24.2	38%	0.381	14%	0.141	S	C	.	.	H	α-helix	trans	-60.6	-30.3	-178.9	-168.7	173.8	67.4	173.8	1.4	113.4	P166 F170 A482	P166-R486 HydrophobicContact CB-CB 4.4Å; F170-R486 HydrophobicContact CE2-CB 4.19Å; F170-R486 HydrophobicContact CE2-CG 4.29Å; A482-R486 PolarHBondContact O-N 3.23Å
487	D	78.9	Confident	85.5	Confident	53 Å²	53	24.3 Å²	24.3	28%	0.283	14%	0.141	S	C	.	.			trans	-134.2	93.8	177.2	-170.2	-16.4	0	0	0	111.3	I485 A489 R493	I485-D487 PolarHBondContact O-N 3.36Å; D487-A489 PolarHBondContact OD1-N 3.41Å; D487-R493 VanDerWaalsContact O-CB 3.22Å; D487-R493 WeakPolarHBondContact O-CB 3.25Å; D487-R493 WeakPolarHBondContact O-CD 3.12Å; D487-R493 VanDerWaalsContact OD1-CD 3.29Å; D487-R493 WeakPolarHBondContact OD1-CD 3.32Å; D487-R493 IonicContact OD2-CZ 3.63Å; D487-R493 IonicContact OD2-NE 3.01Å; D487-R493 IonicContact OD2-NH1 3.86Å; D487-R493 PolarHBondContact OD2-NH1 3.26Å; D487-R493 IonicContact OD2-NH2 2.76Å
488	T	81.6	Confident	85.8	Confident	37 Å²	37	24.2 Å²	24.2	23%	0.227	14%	0.14	C	C	.	.			trans	-113.2	25.6	174.4	62.6	0	0	0	0	112.4	F422 T490 Q494 F497	F422-T488 HydrophobicContact CZ-CG2 4.25Å; T488-T490 VanDerWaalsContact C-N 3.32Å; T488-T490 PolarHBondContact O-N 2.88Å; T488-Q494 WeakPolarHBondContact O-CG 3.49Å; T488-Q494 PolarHBondContact O-NE2 3.16Å; T488-F497 HydrophobicContact CG2-CB 4.23Å; T488-F497 HydrophobicContact CG2-CG 4.31Å
489	A	78.8	Confident	86.3	Confident	89 Å²	89	23.9 Å²	23.9	74%	0.736	14%	0.138	S	C	*	.			trans	-67.7	-31.4	-172.5	0	0	0	0	0	113.1	D487	D487-A489 PolarHBondContact OD1-N 3.41Å
490	T	82.4	Confident	86.6	Confident	66 Å²	66	23.6 Å²	23.6	41%	0.405	14%	0.136	S	C	.	.	S	Bend	trans	-107.5	154.2	-179.7	66.9	0	0	0	0	111.8	T488 A492 R493 Q494	T488-T490 VanDerWaalsContact C-N 3.32Å; T488-T490 PolarHBondContact O-N 2.88Å; T490-A492 PolarHBondContact O-N 3.34Å; T490-R493 WeakPolarHBondContact O-CA 3.11Å; T490-R493 PolarHBondContact O-N 3.4Å; T490-R493 WeakPolarHBondContact OG1-CB 3.39Å; T490-R493 VanDerWaalsContact OG1-CG 3.31Å; T490-R493 WeakPolarHBondContact OG1-CG 3.31Å; T490-R493 PolarHBondContact OG1-N 2.92Å; T490-Q494 WeakPolarHBondContact O-CG 3.24Å; T490-Q494 PolarHBondContact O-N 3.32Å
491	S	80.4	Confident	86.6	Confident	45 Å²	45	23.5 Å²	23.5	32%	0.315	14%	0.136	S	C	.	.	H	α-helix	trans	-61.2	-34	175.4	-63.4	0	0	0	0	112.5	E231 R493 Q494 M495	E231-S491 WeakPolarHBondContact OE2-CB 3.18Å; S491-R493 VanDerWaalsContact C-N 3.32Å; S491-R493 PolarHBondContact O-N 2.93Å; S491-Q494 PolarHBondContact O-N 3.14Å; S491-M495 PolarHBondContact O-N 2.87Å
492	A	83.6	Confident	86.8	Confident	6 Å²	6	25.7 Å²	25.7	5%	0.05	15%	0.147	C	C	.	.	H	α-helix	trans	-58.5	-44.7	170.7	0	0	0	0	0	111.5	F233 T490 M495 M496	F233-A492 HydrophobicContact CD1-CB 3.98Å; F233-A492 HydrophobicContact CD2-CB 4.4Å; F233-A492 HydrophobicContact CE1-CB 3.55Å; F233-A492 HydrophobicContact CE2-CB 4Å; F233-A492 HydrophobicContact CG-CB 4.39Å; F233-A492 HydrophobicContact CZ-CB 3.57Å; T490-A492 PolarHBondContact O-N 3.34Å; A492-M495 WeakPolarHBondContact O-CB 3.41Å; A492-M495 PolarHBondContact O-N 2.84Å; A492-M496 WeakPolarHBondContact O-CG 3.34Å; A492-M496 PolarHBondContact O-N 3.46Å
493	R	86.4	Confident	87	Confident	23 Å²	23	25.7 Å²	25.7	9%	0.087	15%	0.147	C	C	.	.	H	α-helix	trans	-70.4	-33.2	178	-71.4	-170.8	178.4	-142.7	12.4	113.8	D237 D487 T490 S491 M496 F497	D237-R493 IonicContact OD1-NE 3.68Å; D487-R493 VanDerWaalsContact O-CB 3.22Å; D487-R493 WeakPolarHBondContact O-CB 3.25Å; D487-R493 WeakPolarHBondContact O-CD 3.12Å; D487-R493 VanDerWaalsContact OD1-CD 3.29Å; D487-R493 WeakPolarHBondContact OD1-CD 3.32Å; D487-R493 IonicContact OD2-CZ 3.63Å; D487-R493 IonicContact OD2-NE 3.01Å; D487-R493 IonicContact OD2-NH1 3.86Å; D487-R493 PolarHBondContact OD2-NH1 3.26Å; D487-R493 IonicContact OD2-NH2 2.76Å; T490-R493 WeakPolarHBondContact O-CA 3.11Å; T490-R493 PolarHBondContact O-N 3.4Å; T490-R493 WeakPolarHBondContact OG1-CB 3.39Å; T490-R493 VanDerWaalsContact OG1-CG 3.31Å; T490-R493 WeakPolarHBondContact OG1-CG 3.31Å; T490-R493 PolarHBondContact OG1-N 2.92Å; S491-R493 VanDerWaalsContact C-N 3.32Å; S491-R493 PolarHBondContact O-N 2.93Å; R493-M496 HydrophobicContact CB-CE 4.11Å; R493-M496 HydrophobicContact CG-CE 3.46Å; R493-M496 VanDerWaalsContact CG-CE 3.46Å; R493-M496 PolarHBondContact O-N 3.33Å; R493-F497 WeakPolarHBondContact O-CB 3.35Å; R493-F497 PolarHBondContact O-N 3.04Å
494	Q	87.9	Confident	87.2	Confident	29 Å²	29	25.6 Å²	25.6	14%	0.136	15%	0.147	C	C	.	.	H	α-helix	trans	-65.3	-38.3	171.4	-69.7	169.4	8.6	0	0	112.6	I426 T488 T490 S491 T498	I426-Q494 HydrophobicContact CD1-CB 4.07Å; I426-Q494 HydrophobicContact CG1-CB 4.44Å; T488-Q494 WeakPolarHBondContact O-CG 3.49Å; T488-Q494 PolarHBondContact O-NE2 3.16Å; T490-Q494 WeakPolarHBondContact O-CG 3.24Å; T490-Q494 PolarHBondContact O-N 3.32Å; S491-Q494 PolarHBondContact O-N 3.14Å; Q494-T498 PolarHBondContact O-N 3.02Å; Q494-T498 PolarHBondContact O-OG1 3.02Å
495	M	87.7	Confident	87.2	Confident	14 Å²	14	26 Å²	26	7%	0.069	15%	0.148	C	C	.	.	H	α-helix	trans	-64.4	-42.7	173.2	-171.8	-174.3	-60.3	0	0	111.1	L229 F233 I426 F431 S491 A492 T498 T499	L229-M495 HydrophobicContact CD2-CE 4.33Å; F233-M495 HydrophobicContact CE2-CE 4.24Å; F233-M495 HydrophobicContact CZ-CE 4.01Å; F233-M495 HydrophobicContact CZ-SD 3.83Å; I426-M495 HydrophobicContact CB-CB 4.39Å; I426-M495 HydrophobicContact CG2-CB 4.42Å; I426-M495 HydrophobicContact CG2-CE 3.94Å; F431-M495 HydrophobicContact CB-SD 3.88Å; F431-M495 HydrophobicContact CD1-CG 4.14Å; F431-M495 HydrophobicContact CD1-SD 4.19Å; F431-M495 HydrophobicContact CD2-SD 4.01Å; F431-M495 HydrophobicContact CG-CG 4.3Å; F431-M495 HydrophobicContact CG-SD 3.76Å; S491-M495 PolarHBondContact O-N 2.87Å; A492-M495 WeakPolarHBondContact O-CB 3.41Å; A492-M495 PolarHBondContact O-N 2.84Å; M495-T498 PolarHBondContact O-N 3.4Å; M495-T499 WeakPolarHBondContact O-CB 3.43Å; M495-T499 PolarHBondContact O-N 3.3Å; M495-T499 PolarHBondContact O-OG1 2.75Å
496	M	90.3	Very high	87.4	Confident	5 Å²	5	29.4 Å²	29.4	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-47.5	175.3	-72.2	-174.8	-70.1	0	0	111.8	D237 F240 F241 F431 A492 R493 T498 T499 T500	D237-M496 HydrophobicContact CB-CE 4.06Å; D237-M496 VanDerWaalsContact O-SD 3.39Å; F240-M496 HydrophobicContact CD1-CE 4.45Å; F241-M496 HydrophobicContact CB-CG 4.35Å; F241-M496 HydrophobicContact CB-SD 3.56Å; F241-M496 VanDerWaalsContact CB-SD 3.56Å; F241-M496 HydrophobicContact CD2-CB 3.71Å; F241-M496 HydrophobicContact CD2-CG 3.6Å; F241-M496 HydrophobicContact CD2-SD 3.89Å; F241-M496 HydrophobicContact CE2-CB 4.1Å; F241-M496 HydrophobicContact CE2-CG 4.23Å; F241-M496 HydrophobicContact CG-CG 4.19Å; F241-M496 HydrophobicContact CG-SD 4.05Å; F431-M496 HydrophobicContact CE1-CG 4.16Å; F431-M496 HydrophobicContact CZ-CG 3.89Å; A492-M496 WeakPolarHBondContact O-CG 3.34Å; A492-M496 PolarHBondContact O-N 3.46Å; R493-M496 HydrophobicContact CB-CE 4.11Å; R493-M496 HydrophobicContact CG-CE 3.46Å; R493-M496 VanDerWaalsContact CG-CE 3.46Å; R493-M496 PolarHBondContact O-N 3.33Å; M496-T498 PolarHBondContact O-N 2.96Å; M496-T499 PolarHBondContact O-N 3.5Å; M496-T500 PolarHBondContact O-N 3.36Å; M496-T500 PolarHBondContact O-OG1 3.18Å
497	F	90.6	Very high	87.7	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.009	15%	0.146	C	C	.	.	H	α-helix	trans	-55.2	-50.9	175.4	170.9	-107.1	0	0	0	112.6	F422 H425 F481 A484 I485 T488 R493 T499 T500 L501	F422-F497 HydrophobicContact CB-CE1 4.16Å; F422-F497 HydrophobicContact CD1-CD1 4.06Å; F422-F497 AromaticContact CD1-CE1 3.76Å; F422-F497 HydrophobicContact CD1-CE1 3.76Å; F422-F497 AromaticContact CD2-CE1 3.89Å; F422-F497 HydrophobicContact CD2-CE1 3.89Å; F422-F497 HydrophobicContact CD2-CZ 4.46Å; F422-F497 AromaticContact CE1-CD1 3.92Å; F422-F497 HydrophobicContact CE1-CD1 3.92Å; F422-F497 HydrophobicContact CE1-CE1 4.04Å; F422-F497 HydrophobicContact CE2-CD1 4.45Å; F422-F497 HydrophobicContact CE2-CE1 4.16Å; F422-F497 HydrophobicContact CG-CD1 4.39Å; F422-F497 AromaticContact CG-CE1 3.67Å; F422-F497 HydrophobicContact CG-CE1 3.67Å; F422-F497 HydrophobicContact CZ-CD1 4.13Å; F422-F497 HydrophobicContact CZ-CE1 4.23Å; H425-F497 AromaticContact CE1-CE1 3.84Å; F481-F497 AromaticContact CD2-CE2 4Å; F481-F497 HydrophobicContact CD2-CE2 4Å; F481-F497 AromaticContact CE2-CE2 3.6Å; F481-F497 HydrophobicContact CE2-CE2 3.6Å; F481-F497 AromaticContact CE2-CZ 3.93Å; F481-F497 HydrophobicContact CE2-CZ 3.93Å; F481-F497 HydrophobicContact CZ-CE2 4.43Å; A484-F497 HydrophobicContact CB-CB 4.4Å; A484-F497 HydrophobicContact CB-CD2 3.96Å; I485-F497 HydrophobicContact CB-CD2 4.06Å; I485-F497 HydrophobicContact CB-CE2 3.71Å; I485-F497 HydrophobicContact CD1-CE2 4.3Å; I485-F497 HydrophobicContact CD1-CZ 4.37Å; I485-F497 HydrophobicContact CG1-CE2 4.12Å; T488-F497 HydrophobicContact CG2-CB 4.23Å; T488-F497 HydrophobicContact CG2-CG 4.31Å; R493-F497 WeakPolarHBondContact O-CB 3.35Å; R493-F497 PolarHBondContact O-N 3.04Å; F497-T499 VanDerWaalsContact C-N 3.26Å; F497-T499 PolarHBondContact O-N 3.11Å; F497-T500 PolarHBondContact O-N 3.32Å; F497-L501 WeakPolarHBondContact O-CB 3.23Å; F497-L501 PolarHBondContact O-N 3.02Å
498	T	90.7	Very high	88.1	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.7	-40.1	179.1	-55.8	0	0	0	0	111.4	H425 F427 Q494 M495 M496 L502	H425-T498 HydrophobicContact CB-CG2 4.05Å; H425-T498 PolarHBondContact ND1-OG1 3.34Å; F427-T498 HydrophobicContact CD1-CG2 3.51Å; F427-T498 HydrophobicContact CE1-CG2 3.33Å; F427-T498 HydrophobicContact CG-CG2 4.18Å; F427-T498 HydrophobicContact CZ-CG2 3.88Å; Q494-T498 PolarHBondContact O-N 3.02Å; Q494-T498 PolarHBondContact O-OG1 3.02Å; M495-T498 PolarHBondContact O-N 3.4Å; M496-T498 PolarHBondContact O-N 2.96Å; T498-L502 WeakPolarHBondContact O-CG 3.3Å; T498-L502 PolarHBondContact O-N 3.22Å
499	T	92.8	Very high	88.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68.8	-46.2	179.1	-56.1	0	0	0	0	111.5	F241 F431 I432 A435 M495 M496 F497 L501 L502 I503	F241-T499 HydrophobicContact CZ-CG2 4.02Å; F431-T499 HydrophobicContact CD1-CG2 3.97Å; F431-T499 WeakPolarHBondContact CD1-OG1 3.2Å; F431-T499 HydrophobicContact CE1-CG2 4.1Å; I432-T499 HydrophobicContact CB-CG2 4.39Å; I432-T499 HydrophobicContact CG1-CG2 3.99Å; A435-T499 HydrophobicContact CB-CG2 3.63Å; M495-T499 WeakPolarHBondContact O-CB 3.43Å; M495-T499 PolarHBondContact O-N 3.3Å; M495-T499 PolarHBondContact O-OG1 2.75Å; M496-T499 PolarHBondContact O-N 3.5Å; F497-T499 VanDerWaalsContact C-N 3.26Å; F497-T499 PolarHBondContact O-N 3.11Å; T499-L501 VanDerWaalsContact C-N 3.29Å; T499-L501 PolarHBondContact O-N 3.21Å; T499-L502 PolarHBondContact O-N 3.2Å; T499-I503 HydrophobicContact CG2-CD1 3.75Å; T499-I503 WeakPolarHBondContact O-CD1 3.41Å; T499-I503 VanDerWaalsContact O-CG1 3.31Å; T499-I503 WeakPolarHBondContact O-CG1 3.46Å; T499-I503 PolarHBondContact O-N 3.45Å
500	T	92.9	Very high	88.7	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.006	13%	0.127	C	C	.	.	H	α-helix	trans	-56.7	-44.3	175.6	-60	0	0	0	0	111.3	I244 I245 A480 A484 M496 F497 I503 V504	I244-T500 HydrophobicContact CG2-CG2 4.45Å; I245-T500 HydrophobicContact CD1-CG2 3.75Å; A480-T500 HydrophobicContact CB-CG2 3.99Å; A484-T500 HydrophobicContact CB-CG2 4.16Å; M496-T500 PolarHBondContact O-N 3.36Å; M496-T500 PolarHBondContact O-OG1 3.18Å; F497-T500 PolarHBondContact O-N 3.32Å; T500-I503 PolarHBondContact O-N 3.48Å; T500-V504 HydrophobicContact CG2-CG2 4.38Å; T500-V504 WeakPolarHBondContact O-CG2 3.48Å; T500-V504 PolarHBondContact O-N 3.4Å
501	L	90.8	Very high	88.9	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.3	-52.6	178	-170.7	62.3	0	0	0	110.9	M415 L419 F481 F497 T499 I503 V504 F505	M415-L501 HydrophobicContact CB-CD1 4.48Å; L419-L501 HydrophobicContact CB-CD2 3.86Å; L419-L501 HydrophobicContact CD1-CD2 3.57Å; L419-L501 HydrophobicContact CD1-CG 4.11Å; L419-L501 HydrophobicContact CG-CD2 4.34Å; F481-L501 HydrophobicContact CD2-CD1 3.84Å; F481-L501 HydrophobicContact CE2-CD1 3.9Å; F497-L501 WeakPolarHBondContact O-CB 3.23Å; F497-L501 PolarHBondContact O-N 3.02Å; T499-L501 VanDerWaalsContact C-N 3.29Å; T499-L501 PolarHBondContact O-N 3.21Å; L501-I503 VanDerWaalsContact C-N 3.3Å; L501-I503 PolarHBondContact O-N 3.04Å; L501-V504 PolarHBondContact O-N 2.98Å; L501-F505 HydrophobicContact CD1-CD2 4.08Å; L501-F505 HydrophobicContact CD1-CE2 3.73Å; L501-F505 HydrophobicContact CG-CD2 4.02Å; L501-F505 HydrophobicContact CG-CE2 3.83Å; L501-F505 VanDerWaalsContact O-CD2 3.28Å; L501-F505 WeakPolarHBondContact O-CD2 3.28Å; L501-F505 PolarHBondContact O-N 3.15Å
502	L	91.9	Very high	89.1	Confident	48 Å²	48	21.1 Å²	21.1	25%	0.251	10%	0.1	S	C	.	.	H	α-helix	trans	-59.9	-37.8	178.3	-68.8	176.5	0	0	0	113.3	L419 F427 I432 T498 T499 F506	L419-L502 HydrophobicContact CD1-CD2 4.19Å; F427-L502 HydrophobicContact CD1-CD1 4.2Å; F427-L502 HydrophobicContact CE1-CD1 4.11Å; I432-L502 HydrophobicContact CD1-CD1 3.65Å; I432-L502 HydrophobicContact CG1-CD1 4.29Å; I432-L502 HydrophobicContact CG2-CD1 4.44Å; T498-L502 WeakPolarHBondContact O-CG 3.3Å; T498-L502 PolarHBondContact O-N 3.22Å; T499-L502 PolarHBondContact O-N 3.2Å; L502-F506 WeakPolarHBondContact O-CB 3.36Å; L502-F506 PolarHBondContact O-N 2.94Å
503	I	92.4	Very high	89.1	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-62.4	-49.7	175.1	-72.5	156.4	0	0	0	110.5	F241 I245 A435 F436 I439 R476 T499 T500 L501 F505 F506 T507	F241-I503 HydrophobicContact CZ-CD1 4.24Å; I245-I503 HydrophobicContact CD1-CD1 4.17Å; A435-I503 HydrophobicContact CB-CD1 4.01Å; F436-I503 HydrophobicContact CD1-CG1 4.47Å; F436-I503 HydrophobicContact CE1-CG1 4.12Å; F436-I503 HydrophobicContact CE2-CG1 4.38Å; F436-I503 HydrophobicContact CZ-CG1 4.08Å; I439-I503 HydrophobicContact CD1-CB 4.32Å; I439-I503 HydrophobicContact CD1-CD1 3.46Å; I439-I503 VanDerWaalsContact CD1-CD1 3.46Å; I439-I503 HydrophobicContact CD1-CG1 3.87Å; I439-I503 HydrophobicContact CD1-CG2 3.51Å; R476-I503 HydrophobicContact CB-CG2 4.13Å; R476-I503 HydrophobicContact CG-CG2 3.84Å; T499-I503 HydrophobicContact CG2-CD1 3.75Å; T499-I503 WeakPolarHBondContact O-CD1 3.41Å; T499-I503 VanDerWaalsContact O-CG1 3.31Å; T499-I503 WeakPolarHBondContact O-CG1 3.46Å; T499-I503 PolarHBondContact O-N 3.45Å; T500-I503 PolarHBondContact O-N 3.48Å; L501-I503 VanDerWaalsContact C-N 3.3Å; L501-I503 PolarHBondContact O-N 3.04Å; I503-F505 VanDerWaalsContact C-N 3.34Å; I503-F505 PolarHBondContact O-N 3.23Å; I503-F506 PolarHBondContact O-N 3.05Å; I503-T507 HydrophobicContact CG2-CG2 4.16Å; I503-T507 VanDerWaalsContact O-CG2 3.31Å; I503-T507 WeakPolarHBondContact O-CG2 3.13Å; I503-T507 PolarHBondContact O-N 3.1Å; I503-T507 PolarHBondContact O-OG1 3.08Å; I503-T507 VanDerWaalsContact O-OG1 3.11Å
504	V	91.4	Very high	89.1	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.4	-49.9	179.7	169.7	0	0	0	0	109.9	M415 R476 T500 L501 F506 T507 V508	M415-V504 HydrophobicContact SD-CG1 3.75Å; R476-V504 HydrophobicContact CB-CG2 3.93Å; T500-V504 HydrophobicContact CG2-CG2 4.38Å; T500-V504 WeakPolarHBondContact O-CG2 3.48Å; T500-V504 PolarHBondContact O-N 3.4Å; L501-V504 PolarHBondContact O-N 2.98Å; V504-F506 PolarHBondContact O-N 3.47Å; V504-T507 PolarHBondContact O-N 2.94Å; V504-T507 PolarHBondContact O-OG1 3.28Å; V504-T507 VanDerWaalsContact O-OG1 3.07Å; V504-V508 HydrophobicContact CG1-CG2 4.19Å; V504-V508 WeakPolarHBondContact O-CB 3.06Å; V504-V508 WeakPolarHBondContact O-CG2 3.4Å; V504-V508 PolarHBondContact O-N 3.07Å
505	F	89.3	Confident	89	Confident	13 Å²	13	20.2 Å²	20.2	6%	0.057	11%	0.107	C	C	.	.	H	α-helix	trans	-53.5	-50.9	176.1	-90.8	-87.7	0	0	0	112.6	M91 L95 L419 L501 I503 W509	M91-F505 HydrophobicContact CE-CB 4.34Å; M91-F505 HydrophobicContact CE-CD1 3.45Å; M91-F505 VanDerWaalsContact CE-CD1 3.45Å; M91-F505 HydrophobicContact CE-CE1 4.04Å; M91-F505 HydrophobicContact CE-CG 4.04Å; M91-F505 HydrophobicContact CG-CD1 3.81Å; M91-F505 HydrophobicContact CG-CE1 3.38Å; M91-F505 HydrophobicContact CG-CZ 3.84Å; M91-F505 HydrophobicContact SD-CB 4.45Å; M91-F505 HydrophobicContact SD-CD1 3.42Å; M91-F505 WeakPolarHBondContact SD-CD1 3.21Å; M91-F505 HydrophobicContact SD-CD2 4.2Å; M91-F505 HydrophobicContact SD-CE1 3.64Å; M91-F505 HydrophobicContact SD-CE2 4.38Å; M91-F505 HydrophobicContact SD-CG 3.75Å; M91-F505 HydrophobicContact SD-CZ 4.15Å; L95-F505 HydrophobicContact CD1-CE1 3.81Å; L95-F505 HydrophobicContact CD1-CZ 4.19Å; L419-F505 HydrophobicContact CB-CE2 4.03Å; L419-F505 HydrophobicContact CB-CZ 4.09Å; L419-F505 HydrophobicContact CD1-CE2 4.48Å; L419-F505 HydrophobicContact CD2-CE1 4.42Å; L419-F505 HydrophobicContact CD2-CE2 4.03Å; L419-F505 HydrophobicContact CD2-CZ 3.88Å; L419-F505 HydrophobicContact CG-CE2 4.41Å; L501-F505 HydrophobicContact CD1-CD2 4.08Å; L501-F505 HydrophobicContact CD1-CE2 3.73Å; L501-F505 HydrophobicContact CG-CD2 4.02Å; L501-F505 HydrophobicContact CG-CE2 3.83Å; L501-F505 VanDerWaalsContact O-CD2 3.28Å; L501-F505 WeakPolarHBondContact O-CD2 3.28Å; L501-F505 PolarHBondContact O-N 3.15Å; I503-F505 VanDerWaalsContact C-N 3.34Å; I503-F505 PolarHBondContact O-N 3.23Å; F505-W509 HydrophobicContact CD1-CH2 4.31Å; F505-W509 HydrophobicContact CD1-CZ2 4.19Å; F505-W509 HydrophobicContact CE1-CZ2 4.44Å; F505-W509 PolarHBondContact O-N 3.14Å
506	F	90.7	Very high	88.9	Confident	84 Å²	84	21.9 Å²	21.9	37%	0.368	12%	0.117	S	C	.	.	H	α-helix	trans	-62.3	-46.8	179.9	178.4	-92.3	0	0	0	111.5	F436 L502 I503 V504 V510 F511	F436-F506 HydrophobicContact CD1-CD1 4.23Å; F436-F506 HydrophobicContact CE1-CB 3.79Å; F436-F506 AromaticContact CE1-CD1 3.41Å; F436-F506 HydrophobicContact CE1-CD1 3.41Å; F436-F506 VanDerWaalsContact CE1-CD1 3.41Å; F436-F506 HydrophobicContact CE1-CD2 4.49Å; F436-F506 HydrophobicContact CE1-CE1 4.09Å; F436-F506 AromaticContact CE1-CG 3.64Å; F436-F506 HydrophobicContact CE1-CG 3.64Å; F436-F506 HydrophobicContact CZ-CB 3.7Å; F436-F506 HydrophobicContact CZ-CD1 4.13Å; F436-F506 HydrophobicContact CZ-CD2 4.49Å; F436-F506 AromaticContact CZ-CG 3.86Å; F436-F506 HydrophobicContact CZ-CG 3.86Å; L502-F506 WeakPolarHBondContact O-CB 3.36Å; L502-F506 PolarHBondContact O-N 2.94Å; I503-F506 PolarHBondContact O-N 3.05Å; V504-F506 PolarHBondContact O-N 3.47Å; F506-V510 HydrophobicContact CD2-CG2 3.89Å; F506-V510 HydrophobicContact CE1-CB 4.4Å; F506-V510 HydrophobicContact CE1-CG2 4.43Å; F506-V510 HydrophobicContact CE2-CB 4.48Å; F506-V510 HydrophobicContact CE2-CG2 3.7Å; F506-V510 HydrophobicContact CG-CG2 4.35Å; F506-V510 HydrophobicContact CZ-CB 4.3Å; F506-V510 HydrophobicContact CZ-CG1 4.29Å; F506-V510 HydrophobicContact CZ-CG2 4Å; F506-V510 VanDerWaalsContact O-CB 3.29Å; F506-V510 WeakPolarHBondContact O-CB 3.42Å; F506-V510 WeakPolarHBondContact O-CG2 3.44Å; F506-V510 PolarHBondContact O-N 3.09Å; F506-F511 HydrophobicContact CD1-CE2 4.36Å; F506-F511 AromaticContact CE1-CE2 3.95Å; F506-F511 HydrophobicContact CE1-CE2 3.95Å; F506-F511 HydrophobicContact CE1-CZ 4.33Å
507	T	90	Very high	88.6	Confident	6 Å²	6	25 Å²	25	4%	0.037	14%	0.139	C	C	.	.	H	α-helix	trans	-66.3	-47.2	-176.5	59.1	0	0	0	0	111.9	L475 R476 I503 V504 W509 F511 G512	L475-T507 WeakPolarHBondContact CD2-O 3.43Å; R476-T507 HydrophobicContact CG-CG2 4.47Å; R476-T507 PolarHBondContact N-OG1 3.12Å; R476-T507 PolarHBondContact O-OG1 3.15Å; I503-T507 HydrophobicContact CG2-CG2 4.16Å; I503-T507 VanDerWaalsContact O-CG2 3.31Å; I503-T507 WeakPolarHBondContact O-CG2 3.13Å; I503-T507 PolarHBondContact O-N 3.1Å; I503-T507 PolarHBondContact O-OG1 3.08Å; I503-T507 VanDerWaalsContact O-OG1 3.11Å; V504-T507 PolarHBondContact O-N 2.94Å; V504-T507 PolarHBondContact O-OG1 3.28Å; V504-T507 VanDerWaalsContact O-OG1 3.07Å; T507-W509 PolarHBondContact O-N 3.12Å; T507-F511 HydrophobicContact CG2-CD2 3.95Å; T507-F511 HydrophobicContact CG2-CE2 4.18Å; T507-F511 WeakPolarHBondContact O-CA 3.46Å; T507-F511 VanDerWaalsContact O-CB 3.28Å; T507-F511 WeakPolarHBondContact O-CB 3.32Å; T507-F511 PolarHBondContact O-N 2.97Å; T507-G512 PolarHBondContact O-N 3.36Å
508	V	87.1	Confident	88.4	Confident	5 Å²	5	26.9 Å²	26.9	3%	0.03	15%	0.148	C	C	.	.	I	π-helix	trans	-62.2	-41.6	-179.2	173.8	0	0	0	0	111.5	M91 F412 V504 G512	M91-V508 HydrophobicContact CE-CB 4.16Å; M91-V508 HydrophobicContact CE-CG1 4.18Å; F412-V508 HydrophobicContact CE1-CG2 4.1Å; V504-V508 HydrophobicContact CG1-CG2 4.19Å; V504-V508 WeakPolarHBondContact O-CB 3.06Å; V504-V508 WeakPolarHBondContact O-CG2 3.4Å; V504-V508 PolarHBondContact O-N 3.07Å; V508-G512 WeakPolarHBondContact O-CA 2.94Å; V508-G512 PolarHBondContact O-N 3.42Å
509	W	85.3	Confident	88	Confident	99 Å²	99	27.1 Å²	27.1	38%	0.375	15%	0.149	S	C	.	.	I	π-helix	trans	-74.8	-49.7	179	-76.1	-7.5	0	0	0	113.3	G88 M91 I92 F505 T507 G513	G88-W509 PolarHBondContact O-NE1 3.2Å; M91-W509 VanDerWaalsContact CE-CD1 3.47Å; M91-W509 HydrophobicContact CE-CD2 4.12Å; M91-W509 HydrophobicContact CE-CG 4.05Å; M91-W509 HydrophobicContact CE-CZ2 4.12Å; I92-W509 HydrophobicContact CD1-CZ2 4.17Å; I92-W509 HydrophobicContact CG1-CH2 4.25Å; I92-W509 HydrophobicContact CG1-CZ2 3.32Å; F505-W509 HydrophobicContact CD1-CH2 4.31Å; F505-W509 HydrophobicContact CD1-CZ2 4.19Å; F505-W509 HydrophobicContact CE1-CZ2 4.44Å; F505-W509 PolarHBondContact O-N 3.14Å; T507-W509 PolarHBondContact O-N 3.12Å; W509-G513 PolarHBondContact O-N 3Å; W509-G513 VanDerWaalsContact O-N 3.12Å
510	V	88.3	Confident	87.5	Confident	72 Å²	72	31.4 Å²	31.4	44%	0.436	18%	0.179	S	C	.	.	I	π-helix	trans	-77.2	-51.4	-172.8	178.8	0	0	0	0	111.1	F506 G514	F506-V510 HydrophobicContact CD2-CG2 3.89Å; F506-V510 HydrophobicContact CE1-CB 4.4Å; F506-V510 HydrophobicContact CE1-CG2 4.43Å; F506-V510 HydrophobicContact CE2-CB 4.48Å; F506-V510 HydrophobicContact CE2-CG2 3.7Å; F506-V510 HydrophobicContact CG-CG2 4.35Å; F506-V510 HydrophobicContact CZ-CB 4.3Å; F506-V510 HydrophobicContact CZ-CG1 4.29Å; F506-V510 HydrophobicContact CZ-CG2 4Å; F506-V510 VanDerWaalsContact O-CB 3.29Å; F506-V510 WeakPolarHBondContact O-CB 3.42Å; F506-V510 WeakPolarHBondContact O-CG2 3.44Å; F506-V510 PolarHBondContact O-N 3.09Å; V510-G514 WeakPolarHBondContact O-CA 3.48Å; V510-G514 PolarHBondContact O-N 3.08Å
511	F	87.2	Confident	87.2	Confident	34 Å²	34	39.9 Å²	39.9	15%	0.149	21%	0.211	C	C	.	.	I	π-helix	trans	-80.5	-37.7	-178.4	-63.3	-59.1	0	0	0	111.6	F440 F472 L475 F506 T507 G514 T515	F440-F511 HydrophobicContact CE1-CE1 4.33Å; F440-F511 AromaticContact CE1-CE2 3.86Å; F440-F511 HydrophobicContact CE1-CE2 3.86Å; F440-F511 AromaticContact CE1-CZ 3.38Å; F440-F511 HydrophobicContact CE1-CZ 3.38Å; F440-F511 AromaticContact CZ-CE2 3.76Å; F440-F511 HydrophobicContact CZ-CE2 3.76Å; F440-F511 AromaticContact CZ-CZ 3.46Å; F440-F511 HydrophobicContact CZ-CZ 3.46Å; F440-F511 VanDerWaalsContact CZ-CZ 3.46Å; F472-F511 AromaticContact CD2-CD1 3.7Å; F472-F511 HydrophobicContact CD2-CD1 3.7Å; F472-F511 HydrophobicContact CD2-CE1 4.12Å; F472-F511 HydrophobicContact CE1-CB 4.35Å; F472-F511 HydrophobicContact CE1-CD1 4.41Å; F472-F511 VanDerWaalsContact CE1-O 3.24Å; F472-F511 WeakPolarHBondContact CE1-O 3.39Å; F472-F511 AromaticContact CE2-CD1 3.42Å; F472-F511 HydrophobicContact CE2-CD1 3.42Å; F472-F511 VanDerWaalsContact CE2-CD1 3.42Å; F472-F511 AromaticContact CE2-CE1 3.97Å; F472-F511 HydrophobicContact CE2-CE1 3.97Å; F472-F511 HydrophobicContact CG-CD1 4.38Å; F472-F511 HydrophobicContact CZ-CB 4.3Å; F472-F511 AromaticContact CZ-CD1 3.79Å; F472-F511 HydrophobicContact CZ-CD1 3.79Å; L475-F511 HydrophobicContact CD2-CB 3.39Å; L475-F511 HydrophobicContact CD2-CG 4.45Å; F506-F511 HydrophobicContact CD1-CE2 4.36Å; F506-F511 AromaticContact CE1-CE2 3.95Å; F506-F511 HydrophobicContact CE1-CE2 3.95Å; F506-F511 HydrophobicContact CE1-CZ 4.33Å; T507-F511 HydrophobicContact CG2-CD2 3.95Å; T507-F511 HydrophobicContact CG2-CE2 4.18Å; T507-F511 WeakPolarHBondContact O-CA 3.46Å; T507-F511 VanDerWaalsContact O-CB 3.28Å; T507-F511 WeakPolarHBondContact O-CB 3.32Å; T507-F511 PolarHBondContact O-N 2.97Å; F511-G514 CarbonylContact O-C 3.59Å; F511-G514 PolarHBondContact O-N 2.93Å; F511-T515 PolarHBondContact O-N 3.49Å; F511-T515 VanDerWaalsContact O-N 3.12Å; F511-T515 PolarHBondContact O-OG1 3.21Å
512	G	84.3	Confident	86.8	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.01	21%	0.213	C	C	.	.	I	π-helix	trans	-63.2	-50.7	174.6	0	0	0	0	0	112	T507 V508 G514 T515	T507-G512 PolarHBondContact O-N 3.36Å; V508-G512 WeakPolarHBondContact O-CA 2.94Å; V508-G512 PolarHBondContact O-N 3.42Å; G512-G514 VanDerWaalsContact C-N 3.32Å; G512-G514 PolarHBondContact O-N 3.32Å; G512-T515 WeakPolarHBondContact O-CB 3.35Å; G512-T515 PolarHBondContact O-N 2.77Å; G512-T515 PolarHBondContact O-OG1 2.83Å
513	G	83.2	Confident	86.1	Confident	22 Å²	22	45.9 Å²	45.9	23%	0.227	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-33.5	174.7	0	0	0	0	0	113.6	W509 T515	W509-G513 PolarHBondContact O-N 3Å; W509-G513 VanDerWaalsContact O-N 3.12Å; G513-T515 VanDerWaalsContact C-N 3.29Å; G513-T515 PolarHBondContact O-N 3.04Å
514	G	86.8	Confident	85.2	Confident	18 Å²	18	46.4 Å²	46.4	19%	0.186	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	1	178.3	0	0	0	0	0	115.5	F472 V510 F511 G512 P517 M518	F472-G514 WeakPolarHBondContact CZ-O 3.35Å; V510-G514 WeakPolarHBondContact O-CA 3.48Å; V510-G514 PolarHBondContact O-N 3.08Å; F511-G514 CarbonylContact O-C 3.59Å; F511-G514 PolarHBondContact O-N 2.93Å; G512-G514 VanDerWaalsContact C-N 3.32Å; G512-G514 PolarHBondContact O-N 3.32Å; G514-P517 VanDerWaalsContact O-CD 3.28Å; G514-P517 WeakPolarHBondContact O-CD 3.31Å; G514-P517 VanDerWaalsContact O-CG 3.25Å; G514-P517 WeakPolarHBondContact O-CG 3.29Å; G514-M518 VanDerWaalsContact O-CB 3.27Å; G514-M518 WeakPolarHBondContact O-CB 3.47Å; G514-M518 PolarHBondContact O-N 2.95Å; G514-M518 VanDerWaalsContact O-N 3.14Å
515	T	86.4	Confident	83.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.6	-42.9	-177.4	-64.6	0	0	0	0	112.6	V253 I256 F257 F511 G512 G513 M518 L519	V253-T515 HydrophobicContact CB-CG2 4.34Å; V253-T515 HydrophobicContact CG1-CG2 3.82Å; V253-T515 HydrophobicContact CG2-CG2 4.37Å; I256-T515 HydrophobicContact CB-CG2 4.34Å; I256-T515 HydrophobicContact CD1-CG2 4.04Å; I256-T515 HydrophobicContact CG2-CG2 4.09Å; F257-T515 HydrophobicContact CE1-CG2 4.09Å; F511-T515 PolarHBondContact O-N 3.49Å; F511-T515 VanDerWaalsContact O-N 3.12Å; F511-T515 PolarHBondContact O-OG1 3.21Å; G512-T515 WeakPolarHBondContact O-CB 3.35Å; G512-T515 PolarHBondContact O-N 2.77Å; G512-T515 PolarHBondContact O-OG1 2.83Å; G513-T515 VanDerWaalsContact C-N 3.29Å; G513-T515 PolarHBondContact O-N 3.04Å; T515-M518 PolarHBondContact O-N 3.36Å; T515-L519 WeakPolarHBondContact O-CB 3.22Å; T515-L519 PolarHBondContact O-N 3.46Å
516	T	83.8	Confident	82.8	Confident	48 Å²	48	58.8 Å²	58.8	29%	0.294	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-46.4	-180	55.2	0	0	0	0	113.7	I256 L519 S520	I256-T516 HydrophobicContact CD1-CG2 4.41Å; I256-T516 HydrophobicContact CG2-CG2 3.79Å; T516-L519 PolarHBondContact O-N 2.87Å; T516-S520 PolarHBondContact O-N 3.49Å
517	P	85.9	Confident	81.2	Confident	72 Å²	72	57.5 Å²	57.5	47%	0.468	31%	0.306	S	S	.	.	H	α-helix	trans	-67.8	-35.2	174.6	26.2	-34.8	0	0	0	112.3	G514 L519 S520 W521	G514-P517 VanDerWaalsContact O-CD 3.28Å; G514-P517 WeakPolarHBondContact O-CD 3.31Å; G514-P517 VanDerWaalsContact O-CG 3.25Å; G514-P517 WeakPolarHBondContact O-CG 3.29Å; P517-L519 VanDerWaalsContact C-N 3.34Å; P517-L519 PolarHBondContact O-N 3.4Å; P517-S520 PolarHBondContact O-N 3.11Å; P517-W521 WeakPolarHBondContact O-CB 3.47Å; P517-W521 PolarHBondContact O-N 3.46Å
518	M	84.4	Confident	79.7	Confident	41 Å²	41	59 Å²	59	20%	0.202	32%	0.315	C	S	.	.	H	α-helix	trans	-62.8	-41.9	176.6	-178.1	59.4	102.9	0	0	111.5	M469 F472 G514 T515 S520 W521 L522	M469-M518 HydrophobicContact CE-CB 4.35Å; M469-M518 HydrophobicContact CE-CG 3.81Å; M469-M518 HydrophobicContact SD-CG 4.26Å; F472-M518 HydrophobicContact CB-CE 3.98Å; F472-M518 HydrophobicContact CB-CG 4.36Å; F472-M518 HydrophobicContact CD1-CB 4.13Å; F472-M518 HydrophobicContact CD1-CG 3.88Å; F472-M518 HydrophobicContact CD2-CE 3.16Å; F472-M518 HydrophobicContact CD2-CG 4.12Å; F472-M518 HydrophobicContact CD2-SD 4.47Å; F472-M518 HydrophobicContact CE1-CB 3.9Å; F472-M518 HydrophobicContact CE1-CG 4.16Å; F472-M518 HydrophobicContact CE2-CB 4.3Å; F472-M518 HydrophobicContact CE2-CE 3.65Å; F472-M518 HydrophobicContact CE2-CG 4.31Å; F472-M518 HydrophobicContact CG-CB 4.46Å; F472-M518 HydrophobicContact CG-CE 3.66Å; F472-M518 HydrophobicContact CG-CG 3.85Å; F472-M518 HydrophobicContact CZ-CB 3.97Å; F472-M518 HydrophobicContact CZ-CG 4.36Å; G514-M518 VanDerWaalsContact O-CB 3.27Å; G514-M518 WeakPolarHBondContact O-CB 3.47Å; G514-M518 PolarHBondContact O-N 2.95Å; G514-M518 VanDerWaalsContact O-N 3.14Å; T515-M518 PolarHBondContact O-N 3.36Å; M518-S520 VanDerWaalsContact C-N 3.33Å; M518-S520 PolarHBondContact O-N 2.72Å; M518-W521 PolarHBondContact O-N 3.01Å; M518-W521 HydrophobicContact SD-CE3 3.73Å; M518-W521 HydrophobicContact SD-CZ3 4.25Å; M518-L522 VanDerWaalsContact O-CB 3.29Å; M518-L522 WeakPolarHBondContact O-CB 3.5Å; M518-L522 PolarHBondContact O-N 2.85Å
519	L	82.6	Confident	77.9	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.026	34%	0.335	C	S	.	.	H	α-helix	trans	-62.4	-41.3	177.7	-167.3	69.6	0	0	0	112.1	F257 L260 M469 T515 T516 P517 H523 I524 V526	F257-L519 HydrophobicContact CE1-CD1 3.85Å; F257-L519 HydrophobicContact CE1-CD2 4.39Å; F257-L519 HydrophobicContact CZ-CD1 4.25Å; L260-L519 HydrophobicContact CD1-CD2 3.55Å; M469-L519 HydrophobicContact CE-CB 4.02Å; M469-L519 HydrophobicContact CE-CD1 3.67Å; M469-L519 HydrophobicContact CE-CG 4.48Å; T515-L519 WeakPolarHBondContact O-CB 3.22Å; T515-L519 PolarHBondContact O-N 3.46Å; T516-L519 PolarHBondContact O-N 2.87Å; P517-L519 VanDerWaalsContact C-N 3.34Å; P517-L519 PolarHBondContact O-N 3.4Å; L519-H523 PolarHBondContact O-N 3.26Å; L519-I524 HydrophobicContact CD1-CB 3.59Å; L519-I524 HydrophobicContact CD1-CD1 3.71Å; L519-I524 HydrophobicContact CD1-CG1 4.19Å; L519-I524 HydrophobicContact CD1-CG2 3.82Å; L519-I524 HydrophobicContact CG-CB 4.4Å; L519-V526 HydrophobicContact CD2-CG1 3.48Å; L519-V526 VanDerWaalsContact CD2-CG1 3.48Å; L519-V526 HydrophobicContact CG-CG1 4.11Å
520	S	82.3	Confident	76.2	Confident	90 Å²	90	61.2 Å²	61.2	63%	0.629	34%	0.337	S	S	*	.	H	α-helix	trans	-63.9	-47.1	174.5	-177.5	0	0	0	0	111.9	T516 P517 M518 L522 H523	T516-S520 PolarHBondContact O-N 3.49Å; P517-S520 PolarHBondContact O-N 3.11Å; M518-S520 VanDerWaalsContact C-N 3.33Å; M518-S520 PolarHBondContact O-N 2.72Å; S520-L522 VanDerWaalsContact C-N 3.28Å; S520-L522 PolarHBondContact O-N 3.23Å; S520-H523 PolarHBondContact O-N 2.87Å
521	W	86.9	Confident	74.2	Confident	179 Å²	179	63.3 Å²	63.3	68%	0.678	35%	0.346	S	S	*	.	H	α-helix	trans	-62.3	-35.9	-179.4	-176.6	72.7	0	0	0	112.8	P517 M518 H523	P517-W521 WeakPolarHBondContact O-CB 3.47Å; P517-W521 PolarHBondContact O-N 3.46Å; M518-W521 PolarHBondContact O-N 3.01Å; M518-W521 HydrophobicContact SD-CE3 3.73Å; M518-W521 HydrophobicContact SD-CZ3 4.25Å; W521-H523 VanDerWaalsContact C-N 3.32Å; W521-H523 PolarHBondContact O-CD2 2.73Å; W521-H523 PolarHBondContact O-N 3.45Å
522	L	82.5	Confident	72.1	Confident	9 Å²	9	67.8 Å²	67.8	5%	0.047	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	1.9	-175.2	-145.2	63.6	0	0	0	113.7	N465 H468 M469 M518 S520 I524	N465-L522 HydrophobicContact CB-CD1 4.42Å; N465-L522 HydrophobicContact CB-CD2 4.37Å; N465-L522 HydrophobicContact CB-CG 3.85Å; N465-L522 PolarHBondContact ND2-O 3.49Å; N465-L522 WeakPolarHBondContact O-CD2 3.42Å; H468-L522 HydrophobicContact CB-CD1 4.11Å; H468-L522 HydrophobicContact CB-CD2 4.08Å; M469-L522 HydrophobicContact CB-CD2 3.78Å; M469-L522 HydrophobicContact CE-CD2 4.32Å; M518-L522 VanDerWaalsContact O-CB 3.29Å; M518-L522 WeakPolarHBondContact O-CB 3.5Å; M518-L522 PolarHBondContact O-N 2.85Å; S520-L522 VanDerWaalsContact C-N 3.28Å; S520-L522 PolarHBondContact O-N 3.23Å; L522-I524 VanDerWaalsContact C-N 3.29Å; L522-I524 HydrophobicContact CB-CD1 4.33Å; L522-I524 HydrophobicContact CB-CG1 4.38Å; L522-I524 HydrophobicContact CD2-CD1 3.93Å; L522-I524 PolarHBondContact O-N 2.97Å
523	H	76.7	Confident	70.1	Confident	164 Å²	164	72 Å²	72	76%	0.759	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	44.7	179.3	-67.8	-83	0	0	0	113.6	L519 S520 W521	L519-H523 PolarHBondContact O-N 3.26Å; S520-H523 PolarHBondContact O-N 2.87Å; W521-H523 VanDerWaalsContact C-N 3.32Å; W521-H523 PolarHBondContact O-CD2 2.73Å; W521-H523 PolarHBondContact O-N 3.45Å
524	I	74.6	Confident	68.1	Low	13 Å²	13	76.4 Å²	76.4	7%	0.067	41%	0.407	C	S	.	.			trans	-78.4	137.3	173.8	-66.1	167.3	0	0	0	108.6	L266 F466 M469 L519 L522 V526	L266-I524 HydrophobicContact CD2-CD1 4.04Å; F466-I524 HydrophobicContact CD1-CD1 4.42Å; F466-I524 HydrophobicContact CD1-CG1 4.31Å; F466-I524 HydrophobicContact CE1-CG1 4.19Å; F466-I524 HydrophobicContact CE1-CG2 4.3Å; M469-I524 HydrophobicContact CB-CD1 3.84Å; M469-I524 HydrophobicContact CE-CD1 3.69Å; M469-I524 HydrophobicContact CG-CD1 3.94Å; L519-I524 HydrophobicContact CD1-CB 3.59Å; L519-I524 HydrophobicContact CD1-CD1 3.71Å; L519-I524 HydrophobicContact CD1-CG1 4.19Å; L519-I524 HydrophobicContact CD1-CG2 3.82Å; L519-I524 HydrophobicContact CG-CB 4.4Å; L522-I524 VanDerWaalsContact C-N 3.29Å; L522-I524 HydrophobicContact CB-CD1 4.33Å; L522-I524 HydrophobicContact CB-CG1 4.38Å; L522-I524 HydrophobicContact CD2-CD1 3.93Å; L522-I524 PolarHBondContact O-N 2.97Å; I524-V526 PolarHBondContact O-N 2.9Å
525	R	64.4	Low	65.2	Low	194 Å²	194	83.3 Å²	83.3	73%	0.732	44%	0.435	S	S	*	.			trans	-60.8	128.3	178.5	-66.6	-175.7	-132.1	-164.5	3.7	109.7	V528	R525-V528 HydrophobicContact CB-CG2 3.93Å
526	V	64.8	Low	62.6	Low	79 Å²	79	89 Å²	89	48%	0.479	47%	0.472	S	S	.	.	B	Isolated β-bridge	trans	-126.5	146.4	176.5	-75.5	0	0	0	0	108.6	L260 L519 I524	L260-V526 HydrophobicContact CB-CG1 4.1Å; L519-V526 HydrophobicContact CD2-CG1 3.48Å; L519-V526 VanDerWaalsContact CD2-CG1 3.48Å; L519-V526 HydrophobicContact CG-CG1 4.11Å; I524-V526 PolarHBondContact O-N 2.9Å
527	G	58.7	Low	59.9	Low	57 Å²	57	91.8 Å²	91.8	59%	0.588	49%	0.493	S	S	*	.	S	Bend	trans	81.9	26.5	-173.7	0	0	0	0	0	114.2	L260 H261	L260-G527 PolarHBondContact O-N 3.01Å; H261-G527 PolarHBondContact O-N 3.47Å; H261-G527 VanDerWaalsContact O-N 3.09Å
528	V	57.7	Low	57.2	Low	38 Å²	38	91.8 Å²	91.8	23%	0.23	51%	0.506	C	S	.	.			trans	-82.4	119.6	173.8	-175.9	0	0	0	0	107.8	H261 R525	H261-V528 PolarHBondContact O-N 3.09Å; H261-V528 VanDerWaalsContact O-N 3.07Å; R525-V528 HydrophobicContact CB-CG2 3.93Å
529	D	48.4	Very low	54.5	Low	86 Å²	86	97 Å²	97	46%	0.46	54%	0.535	S	S	.	.			trans	-62.2	130.8	170.1	-92.4	-44.7	0	0	0	108.8	D531 Q532	D529-D531 PolarHBondContact O-N 3.42Å; D529-Q532 HydrophobicContact CB-CB 4.07Å; D529-Q532 HydrophobicContact CB-CG 4.08Å; D529-Q532 PolarHBondContact O-N 3.28Å
530	P	49.4	Very low	51.9	Low	63 Å²	63	102.1 Å²	102.1	41%	0.409	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.3	-16.5	-179.6	25.6	-34.1	0	0	0	113.2
531	D	46.4	Very low	49.3	Very low	117 Å²	117	106.5 Å²	106.5	63%	0.626	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	-3.4	179	-55.1	-36.6	0	0	0	112.9	D529 L534	D529-D531 PolarHBondContact O-N 3.42Å; D531-L534 HydrophobicContact CB-CD1 4.07Å; D531-L534 WeakPolarHBondContact O-CB 3.31Å; D531-L534 WeakPolarHBondContact O-CD1 3.37Å; D531-L534 PolarHBondContact O-N 2.99Å
532	Q	43.8	Very low	46.4	Very low	128 Å²	128	106.3 Å²	106.3	60%	0.598	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-80.1	-16.8	178.4	-102.1	177.7	22.2	0	0	114.1	D529 L534 Q535	D529-Q532 HydrophobicContact CB-CB 4.07Å; D529-Q532 HydrophobicContact CB-CG 4.08Å; D529-Q532 PolarHBondContact O-N 3.28Å; Q532-L534 PolarHBondContact O-N 3.31Å; Q532-Q535 PolarHBondContact O-N 3.05Å
533	D	42.5	Very low	43.9	Very low	89 Å²	89	111.6 Å²	111.6	48%	0.476	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-67.1	1.5	168.6	-79.6	-14.7	0	0	0	112.6	H189 Q535	H189-D533 IonicContact CE1-OD2 3.82Å; D533-Q535 VanDerWaalsContact C-N 3.29Å; D533-Q535 PolarHBondContact O-N 3.32Å
534	L	41.3	Very low	41.7	Very low	114 Å²	114	111.6 Å²	111.6	60%	0.597	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-74.8	-6.8	172.4	-89.2	112.6	0	0	0	114.8	D531 Q532	D531-L534 HydrophobicContact CB-CD1 4.07Å; D531-L534 WeakPolarHBondContact O-CB 3.31Å; D531-L534 WeakPolarHBondContact O-CD1 3.37Å; D531-L534 PolarHBondContact O-N 2.99Å; Q532-L534 PolarHBondContact O-N 3.31Å
535	Q	26.6	Very low	39.5	Very low	163 Å²	163	120.1 Å²	120.1	76%	0.762	66%	0.663	S	S	*	*	S	Bend	trans	-109.5	118.8	170.7	-72.4	-168.3	-13.7	0	0	110.6	Q532 D533 S537	Q532-Q535 PolarHBondContact O-N 3.05Å; D533-Q535 VanDerWaalsContact C-N 3.29Å; D533-Q535 PolarHBondContact O-N 3.32Å; Q535-S537 PolarHBondContact O-N 3.4Å
536	P	32.1	Very low	37.7	Very low	121 Å²	121	114.5 Å²	114.5	79%	0.786	67%	0.665	S	S	*	*			trans	-58.6	119.1	163	25.4	-28.4	0	0	0	105.9	G538	P536-G538 PolarHBondContact O-N 3.25Å
537	S	25.5	Very low	36	Very low	106 Å²	106	119 Å²	119	74%	0.741	69%	0.686	S	S	*	*			trans	-54	108.5	173.4	-63.9	0	0	0	0	107.2	Q535 D539	Q535-S537 PolarHBondContact O-N 3.4Å; S537-D539 PolarHBondContact O-N 3.22Å
538	G	30.1	Very low	34.4	Very low	72 Å²	72	119.7 Å²	119.7	74%	0.742	69%	0.693	S	S	*	*			trans	-68.7	72.2	170	0	0	0	0	0	108.5	P536 S540	P536-G538 PolarHBondContact O-N 3.25Å; G538-S540 PolarHBondContact O-N 2.61Å
539	D	26.7	Very low	33	Very low	149 Å²	149	125.3 Å²	125.3	80%	0.797	72%	0.722	S	S	*	*			trans	-65.5	119.9	168.2	-95.5	-5.1	0	0	0	107.3	S537 F541	S537-D539 PolarHBondContact O-N 3.22Å; D539-F541 PolarHBondContact O-N 3.41Å
540	S	28.9	Very low	32	Very low	114 Å²	114	129.7 Å²	129.7	80%	0.797	74%	0.739	S	S	*	*			trans	-58.6	99.7	-173.4	-44.3	0	0	0	0	110.1	G538 Q542	G538-S540 PolarHBondContact O-N 2.61Å; S540-Q542 VanDerWaalsContact C-N 3.3Å; S540-Q542 PolarHBondContact O-N 3.23Å
541	F	26.6	Very low	30.9	Very low	182 Å²	182	133.8 Å²	133.8	80%	0.798	76%	0.758	S	S	*	*			trans	-74.4	86.8	170.1	-170	-99.7	0	0	0	108.8	D539 V543	D539-F541 PolarHBondContact O-N 3.41Å; F541-V543 HydrophobicContact CD1-CG2 4.2Å; F541-V543 HydrophobicContact CE1-CG2 4.27Å; F541-V543 PolarHBondContact O-N 3.17Å
542	Q	27.8	Very low	30.2	Very low	175 Å²	175	138 Å²	138	82%	0.818	77%	0.774	S	S	*	*			trans	-64.8	111.8	161.5	-98.3	-179.7	-6.8	0	0	108.3	S540 L544	S540-Q542 VanDerWaalsContact C-N 3.3Å; S540-Q542 PolarHBondContact O-N 3.23Å; Q542-L544 PolarHBondContact O-N 3.45Å
543	V	28.9	Very low	29.7	Very low	120 Å²	120	135.1 Å²	135.1	73%	0.727	78%	0.779	S	S	*	*			trans	-58	105.6	171.5	177.3	0	0	0	0	109	F541	F541-V543 HydrophobicContact CD1-CG2 4.2Å; F541-V543 HydrophobicContact CE1-CG2 4.27Å; F541-V543 PolarHBondContact O-N 3.17Å
544	L	29.7	Very low	29	Very low	163 Å²	163	139.1 Å²	139.1	85%	0.853	79%	0.794	S	S	*	*			trans	-118.9	105.2	157.6	-108	155.4	0	0	0	107.9	Q542 G546	Q542-L544 PolarHBondContact O-N 3.45Å; L544-G546 PolarHBondContact O-N 3.41Å
545	Q	30.2	Very low	28.6	Very low	193 Å²	193	137.1 Å²	137.1	90%	0.902	79%	0.79	S	S	*	*			trans	-54.4	119.4	175.1	-164.1	169.1	21.1	0	0	110.1
546	G	26.1	Very low	28.8	Very low	75 Å²	75	137.4 Å²	137.4	77%	0.773	79%	0.789	S	S	*	*			trans	-160.6	107.2	178.7	0	0	0	0	0	111.1	L544	L544-G546 PolarHBondContact O-N 3.41Å
547	D	27.8	Very low	29.1	Very low	175 Å²	175	135.8 Å²	135.8	94%	0.936	78%	0.777	S	S	*	*			trans	-63.7	141.9	-179.8	-166.9	14.7	0	0	0	112.8
548	G	25.7	Very low	29.6	Very low	70 Å²	70	136.2 Å²	136.2	72%	0.722	77%	0.765	S	S	*	*			trans	165.5	112.7	175.4	0	0	0	0	0	116.3
549	N	29.3	Very low	29.8	Very low	156 Å²	156	138.9 Å²	138.9	83%	0.834	76%	0.759	S	S	*	*			trans	-68.9	164.4	174.4	-83.5	-34.3	0	0	0	115
550	Q	26.3	Very low	30.3	Very low	178 Å²	178	138.3 Å²	138.3	83%	0.832	75%	0.751	S	S	*	*			trans	92.8	133.1	168.3	-59	173	3.3	0	0	114.5
551	D	27.3	Very low	31	Very low	150 Å²	150	136.8 Å²	136.8	80%	0.802	74%	0.74	S	S	*	*			cis	-155.2	144.7	32.2	-100.4	-43.1	0	0	0	113.3	G553	D551-G553 VanDerWaalsContact C-N 3.34Å; D551-G553 PolarHBondContact O-N 2.94Å
552	E	30.9	Very low	31.9	Very low	205 Å²	205	129.9 Å²	129.9	96%	0.958	72%	0.717	S	S	*	*			trans	-85.1	25.9	-173.9	-119.4	-176.2	158.9	0	0	115.3
553	G	32.4	Very low	33	Very low	68 Å²	68	128.6 Å²	128.6	70%	0.701	71%	0.705	S	S	*	*			trans	-97.9	-14.4	-168.3	0	0	0	0	0	118.1	D551	D551-G553 VanDerWaalsContact C-N 3.34Å; D551-G553 PolarHBondContact O-N 2.94Å
554	Q	29.3	Very low	34.1	Very low	172 Å²	172	128 Å²	128	80%	0.804	70%	0.697	S	S	*	*	S	Bend	trans	-112.3	14.6	-159.3	-76.3	-177.3	-8.7	0	0	116.7
555	S	31.8	Very low	35.4	Very low	72 Å²	72	124.4 Å²	124.4	50%	0.503	67%	0.674	S	S	.	*	S	Bend	trans	-88.3	-19.6	-174.9	-171.8	0	0	0	0	115.8
556	K	31.8	Very low	36.9	Very low	170 Å²	170	123.3 Å²	123.3	74%	0.739	66%	0.662	S	S	*	*	H	α-helix	trans	-74	-39.4	-165.4	-72.6	-176.9	175.8	178	0	114.9	Q559 E560	K556-Q559 PolarHBondContact O-N 3.48Å; K556-E560 PolarHBondContact O-N 3.12Å
557	T	38.4	Very low	38.7	Very low	87 Å²	87	124 Å²	124	53%	0.534	65%	0.647	S	S	.	*	H	α-helix	trans	-79	-24.7	-174	46.3	0	0	0	0	114.3
558	K	36.4	Very low	40.5	Very low	115 Å²	115	120.3 Å²	120.3	50%	0.5	62%	0.621	S	S	.	*	H	α-helix	trans	-73.7	-30.3	173.9	-145.5	-152.3	-161.4	178	0	111.8	R459 A562	R459-K558 VanDerWaalsContact NH1-CE 3.3Å; R459-K558 VanDerWaalsContact NH1-NZ 3.17Å; K558-A562 VanDerWaalsContact O-CB 3.23Å; K558-A562 WeakPolarHBondContact O-CB 3.39Å
559	Q	33.7	Very low	42.2	Very low	128 Å²	128	118.6 Å²	118.6	60%	0.598	59%	0.593	S	S	*	*	H	α-helix	trans	-68.2	-45.6	175.2	-91.5	173.2	-34.8	0	0	110.8	K556 W563	K556-Q559 PolarHBondContact O-N 3.48Å; Q559-W563 WeakPolarHBondContact O-CA 3.28Å; Q559-W563 WeakPolarHBondContact O-CB 3.4Å; Q559-W563 PolarHBondContact O-N 3.31Å
560	E	37.7	Very low	43.7	Very low	136 Å²	136	114.5 Å²	114.5	64%	0.636	57%	0.574	S	S	*	*	H	α-helix	trans	-70.8	-41.4	-170.4	-69.3	-176.7	166.4	0	0	115.3	K556 W563 L564	K556-E560 PolarHBondContact O-N 3.12Å; E560-W563 PolarHBondContact O-N 2.96Å; E560-L564 PolarHBondContact O-N 2.58Å
561	S	42.6	Very low	45.7	Very low	82 Å²	82	111.1 Å²	111.1	57%	0.573	56%	0.556	S	S	*	*	H	α-helix	trans	-76.9	-37.2	179.5	59.7	0	0	0	0	112.9	W563 F565	S561-W563 VanDerWaalsContact C-N 3.28Å; S561-F565 WeakPolarHBondContact O-CB 3.36Å; S561-F565 PolarHBondContact O-N 3.35Å
562	A	46.9	Very low	47.7	Very low	38 Å²	38	104 Å²	104	31%	0.314	52%	0.518	S	S	.	.	H	α-helix	trans	-70	-27.6	169.6	0	0	0	0	0	111.6	K558 R566	K558-A562 VanDerWaalsContact O-CB 3.23Å; K558-A562 WeakPolarHBondContact O-CB 3.39Å; A562-R566 WeakPolarHBondContact O-CB 3.23Å; A562-R566 WeakPolarHBondContact O-CG 3.49Å; A562-R566 PolarHBondContact O-N 2.94Å
563	W	49.2	Very low	49.2	Very low	148 Å²	148	96.7 Å²	96.7	56%	0.561	48%	0.484	S	S	*	.	H	α-helix	trans	-72.8	-44	175.7	177.8	86.6	0	0	0	111.8	Q559 E560 S561 F565 R566 L567	Q559-W563 WeakPolarHBondContact O-CA 3.28Å; Q559-W563 WeakPolarHBondContact O-CB 3.4Å; Q559-W563 PolarHBondContact O-N 3.31Å; E560-W563 PolarHBondContact O-N 2.96Å; S561-W563 VanDerWaalsContact C-N 3.28Å; W563-F565 VanDerWaalsContact C-N 3.34Å; W563-F565 PolarHBondContact O-N 3.47Å; W563-R566 PolarHBondContact O-N 3.23Å; W563-L567 HydrophobicContact CH2-CD2 3.69Å; W563-L567 HydrophobicContact CZ2-CD2 3.85Å; W563-L567 HydrophobicContact CZ3-CD2 4.1Å; W563-L567 WeakPolarHBondContact O-CA 3.33Å; W563-L567 WeakPolarHBondContact O-CB 3.03Å; W563-L567 PolarHBondContact O-N 3.02Å
564	L	53.4	Low	50.3	Low	108 Å²	108	96 Å²	96	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-63.1	-42	174.2	-75.1	174.4	0	0	0	111.7	E560 W568	E560-L564 PolarHBondContact O-N 2.58Å; L564-W568 VanDerWaalsContact O-CB 3.22Å; L564-W568 WeakPolarHBondContact O-CB 3.45Å; L564-W568 PolarHBondContact O-N 3.34Å
565	F	56.7	Low	51.6	Low	86 Å²	86	92 Å²	92	38%	0.377	44%	0.442	S	S	.	.	H	α-helix	trans	-65.6	-45	174.8	-178.5	-97.1	0	0	0	111.9	F191 S561 W563 W568 Y569	F191-F565 HydrophobicContact CB-CE2 4.13Å; S561-F565 WeakPolarHBondContact O-CB 3.36Å; S561-F565 PolarHBondContact O-N 3.35Å; W563-F565 VanDerWaalsContact C-N 3.34Å; W563-F565 PolarHBondContact O-N 3.47Å; F565-W568 PolarHBondContact O-N 2.98Å; F565-Y569 HydrophobicContact CZ-CD2 4.47Å; F565-Y569 WeakPolarHBondContact O-CB 3.32Å; F565-Y569 PolarHBondContact O-N 2.86Å
566	R	60.3	Low	53.1	Low	170 Å²	170	90.4 Å²	90.4	64%	0.642	43%	0.428	S	S	*	.	H	α-helix	trans	-64	-44	175.7	-80	173.9	176.6	-174.1	-2.6	111.7	A562 W563 Y569 T570	A562-R566 WeakPolarHBondContact O-CB 3.23Å; A562-R566 WeakPolarHBondContact O-CG 3.49Å; A562-R566 PolarHBondContact O-N 2.94Å; W563-R566 PolarHBondContact O-N 3.23Å; R566-Y569 PolarHBondContact O-N 2.88Å; R566-T570 WeakPolarHBondContact O-CB 3.37Å; R566-T570 PolarHBondContact O-N 2.96Å; R566-T570 PolarHBondContact O-OG1 3.42Å
567	L	63.9	Low	54.8	Low	89 Å²	89	82.7 Å²	82.7	47%	0.466	39%	0.394	S	S	.	.	H	α-helix	trans	-63.2	-46	178.4	-175.9	70.9	0	0	0	110.6	W563 F571	W563-L567 HydrophobicContact CH2-CD2 3.69Å; W563-L567 HydrophobicContact CZ2-CD2 3.85Å; W563-L567 HydrophobicContact CZ3-CD2 4.1Å; W563-L567 WeakPolarHBondContact O-CA 3.33Å; W563-L567 WeakPolarHBondContact O-CB 3.03Å; W563-L567 PolarHBondContact O-N 3.02Å; L567-F571 WeakPolarHBondContact O-CB 3.47Å; L567-F571 PolarHBondContact O-N 3.27Å
568	W	67.1	Low	55.8	Low	98 Å²	98	79 Å²	79	37%	0.371	37%	0.372	S	S	.	.	H	α-helix	trans	-65.4	-44.1	175.9	-177.5	82.6	0	0	0	111.6	L564 F565 F571 D572	L564-W568 VanDerWaalsContact O-CB 3.22Å; L564-W568 WeakPolarHBondContact O-CB 3.45Å; L564-W568 PolarHBondContact O-N 3.34Å; F565-W568 PolarHBondContact O-N 2.98Å; W568-F571 PolarHBondContact O-N 3.23Å; W568-D572 HydrophobicContact CH2-CB 4.49Å; W568-D572 HydrophobicContact CZ2-CB 4.49Å; W568-D572 WeakPolarHBondContact O-CA 3.5Å; W568-D572 WeakPolarHBondContact O-CB 3.5Å; W568-D572 PolarHBondContact O-N 3.39Å
569	Y	61.7	Low	57.2	Low	34 Å²	34	75.7 Å²	75.7	13%	0.133	36%	0.359	C	S	.	.	H	α-helix	trans	-66.1	-43.2	178.8	-175.1	-87	0	0	0	111.8	F565 R566 D572 H573 D618 I622	F565-Y569 HydrophobicContact CZ-CD2 4.47Å; F565-Y569 WeakPolarHBondContact O-CB 3.32Å; F565-Y569 PolarHBondContact O-N 2.86Å; R566-Y569 PolarHBondContact O-N 2.88Å; Y569-D572 PolarHBondContact O-N 2.9Å; Y569-H573 HydrophobicContact CE1-CB 4.37Å; Y569-H573 WeakPolarHBondContact O-CB 3.5Å; Y569-H573 PolarHBondContact O-N 2.69Å; Y569-D618 PolarHBondContact OH-O 3.07Å; Y569-I622 HydrophobicContact CE1-CD1 3.95Å
570	T	60.6	Low	58.8	Low	71 Å²	71	69.9 Å²	69.9	44%	0.436	33%	0.332	S	S	.	.	H	α-helix	trans	-64.8	-41.4	174.6	-61	0	0	0	0	110.8	R566 N574	R566-T570 WeakPolarHBondContact O-CB 3.37Å; R566-T570 PolarHBondContact O-N 2.96Å; R566-T570 PolarHBondContact O-OG1 3.42Å; T570-N574 VanDerWaalsContact CG2-ND2 3.35Å; T570-N574 WeakPolarHBondContact CG2-ND2 3.1Å; T570-N574 WeakPolarHBondContact O-CB 3.47Å; T570-N574 PolarHBondContact O-N 3.32Å; T570-N574 PolarHBondContact O-ND2 3.3Å
571	F	67.4	Low	59.8	Low	107 Å²	107	63.6 Å²	63.6	47%	0.469	30%	0.303	S	S	.	.	H	α-helix	trans	-65.4	-43	174.8	177.1	-106.5	0	0	0	111.9	L567 W568 Y575 L576	L567-F571 WeakPolarHBondContact O-CB 3.47Å; L567-F571 PolarHBondContact O-N 3.27Å; W568-F571 PolarHBondContact O-N 3.23Å; F571-Y575 AromaticContact CD2-CD2 3.59Å; F571-Y575 HydrophobicContact CD2-CD2 3.59Å; F571-Y575 HydrophobicContact CD2-CE2 4.29Å; F571-Y575 HydrophobicContact CD2-CG 4.36Å; F571-Y575 HydrophobicContact CE2-CD2 4.01Å; F571-Y575 HydrophobicContact CE2-CG 4.38Å; F571-Y575 HydrophobicContact CG-CD2 4.42Å; F571-Y575 WeakPolarHBondContact O-CA 3.38Å; F571-Y575 WeakPolarHBondContact O-CB 3.47Å; F571-Y575 PolarHBondContact O-N 3.4Å; F571-L576 HydrophobicContact CD1-CD1 3.79Å; F571-L576 HydrophobicContact CE1-CD1 3.18Å; F571-L576 HydrophobicContact CZ-CD1 3.69Å; F571-L576 PolarHBondContact O-N 3.32Å
572	D	69	Low	60.4	Low	0 Å²	0	61.3 Å²	61.3	0%	0	28%	0.283	C	S	.	.	I	π-helix	trans	-63.3	-52.5	178	177.6	61	0	0	0	111	H382 Y383 W568 Y569 N574 L576 K577	H382-D572 IonicContact CE1-OD1 3.09Å; H382-D572 IonicContact CE1-OD2 3.4Å; H382-D572 PolarHBondContact CE1-OD2 3.04Å; H382-D572 VanDerWaalsContact CE1-OD2 3.23Å; H382-D572 IonicContact NE2-OD2 2.68Å; Y383-D572 WeakPolarHBondContact CE1-OD1 3.47Å; Y383-D572 PolarHBondContact OH-OD1 3.41Å; W568-D572 HydrophobicContact CH2-CB 4.49Å; W568-D572 HydrophobicContact CZ2-CB 4.49Å; W568-D572 WeakPolarHBondContact O-CA 3.5Å; W568-D572 WeakPolarHBondContact O-CB 3.5Å; W568-D572 PolarHBondContact O-N 3.39Å; Y569-D572 PolarHBondContact O-N 2.9Å; D572-N574 PolarHBondContact O-N 3.3Å; D572-L576 CarbonylContact O-C 3.55Å; D572-L576 PolarHBondContact O-N 3.07Å; D572-L576 WeakPolarHBondContact OD1-CB 3.3Å; D572-K577 PolarHBondContact O-N 3.1Å; D572-K577 WeakPolarHBondContact OD2-CE 3.38Å
573	H	63.4	Low	60.4	Low	52 Å²	52	61 Å²	61	24%	0.241	28%	0.278	C	S	.	.	I	π-helix	trans	-64.7	-39.9	-179.1	-166.6	81.7	0	0	0	112.8	Y569 P578	Y569-H573 HydrophobicContact CE1-CB 4.37Å; Y569-H573 WeakPolarHBondContact O-CB 3.5Å; Y569-H573 PolarHBondContact O-N 2.69Å; H573-P578 WeakPolarHBondContact O-CD 3.31Å
574	N	54.4	Low	60.6	Low	52 Å²	52	55.7 Å²	55.7	28%	0.278	27%	0.27	S	S	.	.	I	π-helix	trans	-83.8	-28.9	-176.6	-65.8	-11.5	0	0	0	113.6	T570 D572 P578 T590	T570-N574 VanDerWaalsContact CG2-ND2 3.35Å; T570-N574 WeakPolarHBondContact CG2-ND2 3.1Å; T570-N574 WeakPolarHBondContact O-CB 3.47Å; T570-N574 PolarHBondContact O-N 3.32Å; T570-N574 PolarHBondContact O-ND2 3.3Å; D572-N574 PolarHBondContact O-N 3.3Å; N574-P578 WeakPolarHBondContact O-CG 3.49Å; N574-T590 PolarHBondContact O-OG1 2.95Å; N574-T590 VanDerWaalsContact O-OG1 3.06Å
575	Y	56.8	Low	60.2	Low	89 Å²	89	52.3 Å²	52.3	35%	0.349	26%	0.255	S	S	.	.	I	π-helix	trans	-124.1	-52.8	-172.9	-56.8	-75.1	0	0	0	113.7	F571 I579	F571-Y575 AromaticContact CD2-CD2 3.59Å; F571-Y575 HydrophobicContact CD2-CD2 3.59Å; F571-Y575 HydrophobicContact CD2-CE2 4.29Å; F571-Y575 HydrophobicContact CD2-CG 4.36Å; F571-Y575 HydrophobicContact CE2-CD2 4.01Å; F571-Y575 HydrophobicContact CE2-CG 4.38Å; F571-Y575 HydrophobicContact CG-CD2 4.42Å; F571-Y575 WeakPolarHBondContact O-CA 3.38Å; F571-Y575 WeakPolarHBondContact O-CB 3.47Å; F571-Y575 PolarHBondContact O-N 3.4Å; Y575-I579 VanDerWaalsContact O-CB 3.3Å; Y575-I579 WeakPolarHBondContact O-CB 3.31Å; Y575-I579 WeakPolarHBondContact O-CD1 3.44Å; Y575-I579 WeakPolarHBondContact O-CG1 3.37Å; Y575-I579 PolarHBondContact O-N 3.2Å
576	L	64.3	Low	59.9	Low	39 Å²	39	49.1 Å²	49.1	20%	0.204	24%	0.242	C	C	.	.	I	π-helix	trans	-73.8	-50.2	-175.3	-94.6	78.2	0	0	0	113.4	Y383 F571 D572 I579 L580	Y383-L576 HydrophobicContact CE1-CB 3.98Å; Y383-L576 HydrophobicContact CE1-CD2 4.08Å; Y383-L576 HydrophobicContact CE2-CD2 4.28Å; Y383-L576 WeakPolarHBondContact OH-CD2 3.44Å; F571-L576 HydrophobicContact CD1-CD1 3.79Å; F571-L576 HydrophobicContact CE1-CD1 3.18Å; F571-L576 HydrophobicContact CZ-CD1 3.69Å; F571-L576 PolarHBondContact O-N 3.32Å; D572-L576 CarbonylContact O-C 3.55Å; D572-L576 PolarHBondContact O-N 3.07Å; D572-L576 WeakPolarHBondContact OD1-CB 3.3Å; L576-I579 PolarHBondContact O-N 3Å; L576-I579 VanDerWaalsContact O-N 3.17Å; L576-L580 HydrophobicContact CB-CD1 4.07Å; L576-L580 HydrophobicContact CD2-CD1 3.79Å; L576-L580 HydrophobicContact CG-CD1 3.84Å; L576-L580 WeakPolarHBondContact O-CB 3.38Å; L576-L580 VanDerWaalsContact O-CG 3.32Å; L576-L580 WeakPolarHBondContact O-CG 3.25Å; L576-L580 PolarHBondContact O-N 3.49Å
577	K	67.3	Low	59.2	Low	7 Å²	7	41.1 Å²	41.1	3%	0.03	21%	0.212	C	C	.	.	H	α-helix	trans	-52.4	-48.8	178.7	-80.6	-169.3	174.5	-170.9	0	112.2	D572 T581 D616 D618	D572-K577 PolarHBondContact O-N 3.1Å; D572-K577 WeakPolarHBondContact OD2-CE 3.38Å; K577-T581 VanDerWaalsContact O-CA 3.29Å; K577-T581 WeakPolarHBondContact O-CA 3.36Å; K577-T581 WeakPolarHBondContact O-CB 3.5Å; K577-T581 PolarHBondContact O-N 3.34Å; K577-T581 PolarHBondContact O-OG1 2.76Å; K577-D616 IonicContact NZ-OD2 2.76Å; K577-D616 PolarHBondContact NZ-OD2 3.23Å; K577-D618 IonicContact NZ-OD2 3.8Å
578	P	58.6	Low	58.7	Low	9 Å²	9	40.5 Å²	40.5	6%	0.058	21%	0.212	C	C	.	.	H	α-helix	trans	-74.9	-26.6	179.2	27.5	-34.1	0	0	0	114	K336 H573 N574 P585 L587	K336-P578 PolarHBondContact NZ-O 2.87Å; H573-P578 WeakPolarHBondContact O-CD 3.31Å; N574-P578 WeakPolarHBondContact O-CG 3.49Å; P578-P585 WeakPolarHBondContact CB-O 3.31Å; P578-L587 HydrophobicContact CB-CD1 4.07Å; P578-L587 HydrophobicContact CB-CG 3.96Å; P578-L587 HydrophobicContact CG-CG 4.21Å; P578-L587 WeakPolarHBondContact O-CD1 3.48Å
579	I	67.1	Low	57.9	Low	47 Å²	47	39.7 Å²	39.7	24%	0.241	22%	0.222	C	C	.	.	H	α-helix	trans	-74.4	-40.7	174.1	-68.7	170.6	0	0	0	111.2	K336 Y575 L576 L587	K336-I579 WeakPolarHBondContact CD-O 3.34Å; K336-I579 VanDerWaalsContact NZ-C 3.32Å; K336-I579 PolarHBondContact NZ-O 3.33Å; Y575-I579 VanDerWaalsContact O-CB 3.3Å; Y575-I579 WeakPolarHBondContact O-CB 3.31Å; Y575-I579 WeakPolarHBondContact O-CD1 3.44Å; Y575-I579 WeakPolarHBondContact O-CG1 3.37Å; Y575-I579 PolarHBondContact O-N 3.2Å; L576-I579 PolarHBondContact O-N 3Å; L576-I579 VanDerWaalsContact O-N 3.17Å; I579-L587 HydrophobicContact CB-CD1 4.5Å; I579-L587 HydrophobicContact CD1-CD2 4.08Å; I579-L587 HydrophobicContact CG1-CD1 3.75Å; I579-L587 HydrophobicContact CG1-CD2 3.59Å; I579-L587 HydrophobicContact CG1-CG 4.23Å
580	L	65.6	Low	57.2	Low	6 Å²	6	39.6 Å²	39.6	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-99.5	-19.5	-169.7	-59.7	179.6	0	0	0	113.3	V329 A332 L333 Y383 N387 L576	V329-L580 HydrophobicContact CG1-CD1 4.28Å; V329-L580 HydrophobicContact CG1-CD2 3.7Å; V329-L580 HydrophobicContact CG2-CD1 4.09Å; A332-L580 HydrophobicContact CB-CB 4.48Å; L333-L580 HydrophobicContact CD1-CD2 4.45Å; L333-L580 HydrophobicContact CD2-CD2 3.64Å; L333-L580 HydrophobicContact CG-CD2 3.85Å; Y383-L580 HydrophobicContact CD1-CB 4.1Å; Y383-L580 HydrophobicContact CD1-CD1 3.87Å; Y383-L580 HydrophobicContact CD2-CD1 4.2Å; Y383-L580 HydrophobicContact CE1-CD1 3.99Å; Y383-L580 HydrophobicContact CE2-CD1 4.33Å; Y383-L580 HydrophobicContact CG-CB 4.37Å; Y383-L580 HydrophobicContact CG-CD1 3.98Å; N387-L580 PolarHBondContact ND2-O 3.47Å; L576-L580 HydrophobicContact CB-CD1 4.07Å; L576-L580 HydrophobicContact CD2-CD1 3.79Å; L576-L580 HydrophobicContact CG-CD1 3.84Å; L576-L580 WeakPolarHBondContact O-CB 3.38Å; L576-L580 VanDerWaalsContact O-CG 3.32Å; L576-L580 WeakPolarHBondContact O-CG 3.25Å; L576-L580 PolarHBondContact O-N 3.49Å
581	T	59.7	Low	56.5	Low	3 Å²	3	38.7 Å²	38.7	2%	0.018	22%	0.217	C	C	.	.			trans	-128.5	167.2	-177.3	80.8	0	0	0	0	114.1	K336 Y383 N386 N387 K577 S583	K336-T581 VanDerWaalsContact CE-O 3.29Å; K336-T581 WeakPolarHBondContact CE-O 3.44Å; K336-T581 PolarHBondContact NZ-O 2.89Å; Y383-T581 HydrophobicContact CD1-CG2 4.25Å; Y383-T581 WeakPolarHBondContact O-CG2 3.21Å; N386-T581 HydrophobicContact CB-CG2 4.29Å; N387-T581 WeakPolarHBondContact OD1-CA 3.38Å; N387-T581 WeakPolarHBondContact OD1-CB 3.22Å; K577-T581 VanDerWaalsContact O-CA 3.29Å; K577-T581 WeakPolarHBondContact O-CA 3.36Å; K577-T581 WeakPolarHBondContact O-CB 3.5Å; K577-T581 PolarHBondContact O-N 3.34Å; K577-T581 PolarHBondContact O-OG1 2.76Å; T581-S583 VanDerWaalsContact C-N 3.26Å; T581-S583 PolarHBondContact OG1-N 2.86Å; T581-S583 PolarHBondContact OG1-O 2.87Å
582	H	55.3	Low	55.5	Low	35 Å²	35	37.8 Å²	37.8	16%	0.162	22%	0.222	C	C	.	.	S	Bend	trans	-84.5	2.6	169.6	-67.2	-67.1	0	0	0	113.4	K336 N387 S604	K336-H582 PolarHBondContact O-NE2 3.28Å; N387-H582 PolarHBondContact OD1-N 3.41Å; H582-S604 VanDerWaalsContact CE1-CB 3.48Å; H582-S604 WeakPolarHBondContact CE1-CB 3.25Å; H582-S604 PolarHBondContact CE1-OG 3.39Å; H582-S604 PolarHBondContact ND1-OG 3.45Å; H582-S604 VanDerWaalsContact ND1-OG 3.08Å
583	S	47.3	Very low	54.4	Low	30 Å²	30	43.6 Å²	43.6	21%	0.21	26%	0.262	C	S	.	.	S	Bend	trans	-113	132.1	-177.6	-56.2	0	0	0	0	110.2	T581	T581-S583 VanDerWaalsContact C-N 3.26Å; T581-S583 PolarHBondContact OG1-N 2.86Å; T581-S583 PolarHBondContact OG1-O 2.87Å
584	G	52.4	Low	53.8	Low	37 Å²	37	51.9 Å²	51.9	38%	0.381	29%	0.293	S	S	.	.	S	Bend	trans	124	170	-178.7	0	0	0	0	0	113.6
585	P	46.3	Very low	53.7	Low	38 Å²	38	51.7 Å²	51.7	25%	0.247	30%	0.295	C	S	.	.	S	Bend	trans	-64.1	140.2	-179.1	26.1	-32.9	0	0	0	110.7	P578 L587 T590	P578-P585 WeakPolarHBondContact CB-O 3.31Å; P585-L587 PolarHBondContact O-N 2.87Å; P585-T590 HydrophobicContact CG-CG2 4.29Å
586	P	49	Very low	53.5	Low	19 Å²	19	49.3 Å²	49.3	12%	0.123	30%	0.297	C	S	.	.			trans	-59.9	136.4	179.3	24.8	-33.1	0	0	0	110.3	T588 S589 T603 Y608	P586-T588 PolarHBondContact O-N 3.43Å; P586-S589 PolarHBondContact O-N 3.3Å; P586-S589 PolarHBondContact O-OG 3.42Å; P586-T603 HydrophobicContact CB-CG2 4.29Å; P586-Y608 HydrophobicContact CB-CE2 4.09Å
587	L	46.8	Very low	53.1	Low	1 Å²	1	52.1 Å²	52.1	1%	0.005	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-16.1	-178.4	-86.7	136.3	0	0	0	114.2	P578 I579 P585 S589 T590 L591 A599	P578-L587 HydrophobicContact CB-CD1 4.07Å; P578-L587 HydrophobicContact CB-CG 3.96Å; P578-L587 HydrophobicContact CG-CG 4.21Å; P578-L587 WeakPolarHBondContact O-CD1 3.48Å; I579-L587 HydrophobicContact CB-CD1 4.5Å; I579-L587 HydrophobicContact CD1-CD2 4.08Å; I579-L587 HydrophobicContact CG1-CD1 3.75Å; I579-L587 HydrophobicContact CG1-CD2 3.59Å; I579-L587 HydrophobicContact CG1-CG 4.23Å; P585-L587 PolarHBondContact O-N 2.87Å; L587-S589 PolarHBondContact O-N 3.34Å; L587-T590 PolarHBondContact O-N 3.06Å; L587-L591 HydrophobicContact CB-CD1 4.37Å; L587-L591 HydrophobicContact CD2-CD1 3.4Å; L587-L591 VanDerWaalsContact CD2-CD1 3.4Å; L587-L591 HydrophobicContact CD2-CG 4.14Å; L587-L591 PolarHBondContact O-N 2.99Å; L587-A599 HydrophobicContact CB-CB 4.19Å
588	T	52.6	Low	52.3	Low	77 Å²	77	57 Å²	57	47%	0.472	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.1	171.9	50.3	0	0	0	0	113.2	P586 Y608	P586-T588 PolarHBondContact O-N 3.43Å; T588-Y608 PolarHBondContact OG1-OH 3.41Å
589	S	49.9	Very low	51.8	Low	81 Å²	81	56.7 Å²	56.7	57%	0.566	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-20.2	178	66.1	0	0	0	0	114.4	P586 L587	P586-S589 PolarHBondContact O-N 3.3Å; P586-S589 PolarHBondContact O-OG 3.42Å; L587-S589 PolarHBondContact O-N 3.34Å
590	T	48.4	Very low	51.2	Low	31 Å²	31	58.3 Å²	58.3	19%	0.19	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-18.1	-172.2	60.1	0	0	0	0	115.4	N574 P585 L587	N574-T590 PolarHBondContact O-OG1 2.95Å; N574-T590 VanDerWaalsContact O-OG1 3.06Å; P585-T590 HydrophobicContact CG-CG2 4.29Å; L587-T590 PolarHBondContact O-N 3.06Å
591	L	44.6	Very low	50.7	Low	53 Å²	53	62.5 Å²	62.5	28%	0.277	39%	0.386	S	S	.	.	S	Bend	trans	-93.7	143.8	175	-88.6	161	0	0	0	112.3	L587 C595 A599	L587-L591 HydrophobicContact CB-CD1 4.37Å; L587-L591 HydrophobicContact CD2-CD1 3.4Å; L587-L591 VanDerWaalsContact CD2-CD1 3.4Å; L587-L591 HydrophobicContact CD2-CG 4.14Å; L587-L591 PolarHBondContact O-N 2.99Å; L591-C595 HydrophobicContact CB-CB 4.44Å; L591-C595 HydrophobicContact CD1-CB 4.48Å; L591-C595 HydrophobicContact CD2-CB 4.13Å; L591-A599 HydrophobicContact CD1-CB 4.02Å
592	P	46.2	Very low	50.3	Low	88 Å²	88	64.5 Å²	64.5	57%	0.571	40%	0.397	S	S	*	.			trans	-62.6	149.1	173.7	20.9	-25	0	0	0	111.6	Y594 C595	P592-Y594 PolarHBondContact O-N 3.23Å; P592-C595 PolarHBondContact O-N 3.2Å
593	S	45.8	Very low	50	Low	121 Å²	121	63.8 Å²	63.8	85%	0.846	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-54.3	-16.4	-170.8	47	0	0	0	0	115.9
594	Y	52.2	Low	50	Low	227 Å²	227	63.3 Å²	63.3	89%	0.89	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-76.5	-15.1	175	-103.4	-96	0	0	0	114.8	P592	P592-Y594 PolarHBondContact O-N 3.23Å
595	C	51	Low	49.9	Very low	48 Å²	48	66.9 Å²	66.9	32%	0.324	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-103.7	18.8	179.1	-69.2	0	0	0	0	114	L591 P592 L598 A599	L591-C595 HydrophobicContact CB-CB 4.44Å; L591-C595 HydrophobicContact CD1-CB 4.48Å; L591-C595 HydrophobicContact CD2-CB 4.13Å; P592-C595 PolarHBondContact O-N 3.2Å; C595-L598 PolarHBondContact O-N 2.93Å; C595-A599 WeakPolarHBondContact O-CB 3.36Å; C595-A599 PolarHBondContact O-N 3.4Å
596	G	54.2	Low	49.9	Very low	38 Å²	38	70.4 Å²	70.4	39%	0.392	42%	0.416	S	S	.	.	H	α-helix	trans	-49.3	-47.9	-177.9	0	0	0	0	0	116.8	A599 S600	G596-A599 PolarHBondContact O-N 3.39Å; G596-S600 PolarHBondContact O-N 3.42Å; G596-S600 PolarHBondContact O-OG 2.79Å
597	P	55.3	Low	49.8	Very low	98 Å²	98	70.2 Å²	70.2	64%	0.636	42%	0.416	S	S	*	.	H	α-helix	trans	-73.8	-28.3	-178.2	24.5	-30.9	0	0	0	113.8	S600 C601	P597-S600 WeakPolarHBondContact CA-OG 3.46Å; P597-S600 PolarHBondContact O-OG 3.36Å; P597-C601 VanDerWaalsContact O-CB 3.32Å; P597-C601 WeakPolarHBondContact O-CB 3.24Å; P597-C601 PolarHBondContact O-N 3.44Å; P597-C601 VanDerWaalsContact O-N 3.12Å
598	L	50.1	Low	49.9	Very low	110 Å²	110	77 Å²	77	58%	0.576	44%	0.443	S	S	*	.	H	α-helix	trans	-73.1	-40.9	172.7	-100.1	155.8	0	0	0	110.9	C595 C601 L602	C595-L598 PolarHBondContact O-N 2.93Å; L598-C601 PolarHBondContact O-N 2.85Å; L598-L602 HydrophobicContact CD2-CD1 4.18Å; L598-L602 WeakPolarHBondContact O-CB 3.25Å; L598-L602 WeakPolarHBondContact O-CG 3.5Å; L598-L602 PolarHBondContact O-N 3.14Å
599	A	48.8	Very low	49.5	Very low	3 Å²	3	80.5 Å²	80.5	3%	0.025	45%	0.454	C	S	.	.	H	α-helix	trans	-60.6	-46.1	172.3	0	0	0	0	0	110.8	L587 L591 C595 G596 C601 L602 T603	L587-A599 HydrophobicContact CB-CB 4.19Å; L591-A599 HydrophobicContact CD1-CB 4.02Å; C595-A599 WeakPolarHBondContact O-CB 3.36Å; C595-A599 PolarHBondContact O-N 3.4Å; G596-A599 PolarHBondContact O-N 3.39Å; A599-C601 VanDerWaalsContact C-N 3.31Å; A599-C601 PolarHBondContact O-N 3.46Å; A599-L602 PolarHBondContact O-N 3.46Å; A599-T603 VanDerWaalsContact O-CB 3.26Å; A599-T603 WeakPolarHBondContact O-CB 3.34Å; A599-T603 PolarHBondContact O-N 3.27Å; A599-T603 PolarHBondContact O-OG1 3.4Å
600	S	54.1	Low	49.1	Very low	81 Å²	81	80.3 Å²	80.3	57%	0.566	45%	0.446	S	S	*	.	H	α-helix	trans	-67.5	-27.6	178.3	67.3	0	0	0	0	114	G596 P597	G596-S600 PolarHBondContact O-N 3.42Å; G596-S600 PolarHBondContact O-OG 2.79Å; P597-S600 WeakPolarHBondContact CA-OG 3.46Å; P597-S600 PolarHBondContact O-OG 3.36Å
601	C	54.3	Low	48.7	Very low	93 Å²	93	86.4 Å²	86.4	63%	0.628	47%	0.472	S	S	*	.	H	α-helix	trans	-78	-37	177.4	-175.2	0	0	0	0	112.5	P597 L598 A599	P597-C601 VanDerWaalsContact O-CB 3.32Å; P597-C601 WeakPolarHBondContact O-CB 3.24Å; P597-C601 PolarHBondContact O-N 3.44Å; P597-C601 VanDerWaalsContact O-N 3.12Å; L598-C601 PolarHBondContact O-N 2.85Å; A599-C601 VanDerWaalsContact C-N 3.31Å; A599-C601 PolarHBondContact O-N 3.46Å
602	L	51.3	Low	48.3	Very low	46 Å²	46	92.9 Å²	92.9	24%	0.241	50%	0.501	C	S	.	.	H	α-helix	trans	-88.2	-16.8	-178.7	-65.3	171.7	0	0	0	113.5	K336 F337 L598 A599	K336-L602 PolarHBondContact NZ-O 2.94Å; F337-L602 HydrophobicContact CZ-CD2 3.95Å; L598-L602 HydrophobicContact CD2-CD1 4.18Å; L598-L602 WeakPolarHBondContact O-CB 3.25Å; L598-L602 WeakPolarHBondContact O-CG 3.5Å; L598-L602 PolarHBondContact O-N 3.14Å; A599-L602 PolarHBondContact O-N 3.46Å
603	T	48.8	Very low	47.8	Very low	20 Å²	20	96.3 Å²	96.3	12%	0.123	51%	0.51	C	S	.	.	S	Bend	trans	-85.2	117.9	174.8	-45.2	0	0	0	0	109.4	P586 A599 A607	P586-T603 HydrophobicContact CB-CG2 4.29Å; A599-T603 VanDerWaalsContact O-CB 3.26Å; A599-T603 WeakPolarHBondContact O-CB 3.34Å; A599-T603 PolarHBondContact O-N 3.27Å; A599-T603 PolarHBondContact O-OG1 3.4Å; T603-A607 HydrophobicContact CG2-CB 4.09Å
604	S	49.1	Very low	47.4	Very low	20 Å²	20	97 Å²	97	14%	0.14	50%	0.503	C	S	.	.			trans	-74.6	146	174.3	127.8	0	0	0	0	110.2	H582 R606 A607	H582-S604 VanDerWaalsContact CE1-CB 3.48Å; H582-S604 WeakPolarHBondContact CE1-CB 3.25Å; H582-S604 PolarHBondContact CE1-OG 3.39Å; H582-S604 PolarHBondContact ND1-OG 3.45Å; H582-S604 VanDerWaalsContact ND1-OG 3.08Å; S604-R606 PolarHBondContact O-N 3.4Å; S604-R606 PolarHBondContact OG-N 3.38Å; S604-R606 VanDerWaalsContact OG-N 3.14Å; S604-A607 WeakPolarHBondContact O-CB 3.38Å; S604-A607 PolarHBondContact O-N 2.85Å
605	P	48.4	Very low	46.7	Very low	111 Å²	111	96.3 Å²	96.3	72%	0.721	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-55.8	-24.7	175.9	-24.1	32.3	0	0	0	114.2	A607 Y608	P605-A607 VanDerWaalsContact C-N 3.34Å; P605-A607 PolarHBondContact O-N 2.84Å; P605-Y608 PolarHBondContact O-N 2.83Å
606	R	47	Very low	46.2	Very low	113 Å²	113	95.9 Å²	95.9	43%	0.426	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-75.7	-16.9	179.1	-72.2	-175.4	170.7	176.5	-4.6	114.2	S604 Y608 E609 N610	S604-R606 PolarHBondContact O-N 3.4Å; S604-R606 PolarHBondContact OG-N 3.38Å; S604-R606 VanDerWaalsContact OG-N 3.14Å; R606-Y608 PolarHBondContact O-N 3.35Å; R606-E609 PolarHBondContact O-N 2.87Å; R606-N610 PolarHBondContact O-N 3.16Å
607	A	47.9	Very low	45.6	Very low	15 Å²	15	98.9 Å²	98.9	12%	0.124	51%	0.506	C	S	.	.	G	3₁₀ helix	trans	-66	-20.7	173.8	0	0	0	0	0	112.2	T603 S604 P605	T603-A607 HydrophobicContact CG2-CB 4.09Å; S604-A607 WeakPolarHBondContact O-CB 3.38Å; S604-A607 PolarHBondContact O-N 2.85Å; P605-A607 VanDerWaalsContact C-N 3.34Å; P605-A607 PolarHBondContact O-N 2.84Å
608	Y	48.3	Very low	45	Very low	142 Å²	142	96.9 Å²	96.9	56%	0.557	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-25	174.2	-86.3	-87.2	0	0	0	113.5	P586 T588 P605 R606	P586-Y608 HydrophobicContact CB-CE2 4.09Å; T588-Y608 PolarHBondContact OG1-OH 3.41Å; P605-Y608 PolarHBondContact O-N 2.83Å; R606-Y608 PolarHBondContact O-N 3.35Å
609	E	44.1	Very low	44.5	Very low	152 Å²	152	94.7 Å²	94.7	71%	0.71	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-31.5	-179.3	-78.8	176	158.5	0	0	113	R606 H611	R606-E609 PolarHBondContact O-N 2.87Å; E609-H611 PolarHBondContact O-N 3.18Å
610	N	41.8	Very low	44	Very low	76 Å²	76	98.4 Å²	98.4	41%	0.406	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-81.4	13.5	-177.4	-78.9	-9.6	0	0	0	114.7	R606 E612 Q613	R606-N610 PolarHBondContact O-N 3.16Å; N610-E612 PolarHBondContact O-N 2.92Å; N610-E612 VanDerWaalsContact O-N 3.09Å; N610-Q613 PolarHBondContact O-N 3.42Å
611	H	39.7	Very low	43.5	Very low	160 Å²	160	98 Å²	98	74%	0.741	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-61.8	-19.3	-178.2	-148.7	62.7	0	0	0	113.2	E609	E609-H611 PolarHBondContact O-N 3.18Å
612	E	36.6	Very low	42.9	Very low	189 Å²	189	98.5 Å²	98.5	88%	0.883	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-106.3	-6.4	-178.6	-72.1	-165.5	146.8	0	0	115.5	N610	N610-E612 PolarHBondContact O-N 2.92Å; N610-E612 VanDerWaalsContact O-N 3.09Å
613	Q	35.9	Very low	42.1	Very low	160 Å²	160	103.3 Å²	103.3	75%	0.748	51%	0.508	S	S	*	.	S	Bend	trans	-150.2	77.3	-166.8	-133.4	157.4	3.6	0	0	113.8	N610	N610-Q613 PolarHBondContact O-N 3.42Å
614	L	36.6	Very low	41.4	Very low	136 Å²	136	109 Å²	109	71%	0.712	54%	0.537	S	S	*	.			trans	-173.5	101.3	142.3	-96.8	148.4	0	0	0	108.1	D616	L614-D616 PolarHBondContact O-N 3.44Å
615	R	37.2	Very low	40.7	Very low	212 Å²	212	114.2 Å²	114.2	80%	0.8	56%	0.564	S	S	*	*			trans	-66.8	91.9	173.3	-169.2	177	-176.7	173.6	2.7	107.8	P617 D620	R615-P617 WeakPolarHBondContact O-CD 3.45Å; R615-D620 IonicContact NE-OD2 3.83Å; R615-D620 IonicContact NH2-OD2 3.99Å
616	D	40.8	Very low	40	Very low	39 Å²	39	111.1 Å²	111.1	21%	0.209	55%	0.548	C	S	.	.			trans	-65.1	117	176.5	-153.1	4.1	0	0	0	106.7	K577 L614 D618 T619	K577-D616 IonicContact NZ-OD2 2.76Å; K577-D616 PolarHBondContact NZ-OD2 3.23Å; L614-D616 PolarHBondContact O-N 3.44Å; D616-D618 PolarHBondContact O-N 3.5Å; D616-T619 WeakPolarHBondContact CB-OG1 3.45Å; D616-T619 WeakPolarHBondContact O-CB 3.48Å; D616-T619 PolarHBondContact O-N 2.93Å; D616-T619 PolarHBondContact O-OG1 3.21Å
617	P	41.2	Very low	39.2	Very low	100 Å²	100	113.4 Å²	113.4	65%	0.649	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-12.8	-178.1	24.4	-33.5	0	0	0	112.8	R615 T619	R615-P617 WeakPolarHBondContact O-CD 3.45Å; P617-T619 VanDerWaalsContact C-N 3.35Å
618	D	42.6	Very low	38.5	Very low	57 Å²	57	120.2 Å²	120.2	31%	0.305	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.3	-17.9	172.9	-66.9	-20.9	0	0	0	113.3	Y569 K577 D616 L621	Y569-D618 PolarHBondContact OH-O 3.07Å; K577-D618 IonicContact NZ-OD2 3.8Å; D616-D618 PolarHBondContact O-N 3.5Å; D618-L621 VanDerWaalsContact O-CB 3.28Å; D618-L621 WeakPolarHBondContact O-CB 3.44Å
619	T	39.8	Very low	37.6	Very low	63 Å²	63	118.9 Å²	118.9	39%	0.387	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.2	-32.7	-177.3	-29.9	0	0	0	0	112.3	D616 P617 L621 I622	D616-T619 WeakPolarHBondContact CB-OG1 3.45Å; D616-T619 WeakPolarHBondContact O-CB 3.48Å; D616-T619 PolarHBondContact O-N 2.93Å; D616-T619 PolarHBondContact O-OG1 3.21Å; P617-T619 VanDerWaalsContact C-N 3.35Å; T619-L621 PolarHBondContact O-N 2.83Å; T619-L621 VanDerWaalsContact O-N 3.11Å; T619-I622 PolarHBondContact O-N 3.27Å
620	D	37.4	Very low	37	Very low	82 Å²	82	121.3 Å²	121.3	44%	0.439	62%	0.617	S	S	.	*	H	α-helix	trans	-67.1	-10.5	177	-70.4	-16.7	0	0	0	112	R615	R615-D620 IonicContact NE-OD2 3.83Å; R615-D620 IonicContact NH2-OD2 3.99Å
621	L	44.4	Very low	36.4	Very low	72 Å²	72	123.7 Å²	123.7	38%	0.377	64%	0.635	S	S	.	*	H	α-helix	trans	-78.5	-20.5	-179	-154.5	76.8	0	0	0	113.9	D618 T619	D618-L621 VanDerWaalsContact O-CB 3.28Å; D618-L621 WeakPolarHBondContact O-CB 3.44Å; T619-L621 PolarHBondContact O-N 2.83Å; T619-L621 VanDerWaalsContact O-N 3.11Å
622	I	42.5	Very low	35.7	Very low	104 Å²	104	125.4 Å²	125.4	53%	0.533	64%	0.64	S	S	.	*	H	α-helix	trans	-94.3	-29.1	-178.7	-58.2	179	0	0	0	111.4	Y569 T619	Y569-I622 HydrophobicContact CE1-CD1 3.95Å; T619-I622 PolarHBondContact O-N 3.27Å
623	H	34.3	Very low	35.3	Very low	146 Å²	146	119.6 Å²	119.6	68%	0.676	63%	0.631	S	S	*	*	H	α-helix	trans	-72.2	-28.7	-179.2	-86.6	-64.3	0	0	0	113.7
624	N	33.8	Very low	34.8	Very low	139 Å²	139	119.5 Å²	119.5	74%	0.743	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-14.1	179	-86.2	-10.4	0	0	0	114.7
625	D	34.5	Very low	34.3	Very low	130 Å²	130	119.4 Å²	119.4	70%	0.695	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	1.6	175	-91.6	-15.8	0	0	0	112.7	D627	D625-D627 VanDerWaalsContact C-N 3.33Å
626	A	34.6	Very low	33.8	Very low	46 Å²	46	113.3 Å²	113.3	38%	0.38	64%	0.636	S	S	.	*	G	3₁₀ helix	trans	-80.7	-7.3	-179.5	0	0	0	0	0	114.3	L628 T629	A626-L628 PolarHBondContact O-N 3.42Å; A626-L628 VanDerWaalsContact O-N 3.13Å; A626-T629 PolarHBondContact O-N 2.85Å; A626-T629 PolarHBondContact O-OG1 2.87Å
627	D	30.1	Very low	33.2	Very low	162 Å²	162	119.3 Å²	119.3	87%	0.866	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-75	5.9	177	-92.4	-7.2	0	0	0	114.1	D625	D625-D627 VanDerWaalsContact C-N 3.33Å
628	L	32.2	Very low	32.4	Very low	157 Å²	157	121 Å²	121	82%	0.822	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-109.6	35.6	171.2	-145.4	86.4	0	0	0	113	A626	A626-L628 PolarHBondContact O-N 3.42Å; A626-L628 VanDerWaalsContact O-N 3.13Å
629	T	30.5	Very low	31.7	Very low	115 Å²	115	122.9 Å²	122.9	71%	0.706	70%	0.699	S	S	*	*			trans	-110.4	13.3	176.4	-15.8	0	0	0	0	114.2	A626	A626-T629 PolarHBondContact O-N 2.85Å; A626-T629 PolarHBondContact O-OG1 2.87Å
630	F	30.5	Very low	31	Very low	202 Å²	202	128.1 Å²	128.1	89%	0.886	73%	0.725	S	S	*	*	S	Bend	trans	-110.7	40	-177.5	-115.8	-77.4	0	0	0	114.6
631	T	28.7	Very low	30.5	Very low	127 Å²	127	127.9 Å²	127.9	78%	0.779	74%	0.741	S	S	*	*	S	Bend	trans	-143.5	32.9	170.5	55.2	0	0	0	0	114.6
632	F	26.5	Very low	29.5	Very low	195 Å²	195	129.2 Å²	129.2	86%	0.855	76%	0.763	S	S	*	*			trans	-135.3	66	163.3	-132.7	-94.1	0	0	0	109.5
633	G	26.8	Very low	28.7	Very low	67 Å²	67	130 Å²	130	69%	0.691	78%	0.778	S	S	*	*			trans	-74.2	120.3	162.5	0	0	0	0	0	108.9	T635	G633-T635 PolarHBondContact O-N 3.41Å
634	D	26.3	Very low	28.2	Very low	159 Å²	159	129.6 Å²	129.6	85%	0.85	79%	0.786	S	S	*	*			trans	-16.2	95.7	163.2	-64.8	-42.8	0	0	0	115.9	A636	D634-A636 VanDerWaalsContact C-N 3.26Å; D634-A636 PolarHBondContact O-N 2.84Å
635	T	25.5	Very low	27.8	Very low	133 Å²	133	129.1 Å²	129.1	82%	0.816	79%	0.794	S	S	*	*			trans	-84.4	75.3	150.2	23.4	0	0	0	0	108.9	G633	G633-T635 PolarHBondContact O-N 3.41Å
636	A	27.4	Very low	27.2	Very low	85 Å²	85	134.5 Å²	134.5	70%	0.702	80%	0.804	S	S	*	*			trans	-89.6	109.5	159.1	0	0	0	0	0	108.3	D634 T638	D634-A636 VanDerWaalsContact C-N 3.26Å; D634-A636 PolarHBondContact O-N 2.84Å; A636-T638 PolarHBondContact O-N 2.98Å
637	I	27.6	Very low	26.8	Very low	165 Å²	165	136.4 Å²	136.4	85%	0.846	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-56.7	122.8	178.7	-67.4	165.7	0	0	0	109.9	A639	I637-A639 PolarHBondContact O-N 2.94Å
638	T	24.2	Very low	26.5	Very low	134 Å²	134	136.4 Å²	136.4	82%	0.822	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-69.6	117.9	168.6	27.1	0	0	0	0	110	A636	A636-T638 PolarHBondContact O-N 2.98Å
639	A	27.6	Very low	26.3	Very low	98 Å²	98	132.7 Å²	132.7	81%	0.81	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-100.6	120.5	161.2	0	0	0	0	0	108.5	I637	I637-A639 PolarHBondContact O-N 2.94Å
640	N	26.8	Very low	26.1	Very low	172 Å²	172	134.4 Å²	134.4	92%	0.92	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-64.8	142.2	175.7	-78.9	-29.6	0	0	0	111.9
641	G	25.2	Very low	25.8	Very low	77 Å²	77	128.6 Å²	128.6	79%	0.794	82%	0.82	S	S	*	*			trans	-177.2	97.1	168.6	0	0	0	0	0	112.9
642	A	24.2	Very low	25.7	Very low	101 Å²	101	126.7 Å²	126.7	84%	0.835	83%	0.825	S	S	*	*			trans	-31.5	139.4	176	0	0	0	0	0	118.2
643	S	26.1	Very low	25.6	Very low	121 Å²	121	126.2 Å²	126.2	85%	0.846	83%	0.83	S	S	*	*				-178.1	139.3	114.6	44.6	0	0	0	0	112.6
644	T	23.1	Very low	25.5	Very low	137 Å²	137	126.6 Å²	126.6	84%	0.84	83%	0.834	S	S	*	*			trans	-63.4	141	173.1	41.4	0	0	0	0	114.3
645	S	25.2	Very low	25.4	Very low	129 Å²	129	130.5 Å²	130.5	90%	0.902	84%	0.837	S	S	*	*				-173.9	146.5	128.2	53.2	0	0	0	0	113.5
646	R	23.1	Very low	25.3	Very low	243 Å²	243	128.5 Å²	128.5	92%	0.917	83%	0.828	S	S	*	*			trans	-85.7	166.4	-172	-128.6	168.7	164.4	152	-6.9	112.6
647	A	25	Very low	25.2	Very low	86 Å²	86	130 Å²	130	71%	0.711	83%	0.829	S	S	*	*			trans	73.3	141.7	156.9	0	0	0	0	0	115.7
648	D	25.2	Very low	25	Very low	161 Å²	161	130.5 Å²	130.5	86%	0.861	83%	0.833	S	S	*	*			cis	-156.7	160.2	38.7	-116.2	-30.6	0	0	0	113.4
649	A	27.4	Very low	25.1	Very low	79 Å²	79	127.6 Å²	127.6	65%	0.653	83%	0.83	S	S	*	*			trans	-84.4	159.9	174.9	0	0	0	0	0	112.7
650	T	26.2	Very low	25.1	Very low	151 Å²	151	133.3 Å²	133.3	93%	0.926	84%	0.837	S	S	*	*			trans	158.3	130.5	148	36.2	0	0	0	0	106.5
651	G	24.7	Very low	25.1	Very low	81 Å²	81	137 Å²	137	84%	0.835	84%	0.838	S	S	*	*			cis	123	119.2	26	0	0	0	0	0	107
652	G	25.2	Very low	25.1	Very low	86 Å²	86	138.5 Å²	138.5	89%	0.887	84%	0.836	S	S	*	*			trans	159.6	100.6	170.9	0	0	0	0	0	117.3
653	L	24.7	Very low	25.5	Very low	185 Å²	185	137.3 Å²	137.3	97%	0.969	83%	0.834	S	S	*	*			trans	-64.1	153.2	174.3	-147.2	76.2	0	0	0	114
654	G	24.8	Very low	25.9	Very low	75 Å²	75	135.9 Å²	135.9	77%	0.773	82%	0.824	S	S	*	*			trans	-179.9	80.5	167.9	0	0	0	0	0	118.4
655	W	23.7	Very low	26.4	Very low	242 Å²	242	135.4 Å²	135.4	92%	0.917	82%	0.821	S	S	*	*			trans	44.2	107.2	139.6	-149.7	-68.9	0	0	0	123.5
656	S	23.1	Very low	27.1	Very low	90 Å²	90	133.9 Å²	133.9	63%	0.629	81%	0.81	S	S	*	*				27.4	133.4	127.5	-147.3	0	0	0	0	124.6
657	T	25.2	Very low	28	Very low	118 Å²	118	129.9 Å²	129.9	72%	0.724	80%	0.802	S	S	*	*				130.2	128.1	124.4	58.4	0	0	0	0	117.8
658	N	25.2	Very low	28.7	Very low	174 Å²	174	131.1 Å²	131.1	93%	0.93	79%	0.793	S	S	*	*			trans	85.3	122.7	150.8	-100.7	0.3	0	0	0	121.8
659	G	25.3	Very low	29.5	Very low	73 Å²	73	125.8 Å²	125.8	75%	0.753	77%	0.771	S	S	*	*			trans	154.6	87.2	154.3	0	0	0	0	0	115.8
660	K	27.1	Very low	30	Very low	218 Å²	218	127 Å²	127	95%	0.948	77%	0.766	S	S	*	*			trans	-39.8	138.1	165.6	-82.6	169.2	165.5	174.5	0	113
661	R	26.6	Very low	30.8	Very low	249 Å²	249	126.4 Å²	126.4	94%	0.94	75%	0.753	S	S	*	*			trans	-135.2	122.3	153.9	-127.6	175.9	-170.9	177.1	1.5	111.6
662	S	26.8	Very low	31.5	Very low	109 Å²	109	130 Å²	130	76%	0.762	74%	0.741	S	S	*	*			trans	-57.3	134.9	176.2	-168	0	0	0	0	111.6
663	G	32.6	Very low	32.3	Very low	76 Å²	76	132.1 Å²	132.1	78%	0.784	73%	0.728	S	S	*	*			trans	-103.5	115	161.8	0	0	0	0	0	108.9
664	S	32.9	Very low	33.2	Very low	92 Å²	92	128.2 Å²	128.2	64%	0.643	71%	0.708	S	S	*	*			trans	175	88.9	154.9	60.7	0	0	0	0	109.2
665	T	34.6	Very low	33.6	Very low	126 Å²	126	129.8 Å²	129.8	77%	0.773	70%	0.698	S	S	*	*			trans	-140.8	8.2	171.3	52.4	0	0	0	0	114.5
666	S	39.8	Very low	34.3	Very low	97 Å²	97	121.3 Å²	121.3	68%	0.678	68%	0.676	S	S	*	*	S	Bend	trans	-98.8	-28.7	178.1	87.6	0	0	0	0	114.2	L670	S666-L670 PolarHBondContact O-N 3.45Å
667	E	41.4	Very low	35.1	Very low	159 Å²	159	125.6 Å²	125.6	74%	0.743	68%	0.679	S	S	*	*	H	α-helix	trans	-78	-42.2	179.7	-80.8	-180	137.7	0	0	112.7	A669 L670 E671	E667-A669 PolarHBondContact O-N 3.42Å; E667-L670 PolarHBondContact O-N 2.78Å; E667-L670 VanDerWaalsContact O-N 3.13Å; E667-E671 PolarHBondContact O-N 2.95Å
668	E	39.5	Very low	35.7	Very low	113 Å²	113	126 Å²	126	53%	0.528	67%	0.672	S	S	.	*	H	α-helix	trans	-66.5	-22.6	175.5	-73.4	-171.5	179.8	0	0	113.6	R672	E668-R672 WeakPolarHBondContact O-CG 3.3Å; E668-R672 PolarHBondContact O-N 3.39Å; E668-R672 PolarHBondContact O-NH1 2.92Å; E668-R672 VanDerWaalsContact O-NH1 3.16Å; E668-R672 IonicContact OE2-NH2 2.95Å; E668-R672 PolarHBondContact OE2-NH2 3.1Å
669	A	41.9	Very low	36.1	Very low	49 Å²	49	124.7 Å²	124.7	41%	0.405	66%	0.66	S	S	.	*	H	α-helix	trans	-77.3	-36.2	174.6	0	0	0	0	0	111.3	E667 E673	E667-A669 PolarHBondContact O-N 3.42Å; A669-E673 PolarHBondContact O-N 3.4Å
670	L	39.3	Very low	36.6	Very low	105 Å²	105	127.7 Å²	127.7	55%	0.55	66%	0.655	S	S	.	*	H	α-helix	trans	-72.8	-38	178.4	-154.4	86.5	0	0	0	111.8	S666 E667 E673 L674	S666-L670 PolarHBondContact O-N 3.45Å; E667-L670 PolarHBondContact O-N 2.78Å; E667-L670 VanDerWaalsContact O-N 3.13Å; L670-E673 PolarHBondContact O-N 3.23Å; L670-L674 PolarHBondContact O-N 3.22Å
671	E	41.7	Very low	37	Very low	137 Å²	137	123.7 Å²	123.7	64%	0.64	64%	0.643	S	S	*	*	H	α-helix	trans	-67.5	-36.6	175.6	-74.7	-174.9	158.7	0	0	112.1	E667 E673 L674 D675	E667-E671 PolarHBondContact O-N 2.95Å; E671-E673 VanDerWaalsContact C-N 3.33Å; E671-E673 PolarHBondContact O-N 3.48Å; E671-L674 PolarHBondContact O-N 3.05Å; E671-D675 PolarHBondContact O-N 2.79Å
672	R	41.1	Very low	37.4	Very low	157 Å²	157	119.2 Å²	119.2	59%	0.592	64%	0.637	S	S	*	*	H	α-helix	trans	-68.9	-28.3	173.4	-72.9	-174.7	-149.9	101.9	4.4	113.4	E668 S676	E668-R672 WeakPolarHBondContact O-CG 3.3Å; E668-R672 PolarHBondContact O-N 3.39Å; E668-R672 PolarHBondContact O-NH1 2.92Å; E668-R672 VanDerWaalsContact O-NH1 3.16Å; E668-R672 IonicContact OE2-NH2 2.95Å; E668-R672 PolarHBondContact OE2-NH2 3.1Å; R672-S676 PolarHBondContact O-N 2.72Å
673	E	41.6	Very low	37.8	Very low	131 Å²	131	118.4 Å²	118.4	61%	0.612	63%	0.631	S	S	*	*	H	α-helix	trans	-76.2	-31.8	173.6	-97.9	-167.4	154.8	0	0	112.9	A669 L670 E671 S676 R677	A669-E673 PolarHBondContact O-N 3.4Å; L670-E673 PolarHBondContact O-N 3.23Å; E671-E673 VanDerWaalsContact C-N 3.33Å; E671-E673 PolarHBondContact O-N 3.48Å; E673-S676 PolarHBondContact O-OG 2.78Å; E673-R677 WeakPolarHBondContact O-CG 3.38Å; E673-R677 PolarHBondContact O-N 3Å
674	L	42.2	Very low	37.9	Very low	103 Å²	103	125 Å²	125	54%	0.539	63%	0.633	S	S	.	*	H	α-helix	trans	-73.3	-42.8	175.2	-90.8	149.5	0	0	0	111.8	L670 E671 S676 R677 E678	L670-L674 PolarHBondContact O-N 3.22Å; E671-L674 PolarHBondContact O-N 3.05Å; L674-S676 PolarHBondContact O-N 3.39Å; L674-R677 PolarHBondContact O-N 3.34Å; L674-E678 PolarHBondContact O-N 3.02Å; L674-E678 VanDerWaalsContact O-N 3.11Å
675	D	34.4	Very low	37.7	Very low	108 Å²	108	123.7 Å²	123.7	58%	0.578	63%	0.634	S	S	*	*	H	α-helix	trans	-65	-37.3	176.5	-98.3	0.4	0	0	0	112.2	E671 R677 E678 Q679	E671-D675 PolarHBondContact O-N 2.79Å; D675-R677 VanDerWaalsContact C-N 3.35Å; D675-R677 PolarHBondContact O-N 3.48Å; D675-E678 PolarHBondContact O-N 3.1Å; D675-Q679 PolarHBondContact O-N 2.8Å
676	S	38.8	Very low	37.4	Very low	64 Å²	64	124.7 Å²	124.7	45%	0.448	64%	0.64	S	S	.	*	H	α-helix	trans	-68.2	-34.2	178	81.1	0	0	0	0	112.5	R672 E673 L674 Q679 E680	R672-S676 PolarHBondContact O-N 2.72Å; E673-S676 PolarHBondContact O-OG 2.78Å; L674-S676 PolarHBondContact O-N 3.39Å; S676-Q679 PolarHBondContact O-N 3.06Å; S676-E680 WeakPolarHBondContact O-CB 3.37Å; S676-E680 PolarHBondContact O-N 2.79Å
677	R	39.4	Very low	36.7	Very low	180 Å²	180	130.8 Å²	130.8	68%	0.679	65%	0.648	S	S	*	*	H	α-helix	trans	-72.3	-33.6	175.9	-77.8	174.6	71.7	157.6	1	112.9	E673 L674 D675 L681	E673-R677 WeakPolarHBondContact O-CG 3.38Å; E673-R677 PolarHBondContact O-N 3Å; L674-R677 PolarHBondContact O-N 3.34Å; D675-R677 VanDerWaalsContact C-N 3.35Å; D675-R677 PolarHBondContact O-N 3.48Å; R677-L681 WeakPolarHBondContact O-CG 3.32Å; R677-L681 PolarHBondContact O-N 2.87Å; R677-L681 VanDerWaalsContact O-N 3.17Å
678	E	37.5	Very low	36	Very low	126 Å²	126	130.4 Å²	130.4	59%	0.589	65%	0.65	S	S	*	*	H	α-helix	trans	-70.4	-36.2	172.3	-78.3	-164.6	156.5	0	0	112.1	L674 D675 L681 L682	L674-E678 PolarHBondContact O-N 3.02Å; L674-E678 VanDerWaalsContact O-N 3.11Å; D675-E678 PolarHBondContact O-N 3.1Å; E678-L681 PolarHBondContact O-N 3.07Å; E678-L682 PolarHBondContact O-N 2.82Å; E678-L682 VanDerWaalsContact O-N 3.13Å
679	Q	34.5	Very low	35.5	Very low	147 Å²	147	130.3 Å²	130.3	69%	0.687	66%	0.657	S	S	*	*	H	α-helix	trans	-70.6	-33.4	176.2	-130.4	161.5	-3.5	0	0	112.6	D675 S676 L682 S683	D675-Q679 PolarHBondContact O-N 2.8Å; S676-Q679 PolarHBondContact O-N 3.06Å; Q679-L682 PolarHBondContact O-N 2.74Å; Q679-S683 PolarHBondContact O-N 2.8Å
680	E	35.6	Very low	34.9	Very low	135 Å²	135	136.1 Å²	136.1	63%	0.631	67%	0.674	S	S	*	*	H	α-helix	trans	-70.8	-34.2	174.9	-153.3	176.7	-167.7	0	0	112	S676 S683	S676-E680 WeakPolarHBondContact O-CB 3.37Å; S676-E680 PolarHBondContact O-N 2.79Å; E680-S683 PolarHBondContact O-N 2.96Å; E680-S683 PolarHBondContact O-OG 3.04Å; E680-S683 VanDerWaalsContact O-OG 3.07Å
681	L	35.6	Very low	34.4	Very low	135 Å²	135	135.7 Å²	135.7	71%	0.707	68%	0.677	S	S	*	*	H	α-helix	trans	-70.3	-29.6	173.6	-82.3	166.8	0	0	0	113.7	R677 E678	R677-L681 WeakPolarHBondContact O-CG 3.32Å; R677-L681 PolarHBondContact O-N 2.87Å; R677-L681 VanDerWaalsContact O-N 3.17Å; E678-L681 PolarHBondContact O-N 3.07Å
682	L	34.6	Very low	34.1	Very low	155 Å²	155	137.9 Å²	137.9	81%	0.812	69%	0.69	S	S	*	*	H	α-helix	trans	-81.4	-17.4	176.6	-75.4	167.3	0	0	0	113.8	E678 Q679	E678-L682 PolarHBondContact O-N 2.82Å; E678-L682 VanDerWaalsContact O-N 3.13Å; Q679-L682 PolarHBondContact O-N 2.74Å
683	S	34.1	Very low	33.6	Very low	92 Å²	92	138.8 Å²	138.8	64%	0.643	70%	0.701	S	S	*	*	H	α-helix	trans	-85.7	-17.1	177.3	79.5	0	0	0	0	114.1	Q679 E680 G685	Q679-S683 PolarHBondContact O-N 2.8Å; E680-S683 PolarHBondContact O-N 2.96Å; E680-S683 PolarHBondContact O-OG 3.04Å; E680-S683 VanDerWaalsContact O-OG 3.07Å; S683-G685 PolarHBondContact O-N 3.1Å
684	R	34.5	Very low	33.4	Very low	214 Å²	214	138.9 Å²	138.9	81%	0.808	71%	0.705	S	S	*	*	S	Bend	trans	-92.1	88	174.4	-91.3	178.6	156.9	173.3	-4.6	110.7
685	G	30.4	Very low	32.8	Very low	65 Å²	65	141.8 Å²	141.8	67%	0.67	72%	0.716	S	S	*	*			trans	52.1	101.1	149.1	0	0	0	0	0	117.1	S683 R687	S683-G685 PolarHBondContact O-N 3.1Å; G685-R687 PolarHBondContact O-N 3.29Å
686	T	27.1	Very low	32.9	Very low	146 Å²	146	147.8 Å²	147.8	90%	0.896	75%	0.745	S	S	*	*			trans	-38	109.3	162.9	4.5	0	0	0	0	112.1	L688	T686-L688 PolarHBondContact O-N 3.14Å; T686-L688 VanDerWaalsContact O-N 3.12Å
687	R	26.3	Very low	32.6	Very low	226 Å²	226	152 Å²	152	85%	0.853	76%	0.76	S	S	*	*			trans	-65.5	104.5	168.6	-158.8	-178.4	-170.5	-171.4	3.3	107.4	G685 V689	G685-R687 PolarHBondContact O-N 3.29Å; R687-V689 VanDerWaalsContact C-N 3.25Å; R687-V689 HydrophobicContact CG-CG2 4.31Å; R687-V689 PolarHBondContact O-N 3.16Å
688	L	26.8	Very low	32.2	Very low	150 Å²	150	150.5 Å²	150.5	79%	0.785	77%	0.765	S	S	*	*			trans	-66.4	88.8	168	-86.6	160.7	0	0	0	108.5	T686	T686-L688 PolarHBondContact O-N 3.14Å; T686-L688 VanDerWaalsContact O-N 3.12Å
689	V	28.3	Very low	31.9	Very low	112 Å²	112	151.9 Å²	151.9	68%	0.679	77%	0.774	S	S	*	*			trans	-79.3	109.4	162.9	177.7	0	0	0	0	106.1	R687	R687-V689 VanDerWaalsContact C-N 3.25Å; R687-V689 HydrophobicContact CG-CG2 4.31Å; R687-V689 PolarHBondContact O-N 3.16Å
690	F	28.8	Very low	31.7	Very low	171 Å²	171	152.2 Å²	152.2	75%	0.75	78%	0.779	S	S	*	*			trans	-72.2	134.2	168	-77.5	-84.4	0	0	0	108.9	M692	F690-M692 PolarHBondContact O-N 3.35Å
691	P	29.8	Very low	31.5	Very low	96 Å²	96	153.3 Å²	153.3	62%	0.623	79%	0.789	S	S	*	*			trans	-67.1	131.9	171	28.4	-30.3	0	0	0	108.9	E693	P691-E693 PolarHBondContact O-N 2.91Å
692	M	35.1	Very low	31.2	Very low	183 Å²	183	154.5 Å²	154.5	90%	0.901	79%	0.794	S	S	*	*			trans	-70.6	110.7	158	-75.9	-155.1	-74.1	0	0	106.8	F690 D694	F690-M692 PolarHBondContact O-N 3.35Å; M692-D694 PolarHBondContact O-N 3.43Å
693	E	31.3	Very low	31	Very low	176 Å²	176	154.4 Å²	154.4	82%	0.822	79%	0.793	S	S	*	*			trans	-87.1	102.3	163	-83.3	153.9	159.6	0	0	107.8	P691	P691-E693 PolarHBondContact O-N 2.91Å
694	D	35.4	Very low	30.8	Very low	133 Å²	133	159.2 Å²	159.2	71%	0.711	80%	0.804	S	S	*	*			trans	-57.2	131.4	152.1	-74.3	-43.2	0	0	0	108.8	M692	M692-D694 PolarHBondContact O-N 3.43Å
695	H	29.8	Very low	30.4	Very low	164 Å²	164	154.7 Å²	154.7	76%	0.759	80%	0.804	S	S	*	*				163.6	123.1	121.4	-83.8	-55.9	0	0	0	112.5
696	I	36.4	Very low	30.5	Very low	234 Å²	234	162.8 Å²	162.8	100%	1.2	82%	0.816	S	S	*	*			trans	67.7	0	139.2	-55.4	169.3	0	0	0	118

Retrieved 696 of 696 residues in 824.5 ms (Link to these results)

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