A0A087XD62_POEFO Loading...

Solute carrier organic anion transporter family member

AlphaFold DB , UniProt , Accession A0A087XD62, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 618 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	37.4	Very low	34.1	Very low	239 Å²	239	165 Å²	165	100%	1.177	82%	0.815	S	S	*	*				0	88.5	0	-92.6	177.3	172.3	0	0	107.3
2	E	31.5	Very low	34.8	Very low	187 Å²	187	160.3 Å²	160.3	87%	0.874	81%	0.806	S	S	*	*			trans	-77.9	118.2	168.7	-79.3	176.1	147.9	0	0	107.9	N4	E2-N4 PolarHBondContact O-N 3.21Å
3	I	34.5	Very low	35.2	Very low	144 Å²	144	160 Å²	160	74%	0.738	81%	0.808	S	S	*	*			trans	-81.9	96.6	176.1	-62.1	171	0	0	0	106.6	Y5	I3-Y5 PolarHBondContact O-N 3.21Å
4	N	28.7	Very low	36.5	Very low	146 Å²	146	162.7 Å²	162.7	78%	0.781	80%	0.804	S	S	*	*			trans	-66.3	109.3	170.2	-89.5	-27.8	0	0	0	109.7	E2	E2-N4 PolarHBondContact O-N 3.21Å
5	Y	31.6	Very low	38.4	Very low	201 Å²	201	157.1 Å²	157.1	79%	0.788	78%	0.782	S	S	*	*			trans	-71.8	123.7	162.3	-84	-89.5	0	0	0	108.9	I3 T7	I3-Y5 PolarHBondContact O-N 3.21Å; Y5-T7 PolarHBondContact O-N 2.83Å; Y5-T7 VanDerWaalsContact O-N 3.1Å
6	P	34.2	Very low	40.5	Very low	114 Å²	114	151.6 Å²	151.6	74%	0.74	77%	0.769	S	S	*	*			trans	-71.3	109.7	173.6	27.6	-29.7	0	0	0	109	N8	P6-N8 PolarHBondContact O-N 3.1Å
7	T	36.8	Very low	42.7	Very low	128 Å²	128	147.6 Å²	147.6	79%	0.785	74%	0.743	S	S	*	*			trans	-68.1	76.5	165.4	37.3	0	0	0	0	109.4	Y5 T9	Y5-T7 PolarHBondContact O-N 2.83Å; Y5-T7 VanDerWaalsContact O-N 3.1Å; T7-T9 PolarHBondContact O-N 3.41Å
8	N	31.9	Very low	44.7	Very low	130 Å²	130	142.3 Å²	142.3	70%	0.695	72%	0.721	S	S	*	*			trans	-75.6	73.5	171.5	-158	-2.1	0	0	0	109.3	P6 R10	P6-N8 PolarHBondContact O-N 3.1Å; N8-R10 PolarHBondContact O-N 3.27Å
9	T	37	Very low	46.8	Very low	122 Å²	122	138.8 Å²	138.8	75%	0.748	70%	0.704	S	S	*	*			trans	-74	75.7	166.9	48.7	0	0	0	0	108.7	T7 K11	T7-T9 PolarHBondContact O-N 3.41Å; T9-K11 VanDerWaalsContact C-N 3.27Å; T9-K11 PolarHBondContact O-N 3.5Å
10	R	34.8	Very low	48.8	Very low	213 Å²	213	132.3 Å²	132.3	80%	0.804	67%	0.671	S	S	*	*			trans	-59.5	98.2	158.1	-88.8	-176.3	173.4	176.3	-1	106.9	N8 P12	N8-R10 PolarHBondContact O-N 3.27Å; R10-P12 VanDerWaalsContact O-CD 3.29Å; R10-P12 WeakPolarHBondContact O-CD 3.45Å
11	K	36.9	Very low	50.8	Low	191 Å²	191	132.2 Å²	132.2	83%	0.83	67%	0.666	S	S	*	*			trans	-50.4	115.1	163.1	-75.7	179.5	179	175	0	106.2	T9 N13	T9-K11 VanDerWaalsContact C-N 3.27Å; T9-K11 PolarHBondContact O-N 3.5Å; K11-N13 PolarHBondContact O-N 3.27Å
12	P	42.1	Very low	53.4	Low	109 Å²	109	123.3 Å²	123.3	71%	0.708	62%	0.623	S	S	*	*			trans	-60.5	128.3	177.4	23.3	-30.2	0	0	0	106.8	R10 R14	R10-P12 VanDerWaalsContact O-CD 3.29Å; R10-P12 WeakPolarHBondContact O-CD 3.45Å; P12-R14 PolarHBondContact O-N 3.28Å
13	N	40.5	Very low	56.4	Low	156 Å²	156	114.4 Å²	114.4	83%	0.834	58%	0.582	S	S	*	*			trans	-46.1	108	170.2	-84.7	-17.5	0	0	0	106.9	K11 T15	K11-N13 PolarHBondContact O-N 3.27Å; N13-T15 PolarHBondContact O-N 2.86Å
14	R	53	Low	59.1	Low	198 Å²	198	108.1 Å²	108.1	75%	0.747	55%	0.55	S	S	*	*			trans	-67	87.5	179	-85.2	-174.9	173.5	-178.5	-1.6	106.9	P12 A16	P12-R14 PolarHBondContact O-N 3.28Å; R14-A16 PolarHBondContact O-N 3.37Å
15	T	64.6	Low	62.2	Low	78 Å²	78	106.9 Å²	106.9	48%	0.479	54%	0.543	S	S	.	.			trans	-53.1	138	166.6	42.6	0	0	0	0	107.8	N13 W17 C18	N13-T15 PolarHBondContact O-N 2.86Å; T15-W17 PolarHBondContact O-N 3.43Å; T15-C18 WeakPolarHBondContact O-CB 3.36Å; T15-C18 PolarHBondContact O-N 2.91Å; T15-C18 PolarHBondContact OG1-SG 3.44Å
16	A	72.1	Confident	65.2	Low	70 Å²	70	97.9 Å²	97.9	58%	0.579	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-51.8	-26.3	-179.9	0	0	0	0	0	113.1	R14 C18 N19 L22	R14-A16 PolarHBondContact O-N 3.37Å; A16-C18 PolarHBondContact O-N 2.88Å; A16-N19 WeakPolarHBondContact O-CB 3.39Å; A16-N19 PolarHBondContact O-N 2.88Å; A16-L22 WeakPolarHBondContact O-CD2 3.49Å
17	W	78.9	Confident	68.2	Low	84 Å²	84	92.5 Å²	92.5	32%	0.318	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-66.5	-9	174.2	-55.8	109	0	0	0	115.5	T15 N19 L22 P259 F262 F263 P264 M267	T15-W17 PolarHBondContact O-N 3.43Å; W17-N19 VanDerWaalsContact C-N 3.33Å; W17-L22 HydrophobicContact CE3-CD2 4.13Å; W17-L22 HydrophobicContact CZ3-CD2 4.38Å; W17-P259 HydrophobicContact CH2-CB 4.04Å; W17-P259 HydrophobicContact CZ3-CB 3.78Å; W17-P259 WeakPolarHBondContact CZ3-O 3.44Å; W17-F262 HydrophobicContact CD2-CB 3.45Å; W17-F262 VanDerWaalsContact CD2-CB 3.45Å; W17-F262 HydrophobicContact CD2-CG 4.35Å; W17-F262 HydrophobicContact CE3-CB 3.65Å; W17-F262 HydrophobicContact CG-CB 3.91Å; W17-F262 HydrophobicContact CH2-CB 4.13Å; W17-F262 AromaticContact CH2-CD2 3.91Å; W17-F262 HydrophobicContact CH2-CD2 3.91Å; W17-F262 HydrophobicContact CH2-CG 4.28Å; W17-F262 HydrophobicContact CZ2-CB 3.96Å; W17-F262 AromaticContact CZ2-CD2 3.93Å; W17-F262 HydrophobicContact CZ2-CD2 3.93Å; W17-F262 AromaticContact CZ2-CG 3.98Å; W17-F262 HydrophobicContact CZ2-CG 3.98Å; W17-F262 HydrophobicContact CZ3-CB 3.98Å; W17-F262 HydrophobicContact CZ3-CD2 4.39Å; W17-F263 HydrophobicContact CE3-CD2 4.17Å; W17-F263 HydrophobicContact CE3-CE1 4.26Å; W17-F263 AromaticContact CE3-CE2 3.91Å; W17-F263 HydrophobicContact CE3-CE2 3.91Å; W17-F263 HydrophobicContact CE3-CG 4.49Å; W17-F263 AromaticContact CE3-CZ 3.95Å; W17-F263 HydrophobicContact CE3-CZ 3.95Å; W17-F263 HydrophobicContact CZ3-CD2 4.38Å; W17-F263 AromaticContact CZ3-CE2 3.9Å; W17-F263 HydrophobicContact CZ3-CE2 3.9Å; W17-F263 HydrophobicContact CZ3-CZ 4.2Å; W17-F263 WeakPolarHBondContact O-CD1 3.47Å; W17-P264 WeakPolarHBondContact O-CD 3.36Å; W17-M267 WeakPolarHBondContact O-CE 3.4Å
18	C	77.7	Confident	70.9	Confident	52 Å²	52	86.5 Å²	86.5	35%	0.351	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-94.9	23.5	172.6	-67.6	0	0	0	0	112.9	T15 A16 M267	T15-C18 WeakPolarHBondContact O-CB 3.36Å; T15-C18 PolarHBondContact O-N 2.91Å; T15-C18 PolarHBondContact OG1-SG 3.44Å; A16-C18 PolarHBondContact O-N 2.88Å; C18-M267 VanDerWaalsContact CA-CE 3.46Å
19	N	85.8	Confident	73.9	Confident	76 Å²	76	84 Å²	84	41%	0.406	42%	0.421	S	S	.	.			trans	-113.6	119.9	179.4	-171.7	-14.6	0	0	0	111.9	A16 W17 K21 L22 F23	A16-N19 WeakPolarHBondContact O-CB 3.39Å; A16-N19 PolarHBondContact O-N 2.88Å; W17-N19 VanDerWaalsContact C-N 3.33Å; N19-K21 VanDerWaalsContact C-N 3.27Å; N19-K21 PolarHBondContact O-N 3.32Å; N19-K21 WeakPolarHBondContact OD1-CB 3.27Å; N19-K21 PolarHBondContact OD1-N 3.39Å; N19-L22 HydrophobicContact CB-CB 4.24Å; N19-L22 WeakPolarHBondContact O-CB 3.3Å; N19-L22 PolarHBondContact O-N 2.81Å; N19-F23 PolarHBondContact O-N 3.27Å
20	I	86.9	Confident	76.8	Confident	8 Å²	8	78.1 Å²	78.1	4%	0.041	39%	0.385	C	S	.	.	H	α-helix	trans	-62.2	-33.1	179.1	-167.6	59.2	0	0	0	112.6	L22 F23 V24 Y178 F182 A183 Y191 M267 E270	I20-L22 VanDerWaalsContact C-N 3.3Å; I20-L22 PolarHBondContact O-N 2.82Å; I20-F23 HydrophobicContact CD1-CB 4.38Å; I20-F23 HydrophobicContact CD1-CD1 4.49Å; I20-F23 WeakPolarHBondContact O-CB 3.41Å; I20-F23 PolarHBondContact O-N 2.94Å; I20-F23 VanDerWaalsContact O-N 3.16Å; I20-V24 WeakPolarHBondContact O-CG2 3.44Å; I20-V24 PolarHBondContact O-N 2.97Å; I20-Y178 HydrophobicContact CD1-CD1 4.43Å; I20-Y178 HydrophobicContact CD1-CE1 4.37Å; I20-F182 HydrophobicContact CD1-CB 3.99Å; I20-A183 HydrophobicContact CG1-CB 4.38Å; I20-Y191 HydrophobicContact CG1-CE2 4.5Å; I20-Y191 HydrophobicContact CG2-CE2 4.04Å; I20-M267 HydrophobicContact CB-SD 4.24Å; I20-M267 PolarHBondContact N-SD 3.37Å; I20-E270 HydrophobicContact CG2-CG 4.37Å; I20-E270 WeakPolarHBondContact CG2-OE1 3.24Å
21	K	90.6	Very high	79.7	Confident	130 Å²	130	68.3 Å²	68.3	57%	0.565	35%	0.348	S	S	*	.	H	α-helix	trans	-65.2	-36.4	178	-60.2	178.6	-178.3	178.4	0	111.6	N19 V24 L25 Y191	N19-K21 VanDerWaalsContact C-N 3.27Å; N19-K21 PolarHBondContact O-N 3.32Å; N19-K21 WeakPolarHBondContact OD1-CB 3.27Å; N19-K21 PolarHBondContact OD1-N 3.39Å; K21-V24 PolarHBondContact O-N 2.99Å; K21-L25 PolarHBondContact O-N 3.23Å; K21-Y191 WeakPolarHBondContact CE-OH 3.42Å
22	L	92.1	Very high	82.5	Confident	53 Å²	53	60.5 Å²	60.5	28%	0.277	32%	0.315	S	S	.	.	H	α-helix	trans	-67.4	-41.1	174.4	-176.8	64.8	0	0	0	110.7	A16 W17 N19 I20 V24 L25 C26 F263	A16-L22 WeakPolarHBondContact O-CD2 3.49Å; W17-L22 HydrophobicContact CE3-CD2 4.13Å; W17-L22 HydrophobicContact CZ3-CD2 4.38Å; N19-L22 HydrophobicContact CB-CB 4.24Å; N19-L22 WeakPolarHBondContact O-CB 3.3Å; N19-L22 PolarHBondContact O-N 2.81Å; I20-L22 VanDerWaalsContact C-N 3.3Å; I20-L22 PolarHBondContact O-N 2.82Å; L22-V24 PolarHBondContact O-N 3.38Å; L22-L25 PolarHBondContact O-N 3.36Å; L22-C26 PolarHBondContact O-N 3.18Å; L22-C26 PolarHBondContact O-SG 2.96Å; L22-C26 VanDerWaalsContact O-SG 3.37Å; L22-F263 HydrophobicContact CB-CZ 4.44Å; L22-F263 HydrophobicContact CD2-CZ 4.24Å; L22-F263 HydrophobicContact CG-CZ 4.03Å
23	F	92.8	Very high	85.1	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-46.6	174.4	-176.7	-89.1	0	0	0	111.6	N19 I20 L25 C26 H27 P87 I90 Y178 I179 Y260 F263	N19-F23 PolarHBondContact O-N 3.27Å; I20-F23 HydrophobicContact CD1-CB 4.38Å; I20-F23 HydrophobicContact CD1-CD1 4.49Å; I20-F23 WeakPolarHBondContact O-CB 3.41Å; I20-F23 PolarHBondContact O-N 2.94Å; I20-F23 VanDerWaalsContact O-N 3.16Å; F23-L25 VanDerWaalsContact C-N 3.3Å; F23-L25 PolarHBondContact O-N 3.47Å; F23-C26 PolarHBondContact O-N 3.49Å; F23-H27 HydrophobicContact CE1-CB 4.31Å; F23-H27 WeakPolarHBondContact O-CB 3.29Å; F23-H27 PolarHBondContact O-N 3.03Å; F23-P87 HydrophobicContact CE2-CB 4.48Å; F23-P87 HydrophobicContact CE2-CG 4.27Å; F23-I90 HydrophobicContact CZ-CD1 4.21Å; F23-Y178 AromaticContact CD1-CD1 3.75Å; F23-Y178 HydrophobicContact CD1-CD1 3.75Å; F23-Y178 HydrophobicContact CD1-CE1 4.23Å; F23-Y178 AromaticContact CD2-CD1 3.87Å; F23-Y178 HydrophobicContact CD2-CD1 3.87Å; F23-Y178 AromaticContact CD2-CE1 3.73Å; F23-Y178 HydrophobicContact CD2-CE1 3.73Å; F23-Y178 AromaticContact CE1-CD1 3.52Å; F23-Y178 HydrophobicContact CE1-CD1 3.52Å; F23-Y178 HydrophobicContact CE1-CE1 4.34Å; F23-Y178 HydrophobicContact CE1-CG 4.15Å; F23-Y178 AromaticContact CE2-CD1 3.62Å; F23-Y178 HydrophobicContact CE2-CD1 3.62Å; F23-Y178 AromaticContact CE2-CE1 3.83Å; F23-Y178 HydrophobicContact CE2-CE1 3.83Å; F23-Y178 HydrophobicContact CE2-CG 4.16Å; F23-Y178 AromaticContact CG-CD1 3.92Å; F23-Y178 HydrophobicContact CG-CD1 3.92Å; F23-Y178 AromaticContact CG-CE1 3.93Å; F23-Y178 HydrophobicContact CG-CE1 3.93Å; F23-Y178 AromaticContact CZ-CD1 3.44Å; F23-Y178 HydrophobicContact CZ-CD1 3.44Å; F23-Y178 VanDerWaalsContact CZ-CD1 3.44Å; F23-Y178 HydrophobicContact CZ-CE1 4.15Å; F23-Y178 AromaticContact CZ-CG 3.8Å; F23-Y178 HydrophobicContact CZ-CG 3.8Å; F23-I179 HydrophobicContact CD1-CD1 4.33Å; F23-I179 HydrophobicContact CD1-CG1 3.8Å; F23-I179 HydrophobicContact CE1-CD1 4.25Å; F23-I179 HydrophobicContact CE1-CG1 3.83Å; F23-Y260 HydrophobicContact CD2-CE1 4.32Å; F23-Y260 HydrophobicContact CE2-CD1 4.17Å; F23-Y260 AromaticContact CE2-CE1 3.59Å; F23-Y260 HydrophobicContact CE2-CE1 3.59Å; F23-Y260 AromaticContact CZ-CE1 3.98Å; F23-Y260 HydrophobicContact CZ-CE1 3.98Å; F23-F263 HydrophobicContact CB-CD1 4.35Å; F23-F263 HydrophobicContact CB-CE1 3.75Å; F23-F263 HydrophobicContact CB-CZ 3.94Å; F23-F263 HydrophobicContact CD2-CD1 4.04Å; F23-F263 HydrophobicContact CD2-CD2 4.12Å; F23-F263 HydrophobicContact CD2-CE1 4.14Å; F23-F263 HydrophobicContact CD2-CE2 4.2Å; F23-F263 HydrophobicContact CD2-CG 4.04Å; F23-F263 HydrophobicContact CD2-CZ 4.21Å; F23-F263 HydrophobicContact CG-CE1 4.48Å
24	V	92.6	Very high	87.7	Confident	12 Å²	12	49 Å²	49	7%	0.073	25%	0.247	C	C	.	.	H	α-helix	trans	-59	-41.7	177.1	174.4	0	0	0	0	111.1	I20 K21 L22 H27 G28 I179 Y191	I20-V24 WeakPolarHBondContact O-CG2 3.44Å; I20-V24 PolarHBondContact O-N 2.97Å; K21-V24 PolarHBondContact O-N 2.99Å; L22-V24 PolarHBondContact O-N 3.38Å; V24-H27 PolarHBondContact O-N 3.17Å; V24-G28 PolarHBondContact O-N 3Å; V24-I179 HydrophobicContact CG2-CD1 3.94Å; V24-I179 HydrophobicContact CG2-CG1 3.99Å; V24-I179 HydrophobicContact CG2-CG2 4.41Å; V24-Y191 HydrophobicContact CG2-CD2 4.28Å; V24-Y191 HydrophobicContact CG2-CG 4.05Å
25	L	94	Very high	89.7	Confident	119 Å²	119	42.3 Å²	42.3	62%	0.623	23%	0.226	S	C	*	.	H	α-helix	trans	-64.6	-50.2	176.8	-176.8	147.3	0	0	0	112.1	K21 L22 F23 H27 G28 F29	K21-L25 PolarHBondContact O-N 3.23Å; L22-L25 PolarHBondContact O-N 3.36Å; F23-L25 VanDerWaalsContact C-N 3.3Å; F23-L25 PolarHBondContact O-N 3.47Å; L25-H27 PolarHBondContact O-N 2.86Å; L25-G28 PolarHBondContact O-N 3.5Å; L25-F29 PolarHBondContact O-N 3.3Å
26	C	94.9	Very high	91.2	Very high	13 Å²	13	39 Å²	39	9%	0.088	21%	0.206	C	C	.	.	H	α-helix	trans	-59.3	-39.7	176.6	-68.5	0	0	0	0	111.3	L22 F23 F29 L30 P259 F263	L22-C26 PolarHBondContact O-N 3.18Å; L22-C26 PolarHBondContact O-SG 2.96Å; L22-C26 VanDerWaalsContact O-SG 3.37Å; F23-C26 PolarHBondContact O-N 3.49Å; C26-F29 PolarHBondContact O-N 3.27Å; C26-L30 PolarHBondContact O-N 3.09Å; C26-P259 HydrophobicContact CB-CB 4.39Å; C26-F263 HydrophobicContact CB-CE2 4.38Å
27	H	95.3	Very high	92.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-71.6	-40.8	-179.8	-161.8	71.3	0	0	0	113.6	F23 V24 L25 F29 L30 Q31 I171 G175 L195 Y260	F23-H27 HydrophobicContact CE1-CB 4.31Å; F23-H27 WeakPolarHBondContact O-CB 3.29Å; F23-H27 PolarHBondContact O-N 3.03Å; V24-H27 PolarHBondContact O-N 3.17Å; L25-H27 PolarHBondContact O-N 2.86Å; H27-F29 VanDerWaalsContact C-N 3.28Å; H27-F29 PolarHBondContact O-N 2.95Å; H27-L30 PolarHBondContact O-N 3.29Å; H27-Q31 PolarHBondContact CD2-NE2 3.01Å; H27-Q31 PolarHBondContact NE2-NE2 3.08Å; H27-Q31 WeakPolarHBondContact O-CG 3.3Å; H27-Q31 PolarHBondContact O-N 3.31Å; H27-I171 PolarHBondContact CE1-O 2.95Å; H27-G175 VanDerWaalsContact CE1-CA 3.49Å; H27-G175 WeakPolarHBondContact CE1-CA 3.49Å; H27-L195 WeakPolarHBondContact CD2-CD1 3.11Å; H27-Y260 WeakPolarHBondContact CA-OH 3.32Å; H27-Y260 WeakPolarHBondContact CB-OH 3.32Å; H27-Y260 PolarHBondContact N-OH 2.7Å; H27-Y260 AromaticContact ND1-CZ 3.92Å; H27-Y260 PolarHBondContact ND1-OH 2.98Å
28	G	94.8	Very high	93.1	Very high	3 Å²	3	33.1 Å²	33.1	3%	0.031	17%	0.172	C	C	.	.	H	α-helix	trans	-58.9	-41	170.9	0	0	0	0	0	111.8	V24 L25 L32	V24-G28 PolarHBondContact O-N 3Å; L25-G28 PolarHBondContact O-N 3.5Å; G28-L32 WeakPolarHBondContact O-CB 3.31Å; G28-L32 PolarHBondContact O-N 2.83Å
29	F	95.4	Very high	94	Very high	76 Å²	76	31 Å²	31	33%	0.333	16%	0.158	S	C	.	.	H	α-helix	trans	-68.7	-39.7	177.5	-173.2	-117	0	0	0	113.2	L25 C26 H27 S33 F252 S256	L25-F29 PolarHBondContact O-N 3.3Å; C26-F29 PolarHBondContact O-N 3.27Å; H27-F29 VanDerWaalsContact C-N 3.28Å; H27-F29 PolarHBondContact O-N 2.95Å; F29-S33 WeakPolarHBondContact O-CB 3.5Å; F29-S33 PolarHBondContact O-N 2.91Å; F29-S33 PolarHBondContact O-OG 3.38Å; F29-F252 HydrophobicContact CZ-CD1 4.18Å; F29-S256 VanDerWaalsContact CD1-CB 3.41Å
30	L	96.5	Very high	94.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.3	-46.9	174.7	179.5	63	0	0	0	111.7	C26 H27 L32 S33 Q34 I90 I171 L253 S256 Y260	C26-L30 PolarHBondContact O-N 3.09Å; H27-L30 PolarHBondContact O-N 3.29Å; L30-L32 PolarHBondContact O-N 2.93Å; L30-S33 WeakPolarHBondContact O-CB 3.43Å; L30-S33 PolarHBondContact O-N 3.18Å; L30-Q34 PolarHBondContact O-N 3.05Å; L30-I90 HydrophobicContact CD2-CG2 3.43Å; L30-I90 VanDerWaalsContact CD2-CG2 3.43Å; L30-I171 HydrophobicContact CD2-CD1 4.23Å; L30-I171 HydrophobicContact CD2-CG1 4.44Å; L30-I171 HydrophobicContact CD2-CG2 3.93Å; L30-I171 HydrophobicContact CG-CD1 4.42Å; L30-I171 HydrophobicContact CG-CG2 4.28Å; L30-L253 HydrophobicContact CD1-CD2 4.39Å; L30-S256 VanDerWaalsContact CD1-OG 3.3Å; L30-S256 WeakPolarHBondContact CD1-OG 3.42Å; L30-Y260 HydrophobicContact CB-CE2 4.27Å; L30-Y260 HydrophobicContact CD2-CD2 4.3Å; L30-Y260 HydrophobicContact CD2-CE2 3.55Å; L30-Y260 HydrophobicContact CG-CE2 4.48Å
31	Q	95.6	Very high	94.9	Very high	7 Å²	7	27.2 Å²	27.2	3%	0.033	14%	0.138	C	C	.	.	H	α-helix	trans	-65.7	-37.9	177.5	-74	-163.1	5.6	0	0	112.5	H27 S33 Q34 L35 I171 S199	H27-Q31 PolarHBondContact CD2-NE2 3.01Å; H27-Q31 PolarHBondContact NE2-NE2 3.08Å; H27-Q31 WeakPolarHBondContact O-CG 3.3Å; H27-Q31 PolarHBondContact O-N 3.31Å; Q31-S33 VanDerWaalsContact C-N 3.32Å; Q31-S33 PolarHBondContact O-N 3.28Å; Q31-Q34 WeakPolarHBondContact O-CB 3.49Å; Q31-Q34 PolarHBondContact O-N 3.25Å; Q31-L35 WeakPolarHBondContact O-CG 3.49Å; Q31-L35 PolarHBondContact O-N 3.18Å; Q31-I171 HydrophobicContact CG-CG2 4.25Å; Q31-S199 WeakPolarHBondContact CB-OG 3.01Å; Q31-S199 PolarHBondContact OE1-OG 2.73Å
32	L	95.6	Very high	95.1	Very high	26 Å²	26	21.3 Å²	21.3	14%	0.136	11%	0.112	C	C	.	.	H	α-helix	trans	-57.9	-47.4	171.3	-178.9	153.7	0	0	0	110.5	G28 L30 Q34 L35 L36 V198 L205	G28-L32 WeakPolarHBondContact O-CB 3.31Å; G28-L32 PolarHBondContact O-N 2.83Å; L30-L32 PolarHBondContact O-N 2.93Å; L32-Q34 PolarHBondContact O-N 3.5Å; L32-L35 PolarHBondContact O-N 3.29Å; L32-L36 WeakPolarHBondContact O-CB 3.1Å; L32-L36 PolarHBondContact O-N 2.89Å; L32-V198 HydrophobicContact CB-CG1 4.42Å; L32-V198 HydrophobicContact CD1-CG1 3.97Å; L32-L205 HydrophobicContact CD1-CD1 4.31Å; L32-L205 HydrophobicContact CD2-CD1 4.24Å
33	S	96.4	Very high	95.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.2	-37.8	179	-58.7	0	0	0	0	112.6	F29 L30 Q31 L36 Y37	F29-S33 WeakPolarHBondContact O-CB 3.5Å; F29-S33 PolarHBondContact O-N 2.91Å; F29-S33 PolarHBondContact O-OG 3.38Å; L30-S33 WeakPolarHBondContact O-CB 3.43Å; L30-S33 PolarHBondContact O-N 3.18Å; Q31-S33 VanDerWaalsContact C-N 3.32Å; Q31-S33 PolarHBondContact O-N 3.28Å; S33-L36 WeakPolarHBondContact O-CB 3.07Å; S33-Y37 PolarHBondContact O-N 3.19Å; S33-Y37 VanDerWaalsContact O-N 3.08Å
34	Q	96.1	Very high	95.3	Very high	23 Å²	23	18.8 Å²	18.8	11%	0.107	10%	0.099	C	C	.	.	H	α-helix	trans	-60.3	-48.9	173.3	172.8	174.3	-8.2	0	0	112.1	L30 Q31 L32 Y37 S38 M97 F164	L30-Q34 PolarHBondContact O-N 3.05Å; Q31-Q34 WeakPolarHBondContact O-CB 3.49Å; Q31-Q34 PolarHBondContact O-N 3.25Å; L32-Q34 PolarHBondContact O-N 3.5Å; Q34-Y37 WeakPolarHBondContact O-CB 3.29Å; Q34-Y37 PolarHBondContact O-N 3.11Å; Q34-S38 PolarHBondContact O-N 2.84Å; Q34-M97 HydrophobicContact CB-CE 3.61Å; Q34-M97 HydrophobicContact CG-CE 3.48Å; Q34-M97 VanDerWaalsContact CG-CE 3.48Å; Q34-F164 HydrophobicContact CG-CZ 4.43Å
35	L	94.9	Very high	95.3	Very high	59 Å²	59	18.4 Å²	18.4	31%	0.309	10%	0.097	S	C	.	.	H	α-helix	trans	-76.3	-29.6	-177.5	-66.5	175.4	0	0	0	112.3	Q31 L32 S38 A39 S199 P203	Q31-L35 WeakPolarHBondContact O-CG 3.49Å; Q31-L35 PolarHBondContact O-N 3.18Å; L32-L35 PolarHBondContact O-N 3.29Å; L35-S38 PolarHBondContact O-N 3.22Å; L35-A39 PolarHBondContact O-N 3.43Å; L35-A39 VanDerWaalsContact O-N 3.13Å; L35-S199 WeakPolarHBondContact CD1-O 3.45Å; L35-P203 HydrophobicContact CB-CG 4.06Å
36	L	96.4	Very high	95.1	Very high	9 Å²	9	12.9 Å²	12.9	5%	0.047	7%	0.068	C	C	.	.	H	α-helix	trans	-55.8	-49.5	167.8	-178.8	90.6	0	0	0	110.7	L32 S33 Y40 G202 L205 I249 F252	L32-L36 WeakPolarHBondContact O-CB 3.1Å; L32-L36 PolarHBondContact O-N 2.89Å; S33-L36 WeakPolarHBondContact O-CB 3.07Å; L36-Y40 VanDerWaalsContact O-CB 3.28Å; L36-Y40 WeakPolarHBondContact O-CB 3.44Å; L36-Y40 PolarHBondContact O-N 3.23Å; L36-G202 WeakPolarHBondContact CA-O 3.35Å; L36-L205 HydrophobicContact CD1-CB 3.36Å; L36-I249 HydrophobicContact CD2-CD1 4.46Å; L36-I249 HydrophobicContact CD2-CG1 3.68Å; L36-I249 HydrophobicContact CD2-CG2 4.48Å; L36-I249 HydrophobicContact CG-CD1 4.47Å; L36-I249 HydrophobicContact CG-CG1 4.2Å; L36-F252 HydrophobicContact CD2-CD2 3.98Å
37	Y	96.8	Very high	94.9	Very high	3 Å²	3	12.3 Å²	12.3	1%	0.012	6%	0.064	C	C	.	.	H	α-helix	trans	-55.5	-52	174.1	171.4	-90.9	0	0	0	112.1	S33 Q34 A39 Y40 F41 A101 L104 Q161 F164 L246 I249	S33-Y37 PolarHBondContact O-N 3.19Å; S33-Y37 VanDerWaalsContact O-N 3.08Å; Q34-Y37 WeakPolarHBondContact O-CB 3.29Å; Q34-Y37 PolarHBondContact O-N 3.11Å; Y37-A39 VanDerWaalsContact C-N 3.3Å; Y37-A39 PolarHBondContact O-N 3.1Å; Y37-Y40 PolarHBondContact O-N 3.01Å; Y37-F41 PolarHBondContact O-N 3.18Å; Y37-A101 HydrophobicContact CD2-CB 3.97Å; Y37-A101 HydrophobicContact CE2-CB 3.76Å; Y37-L104 HydrophobicContact CE2-CD2 4.15Å; Y37-L104 WeakPolarHBondContact OH-CD2 3.47Å; Y37-Q161 PolarHBondContact OH-NE2 3.2Å; Y37-F164 HydrophobicContact CD1-CD1 4.09Å; Y37-F164 AromaticContact CD1-CD2 3.7Å; Y37-F164 HydrophobicContact CD1-CD2 3.7Å; Y37-F164 AromaticContact CD1-CE1 3.54Å; Y37-F164 HydrophobicContact CD1-CE1 3.54Å; Y37-F164 AromaticContact CD1-CE2 3.08Å; Y37-F164 HydrophobicContact CD1-CE2 3.08Å; Y37-F164 HydrophobicContact CD1-CG 4.16Å; Y37-F164 AromaticContact CD1-CZ 2.98Å; Y37-F164 HydrophobicContact CD1-CZ 2.98Å; Y37-F164 HydrophobicContact CD2-CD2 4.37Å; Y37-F164 AromaticContact CD2-CE2 3.92Å; Y37-F164 HydrophobicContact CD2-CE2 3.92Å; Y37-F164 HydrophobicContact CE1-CB 4.45Å; Y37-F164 AromaticContact CE1-CD1 3.68Å; Y37-F164 HydrophobicContact CE1-CD1 3.68Å; Y37-F164 AromaticContact CE1-CD2 3.36Å; Y37-F164 HydrophobicContact CE1-CD2 3.36Å; Y37-F164 AromaticContact CE1-CE1 3.63Å; Y37-F164 HydrophobicContact CE1-CE1 3.63Å; Y37-F164 AromaticContact CE1-CE2 3.31Å; Y37-F164 HydrophobicContact CE1-CE2 3.31Å; Y37-F164 AromaticContact CE1-CG 3.55Å; Y37-F164 HydrophobicContact CE1-CG 3.55Å; Y37-F164 AromaticContact CE1-CZ 3.44Å; Y37-F164 HydrophobicContact CE1-CZ 3.44Å; Y37-F164 VanDerWaalsContact CE1-CZ 3.44Å; Y37-F164 HydrophobicContact CE2-CD2 4.1Å; Y37-F164 HydrophobicContact CE2-CE2 4.11Å; Y37-F164 HydrophobicContact CG-CD2 4.16Å; Y37-F164 AromaticContact CG-CE2 3.39Å; Y37-F164 HydrophobicContact CG-CE2 3.39Å; Y37-F164 AromaticContact CG-CZ 3.61Å; Y37-F164 HydrophobicContact CG-CZ 3.61Å; Y37-F164 AromaticContact CZ-CD2 3.55Å; Y37-F164 AromaticContact CZ-CE2 3.8Å; Y37-F164 AromaticContact CZ-CG 3.95Å; Y37-L246 HydrophobicContact CD2-CD2 4.06Å; Y37-L246 HydrophobicContact CE2-CD2 3.85Å; Y37-I249 HydrophobicContact CD2-CG2 4.07Å; Y37-I249 HydrophobicContact CG-CG2 4.36Å
38	S	94.1	Very high	94.7	Very high	27 Å²	27	12.5 Å²	12.5	19%	0.189	7%	0.065	C	C	.	.	H	α-helix	trans	-59.6	-42.7	-173.5	-172.7	0	0	0	0	111.6	Q34 L35 R42	Q34-S38 PolarHBondContact O-N 2.84Å; L35-S38 PolarHBondContact O-N 3.22Å; S38-R42 WeakPolarHBondContact O-CG 3.28Å; S38-R42 PolarHBondContact O-N 3.18Å
39	A	95.6	Very high	94.5	Very high	6 Å²	6	12.6 Å²	12.6	5%	0.05	7%	0.065	C	C	.	.	H	α-helix	trans	-74	-39.2	177.1	0	0	0	0	0	113.3	L35 Y37 R42 S43 P203 Y207	L35-A39 PolarHBondContact O-N 3.43Å; L35-A39 VanDerWaalsContact O-N 3.13Å; Y37-A39 VanDerWaalsContact C-N 3.3Å; Y37-A39 PolarHBondContact O-N 3.1Å; A39-R42 PolarHBondContact O-N 3.34Å; A39-S43 WeakPolarHBondContact O-CB 3.42Å; A39-S43 PolarHBondContact O-N 2.8Å; A39-P203 VanDerWaalsContact CB-CA 3.41Å; A39-P203 HydrophobicContact CB-CB 3.88Å; A39-P203 VanDerWaalsContact CB-O 3.26Å; A39-P203 WeakPolarHBondContact CB-O 3.23Å; A39-Y207 HydrophobicContact CB-CD2 3.87Å; A39-Y207 HydrophobicContact CB-CE2 3.9Å
40	Y	97	Very high	94	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-59.4	-48.9	176.1	-179.1	-87.3	0	0	0	110.8	L36 Y37 R42 S43 T44 L209 M213 W242 G245 L246 I249	L36-Y40 VanDerWaalsContact O-CB 3.28Å; L36-Y40 WeakPolarHBondContact O-CB 3.44Å; L36-Y40 PolarHBondContact O-N 3.23Å; Y37-Y40 PolarHBondContact O-N 3.01Å; Y40-R42 VanDerWaalsContact C-N 3.35Å; Y40-R42 PolarHBondContact O-N 3.37Å; Y40-S43 WeakPolarHBondContact O-CB 3.47Å; Y40-S43 PolarHBondContact O-N 3.16Å; Y40-S43 VanDerWaalsContact O-N 3.09Å; Y40-S43 PolarHBondContact O-OG 2.97Å; Y40-T44 HydrophobicContact CD1-CG2 4.32Å; Y40-T44 HydrophobicContact CE1-CG2 3.75Å; Y40-T44 PolarHBondContact O-N 3.09Å; Y40-L209 HydrophobicContact CD2-CB 4.16Å; Y40-L209 HydrophobicContact CD2-CD2 4.08Å; Y40-L209 HydrophobicContact CD2-CG 3.95Å; Y40-L209 HydrophobicContact CE2-CD2 4.37Å; Y40-L209 HydrophobicContact CE2-CG 3.98Å; Y40-M213 HydrophobicContact CE2-CB 4.31Å; Y40-M213 HydrophobicContact CE2-CG 4.1Å; Y40-W242 VanDerWaalsContact CE1-O 3.32Å; Y40-W242 WeakPolarHBondContact CE1-O 3.4Å; Y40-W242 PolarHBondContact OH-O 3.25Å; Y40-G245 VanDerWaalsContact OH-CA 3.26Å; Y40-G245 WeakPolarHBondContact OH-CA 3.46Å; Y40-G245 PolarHBondContact OH-N 3.18Å; Y40-L246 HydrophobicContact CD1-CD2 3.71Å; Y40-L246 HydrophobicContact CD1-CG 4.04Å; Y40-L246 HydrophobicContact CE1-CD2 3.96Å; Y40-L246 HydrophobicContact CE1-CG 3.74Å; Y40-I249 HydrophobicContact CD1-CD1 3.71Å; Y40-I249 HydrophobicContact CD2-CD1 3.92Å; Y40-I249 HydrophobicContact CG-CD1 3.35Å
41	F	95.9	Very high	93.5	Very high	6 Å²	6	12.6 Å²	12.6	3%	0.026	6%	0.062	C	C	.	.	H	α-helix	trans	-57.9	-47.9	179.2	-178.6	-116.7	0	0	0	111.5	Y37 S43 T44 I45 I48 I62 L104 M157 Q161	Y37-F41 PolarHBondContact O-N 3.18Å; F41-S43 VanDerWaalsContact C-N 3.27Å; F41-S43 PolarHBondContact O-N 2.65Å; F41-T44 PolarHBondContact O-N 3.37Å; F41-T44 PolarHBondContact O-OG1 3.26Å; F41-I45 PolarHBondContact O-N 2.76Å; F41-I48 HydrophobicContact CD2-CD1 4.48Å; F41-I48 HydrophobicContact CE2-CD1 3.88Å; F41-I62 HydrophobicContact CE1-CG2 4.21Å; F41-I62 HydrophobicContact CZ-CG2 3.84Å; F41-L104 HydrophobicContact CD2-CD2 3.33Å; F41-L104 HydrophobicContact CD2-CG 4.36Å; F41-L104 HydrophobicContact CE2-CD1 4.07Å; F41-L104 HydrophobicContact CE2-CD2 3.48Å; F41-L104 VanDerWaalsContact CE2-CD2 3.48Å; F41-L104 HydrophobicContact CE2-CG 4.08Å; F41-L104 HydrophobicContact CG-CD2 4.1Å; F41-L104 HydrophobicContact CZ-CD1 4.42Å; F41-L104 HydrophobicContact CZ-CD2 4.34Å; F41-M157 HydrophobicContact CE2-CE 3.58Å; F41-M157 HydrophobicContact CZ-CE 3.67Å; F41-Q161 VanDerWaalsContact CD1-NE2 3.26Å; F41-Q161 HydrophobicContact CE1-CG 4.4Å
42	R	94.3	Very high	93.1	Very high	5 Å²	5	13.1 Å²	13.1	2%	0.019	6%	0.064	C	C	.	.	H	α-helix	trans	-60	-36.1	176.6	-69.2	178.7	-160.9	-97.8	3	113	S38 A39 Y40 T44 I45 S63 A329 S330	S38-R42 WeakPolarHBondContact O-CG 3.28Å; S38-R42 PolarHBondContact O-N 3.18Å; A39-R42 PolarHBondContact O-N 3.34Å; Y40-R42 VanDerWaalsContact C-N 3.35Å; Y40-R42 PolarHBondContact O-N 3.37Å; R42-T44 PolarHBondContact O-N 3.48Å; R42-I45 HydrophobicContact CB-CD1 4.32Å; R42-I45 HydrophobicContact CG-CD1 4.33Å; R42-I45 PolarHBondContact O-N 3.37Å; R42-S63 PolarHBondContact NH1-OG 3.4Å; R42-A329 VanDerWaalsContact CB-O 3.28Å; R42-A329 WeakPolarHBondContact CB-O 3.42Å; R42-A329 WeakPolarHBondContact CD-O 3.24Å; R42-S330 PolarHBondContact NH1-OG 3.37Å
43	S	94.7	Very high	92.6	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.7	-26	176.9	81.8	0	0	0	0	113.9	A39 Y40 F41	A39-S43 WeakPolarHBondContact O-CB 3.42Å; A39-S43 PolarHBondContact O-N 2.8Å; Y40-S43 WeakPolarHBondContact O-CB 3.47Å; Y40-S43 PolarHBondContact O-N 3.16Å; Y40-S43 VanDerWaalsContact O-N 3.09Å; Y40-S43 PolarHBondContact O-OG 2.97Å; F41-S43 VanDerWaalsContact C-N 3.27Å; F41-S43 PolarHBondContact O-N 2.65Å
44	T	94.6	Very high	92.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-1.7	-177.4	62.4	0	0	0	0	114.5	Y40 F41 R42 S46 T47 I48 L214 W242	Y40-T44 HydrophobicContact CD1-CG2 4.32Å; Y40-T44 HydrophobicContact CE1-CG2 3.75Å; Y40-T44 PolarHBondContact O-N 3.09Å; F41-T44 PolarHBondContact O-N 3.37Å; F41-T44 PolarHBondContact O-OG1 3.26Å; R42-T44 PolarHBondContact O-N 3.48Å; T44-S46 VanDerWaalsContact C-N 3.32Å; T44-S46 PolarHBondContact O-N 3.12Å; T44-T47 PolarHBondContact O-N 3.05Å; T44-T47 VanDerWaalsContact O-N 3.15Å; T44-T47 PolarHBondContact O-OG1 3.11Å; T44-I48 WeakPolarHBondContact O-CG1 3.5Å; T44-I48 PolarHBondContact O-N 3.23Å; T44-I48 VanDerWaalsContact O-N 3.09Å; T44-L214 HydrophobicContact CG2-CD2 4.27Å; T44-W242 HydrophobicContact CG2-CB 3.74Å
45	I	92.9	Very high	92.1	Very high	5 Å²	5	13.9 Å²	13.9	3%	0.026	7%	0.071	C	C	.	.	H	α-helix	trans	-54.8	-46.4	-175.9	-74.9	172.3	0	0	0	111.8	F41 R42 T47 I48 E49 F331	F41-I45 PolarHBondContact O-N 2.76Å; R42-I45 HydrophobicContact CB-CD1 4.32Å; R42-I45 HydrophobicContact CG-CD1 4.33Å; R42-I45 PolarHBondContact O-N 3.37Å; I45-T47 VanDerWaalsContact C-N 3.3Å; I45-T47 PolarHBondContact O-N 3.39Å; I45-I48 PolarHBondContact O-N 2.86Å; I45-E49 HydrophobicContact CG2-CG 4.31Å; I45-E49 VanDerWaalsContact O-CG 3.32Å; I45-E49 WeakPolarHBondContact O-CG 3.26Å; I45-E49 PolarHBondContact O-N 3.39Å; I45-F331 HydrophobicContact CG2-CD1 4.48Å; I45-F331 HydrophobicContact CG2-CE1 3.85Å
46	S	89.6	Confident	92	Very high	2 Å²	2	11 Å²	11	1%	0.014	6%	0.056	C	C	.	.	H	α-helix	trans	-67	-29.6	-176.6	71.3	0	0	0	0	113.3	T44 R50 E337 V344	T44-S46 VanDerWaalsContact C-N 3.32Å; T44-S46 PolarHBondContact O-N 3.12Å; S46-R50 WeakPolarHBondContact O-CB 3.08Å; S46-R50 VanDerWaalsContact O-CG 3.26Å; S46-R50 WeakPolarHBondContact O-CG 3.47Å; S46-R50 PolarHBondContact O-N 3.02Å; S46-R50 VanDerWaalsContact O-N 3.13Å; S46-E337 WeakPolarHBondContact CB-OE2 3.38Å; S46-E337 PolarHBondContact OG-OE2 3.32Å; S46-V344 WeakPolarHBondContact OG-CG1 3.05Å
47	T	90.6	Very high	91.9	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-77.3	-36.2	176	58.3	0	0	0	0	112.3	T44 I45 R50 R51 L214 V344	T44-T47 PolarHBondContact O-N 3.05Å; T44-T47 VanDerWaalsContact O-N 3.15Å; T44-T47 PolarHBondContact O-OG1 3.11Å; I45-T47 VanDerWaalsContact C-N 3.3Å; I45-T47 PolarHBondContact O-N 3.39Å; T47-R50 PolarHBondContact O-N 3.15Å; T47-R51 WeakPolarHBondContact O-CB 3.48Å; T47-R51 PolarHBondContact O-N 3.47Å; T47-L214 HydrophobicContact CG2-CD1 4.46Å; T47-L214 HydrophobicContact CG2-CD2 3.62Å; T47-V344 HydrophobicContact CG2-CB 4.4Å; T47-V344 HydrophobicContact CG2-CG1 3.88Å; T47-V344 HydrophobicContact CG2-CG2 4.4Å
48	I	91.6	Very high	91.8	Very high	4 Å²	4	16 Å²	16	2%	0.021	8%	0.079	C	C	.	.	H	α-helix	trans	-63.6	-45	173.8	-66.6	165.8	0	0	0	110.1	F41 T44 I45 R50 R51 Y52 L54 M157 W242	F41-I48 HydrophobicContact CD2-CD1 4.48Å; F41-I48 HydrophobicContact CE2-CD1 3.88Å; T44-I48 WeakPolarHBondContact O-CG1 3.5Å; T44-I48 PolarHBondContact O-N 3.23Å; T44-I48 VanDerWaalsContact O-N 3.09Å; I45-I48 PolarHBondContact O-N 2.86Å; I48-R50 VanDerWaalsContact C-N 3.35Å; I48-R50 PolarHBondContact O-N 2.92Å; I48-R51 PolarHBondContact O-N 2.93Å; I48-Y52 HydrophobicContact CG2-CD2 3.96Å; I48-Y52 HydrophobicContact CG2-CE2 4.49Å; I48-Y52 PolarHBondContact O-N 3.12Å; I48-L54 HydrophobicContact CG2-CD1 4.13Å; I48-M157 HydrophobicContact CD1-CE 3.83Å; I48-M157 HydrophobicContact CG2-CE 3.86Å; I48-M157 HydrophobicContact CG2-SD 3.94Å; I48-W242 HydrophobicContact CD1-CD2 4.27Å; I48-W242 HydrophobicContact CD1-CE3 4Å; I48-W242 HydrophobicContact CG1-CB 4.45Å; I48-W242 HydrophobicContact CG1-CD2 3.81Å; I48-W242 HydrophobicContact CG1-CE3 4.05Å; I48-W242 HydrophobicContact CG1-CG 3.98Å
49	E	89.8	Confident	91.8	Very high	6 Å²	6	15 Å²	15	3%	0.028	7%	0.072	C	C	.	.	H	α-helix	trans	-57.7	-46.1	174.2	-73.3	171.9	169.7	0	0	112	I45 G53 L54 S56 S59 K334	I45-E49 HydrophobicContact CG2-CG 4.31Å; I45-E49 VanDerWaalsContact O-CG 3.32Å; I45-E49 WeakPolarHBondContact O-CG 3.26Å; I45-E49 PolarHBondContact O-N 3.39Å; E49-G53 WeakPolarHBondContact O-CA 3.37Å; E49-G53 PolarHBondContact O-N 2.93Å; E49-L54 HydrophobicContact CG-CB 4.31Å; E49-L54 PolarHBondContact O-N 3.48Å; E49-S56 WeakPolarHBondContact OE1-CA 3.44Å; E49-S59 WeakPolarHBondContact OE1-CB 3.45Å; E49-S59 PolarHBondContact OE1-OG 3.36Å; E49-K334 VanDerWaalsContact CD-NZ 3.32Å; E49-K334 IonicContact OE1-NZ 2.82Å; E49-K334 PolarHBondContact OE1-NZ 3.36Å; E49-K334 WeakPolarHBondContact OE2-CE 3.45Å; E49-K334 IonicContact OE2-NZ 3.29Å; E49-K334 PolarHBondContact OE2-NZ 2.85Å
50	R	85.1	Confident	91.7	Very high	51 Å²	51	14.7 Å²	14.7	19%	0.192	7%	0.07	C	C	.	.	H	α-helix	trans	-65.2	-37.6	178.2	-74.8	171.7	73.8	178.2	-8.4	112.5	S46 T47 I48 D235 P236 W238 E337	S46-R50 WeakPolarHBondContact O-CB 3.08Å; S46-R50 VanDerWaalsContact O-CG 3.26Å; S46-R50 WeakPolarHBondContact O-CG 3.47Å; S46-R50 PolarHBondContact O-N 3.02Å; S46-R50 VanDerWaalsContact O-N 3.13Å; T47-R50 PolarHBondContact O-N 3.15Å; I48-R50 VanDerWaalsContact C-N 3.35Å; I48-R50 PolarHBondContact O-N 2.92Å; R50-D235 PolarHBondContact NH2-O 3.25Å; R50-P236 PolarHBondContact NH2-O 3.39Å; R50-W238 PolarHBondContact NH2-O 3.01Å; R50-W238 VanDerWaalsContact NH2-O 3.15Å; R50-E337 IonicContact CZ-OE1 2.89Å; R50-E337 IonicContact NH1-OE1 3.97Å; R50-E337 PolarHBondContact NH1-OE1 3.41Å
51	R	85.8	Confident	91.6	Very high	25 Å²	25	16.2 Å²	16.2	9%	0.094	8%	0.079	C	C	.	.	H	α-helix	trans	-71.2	-49.4	180	-177.1	172	171.9	116.9	-0.9	112.4	T47 I48 H108 S111 Y114 V218 D219 V239	T47-R51 WeakPolarHBondContact O-CB 3.48Å; T47-R51 PolarHBondContact O-N 3.47Å; I48-R51 PolarHBondContact O-N 2.93Å; R51-H108 PolarHBondContact NH1-ND1 3.47Å; R51-H108 PolarHBondContact NH2-ND1 2.69Å; R51-S111 PolarHBondContact NH2-OG 2.91Å; R51-Y114 HydrophobicContact CG-CD2 4.33Å; R51-V218 VanDerWaalsContact NH1-CG1 3.34Å; R51-D219 IonicContact CZ-OD1 2.8Å; R51-D219 IonicContact NH1-OD1 3.64Å; R51-D219 PolarHBondContact NH1-OD1 3.27Å; R51-D219 IonicContact NH2-OD1 3.71Å; R51-V239 HydrophobicContact CB-CG1 4Å
52	Y	87.5	Confident	91.6	Very high	18 Å²	18	16 Å²	16	7%	0.071	8%	0.079	C	C	.	.	H	α-helix	trans	-101.4	-2	-170.9	-62	-66	0	0	0	114.1	I48 P107 H108 S111 T150 V153 W242	I48-Y52 HydrophobicContact CG2-CD2 3.96Å; I48-Y52 HydrophobicContact CG2-CE2 4.49Å; I48-Y52 PolarHBondContact O-N 3.12Å; Y52-P107 HydrophobicContact CE2-CB 4.46Å; Y52-P107 PolarHBondContact OH-O 2.94Å; Y52-H108 WeakPolarHBondContact OH-CA 3.39Å; Y52-H108 PolarHBondContact OH-N 3.5Å; Y52-S111 PolarHBondContact OH-OG 2.89Å; Y52-T150 WeakPolarHBondContact O-CG2 3.38Å; Y52-T150 PolarHBondContact O-OG1 3.4Å; Y52-V153 HydrophobicContact CD1-CB 4.41Å; Y52-V153 HydrophobicContact CD1-CG1 4.14Å; Y52-V153 HydrophobicContact CD1-CG2 3.89Å; Y52-V153 HydrophobicContact CD2-CG1 3.82Å; Y52-V153 HydrophobicContact CE1-CG1 4.32Å; Y52-V153 HydrophobicContact CE1-CG2 3.81Å; Y52-V153 HydrophobicContact CE2-CG1 3.99Å; Y52-V153 HydrophobicContact CG-CG1 3.88Å; Y52-V153 HydrophobicContact CG-CG2 4.46Å; Y52-W242 AromaticContact CE2-CZ2 3.81Å; Y52-W242 HydrophobicContact CE2-CZ2 3.81Å
53	G	84.9	Confident	91.5	Very high	9 Å²	9	15.8 Å²	15.8	9%	0.093	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	36.5	178.5	0	0	0	0	0	113.4	E49 F568 S569	E49-G53 WeakPolarHBondContact O-CA 3.37Å; E49-G53 PolarHBondContact O-N 2.93Å; G53-F568 CarbonylContact O-C 3.47Å; G53-F568 VanDerWaalsContact O-CA 3.24Å; G53-F568 WeakPolarHBondContact O-CA 3.45Å; G53-F568 WeakPolarHBondContact O-CB 2.91Å; G53-S569 PolarHBondContact O-N 3.26Å
54	L	90	Very high	91.5	Very high	9 Å²	9	16 Å²	16	5%	0.047	8%	0.079	C	C	.	.			trans	-78.4	145.1	176.1	-58.8	176.2	0	0	0	110.6	I48 E49 I62 T150	I48-L54 HydrophobicContact CG2-CD1 4.13Å; E49-L54 HydrophobicContact CG-CB 4.31Å; E49-L54 PolarHBondContact O-N 3.48Å; L54-I62 HydrophobicContact CD1-CD1 4.13Å; L54-T150 HydrophobicContact CD2-CG2 3.72Å
55	N	91.4	Very high	91.5	Very high	46 Å²	46	17.2 Å²	17.2	25%	0.246	9%	0.086	C	C	.	.			trans	-77.5	161.9	167	69.5	20.6	0	0	0	110.6	F57 S58 S59 D554 W560	N55-F57 VanDerWaalsContact C-N 3.32Å; N55-F57 PolarHBondContact O-N 3.43Å; N55-S58 PolarHBondContact O-N 3.23Å; N55-S58 WeakPolarHBondContact OD1-CA 3.17Å; N55-S58 WeakPolarHBondContact OD1-CB 3.19Å; N55-S58 PolarHBondContact OD1-N 3.23Å; N55-S59 PolarHBondContact O-N 3.31Å; N55-S59 VanDerWaalsContact O-N 3.13Å; N55-S59 PolarHBondContact O-OG 2.83Å; N55-D554 WeakPolarHBondContact CB-OD2 3.35Å; N55-W560 HydrophobicContact CB-CH2 4.15Å; N55-W560 HydrophobicContact CB-CZ3 3.85Å
56	S	93.7	Very high	91.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-72.2	-28.1	-174.2	-32.7	0	0	0	0	112.5	E49 S59 G60 F331 K334 G550 I553 D554 Y573	E49-S56 WeakPolarHBondContact OE1-CA 3.44Å; S56-S59 WeakPolarHBondContact CA-OG 3.45Å; S56-S59 PolarHBondContact O-OG 3Å; S56-S59 VanDerWaalsContact O-OG 3.06Å; S56-G60 PolarHBondContact O-N 2.92Å; S56-F331 WeakPolarHBondContact O-CZ 3.39Å; S56-K334 PolarHBondContact OG-NZ 3.35Å; S56-G550 WeakPolarHBondContact CB-O 3.48Å; S56-G550 VanDerWaalsContact O-CA 3.31Å; S56-G550 WeakPolarHBondContact O-CA 3.45Å; S56-I553 WeakPolarHBondContact OG-CG2 3.24Å; S56-D554 WeakPolarHBondContact CB-OD1 3.47Å; S56-D554 VanDerWaalsContact N-CG 3.31Å; S56-D554 PolarHBondContact N-OD1 3.22Å; S56-D554 PolarHBondContact N-OD2 3.05Å; S56-D554 PolarHBondContact OG-OD1 2.92Å; S56-Y573 PolarHBondContact OG-OH 3.15Å
57	F	94.3	Very high	91.8	Very high	99 Å²	99	18.2 Å²	18.2	43%	0.434	9%	0.09	S	C	.	.	H	α-helix	trans	-59	-52.9	170.7	171.1	-110.2	0	0	0	111	N55 S59 G60 T61 A547 T551 D554	N55-F57 VanDerWaalsContact C-N 3.32Å; N55-F57 PolarHBondContact O-N 3.43Å; F57-S59 PolarHBondContact O-N 3.26Å; F57-G60 PolarHBondContact O-N 3.14Å; F57-T61 PolarHBondContact O-N 3.37Å; F57-T61 PolarHBondContact O-OG1 2.91Å; F57-A547 HydrophobicContact CD2-CB 4.17Å; F57-A547 HydrophobicContact CE2-CB 4.02Å; F57-T551 HydrophobicContact CB-CG2 4.11Å; F57-T551 HydrophobicContact CD2-CG2 3.32Å; F57-T551 HydrophobicContact CE2-CG2 4Å; F57-T551 HydrophobicContact CG-CG2 3.98Å; F57-D554 PolarHBondContact N-OD2 3.48Å
58	S	93.7	Very high	91.9	Very high	16 Å²	16	20.3 Å²	20.3	11%	0.112	10%	0.103	C	C	.	.	H	α-helix	trans	-60.4	-46.9	-179	169	0	0	0	0	112.3	N55 G60 T61 I62 W154	N55-S58 PolarHBondContact O-N 3.23Å; N55-S58 WeakPolarHBondContact OD1-CA 3.17Å; N55-S58 WeakPolarHBondContact OD1-CB 3.19Å; N55-S58 PolarHBondContact OD1-N 3.23Å; S58-G60 VanDerWaalsContact C-N 3.34Å; S58-T61 PolarHBondContact O-N 3.46Å; S58-I62 WeakPolarHBondContact O-CG1 3.41Å; S58-I62 PolarHBondContact O-N 2.9Å; S58-W154 PolarHBondContact OG-NE1 3.45Å
59	S	93.8	Very high	92	Very high	6 Å²	6	20.6 Å²	20.6	4%	0.042	11%	0.105	C	C	.	.	H	α-helix	trans	-66.2	-38.3	178.6	68.1	0	0	0	0	111.9	E49 N55 S56 F57 I62 S63	E49-S59 WeakPolarHBondContact OE1-CB 3.45Å; E49-S59 PolarHBondContact OE1-OG 3.36Å; N55-S59 PolarHBondContact O-N 3.31Å; N55-S59 VanDerWaalsContact O-N 3.13Å; N55-S59 PolarHBondContact O-OG 2.83Å; S56-S59 WeakPolarHBondContact CA-OG 3.45Å; S56-S59 PolarHBondContact O-OG 3Å; S56-S59 VanDerWaalsContact O-OG 3.06Å; F57-S59 PolarHBondContact O-N 3.26Å; S59-I62 PolarHBondContact O-N 3.04Å; S59-S63 PolarHBondContact O-N 3.14Å
60	G	94.1	Very high	91.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.3	-46.1	172.7	0	0	0	0	0	111.9	S56 F57 S58 S63 S64 P546	S56-G60 PolarHBondContact O-N 2.92Å; F57-G60 PolarHBondContact O-N 3.14Å; S58-G60 VanDerWaalsContact C-N 3.34Å; G60-S63 PolarHBondContact O-N 3.03Å; G60-S64 PolarHBondContact O-N 3.31Å; G60-S64 PolarHBondContact O-OG 3.39Å; G60-P546 WeakPolarHBondContact O-CB 3.38Å
61	T	95.2	Very high	92.1	Very high	32 Å²	32	19 Å²	19	20%	0.196	10%	0.102	C	C	.	.	H	α-helix	trans	-60.2	-48.1	174.4	-58.4	0	0	0	0	111.4	F57 S58 S63 S64 L65	F57-T61 PolarHBondContact O-N 3.37Å; F57-T61 PolarHBondContact O-OG1 2.91Å; S58-T61 PolarHBondContact O-N 3.46Å; T61-S63 VanDerWaalsContact C-N 3.26Å; T61-S63 PolarHBondContact O-N 3.46Å; T61-S64 PolarHBondContact O-N 3.24Å; T61-S64 PolarHBondContact O-OG 2.92Å; T61-L65 WeakPolarHBondContact O-CG 3.38Å; T61-L65 PolarHBondContact O-N 3.26Å; T61-L65 VanDerWaalsContact O-N 3.14Å
62	I	95.5	Very high	92.3	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-55.3	-45.8	176.2	-69.9	163.9	0	0	0	110.3	F41 L54 S58 S59 S64 L65 W154 M157 Q161	F41-I62 HydrophobicContact CE1-CG2 4.21Å; F41-I62 HydrophobicContact CZ-CG2 3.84Å; L54-I62 HydrophobicContact CD1-CD1 4.13Å; S58-I62 WeakPolarHBondContact O-CG1 3.41Å; S58-I62 PolarHBondContact O-N 2.9Å; S59-I62 PolarHBondContact O-N 3.04Å; I62-S64 PolarHBondContact O-N 2.88Å; I62-S64 VanDerWaalsContact O-N 3.16Å; I62-L65 PolarHBondContact O-N 3.44Å; I62-W154 VanDerWaalsContact CD1-CD1 3.43Å; I62-W154 HydrophobicContact CD1-CG 4.12Å; I62-M157 HydrophobicContact CD1-CB 4.33Å; I62-M157 HydrophobicContact CD1-SD 4.48Å; I62-M157 HydrophobicContact CG2-CB 3.96Å; I62-M157 HydrophobicContact CG2-CE 4.31Å; I62-Q161 HydrophobicContact CG2-CG 3.93Å; I62-Q161 WeakPolarHBondContact O-CG 3.21Å
63	S	93.1	Very high	92.3	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.2	-21.8	179.6	-174.6	0	0	0	0	114.7	R42 S59 G60 T61 H66	R42-S63 PolarHBondContact NH1-OG 3.4Å; S59-S63 PolarHBondContact O-N 3.14Å; G60-S63 PolarHBondContact O-N 3.03Å; T61-S63 VanDerWaalsContact C-N 3.26Å; T61-S63 PolarHBondContact O-N 3.46Å; S63-H66 PolarHBondContact O-CE1 2.94Å; S63-H66 PolarHBondContact O-ND1 3.25Å; S63-H66 VanDerWaalsContact O-ND1 3.09Å
64	S	94.6	Very high	92.3	Very high	4 Å²	4	25.3 Å²	25.3	3%	0.028	14%	0.135	C	C	.	.	H	α-helix	trans	-103.1	-7.8	-179	67.1	0	0	0	0	114.4	G60 T61 I62 H66 E67 L543	G60-S64 PolarHBondContact O-N 3.31Å; G60-S64 PolarHBondContact O-OG 3.39Å; T61-S64 PolarHBondContact O-N 3.24Å; T61-S64 PolarHBondContact O-OG 2.92Å; I62-S64 PolarHBondContact O-N 2.88Å; I62-S64 VanDerWaalsContact O-N 3.16Å; S64-H66 VanDerWaalsContact C-N 3.27Å; S64-H66 PolarHBondContact O-N 3.48Å; S64-E67 WeakPolarHBondContact O-CB 3.41Å; S64-E67 PolarHBondContact O-N 3.03Å; S64-L543 WeakPolarHBondContact CB-O 3.37Å; S64-L543 WeakPolarHBondContact O-CD1 3.39Å; S64-L543 PolarHBondContact OG-O 3.1Å
65	L	95.2	Very high	91.9	Very high	27 Å²	27	26 Å²	26	14%	0.141	14%	0.139	C	C	.	.	H	α-helix	trans	-59.4	-31.2	-177.7	-80.4	173.6	0	0	0	114.5	T61 I62 E67 V68 A158 Q161 L162	T61-L65 WeakPolarHBondContact O-CG 3.38Å; T61-L65 PolarHBondContact O-N 3.26Å; T61-L65 VanDerWaalsContact O-N 3.14Å; I62-L65 PolarHBondContact O-N 3.44Å; L65-E67 PolarHBondContact O-N 3.44Å; L65-V68 HydrophobicContact CD2-CG2 4.29Å; L65-V68 VanDerWaalsContact O-CB 3.32Å; L65-V68 WeakPolarHBondContact O-CB 3.45Å; L65-V68 PolarHBondContact O-N 3.49Å; L65-A158 HydrophobicContact CD1-CB 3.41Å; L65-A158 VanDerWaalsContact CD1-CB 3.41Å; L65-Q161 HydrophobicContact CB-CB 3.88Å; L65-L162 HydrophobicContact CB-CD2 4.32Å; L65-L162 HydrophobicContact CB-CG 4.42Å; L65-L162 HydrophobicContact CD2-CD2 4.39Å; L65-L162 WeakPolarHBondContact O-CD2 3.27Å
66	H	93.9	Very high	91.5	Very high	13 Å²	13	27.6 Å²	27.6	6%	0.06	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-26.4	176.4	69	-82.9	0	0	0	113	S63 S64 V68 N70 Q161 F164 G165	S63-H66 PolarHBondContact O-CE1 2.94Å; S63-H66 PolarHBondContact O-ND1 3.25Å; S63-H66 VanDerWaalsContact O-ND1 3.09Å; S64-H66 VanDerWaalsContact C-N 3.27Å; S64-H66 PolarHBondContact O-N 3.48Å; H66-V68 VanDerWaalsContact C-N 3.32Å; H66-N70 WeakPolarHBondContact O-CB 3.14Å; H66-N70 PolarHBondContact O-N 3.44Å; H66-Q161 WeakPolarHBondContact CA-O 3.39Å; H66-Q161 WeakPolarHBondContact CB-O 3.26Å; H66-F164 HydrophobicContact CB-CD1 4.24Å; H66-G165 VanDerWaalsContact O-CA 3.29Å; H66-G165 WeakPolarHBondContact O-CA 3.05Å
67	E	93.4	Very high	91	Very high	15 Å²	15	28.3 Å²	28.3	7%	0.07	15%	0.149	C	C	.	.	H	α-helix	trans	-70.1	-29.6	175.3	-59.9	-67.4	-177.1	0	0	111.6	S64 L65 N70 C71 R538 W542 L543	S64-E67 WeakPolarHBondContact O-CB 3.41Å; S64-E67 PolarHBondContact O-N 3.03Å; L65-E67 PolarHBondContact O-N 3.44Å; E67-N70 PolarHBondContact O-N 3.37Å; E67-C71 WeakPolarHBondContact O-CB 3.08Å; E67-C71 PolarHBondContact O-N 3.46Å; E67-C71 PolarHBondContact O-SG 3.01Å; E67-R538 WeakPolarHBondContact OE2-CD 3.47Å; E67-R538 VanDerWaalsContact OE2-CG 3.26Å; E67-R538 WeakPolarHBondContact OE2-CG 3.32Å; E67-R538 IonicContact OE2-NE 3.76Å; E67-R538 PolarHBondContact OE2-NE 3.4Å; E67-R538 VanDerWaalsContact OE2-NE 3.1Å; E67-W542 HydrophobicContact CG-CB 4.11Å; E67-L543 HydrophobicContact CB-CB 4.4Å; E67-L543 HydrophobicContact CB-CD1 4.36Å
68	V	93.9	Very high	90	Very high	45 Å²	45	27.5 Å²	27.5	27%	0.273	16%	0.155	S	C	.	.	H	α-helix	trans	-61.7	-54.2	177.6	-179.2	0	0	0	0	110.5	L65 H66 N70 C71 I72 L162 L543	L65-V68 HydrophobicContact CD2-CG2 4.29Å; L65-V68 VanDerWaalsContact O-CB 3.32Å; L65-V68 WeakPolarHBondContact O-CB 3.45Å; L65-V68 PolarHBondContact O-N 3.49Å; H66-V68 VanDerWaalsContact C-N 3.32Å; V68-N70 PolarHBondContact O-N 3.26Å; V68-C71 PolarHBondContact O-N 2.92Å; V68-I72 HydrophobicContact CG1-CD1 4.09Å; V68-I72 WeakPolarHBondContact O-CG1 3.46Å; V68-I72 PolarHBondContact O-N 3.46Å; V68-I72 VanDerWaalsContact O-N 3.16Å; V68-L162 HydrophobicContact CB-CD2 4.17Å; V68-L162 HydrophobicContact CG1-CD2 4.49Å; V68-L543 HydrophobicContact CG2-CD1 3.39Å; V68-L543 HydrophobicContact CG2-CD2 4.22Å; V68-L543 HydrophobicContact CG2-CG 4.46Å
69	S	92.6	Very high	89.2	Confident	10 Å²	10	28.1 Å²	28.1	7%	0.07	16%	0.155	C	C	.	.	H	α-helix	trans	-57.4	-38.3	175.9	-56.4	0	0	0	0	111.6	I72 L73 L162	S69-I72 PolarHBondContact O-N 3.34Å; S69-L73 WeakPolarHBondContact O-CB 3.39Å; S69-L73 WeakPolarHBondContact O-CG 3.16Å; S69-L73 PolarHBondContact O-N 3.07Å; S69-L162 VanDerWaalsContact CB-O 3.31Å; S69-L162 WeakPolarHBondContact CB-O 3.32Å; S69-L162 VanDerWaalsContact OG-CA 3.28Å; S69-L162 WeakPolarHBondContact OG-CA 3.34Å; S69-L162 WeakPolarHBondContact OG-CD2 3.08Å; S69-L162 PolarHBondContact OG-O 2.94Å
70	N	89.1	Confident	88.4	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.011	17%	0.17	C	C	.	.	H	α-helix	trans	-66.4	-44.5	-179.7	-149	-37.5	0	0	0	112.2	H66 E67 V68 I72 L73 I74 S168 V169 R538	H66-N70 WeakPolarHBondContact O-CB 3.14Å; H66-N70 PolarHBondContact O-N 3.44Å; E67-N70 PolarHBondContact O-N 3.37Å; V68-N70 PolarHBondContact O-N 3.26Å; N70-I72 VanDerWaalsContact C-N 3.31Å; N70-I72 PolarHBondContact O-N 2.9Å; N70-L73 PolarHBondContact O-N 2.61Å; N70-I74 VanDerWaalsContact O-CB 3.25Å; N70-I74 WeakPolarHBondContact O-CB 3.37Å; N70-I74 WeakPolarHBondContact O-CG2 3.38Å; N70-I74 PolarHBondContact O-N 3.25Å; N70-S168 PolarHBondContact ND2-OG 3.34Å; N70-V169 HydrophobicContact CB-CG2 4.13Å; N70-R538 VanDerWaalsContact ND2-CZ 3.31Å; N70-R538 PolarHBondContact ND2-NH1 2.74Å; N70-R538 PolarHBondContact ND2-NH2 3.15Å; N70-R538 VanDerWaalsContact ND2-NH2 3.14Å; N70-R538 PolarHBondContact OD1-NH1 3.08Å
71	C	89.4	Confident	87.3	Confident	20 Å²	20	32 Å²	32	14%	0.135	17%	0.174	C	C	.	.	H	α-helix	trans	-62.1	-38.2	177.9	-66.5	0	0	0	0	112.6	E67 V68 L535 R538 V539	E67-C71 WeakPolarHBondContact O-CB 3.08Å; E67-C71 PolarHBondContact O-N 3.46Å; E67-C71 PolarHBondContact O-SG 3.01Å; V68-C71 PolarHBondContact O-N 2.92Å; C71-L535 HydrophobicContact CB-CD1 4.01Å; C71-R538 VanDerWaalsContact SG-CB 3.59Å; C71-V539 HydrophobicContact CB-CG2 4.13Å; C71-V539 WeakPolarHBondContact SG-CG2 3.46Å
72	I	88.6	Confident	86	Confident	103 Å²	103	33.3 Å²	33.3	53%	0.528	19%	0.185	S	C	.	.	H	α-helix	trans	-71.1	-45.2	179.4	-64.9	168.3	0	0	0	110.6	V68 S69 N70 F76	V68-I72 HydrophobicContact CG1-CD1 4.09Å; V68-I72 WeakPolarHBondContact O-CG1 3.46Å; V68-I72 PolarHBondContact O-N 3.46Å; V68-I72 VanDerWaalsContact O-N 3.16Å; S69-I72 PolarHBondContact O-N 3.34Å; N70-I72 VanDerWaalsContact C-N 3.31Å; N70-I72 PolarHBondContact O-N 2.9Å; I72-F76 VanDerWaalsContact O-CD2 3.28Å; I72-F76 WeakPolarHBondContact O-CD2 3.46Å; I72-F76 WeakPolarHBondContact O-CE2 3.49Å
73	L	89	Confident	85.2	Confident	53 Å²	53	36.7 Å²	36.7	28%	0.277	20%	0.198	S	C	.	.	H	α-helix	trans	-86.8	-20.8	-170	-68.7	173.3	0	0	0	114.6	S69 N70 V75 F76 V77 V166 V169	S69-L73 WeakPolarHBondContact O-CB 3.39Å; S69-L73 WeakPolarHBondContact O-CG 3.16Å; S69-L73 PolarHBondContact O-N 3.07Å; N70-L73 PolarHBondContact O-N 2.61Å; L73-V75 VanDerWaalsContact C-N 3.26Å; L73-V75 PolarHBondContact O-N 2.73Å; L73-F76 HydrophobicContact CD2-CD2 4.48Å; L73-F76 PolarHBondContact O-N 3.26Å; L73-F76 VanDerWaalsContact O-N 3.11Å; L73-V77 WeakPolarHBondContact O-CG2 3.37Å; L73-V77 PolarHBondContact O-N 3.16Å; L73-V166 HydrophobicContact CD1-CB 3.92Å; L73-V166 HydrophobicContact CD1-CG1 3.72Å; L73-V166 HydrophobicContact CD1-CG2 3.68Å; L73-V169 HydrophobicContact CB-CB 4.4Å; L73-V169 HydrophobicContact CB-CG1 4.11Å; L73-V169 HydrophobicContact CB-CG2 3.97Å; L73-V169 HydrophobicContact CD1-CG2 4.37Å
74	I	84.3	Confident	84.8	Confident	29 Å²	29	38.7 Å²	38.7	15%	0.149	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-35.5	-176.3	-164.8	69.2	0	0	0	112.6	N70 F76 V77 S78 V169 P173 L535	N70-I74 VanDerWaalsContact O-CB 3.25Å; N70-I74 WeakPolarHBondContact O-CB 3.37Å; N70-I74 WeakPolarHBondContact O-CG2 3.38Å; N70-I74 PolarHBondContact O-N 3.25Å; I74-F76 VanDerWaalsContact C-N 3.35Å; I74-F76 PolarHBondContact O-N 3.27Å; I74-V77 PolarHBondContact O-N 3.39Å; I74-S78 PolarHBondContact O-N 3.04Å; I74-S78 PolarHBondContact O-OG 3.47Å; I74-S78 VanDerWaalsContact O-OG 3.12Å; I74-V169 HydrophobicContact CB-CG1 4.05Å; I74-V169 HydrophobicContact CD1-CG1 3.73Å; I74-P173 HydrophobicContact CD1-CG 3.76Å; I74-L535 HydrophobicContact CG2-CD1 3.93Å
75	V	81	Confident	84.5	Confident	23 Å²	23	40.3 Å²	40.3	14%	0.139	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-41.3	177.6	179.8	0	0	0	0	111.1	L73 Y79 F294 F298	L73-V75 VanDerWaalsContact C-N 3.26Å; L73-V75 PolarHBondContact O-N 2.73Å; V75-Y79 PolarHBondContact O-N 3.24Å; V75-F294 HydrophobicContact CG1-CE1 4.04Å; V75-F298 HydrophobicContact CG1-CD2 4.07Å; V75-F298 HydrophobicContact CG1-CE2 4.09Å; V75-F298 HydrophobicContact CG1-CG 4.39Å; V75-F298 HydrophobicContact CG1-CZ 4.42Å; V75-F298 HydrophobicContact CG2-CE1 4.36Å; V75-F298 HydrophobicContact CG2-CE2 4.09Å; V75-F298 HydrophobicContact CG2-CZ 3.82Å
76	F	82.4	Confident	84.2	Confident	80 Å²	80	40.7 Å²	40.7	35%	0.351	22%	0.216	S	C	.	.	H	α-helix	trans	-70.8	-40.7	177.8	-62	-81	0	0	0	111.7	I72 L73 I74 S78 Y79 F80	I72-F76 VanDerWaalsContact O-CD2 3.28Å; I72-F76 WeakPolarHBondContact O-CD2 3.46Å; I72-F76 WeakPolarHBondContact O-CE2 3.49Å; L73-F76 HydrophobicContact CD2-CD2 4.48Å; L73-F76 PolarHBondContact O-N 3.26Å; L73-F76 VanDerWaalsContact O-N 3.11Å; I74-F76 VanDerWaalsContact C-N 3.35Å; I74-F76 PolarHBondContact O-N 3.27Å; F76-S78 VanDerWaalsContact C-N 3.28Å; F76-S78 PolarHBondContact O-N 2.95Å; F76-Y79 WeakPolarHBondContact O-CB 3.28Å; F76-Y79 PolarHBondContact O-N 3.39Å; F76-Y79 VanDerWaalsContact O-N 3.09Å; F76-F80 HydrophobicContact CB-CD2 4.26Å; F76-F80 HydrophobicContact CB-CE2 4.23Å; F76-F80 WeakPolarHBondContact O-CD2 3.01Å; F76-F80 PolarHBondContact O-N 3.46Å
77	V	83.1	Confident	84.2	Confident	16 Å²	16	40.1 Å²	40.1	10%	0.097	21%	0.213	C	C	.	.	H	α-helix	trans	-57.8	-42.3	175.6	167.5	0	0	0	0	110.8	L73 I74 Y79 F80 G81 V169 P170 P173 F174	L73-V77 WeakPolarHBondContact O-CG2 3.37Å; L73-V77 PolarHBondContact O-N 3.16Å; I74-V77 PolarHBondContact O-N 3.39Å; V77-Y79 VanDerWaalsContact C-N 3.31Å; V77-Y79 PolarHBondContact O-N 2.85Å; V77-F80 PolarHBondContact O-N 3.39Å; V77-G81 PolarHBondContact O-N 3.4Å; V77-G81 VanDerWaalsContact O-N 3.1Å; V77-V169 HydrophobicContact CB-CG1 4.16Å; V77-V169 HydrophobicContact CG2-CB 4.24Å; V77-V169 HydrophobicContact CG2-CG1 3.61Å; V77-P170 HydrophobicContact CG1-CB 4.47Å; V77-P170 HydrophobicContact CG2-CB 4.46Å; V77-P173 HydrophobicContact CG1-CB 4.2Å; V77-P173 HydrophobicContact CG1-CG 4.25Å; V77-F174 HydrophobicContact CB-CZ 4.34Å; V77-F174 HydrophobicContact CG1-CD1 4.11Å; V77-F174 HydrophobicContact CG1-CE1 3.47Å; V77-F174 VanDerWaalsContact CG1-CE1 3.47Å; V77-F174 HydrophobicContact CG1-CE2 4.21Å; V77-F174 HydrophobicContact CG1-CZ 3.56Å; V77-F174 VanDerWaalsContact O-CE1 3.23Å; V77-F174 WeakPolarHBondContact O-CE1 3.48Å; V77-F174 WeakPolarHBondContact O-CZ 3.21Å
78	S	74.9	Confident	84.2	Confident	82 Å²	82	45.6 Å²	45.6	57%	0.573	23%	0.234	S	C	*	.	H	α-helix	trans	-59.5	-38.2	175.1	-61.5	0	0	0	0	113.1	I74 F76	I74-S78 PolarHBondContact O-N 3.04Å; I74-S78 PolarHBondContact O-OG 3.47Å; I74-S78 VanDerWaalsContact O-OG 3.12Å; F76-S78 VanDerWaalsContact C-N 3.28Å; F76-S78 PolarHBondContact O-N 2.95Å
79	Y	76.2	Confident	84.2	Confident	28 Å²	28	45.9 Å²	45.9	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-70.3	-43.8	175.4	176.7	-89.3	0	0	0	112.7	V75 F76 V77 G81 R83 R289 L291 F294	V75-Y79 PolarHBondContact O-N 3.24Å; F76-Y79 WeakPolarHBondContact O-CB 3.28Å; F76-Y79 PolarHBondContact O-N 3.39Å; F76-Y79 VanDerWaalsContact O-N 3.09Å; V77-Y79 VanDerWaalsContact C-N 3.31Å; V77-Y79 PolarHBondContact O-N 2.85Å; Y79-G81 VanDerWaalsContact C-N 3.26Å; Y79-G81 PolarHBondContact O-N 3.2Å; Y79-R83 PolarHBondContact OH-NH1 3.43Å; Y79-R83 PolarHBondContact OH-NH2 3.09Å; Y79-R289 PolarHBondContact OH-O 1.99Å; Y79-L291 HydrophobicContact CD1-CD2 3.11Å; Y79-L291 HydrophobicContact CD1-CG 3.88Å; Y79-L291 HydrophobicContact CD2-CD2 3.9Å; Y79-L291 HydrophobicContact CE1-CB 4.48Å; Y79-L291 HydrophobicContact CE1-CD1 4.22Å; Y79-L291 HydrophobicContact CE1-CD2 3.14Å; Y79-L291 HydrophobicContact CE1-CG 3.33Å; Y79-L291 HydrophobicContact CE2-CD2 3.92Å; Y79-L291 HydrophobicContact CE2-CG 4.16Å; Y79-L291 HydrophobicContact CG-CD2 3.5Å; Y79-L291 VanDerWaalsContact CG-CD2 3.5Å; Y79-L291 HydrophobicContact CG-CG 4.49Å; Y79-L291 VanDerWaalsContact CZ-CG 3.48Å; Y79-L291 PolarHBondContact OH-N 3.24Å; Y79-F294 HydrophobicContact CD2-CB 3.83Å; Y79-F294 AromaticContact CD2-CD1 3.92Å; Y79-F294 HydrophobicContact CD2-CD1 3.92Å; Y79-F294 HydrophobicContact CD2-CD2 4.42Å; Y79-F294 AromaticContact CD2-CG 3.8Å; Y79-F294 HydrophobicContact CD2-CG 3.8Å; Y79-F294 HydrophobicContact CE2-CB 4.09Å; Y79-F294 HydrophobicContact CG-CD1 4.4Å
80	F	76.3	Confident	84.3	Confident	78 Å²	78	45.4 Å²	45.4	34%	0.342	23%	0.232	S	C	.	.	H	α-helix	trans	-76.1	-11.7	-174.6	-74.2	-61.9	0	0	0	113.7	F76 V77 S82 R83 V84 L291	F76-F80 HydrophobicContact CB-CD2 4.26Å; F76-F80 HydrophobicContact CB-CE2 4.23Å; F76-F80 WeakPolarHBondContact O-CD2 3.01Å; F76-F80 PolarHBondContact O-N 3.46Å; V77-F80 PolarHBondContact O-N 3.39Å; F80-S82 PolarHBondContact O-N 2.85Å; F80-R83 PolarHBondContact O-N 3Å; F80-V84 HydrophobicContact CB-CG1 3.9Å; F80-V84 HydrophobicContact CD1-CG1 4.26Å; F80-V84 HydrophobicContact CG-CG1 4.41Å; F80-V84 VanDerWaalsContact O-CG2 3.3Å; F80-V84 WeakPolarHBondContact O-CG2 3.31Å; F80-V84 PolarHBondContact O-N 3.41Å; F80-V84 VanDerWaalsContact O-N 3.08Å; F80-L291 HydrophobicContact CE1-CD1 4.48Å; F80-L291 HydrophobicContact CZ-CD1 4.06Å; F80-L291 HydrophobicContact CZ-CD2 4.22Å
81	G	71.8	Confident	84.7	Confident	9 Å²	9	45.3 Å²	45.3	9%	0.093	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-48.7	-171.3	0	0	0	0	0	115.9	V77 Y79 R83 R86	V77-G81 PolarHBondContact O-N 3.4Å; V77-G81 VanDerWaalsContact O-N 3.1Å; Y79-G81 VanDerWaalsContact C-N 3.26Å; Y79-G81 PolarHBondContact O-N 3.2Å; G81-R83 VanDerWaalsContact C-N 3.35Å; G81-R86 VanDerWaalsContact O-CG 3.29Å; G81-R86 WeakPolarHBondContact O-CG 3.37Å; G81-R86 PolarHBondContact O-NE 3.4Å
82	S	67.9	Low	85	Confident	61 Å²	61	48.4 Å²	48.4	43%	0.427	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-11.8	179.3	59.4	0	0	0	0	113.9	F80	F80-S82 PolarHBondContact O-N 2.85Å
83	R	77.7	Confident	85.4	Confident	73 Å²	73	43.8 Å²	43.8	28%	0.275	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-25.5	-171.2	-58.9	-171.8	-173.6	-134.4	3.1	113.6	Y79 F80 G81 R265 K287 R289	Y79-R83 PolarHBondContact OH-NH1 3.43Å; Y79-R83 PolarHBondContact OH-NH2 3.09Å; F80-R83 PolarHBondContact O-N 3Å; G81-R83 VanDerWaalsContact C-N 3.35Å; R83-R265 PolarHBondContact O-NH2 2.86Å; R83-K287 PolarHBondContact NH1-O 3.3Å; R83-K287 PolarHBondContact NH2-O 3.41Å; R83-R289 PolarHBondContact NH2-O 3.16Å
84	V	85.4	Confident	85.8	Confident	41 Å²	41	41.2 Å²	41.2	25%	0.248	21%	0.214	C	C	.	.	S	Bend	trans	-99.7	166.3	-176	-57.8	0	0	0	0	113	F80 R86 V89 F174	F80-V84 HydrophobicContact CB-CG1 3.9Å; F80-V84 HydrophobicContact CD1-CG1 4.26Å; F80-V84 HydrophobicContact CG-CG1 4.41Å; F80-V84 VanDerWaalsContact O-CG2 3.3Å; F80-V84 WeakPolarHBondContact O-CG2 3.31Å; F80-V84 PolarHBondContact O-N 3.41Å; F80-V84 VanDerWaalsContact O-N 3.08Å; V84-R86 VanDerWaalsContact C-N 3.32Å; V84-R86 PolarHBondContact O-N 2.91Å; V84-V89 HydrophobicContact CB-CG2 4.09Å; V84-V89 HydrophobicContact CG2-CG2 3.86Å; V84-F174 HydrophobicContact CG2-CE2 3.95Å; V84-F174 HydrophobicContact CG2-CZ 4.07Å
85	H	88.5	Confident	86.4	Confident	39 Å²	39	42.6 Å²	42.6	18%	0.181	22%	0.221	C	C	.	.			trans	-77.1	83.3	170.1	-168	-47.2	0	0	0	110.1	R88 V89 F263 R265	H85-R88 HydrophobicContact CB-CB 4.36Å; H85-R88 PolarHBondContact O-N 3.37Å; H85-V89 PolarHBondContact O-N 2.97Å; H85-F263 PolarHBondContact CE1-O 2.89Å; H85-F263 VanDerWaalsContact CE1-O 3.29Å; H85-R265 PolarHBondContact CE1-N 3.43Å; H85-R265 PolarHBondContact NE2-N 3.35Å
86	R	89.6	Confident	87.2	Confident	35 Å²	35	44 Å²	44	13%	0.132	23%	0.227	C	C	.	.	H	α-helix	trans	-42.7	-53.4	-173.4	-67.4	-177.3	-158.6	162	8.9	114.3	G81 V84 R88 V89 I90 F174 S177 Y178 D181	G81-R86 VanDerWaalsContact O-CG 3.29Å; G81-R86 WeakPolarHBondContact O-CG 3.37Å; G81-R86 PolarHBondContact O-NE 3.4Å; V84-R86 VanDerWaalsContact C-N 3.32Å; V84-R86 PolarHBondContact O-N 2.91Å; R86-R88 PolarHBondContact O-N 3.17Å; R86-V89 PolarHBondContact O-N 3.46Å; R86-I90 WeakPolarHBondContact O-CG1 3.45Å; R86-I90 PolarHBondContact O-N 2.96Å; R86-F174 HydrophobicContact CB-CB 4.1Å; R86-F174 HydrophobicContact CB-CG 4.37Å; R86-F174 HydrophobicContact CG-CB 4.25Å; R86-F174 HydrophobicContact CG-CD1 4.37Å; R86-F174 HydrophobicContact CG-CG 4.15Å; R86-S177 PolarHBondContact NH1-O 3.19Å; R86-S177 VanDerWaalsContact NH1-O 3.16Å; R86-S177 PolarHBondContact NH1-OG 3.48Å; R86-Y178 HydrophobicContact CB-CD2 4.27Å; R86-D181 IonicContact CZ-OD2 3.15Å; R86-D181 IonicContact NH1-OD2 2.65Å; R86-D181 PolarHBondContact NH1-OD2 3.18Å; R86-D181 IonicContact NH2-OD2 2.8Å; R86-D181 PolarHBondContact NH2-OD2 3.23Å
87	P	92.4	Very high	88	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-55.8	-47.8	178.4	-28.3	34.3	0	0	0	114.5	F23 V89 I90 G91 Y178 Y260 F263	F23-P87 HydrophobicContact CE2-CB 4.48Å; F23-P87 HydrophobicContact CE2-CG 4.27Å; P87-V89 VanDerWaalsContact C-N 3.32Å; P87-V89 PolarHBondContact O-N 3.43Å; P87-I90 WeakPolarHBondContact O-CB 3.1Å; P87-I90 PolarHBondContact O-N 3.14Å; P87-I90 VanDerWaalsContact O-N 3.14Å; P87-G91 PolarHBondContact O-N 3.41Å; P87-Y178 HydrophobicContact CG-CD2 3.88Å; P87-Y178 HydrophobicContact CG-CE2 3.45Å; P87-Y178 VanDerWaalsContact CG-CE2 3.45Å; P87-Y260 HydrophobicContact CB-CD1 4.16Å; P87-Y260 WeakPolarHBondContact O-CB 3.22Å; P87-Y260 WeakPolarHBondContact O-CD1 3.45Å; P87-F263 HydrophobicContact CB-CB 3.86Å; P87-F263 HydrophobicContact CG-CB 4.11Å
88	R	94.1	Very high	88.7	Confident	131 Å²	131	39.5 Å²	39.5	49%	0.494	21%	0.207	S	C	.	.	H	α-helix	trans	-63.1	-37.6	-180	-71.4	-179.4	-176	-178.8	0.9	112.2	H85 R86 I90 G91 V92	H85-R88 HydrophobicContact CB-CB 4.36Å; H85-R88 PolarHBondContact O-N 3.37Å; R86-R88 PolarHBondContact O-N 3.17Å; R88-I90 VanDerWaalsContact C-N 3.34Å; R88-G91 PolarHBondContact O-N 3.33Å; R88-V92 WeakPolarHBondContact O-CG2 3.49Å; R88-V92 PolarHBondContact O-N 3.24Å
89	V	94.5	Very high	89.8	Confident	51 Å²	51	39.5 Å²	39.5	31%	0.309	20%	0.203	S	C	.	.	H	α-helix	trans	-66.7	-38.1	176.2	-176	0	0	0	0	111.1	V84 H85 R86 P87 G93 P170 F174	V84-V89 HydrophobicContact CB-CG2 4.09Å; V84-V89 HydrophobicContact CG2-CG2 3.86Å; H85-V89 PolarHBondContact O-N 2.97Å; R86-V89 PolarHBondContact O-N 3.46Å; P87-V89 VanDerWaalsContact C-N 3.32Å; P87-V89 PolarHBondContact O-N 3.43Å; V89-G93 PolarHBondContact O-N 3.07Å; V89-P170 HydrophobicContact CG1-CB 3.9Å; V89-P170 HydrophobicContact CG1-CG 4.16Å; V89-F174 HydrophobicContact CB-CD2 4.21Å; V89-F174 HydrophobicContact CB-CE2 4.11Å; V89-F174 HydrophobicContact CG1-CD2 4.19Å; V89-F174 HydrophobicContact CG1-CE2 3.8Å
90	I	95.1	Very high	90.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.1	-46.5	171.8	-63	167	0	0	0	110.5	F23 L30 R86 P87 R88 G93 G94 I171 F174 Y260	F23-I90 HydrophobicContact CZ-CD1 4.21Å; L30-I90 HydrophobicContact CD2-CG2 3.43Å; L30-I90 VanDerWaalsContact CD2-CG2 3.43Å; R86-I90 WeakPolarHBondContact O-CG1 3.45Å; R86-I90 PolarHBondContact O-N 2.96Å; P87-I90 WeakPolarHBondContact O-CB 3.1Å; P87-I90 PolarHBondContact O-N 3.14Å; P87-I90 VanDerWaalsContact O-N 3.14Å; R88-I90 VanDerWaalsContact C-N 3.34Å; I90-G93 PolarHBondContact O-N 2.87Å; I90-G94 PolarHBondContact O-N 3.09Å; I90-I171 HydrophobicContact CG2-CG1 4.38Å; I90-I171 HydrophobicContact CG2-CG2 4.45Å; I90-F174 HydrophobicContact CD1-CB 3.76Å; I90-F174 HydrophobicContact CG1-CB 3.82Å; I90-Y260 HydrophobicContact CB-CD1 3.9Å; I90-Y260 HydrophobicContact CB-CE1 3.98Å; I90-Y260 HydrophobicContact CB-CG 4.43Å; I90-Y260 HydrophobicContact CD1-CE1 4.08Å; I90-Y260 HydrophobicContact CG2-CD1 3.8Å; I90-Y260 HydrophobicContact CG2-CD2 4.29Å; I90-Y260 HydrophobicContact CG2-CE1 3.51Å; I90-Y260 HydrophobicContact CG2-CE2 4.02Å; I90-Y260 HydrophobicContact CG2-CG 4.18Å
91	G	96.2	Very high	91.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-45.5	178.1	0	0	0	0	0	113.3	P87 R88 G94 L95	P87-G91 PolarHBondContact O-N 3.41Å; R88-G91 PolarHBondContact O-N 3.33Å; G91-G94 PolarHBondContact O-N 3.38Å; G91-L95 WeakPolarHBondContact O-CG 3.49Å; G91-L95 PolarHBondContact O-N 3.35Å
92	V	96.8	Very high	92.9	Very high	85 Å²	85	38.6 Å²	38.6	52%	0.515	20%	0.2	S	C	.	.	H	α-helix	trans	-63.3	-41.3	174.6	172.7	0	0	0	0	111.1	R88 L95 L96 F261	R88-V92 WeakPolarHBondContact O-CG2 3.49Å; R88-V92 PolarHBondContact O-N 3.24Å; V92-L95 PolarHBondContact O-N 3.31Å; V92-L96 WeakPolarHBondContact O-CB 3.49Å; V92-L96 PolarHBondContact O-N 2.63Å; V92-F261 HydrophobicContact CG2-CE1 4.06Å; V92-F261 HydrophobicContact CG2-CZ 4.12Å
93	G	96.4	Very high	94.3	Very high	5 Å²	5	37.7 Å²	37.7	5%	0.052	19%	0.19	C	C	.	.	H	α-helix	trans	-60.8	-43.3	175.5	0	0	0	0	0	113	V89 I90 L96 M97 G167	V89-G93 PolarHBondContact O-N 3.07Å; I90-G93 PolarHBondContact O-N 2.87Å; G93-L96 WeakPolarHBondContact O-CB 3.46Å; G93-L96 PolarHBondContact O-N 2.84Å; G93-M97 WeakPolarHBondContact O-CG 3.41Å; G93-M97 PolarHBondContact O-N 3.33Å; G93-G167 CarbonylContact C-O 3.55Å; G93-G167 VanDerWaalsContact CA-O 3.32Å; G93-G167 WeakPolarHBondContact CA-O 3.48Å; G93-G167 CarbonylContact O-C 3.58Å; G93-G167 VanDerWaalsContact O-CA 3.29Å; G93-G167 WeakPolarHBondContact O-CA 3.25Å
94	G	97.1	Very high	95.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.8	-38.8	176.2	0	0	0	0	0	113.7	I90 G91 L96 M97 A98 S257	I90-G94 PolarHBondContact O-N 3.09Å; G91-G94 PolarHBondContact O-N 3.38Å; G94-L96 VanDerWaalsContact C-N 3.35Å; G94-M97 WeakPolarHBondContact O-CB 3.35Å; G94-M97 PolarHBondContact O-N 3.39Å; G94-A98 PolarHBondContact O-N 3.16Å; G94-S257 WeakPolarHBondContact CA-OG 3.28Å
95	L	97.9	Very high	95.6	Very high	58 Å²	58	32.6 Å²	32.6	30%	0.304	17%	0.167	S	C	.	.	H	α-helix	trans	-63.7	-40.1	171.2	-71.2	179.8	0	0	0	111.8	G91 V92 M97 A98 V99 T254 S257 F261	G91-L95 WeakPolarHBondContact O-CG 3.49Å; G91-L95 PolarHBondContact O-N 3.35Å; V92-L95 PolarHBondContact O-N 3.31Å; L95-M97 VanDerWaalsContact C-N 3.28Å; L95-M97 PolarHBondContact O-N 3.46Å; L95-A98 WeakPolarHBondContact O-CB 3.17Å; L95-A98 PolarHBondContact O-N 2.93Å; L95-A98 VanDerWaalsContact O-N 3.09Å; L95-V99 WeakPolarHBondContact O-CG2 2.9Å; L95-V99 PolarHBondContact O-N 3.4Å; L95-T254 HydrophobicContact CD2-CG2 4.08Å; L95-S257 PolarHBondContact N-OG 3.5Å; L95-F261 HydrophobicContact CD1-CE2 3.76Å; L95-F261 HydrophobicContact CD1-CZ 3.72Å; L95-F261 HydrophobicContact CG-CE2 4.46Å
96	L	97.7	Very high	95.8	Very high	51 Å²	51	33.7 Å²	33.7	27%	0.267	17%	0.174	S	C	.	.	H	α-helix	trans	-62.7	-37.4	176.3	-168.2	66.8	0	0	0	111.7	V92 G93 G94 V99 S100 L163 V166	V92-L96 WeakPolarHBondContact O-CB 3.49Å; V92-L96 PolarHBondContact O-N 2.63Å; G93-L96 WeakPolarHBondContact O-CB 3.46Å; G93-L96 PolarHBondContact O-N 2.84Å; G94-L96 VanDerWaalsContact C-N 3.35Å; L96-V99 PolarHBondContact O-N 3.04Å; L96-S100 PolarHBondContact O-N 3.36Å; L96-S100 PolarHBondContact O-OG 3.49Å; L96-L163 HydrophobicContact CD1-CD1 3.76Å; L96-L163 HydrophobicContact CD1-CD2 4.18Å; L96-L163 HydrophobicContact CD1-CG 3.92Å; L96-L163 HydrophobicContact CD2-CD1 4.11Å; L96-L163 HydrophobicContact CD2-CG 4.47Å; L96-L163 HydrophobicContact CG-CD1 4.06Å; L96-L163 HydrophobicContact CG-CG 4Å; L96-V166 HydrophobicContact CD2-CB 3.98Å; L96-V166 HydrophobicContact CD2-CG1 3.67Å
97	M	97.6	Very high	95.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.7	-35.4	171.8	-70	165.2	64.4	0	0	113	Q34 G93 G94 L95 S100 A101 F164 I171 L253	Q34-M97 HydrophobicContact CB-CE 3.61Å; Q34-M97 HydrophobicContact CG-CE 3.48Å; Q34-M97 VanDerWaalsContact CG-CE 3.48Å; G93-M97 WeakPolarHBondContact O-CG 3.41Å; G93-M97 PolarHBondContact O-N 3.33Å; G94-M97 WeakPolarHBondContact O-CB 3.35Å; G94-M97 PolarHBondContact O-N 3.39Å; L95-M97 VanDerWaalsContact C-N 3.28Å; L95-M97 PolarHBondContact O-N 3.46Å; M97-S100 WeakPolarHBondContact CA-OG 3.18Å; M97-S100 PolarHBondContact O-N 2.89Å; M97-S100 PolarHBondContact O-OG 2.99Å; M97-A101 WeakPolarHBondContact O-CB 3.38Å; M97-A101 PolarHBondContact O-N 3.29Å; M97-F164 HydrophobicContact CB-CD2 3.86Å; M97-F164 HydrophobicContact CB-CE2 3.8Å; M97-F164 HydrophobicContact CE-CD2 4.32Å; M97-F164 HydrophobicContact CE-CE1 3.97Å; M97-F164 HydrophobicContact CE-CE2 3.42Å; M97-F164 VanDerWaalsContact CE-CE2 3.42Å; M97-F164 HydrophobicContact CE-CZ 3.2Å; M97-F164 HydrophobicContact CG-CD2 3.9Å; M97-F164 HydrophobicContact CG-CE2 3.9Å; M97-F164 HydrophobicContact CG-CG 4.36Å; M97-F164 HydrophobicContact CG-CZ 4.38Å; M97-F164 HydrophobicContact SD-CE2 4.49Å; M97-F164 HydrophobicContact SD-CZ 4.5Å; M97-I171 HydrophobicContact CE-CD1 4.2Å; M97-I171 HydrophobicContact SD-CD1 3.23Å; M97-I171 WeakPolarHBondContact SD-CD1 3.44Å; M97-L253 HydrophobicContact CB-CD1 4.14Å; M97-L253 HydrophobicContact CB-CD2 4.48Å; M97-L253 HydrophobicContact CE-CD2 3.95Å
98	A	98	Very high	95.7	Very high	3 Å²	3	32.1 Å²	32.1	3%	0.025	17%	0.168	C	C	.	.	H	α-helix	trans	-65.2	-44.1	174.9	0	0	0	0	0	111.2	G94 L95 A101 M102 S250 L253 T254	G94-A98 PolarHBondContact O-N 3.16Å; L95-A98 WeakPolarHBondContact O-CB 3.17Å; L95-A98 PolarHBondContact O-N 2.93Å; L95-A98 VanDerWaalsContact O-N 3.09Å; A98-A101 PolarHBondContact O-N 2.93Å; A98-M102 WeakPolarHBondContact O-CG 3.36Å; A98-M102 PolarHBondContact O-N 3.27Å; A98-S250 PolarHBondContact O-OG 3.41Å; A98-L253 HydrophobicContact CB-CB 3.82Å; A98-T254 WeakPolarHBondContact CB-OG1 3.45Å
99	V	98	Very high	95.5	Very high	82 Å²	82	30.2 Å²	30.2	50%	0.497	16%	0.164	S	C	.	.	H	α-helix	trans	-62.1	-43.7	175.5	172.3	0	0	0	0	111	L95 L96 A101 M102 L103 L163	L95-V99 WeakPolarHBondContact O-CG2 2.9Å; L95-V99 PolarHBondContact O-N 3.4Å; L96-V99 PolarHBondContact O-N 3.04Å; V99-A101 VanDerWaalsContact C-N 3.35Å; V99-A101 PolarHBondContact O-N 2.87Å; V99-M102 WeakPolarHBondContact O-CB 3.44Å; V99-M102 PolarHBondContact O-N 3.21Å; V99-L103 PolarHBondContact O-N 3.48Å; V99-L163 HydrophobicContact CG1-CD2 4.48Å
100	S	97.6	Very high	95.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.3	-36.7	178.2	67.2	0	0	0	0	112.6	L96 M97 M102 L103 L104 A160 F164	L96-S100 PolarHBondContact O-N 3.36Å; L96-S100 PolarHBondContact O-OG 3.49Å; M97-S100 WeakPolarHBondContact CA-OG 3.18Å; M97-S100 PolarHBondContact O-N 2.89Å; M97-S100 PolarHBondContact O-OG 2.99Å; S100-M102 VanDerWaalsContact C-N 3.34Å; S100-M102 PolarHBondContact O-N 2.95Å; S100-L103 WeakPolarHBondContact O-CB 3.44Å; S100-L103 PolarHBondContact O-N 3Å; S100-L104 PolarHBondContact O-N 2.81Å; S100-A160 WeakPolarHBondContact CB-O 3.41Å; S100-F164 WeakPolarHBondContact OG-CA 3.38Å; S100-F164 VanDerWaalsContact OG-CB 3.32Å; S100-F164 WeakPolarHBondContact OG-CB 3.45Å; S100-F164 WeakPolarHBondContact OG-CD2 3.34Å
101	A	97	Very high	94.6	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.7	-39.5	172.1	0	0	0	0	0	112	Y37 M97 A98 V99 L104 T105	Y37-A101 HydrophobicContact CD2-CB 3.97Å; Y37-A101 HydrophobicContact CE2-CB 3.76Å; M97-A101 WeakPolarHBondContact O-CB 3.38Å; M97-A101 PolarHBondContact O-N 3.29Å; A98-A101 PolarHBondContact O-N 2.93Å; V99-A101 VanDerWaalsContact C-N 3.35Å; V99-A101 PolarHBondContact O-N 2.87Å; A101-L104 WeakPolarHBondContact O-CB 3.45Å; A101-L104 PolarHBondContact O-N 3.13Å; A101-T105 PolarHBondContact O-N 2.88Å
102	M	96.1	Very high	93.8	Very high	95 Å²	95	38.9 Å²	38.9	47%	0.468	21%	0.206	S	C	.	.	H	α-helix	trans	-64.9	-43.8	172.4	-67.2	-174.9	-178.7	0	0	111.5	A98 V99 S100 L104 T105 L106 S250	A98-M102 WeakPolarHBondContact O-CG 3.36Å; A98-M102 PolarHBondContact O-N 3.27Å; V99-M102 WeakPolarHBondContact O-CB 3.44Å; V99-M102 PolarHBondContact O-N 3.21Å; S100-M102 VanDerWaalsContact C-N 3.34Å; S100-M102 PolarHBondContact O-N 2.95Å; M102-L104 PolarHBondContact O-N 3.44Å; M102-T105 WeakPolarHBondContact O-CB 3.39Å; M102-T105 PolarHBondContact O-N 3.49Å; M102-T105 PolarHBondContact O-OG1 3.4Å; M102-L106 PolarHBondContact O-N 2.99Å; M102-S250 WeakPolarHBondContact CE-OG 3.28Å; M102-S250 VanDerWaalsContact CG-OG 3.26Å; M102-S250 WeakPolarHBondContact CG-OG 3.19Å
103	L	96.3	Very high	92.7	Very high	43 Å²	43	38.4 Å²	38.4	23%	0.225	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-34.3	178	-173.5	61.6	0	0	0	111.5	V99 S100 T105 L106 L156 I159 A160	V99-L103 PolarHBondContact O-N 3.48Å; S100-L103 WeakPolarHBondContact O-CB 3.44Å; S100-L103 PolarHBondContact O-N 3Å; L103-T105 PolarHBondContact O-N 3.29Å; L103-L106 HydrophobicContact CD1-CD2 3.83Å; L103-L106 VanDerWaalsContact O-CB 3.25Å; L103-L106 WeakPolarHBondContact O-CB 3Å; L103-L106 PolarHBondContact O-N 3.39Å; L103-L156 HydrophobicContact CD1-CD1 4.19Å; L103-L156 HydrophobicContact CD1-CD2 4.39Å; L103-L156 HydrophobicContact CD1-CG 4.31Å; L103-L156 HydrophobicContact CG-CG 4.5Å; L103-L156 WeakPolarHBondContact O-CD2 3.29Å; L103-I159 HydrophobicContact CD2-CG2 4.11Å; L103-A160 HydrophobicContact CB-CB 4.16Å; L103-A160 HydrophobicContact CD2-CB 4.07Å; L103-A160 HydrophobicContact CG-CB 4.09Å
104	L	95.3	Very high	91.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.5	-22.4	175.6	-158.5	70.4	0	0	0	113.3	Y37 F41 S100 A101 M102 P107 M157 A160 W242 L246	Y37-L104 HydrophobicContact CE2-CD2 4.15Å; Y37-L104 WeakPolarHBondContact OH-CD2 3.47Å; F41-L104 HydrophobicContact CD2-CD2 3.33Å; F41-L104 HydrophobicContact CD2-CG 4.36Å; F41-L104 HydrophobicContact CE2-CD1 4.07Å; F41-L104 HydrophobicContact CE2-CD2 3.48Å; F41-L104 VanDerWaalsContact CE2-CD2 3.48Å; F41-L104 HydrophobicContact CE2-CG 4.08Å; F41-L104 HydrophobicContact CG-CD2 4.1Å; F41-L104 HydrophobicContact CZ-CD1 4.42Å; F41-L104 HydrophobicContact CZ-CD2 4.34Å; S100-L104 PolarHBondContact O-N 2.81Å; A101-L104 WeakPolarHBondContact O-CB 3.45Å; A101-L104 PolarHBondContact O-N 3.13Å; M102-L104 PolarHBondContact O-N 3.44Å; L104-P107 VanDerWaalsContact O-CD 3.27Å; L104-P107 WeakPolarHBondContact O-CD 3.17Å; L104-M157 HydrophobicContact CD1-CB 4.04Å; L104-M157 HydrophobicContact CD1-CE 3.99Å; L104-M157 HydrophobicContact CD1-CG 3.98Å; L104-A160 HydrophobicContact CB-CB 4.18Å; L104-A160 HydrophobicContact CD1-CB 3.82Å; L104-W242 WeakPolarHBondContact O-CH2 3.38Å; L104-W242 VanDerWaalsContact O-CZ3 3.28Å; L104-W242 WeakPolarHBondContact O-CZ3 3.27Å; L104-L246 HydrophobicContact CB-CD1 4.11Å; L104-L246 HydrophobicContact CD2-CD1 3.79Å; L104-L246 HydrophobicContact CD2-CD2 3.98Å; L104-L246 HydrophobicContact CG-CD1 4.01Å
105	T	94.5	Very high	90	Very high	7 Å²	7	45.3 Å²	45.3	4%	0.043	24%	0.241	C	C	.	.	H	α-helix	trans	-82.6	-23.4	173.8	68.5	0	0	0	0	113.5	A101 M102 L103 P107 H108 F109 W243 L246 L247	A101-T105 PolarHBondContact O-N 2.88Å; M102-T105 WeakPolarHBondContact O-CB 3.39Å; M102-T105 PolarHBondContact O-N 3.49Å; M102-T105 PolarHBondContact O-OG1 3.4Å; L103-T105 PolarHBondContact O-N 3.29Å; T105-P107 VanDerWaalsContact C-N 3.34Å; T105-H108 WeakPolarHBondContact O-CB 3.2Å; T105-H108 PolarHBondContact O-N 3.42Å; T105-F109 WeakPolarHBondContact O-CD2 3.39Å; T105-W243 HydrophobicContact CG2-CB 4.32Å; T105-W243 WeakPolarHBondContact CG2-O 3.46Å; T105-L246 HydrophobicContact CG2-CB 3.42Å; T105-L246 VanDerWaalsContact CG2-CB 3.42Å; T105-L246 HydrophobicContact CG2-CD1 3.89Å; T105-L246 HydrophobicContact CG2-CG 4.29Å; T105-L247 HydrophobicContact CG2-CD2 3.93Å; T105-L247 HydrophobicContact CG2-CG 4.15Å
106	L	92.7	Very high	88.1	Confident	62 Å²	62	44.8 Å²	44.8	33%	0.325	24%	0.237	S	C	.	.	H	α-helix	trans	-54.7	-35.9	-175.9	-172.4	69	0	0	0	114.6	M102 L103 H108 F109 L110 L156	M102-L106 PolarHBondContact O-N 2.99Å; L103-L106 HydrophobicContact CD1-CD2 3.83Å; L103-L106 VanDerWaalsContact O-CB 3.25Å; L103-L106 WeakPolarHBondContact O-CB 3Å; L103-L106 PolarHBondContact O-N 3.39Å; L106-H108 PolarHBondContact O-N 3.46Å; L106-H108 VanDerWaalsContact O-N 3.17Å; L106-F109 PolarHBondContact O-N 3.29Å; L106-L110 HydrophobicContact CD1-CD1 4.3Å; L106-L110 HydrophobicContact CD1-CG 4.16Å; L106-L110 HydrophobicContact CD2-CD1 3.97Å; L106-L110 HydrophobicContact CG-CD1 3.7Å; L106-L110 HydrophobicContact CG-CG 3.98Å; L106-L110 WeakPolarHBondContact O-CG 3.34Å; L106-L110 PolarHBondContact O-N 3.48Å; L106-L156 HydrophobicContact CB-CD2 3.9Å; L106-L156 HydrophobicContact CD2-CD1 4.15Å; L106-L156 HydrophobicContact CD2-CD2 4.12Å; L106-L156 HydrophobicContact CG-CD2 4.3Å
107	P	91.4	Very high	85.8	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.013	24%	0.241	C	C	.	.	H	α-helix	trans	-53	-37.6	174	-29.2	38.1	0	0	0	113.5	Y52 L104 T105 F109 S111 V153 L156 M157 W242	Y52-P107 HydrophobicContact CE2-CB 4.46Å; Y52-P107 PolarHBondContact OH-O 2.94Å; L104-P107 VanDerWaalsContact O-CD 3.27Å; L104-P107 WeakPolarHBondContact O-CD 3.17Å; T105-P107 VanDerWaalsContact C-N 3.34Å; P107-F109 VanDerWaalsContact C-N 3.31Å; P107-F109 PolarHBondContact O-N 3.39Å; P107-S111 WeakPolarHBondContact O-CB 3.38Å; P107-S111 PolarHBondContact O-N 3.33Å; P107-S111 PolarHBondContact O-OG 3.4Å; P107-V153 HydrophobicContact CB-CG1 4.01Å; P107-V153 HydrophobicContact CB-CG2 4.09Å; P107-V153 HydrophobicContact CG-CG1 4.35Å; P107-L156 HydrophobicContact CG-CD2 3.45Å; P107-L156 VanDerWaalsContact CG-CD2 3.45Å; P107-M157 HydrophobicContact CG-CG 4.22Å; P107-W242 HydrophobicContact CB-CH2 4.34Å
108	H	89.7	Confident	83	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.4	-35.6	179.2	174.3	70.9	0	0	0	112	R51 Y52 T105 L106 S111 V218 D219 N221 R222 W242 W243	R51-H108 PolarHBondContact NH1-ND1 3.47Å; R51-H108 PolarHBondContact NH2-ND1 2.69Å; Y52-H108 WeakPolarHBondContact OH-CA 3.39Å; Y52-H108 PolarHBondContact OH-N 3.5Å; T105-H108 WeakPolarHBondContact O-CB 3.2Å; T105-H108 PolarHBondContact O-N 3.42Å; L106-H108 PolarHBondContact O-N 3.46Å; L106-H108 VanDerWaalsContact O-N 3.17Å; H108-S111 PolarHBondContact O-OG 2.97Å; H108-V218 PolarHBondContact CE1-O 2.87Å; H108-D219 IonicContact CE1-OD1 3.32Å; H108-D219 PolarHBondContact CE1-OD1 3.09Å; H108-D219 VanDerWaalsContact CE1-OD1 3.25Å; H108-D219 IonicContact ND1-OD1 2.64Å; H108-N221 PolarHBondContact NE2-ND2 3.48Å; H108-R222 PolarHBondContact CE1-NH1 2.87Å; H108-R222 PolarHBondContact NE2-NH1 2.84Å; H108-R222 PolarHBondContact O-NH2 3.48Å; H108-W242 HydrophobicContact CB-CH2 4.17Å; H108-W242 HydrophobicContact CB-CZ2 3.76Å; H108-W243 HydrophobicContact CB-CB 4.13Å; H108-W243 HydrophobicContact CB-CG 4.11Å; H108-W243 AromaticContact CD2-CD1 3.49Å; H108-W243 VanDerWaalsContact CD2-CD1 3.49Å; H108-W243 AromaticContact CD2-CD2 3.72Å; H108-W243 AromaticContact CD2-CE2 3.57Å; H108-W243 AromaticContact CD2-CG 3.69Å; H108-W243 AromaticContact CD2-NE1 3.43Å; H108-W243 PolarHBondContact CD2-NE1 3.36Å; H108-W243 AromaticContact CE1-CD1 3.66Å; H108-W243 AromaticContact CE1-NE1 3.29Å; H108-W243 PolarHBondContact CE1-NE1 3.45Å; H108-W243 VanDerWaalsContact CE1-NE1 3.29Å; H108-W243 AromaticContact CG-CD1 3.37Å; H108-W243 AromaticContact CG-CG 3.75Å; H108-W243 AromaticContact CG-NE1 3.72Å; H108-W243 AromaticContact ND1-CD1 3.5Å; H108-W243 AromaticContact ND1-NE1 3.65Å; H108-W243 AromaticContact NE2-CD1 3.7Å; H108-W243 AromaticContact NE2-CE2 3.43Å; H108-W243 AromaticContact NE2-CZ2 3.82Å; H108-W243 AromaticContact NE2-NE1 3.17Å; H108-W243 PolarHBondContact NE2-NE1 3.41Å; H108-W243 VanDerWaalsContact NE2-NE1 3.17Å
109	F	89.2	Confident	80.1	Confident	91 Å²	91	48.8 Å²	48.8	40%	0.399	27%	0.266	S	S	.	.	H	α-helix	trans	-79.2	-34.9	-178.9	-64.7	-72.9	0	0	0	112.6	T105 L106 P107 R222 W243	T105-F109 WeakPolarHBondContact O-CD2 3.39Å; L106-F109 PolarHBondContact O-N 3.29Å; P107-F109 VanDerWaalsContact C-N 3.31Å; P107-F109 PolarHBondContact O-N 3.39Å; F109-R222 PolarHBondContact O-NH2 3.33Å; F109-W243 HydrophobicContact CE2-CE3 4.38Å; F109-W243 AromaticContact CZ-CE3 3.9Å; F109-W243 HydrophobicContact CZ-CE3 3.9Å; F109-W243 AromaticContact CZ-CZ3 3.87Å; F109-W243 HydrophobicContact CZ-CZ3 3.87Å
110	L	87.1	Confident	77.2	Confident	111 Å²	111	49.4 Å²	49.4	58%	0.581	27%	0.266	S	S	*	.	H	α-helix	trans	-79.9	-31.2	177.9	-63.2	178.6	0	0	0	113.4	L106	L106-L110 HydrophobicContact CD1-CD1 4.3Å; L106-L110 HydrophobicContact CD1-CG 4.16Å; L106-L110 HydrophobicContact CD2-CD1 3.97Å; L106-L110 HydrophobicContact CG-CD1 3.7Å; L106-L110 HydrophobicContact CG-CG 3.98Å; L106-L110 WeakPolarHBondContact O-CG 3.34Å; L106-L110 PolarHBondContact O-N 3.48Å
111	S	83.6	Confident	74.2	Confident	20 Å²	20	56.3 Å²	56.3	14%	0.14	30%	0.298	C	S	.	.	S	Bend	trans	-73.7	152.3	179.8	56.8	0	0	0	0	112.6	R51 Y52 P107 H108	R51-S111 PolarHBondContact NH2-OG 2.91Å; Y52-S111 PolarHBondContact OH-OG 2.89Å; P107-S111 WeakPolarHBondContact O-CB 3.38Å; P107-S111 PolarHBondContact O-N 3.33Å; P107-S111 PolarHBondContact O-OG 3.4Å; H108-S111 PolarHBondContact O-OG 2.97Å
112	Q	79.1	Confident	71.3	Confident	102 Å²	102	59.6 Å²	59.6	48%	0.477	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-61.8	157.3	173.5	-67.1	-172.3	-17.9	0	0	111.6	Y114	Q112-Y114 PolarHBondContact O-N 3.36Å
113	P	75.4	Confident	68.9	Low	75 Å²	75	55.6 Å²	55.6	49%	0.487	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-51.7	137.7	171.4	-24	33.8	0	0	0	110.7	T115	P113-T115 PolarHBondContact O-N 3.44Å
114	Y	74.4	Confident	65.9	Low	48 Å²	48	61.4 Å²	61.4	19%	0.188	32%	0.318	C	S	.	.			trans	-70	100.7	178	175.6	-104.2	0	0	0	109	R51 Q112 H116 Y217 V218 D219 G237 V239	R51-Y114 HydrophobicContact CG-CD2 4.33Å; Q112-Y114 PolarHBondContact O-N 3.36Å; Y114-H116 HydrophobicContact CE1-CB 4.08Å; Y114-H116 PolarHBondContact O-N 2.78Å; Y114-Y217 WeakPolarHBondContact CD1-OH 3.33Å; Y114-V218 HydrophobicContact CD1-CG1 4.26Å; Y114-V218 HydrophobicContact CG-CG1 4.3Å; Y114-D219 WeakPolarHBondContact CB-OD2 3.46Å; Y114-D219 PolarHBondContact N-OD2 3.47Å; Y114-G237 WeakPolarHBondContact CE1-O 3.5Å; Y114-V239 HydrophobicContact CD1-CB 4.48Å; Y114-V239 HydrophobicContact CD1-CG2 4.2Å; Y114-V239 HydrophobicContact CD2-CG2 4.4Å; Y114-V239 HydrophobicContact CE1-CB 4.33Å; Y114-V239 HydrophobicContact CE1-CG2 3.68Å; Y114-V239 HydrophobicContact CE2-CG2 3.89Å
115	T	62.5	Low	63	Low	101 Å²	101	66.8 Å²	66.8	62%	0.62	35%	0.347	S	S	*	.			trans	-82.8	111.3	169.7	53	0	0	0	0	108.3	P113 D117	P113-T115 PolarHBondContact O-N 3.44Å; T115-D117 PolarHBondContact O-N 3.4Å
116	H	56.6	Low	60.3	Low	48 Å²	48	67.3 Å²	67.3	22%	0.222	35%	0.35	C	S	.	.			trans	-70.2	116.9	166.4	-179.7	-108.8	0	0	0	108.1	Y114 S118 G237	Y114-H116 HydrophobicContact CE1-CB 4.08Å; Y114-H116 PolarHBondContact O-N 2.78Å; H116-S118 VanDerWaalsContact ND1-CA 3.33Å; H116-S118 WeakPolarHBondContact ND1-CA 3.34Å; H116-S118 PolarHBondContact ND1-N 3.14Å; H116-S118 PolarHBondContact ND1-OG 3.34Å; H116-S118 VanDerWaalsContact ND1-OG 3.12Å; H116-S118 PolarHBondContact O-N 3.17Å; H116-S118 PolarHBondContact O-OG 2.95Å; H116-G237 WeakPolarHBondContact CD2-CA 3.32Å; H116-G237 WeakPolarHBondContact NE2-CA 3.4Å
117	D	49	Very low	57.8	Low	65 Å²	65	66 Å²	66	35%	0.348	35%	0.345	S	S	.	.			trans	-62.5	75.4	164.1	-75.9	-6	0	0	0	108	T115 A119 K122	T115-D117 PolarHBondContact O-N 3.4Å; D117-A119 PolarHBondContact O-N 3.29Å; D117-K122 IonicContact OD2-NZ 2.84Å; D117-K122 PolarHBondContact OD2-NZ 3Å
118	S	39.9	Very low	55.2	Low	35 Å²	35	71.7 Å²	71.7	25%	0.245	37%	0.374	C	S	.	.			trans	-57.7	132.3	177.2	-54.1	0	0	0	0	106.8	H116 L120 Q121 K122	H116-S118 VanDerWaalsContact ND1-CA 3.33Å; H116-S118 WeakPolarHBondContact ND1-CA 3.34Å; H116-S118 PolarHBondContact ND1-N 3.14Å; H116-S118 PolarHBondContact ND1-OG 3.34Å; H116-S118 VanDerWaalsContact ND1-OG 3.12Å; H116-S118 PolarHBondContact O-N 3.17Å; H116-S118 PolarHBondContact O-OG 2.95Å; S118-L120 PolarHBondContact O-N 3.04Å; S118-Q121 PolarHBondContact O-N 3.19Å; S118-K122 PolarHBondContact O-N 2.98Å
119	A	37.3	Very low	52.7	Low	37 Å²	37	76.1 Å²	76.1	31%	0.306	40%	0.403	S	S	.	.	H	α-helix	trans	-47.5	-31.3	169.2	0	0	0	0	0	110.6	D117 Q121 K122 F123	D117-A119 PolarHBondContact O-N 3.29Å; A119-Q121 PolarHBondContact O-N 3.21Å; A119-K122 PolarHBondContact O-N 2.85Å; A119-F123 HydrophobicContact CB-CE2 4.34Å; A119-F123 WeakPolarHBondContact O-CD2 3.36Å; A119-F123 VanDerWaalsContact O-CE2 3.26Å; A119-F123 WeakPolarHBondContact O-CE2 3.23Å; A119-F123 WeakPolarHBondContact O-CG 3.35Å; A119-F123 PolarHBondContact O-N 2.78Å
120	L	36.1	Very low	50.4	Low	96 Å²	96	79.6 Å²	79.6	50%	0.503	42%	0.42	S	S	.	.	H	α-helix	trans	-53.4	-37.1	169.9	-86	158.4	0	0	0	116.2	S118 Q464	S118-L120 PolarHBondContact O-N 3.04Å; L120-Q464 VanDerWaalsContact CD2-CD 3.48Å; L120-Q464 HydrophobicContact CD2-CG 3.97Å
121	Q	35.3	Very low	48	Very low	145 Å²	145	81.5 Å²	81.5	68%	0.678	43%	0.431	S	S	*	.	H	α-helix	trans	-91.7	-30.7	-178.3	-156.7	160.6	-7.9	0	0	111.5	S118 A119 F123 H124	S118-Q121 PolarHBondContact O-N 3.19Å; A119-Q121 PolarHBondContact O-N 3.21Å; Q121-F123 VanDerWaalsContact C-N 3.26Å; Q121-F123 PolarHBondContact O-N 3.03Å; Q121-H124 PolarHBondContact O-N 3.24Å
122	K	36.8	Very low	46	Very low	68 Å²	68	86.2 Å²	86.2	30%	0.296	46%	0.459	S	S	.	.	H	α-helix	trans	-73.2	-8.7	168.8	-87.7	-179.8	-176.9	155.9	0	114.7	D117 S118 A119 H124 D125 L126	D117-K122 IonicContact OD2-NZ 2.84Å; D117-K122 PolarHBondContact OD2-NZ 3Å; S118-K122 PolarHBondContact O-N 2.98Å; A119-K122 PolarHBondContact O-N 2.85Å; K122-H124 PolarHBondContact O-N 2.95Å; K122-D125 HydrophobicContact CG-CB 4.41Å; K122-D125 CarbonylContact O-C 3.53Å; K122-D125 WeakPolarHBondContact O-CA 3.47Å; K122-D125 PolarHBondContact O-N 2.96Å; K122-L126 PolarHBondContact O-N 3.19Å
123	F	44.1	Very low	44	Very low	11 Å²	11	87.4 Å²	87.4	5%	0.048	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.9	165.9	-74.1	-69.4	0	0	0	112.1	A119 Q121 L126 L446 F466	A119-F123 HydrophobicContact CB-CE2 4.34Å; A119-F123 WeakPolarHBondContact O-CD2 3.36Å; A119-F123 VanDerWaalsContact O-CE2 3.26Å; A119-F123 WeakPolarHBondContact O-CE2 3.23Å; A119-F123 WeakPolarHBondContact O-CG 3.35Å; A119-F123 PolarHBondContact O-N 2.78Å; Q121-F123 VanDerWaalsContact C-N 3.26Å; Q121-F123 PolarHBondContact O-N 3.03Å; F123-L126 HydrophobicContact CB-CD1 4.31Å; F123-L126 HydrophobicContact CD1-CD1 4.08Å; F123-L126 HydrophobicContact CD1-CD2 4.35Å; F123-L126 WeakPolarHBondContact O-CD1 3.4Å; F123-L126 WeakPolarHBondContact O-CG 3.29Å; F123-L446 HydrophobicContact CE1-CB 4.31Å; F123-L446 HydrophobicContact CE1-CD1 3.71Å; F123-F466 HydrophobicContact CD1-CZ 4.04Å; F123-F466 HydrophobicContact CE1-CE1 4.34Å; F123-F466 AromaticContact CE1-CE2 3.73Å; F123-F466 HydrophobicContact CE1-CE2 3.73Å; F123-F466 AromaticContact CE1-CZ 3.36Å; F123-F466 HydrophobicContact CE1-CZ 3.36Å; F123-F466 HydrophobicContact CE2-CE2 4.31Å; F123-F466 HydrophobicContact CE2-CZ 4.32Å; F123-F466 AromaticContact CZ-CE2 3.48Å; F123-F466 HydrophobicContact CZ-CE2 3.48Å; F123-F466 VanDerWaalsContact CZ-CE2 3.48Å; F123-F466 AromaticContact CZ-CZ 3.56Å; F123-F466 HydrophobicContact CZ-CZ 3.56Å
124	H	33.6	Very low	42.6	Very low	165 Å²	165	90.9 Å²	90.9	76%	0.764	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-14.2	167.8	-95.6	-53	0	0	0	113.8	Q121 K122 L126	Q121-H124 PolarHBondContact O-N 3.24Å; K122-H124 PolarHBondContact O-N 2.95Å; H124-L126 VanDerWaalsContact C-N 3.33Å
125	D	34.3	Very low	41	Very low	113 Å²	113	92.5 Å²	92.5	60%	0.604	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	28.3	170.4	-68.6	-26.5	0	0	0	111.3	K122	K122-D125 HydrophobicContact CG-CB 4.41Å; K122-D125 CarbonylContact O-C 3.53Å; K122-D125 WeakPolarHBondContact O-CA 3.47Å; K122-D125 PolarHBondContact O-N 2.96Å
126	L	38.5	Very low	40.3	Very low	19 Å²	19	93.5 Å²	93.5	10%	0.099	52%	0.52	C	S	.	.	S	Bend	trans	-66.9	141.4	162.9	-64.9	162.5	0	0	0	107.5	K122 F123 H124 I128 S445 E447	K122-L126 PolarHBondContact O-N 3.19Å; F123-L126 HydrophobicContact CB-CD1 4.31Å; F123-L126 HydrophobicContact CD1-CD1 4.08Å; F123-L126 HydrophobicContact CD1-CD2 4.35Å; F123-L126 WeakPolarHBondContact O-CD1 3.4Å; F123-L126 WeakPolarHBondContact O-CG 3.29Å; H124-L126 VanDerWaalsContact C-N 3.33Å; L126-I128 PolarHBondContact O-N 3.14Å; L126-S445 WeakPolarHBondContact CD1-OG 3.37Å; L126-E447 HydrophobicContact CD1-CB 4.49Å; L126-E447 HydrophobicContact CD1-CG 3.67Å
127	C	40.1	Very low	40.1	Very low	35 Å²	35	98.9 Å²	98.9	24%	0.236	55%	0.545	C	S	.	.			trans	-37.4	100.9	-171	-118.5	0	0	0	0	114	P129 C425	C127-P129 WeakPolarHBondContact O-CD 3.32Å; C127-C425 HydrophobicContact CB-CB 4.26Å; C127-C425 WeakPolarHBondContact CB-SG 3.49Å; C127-C425 WeakPolarHBondContact SG-CA 3.3Å; C127-C425 WeakPolarHBondContact SG-CB 3.49Å; C127-C425 CovalentContact SG-SG 2Å; C127-C425 PolarHBondContact SG-SG 2.65Å
128	I	37.5	Very low	40.6	Very low	120 Å²	120	100.6 Å²	100.6	62%	0.615	56%	0.562	S	S	*	*			trans	-81.7	119.5	164.6	-54.5	176.6	0	0	0	104.6	L126 H130	L126-I128 PolarHBondContact O-N 3.14Å; I128-H130 VanDerWaalsContact C-N 3.3Å; I128-H130 PolarHBondContact O-N 3.47Å
129	P	36.1	Very low	42.2	Very low	93 Å²	93	101.2 Å²	101.2	60%	0.604	57%	0.566	S	S	*	*			trans	-64.2	94.3	176.6	25.7	-31.8	0	0	0	108.5	C127	C127-P129 WeakPolarHBondContact O-CD 3.32Å
130	H	41.8	Very low	44.2	Very low	165 Å²	165	101 Å²	101	76%	0.764	57%	0.568	S	S	*	*			trans	-83.9	120.3	172.3	-121.4	-71.2	0	0	0	108.4	I128 T132	I128-H130 VanDerWaalsContact C-N 3.3Å; I128-H130 PolarHBondContact O-N 3.47Å; H130-T132 PolarHBondContact O-N 3.2Å
131	N	35.9	Very low	46.2	Very low	151 Å²	151	107.8 Å²	107.8	81%	0.807	59%	0.587	S	S	*	*			trans	-55.2	127.1	172.5	-82	-14.9	0	0	0	109.6	T133	N131-T133 PolarHBondContact O-N 3Å; N131-T133 VanDerWaalsContact O-N 3.15Å
132	T	42.2	Very low	48.2	Very low	119 Å²	119	106.4 Å²	106.4	73%	0.73	58%	0.58	S	S	*	*			trans	-61.6	107.9	-177.7	37.4	0	0	0	0	111.9	H130	H130-T132 PolarHBondContact O-N 3.2Å
133	T	37.4	Very low	50.1	Low	127 Å²	127	105.8 Å²	105.8	78%	0.779	58%	0.58	S	S	*	*			trans	-115.7	108.7	146.6	47	0	0	0	0	107.9	N131 S135	N131-T133 PolarHBondContact O-N 3Å; N131-T133 VanDerWaalsContact O-N 3.15Å; T133-S135 VanDerWaalsContact C-N 3.33Å; T133-S135 PolarHBondContact O-N 3.09Å
134	T	45.4	Very low	51.9	Low	148 Å²	148	108.6 Å²	108.6	91%	0.908	60%	0.598	S	S	*	*			trans	-64.4	86.2	172.5	28.2	0	0	0	0	110.4
135	S	40.8	Very low	54.1	Low	82 Å²	82	107.6 Å²	107.6	57%	0.573	59%	0.588	S	S	*	*			trans	-87.9	143.2	152.9	57.1	0	0	0	0	108.6	T133 E137	T133-S135 VanDerWaalsContact C-N 3.33Å; T133-S135 PolarHBondContact O-N 3.09Å; S135-E137 PolarHBondContact O-N 3.01Å
136	P	47.3	Very low	56.3	Low	121 Å²	121	106.1 Å²	106.1	79%	0.786	57%	0.574	S	S	*	*			trans	-52.3	132.4	168.1	24.1	-31.9	0	0	0	107.9	S138	P136-S138 VanDerWaalsContact C-N 3.31Å; P136-S138 PolarHBondContact O-N 3.37Å
137	E	53.5	Low	58.4	Low	161 Å²	161	106.4 Å²	106.4	75%	0.752	58%	0.575	S	S	*	*			trans	-47.9	90.7	-175.3	-77.4	-170.9	142.2	0	0	110.5	S135 C139 K426	S135-E137 PolarHBondContact O-N 3.01Å; E137-C139 PolarHBondContact O-N 3.02Å; E137-C139 VanDerWaalsContact O-N 3.16Å; E137-K426 IonicContact OE1-NZ 3.81Å; E137-K426 PolarHBondContact OE1-NZ 3.1Å
138	S	57.8	Low	60.5	Low	101 Å²	101	107.5 Å²	107.5	71%	0.706	59%	0.587	S	S	*	*			trans	-74.3	112	176.1	64.5	0	0	0	0	106.2	P136 G140	P136-S138 VanDerWaalsContact C-N 3.31Å; P136-S138 PolarHBondContact O-N 3.37Å; S138-G140 PolarHBondContact O-N 3.45Å; S138-G140 VanDerWaalsContact O-N 3.12Å
139	C	75.1	Confident	62.8	Low	48 Å²	48	104.4 Å²	104.4	32%	0.324	57%	0.572	S	S	.	*			trans	-49.6	120.9	175	-177.4	0	0	0	0	109.3	E137 T144 C564	E137-C139 PolarHBondContact O-N 3.02Å; E137-C139 VanDerWaalsContact O-N 3.16Å; C139-T144 PolarHBondContact SG-N 3.04Å; C139-T144 VanDerWaalsContact SG-N 3.4Å; C139-T144 PolarHBondContact SG-OG1 3.5Å; C139-C564 WeakPolarHBondContact CA-SG 3.19Å; C139-C564 HydrophobicContact CB-CB 3.64Å; C139-C564 WeakPolarHBondContact CB-SG 3Å; C139-C564 WeakPolarHBondContact SG-CB 3.44Å; C139-C564 CovalentContact SG-SG 1.99Å; C139-C564 PolarHBondContact SG-SG 2.85Å
140	G	79.4	Confident	65.3	Low	34 Å²	34	101.1 Å²	101.1	35%	0.351	55%	0.55	S	S	.	*			trans	-56.7	150.8	178.7	0	0	0	0	0	110.8	S138 E142 D143 T144	S138-G140 PolarHBondContact O-N 3.45Å; S138-G140 VanDerWaalsContact O-N 3.12Å; G140-E142 PolarHBondContact O-N 3.4Å; G140-D143 PolarHBondContact O-N 2.88Å; G140-D143 VanDerWaalsContact O-N 3.15Å; G140-T144 PolarHBondContact O-N 3.43Å; G140-T144 PolarHBondContact O-OG1 3.02Å
141	R	77.8	Confident	67.6	Low	237 Å²	237	96.4 Å²	96.4	89%	0.894	53%	0.533	S	S	*	.	H	α-helix	trans	-57.1	-35.2	179.5	-170.5	175.7	-178	175.4	0.7	112	R145	R141-R145 WeakPolarHBondContact O-CB 3.35Å; R141-R145 PolarHBondContact O-N 2.89Å; R141-R145 VanDerWaalsContact O-N 3.12Å
142	E	76.1	Confident	70.2	Confident	116 Å²	116	93.5 Å²	93.5	54%	0.542	52%	0.517	S	S	.	.	H	α-helix	trans	-72	-42.4	177.1	-168.6	171.7	159.8	0	0	112.6	G140 R145 R146	G140-E142 PolarHBondContact O-N 3.4Å; E142-R145 WeakPolarHBondContact O-CB 3.36Å; E142-R145 PolarHBondContact O-N 2.83Å; E142-R146 WeakPolarHBondContact O-CG 3.48Å; E142-R146 PolarHBondContact O-N 3.29Å; E142-R146 IonicContact OE1-CZ 3.66Å; E142-R146 IonicContact OE1-NE 3.78Å; E142-R146 IonicContact OE1-NH2 3.9Å; E142-R146 PolarHBondContact OE1-NH2 3.4Å
143	D	77.3	Confident	72.6	Confident	56 Å²	56	88 Å²	88	30%	0.299	48%	0.483	S	S	.	.	H	α-helix	trans	-69	-35.9	177.3	-74.1	-29.6	0	0	0	112.5	G140 R145 R146 L147 V563 C564	G140-D143 PolarHBondContact O-N 2.88Å; G140-D143 VanDerWaalsContact O-N 3.15Å; D143-R145 VanDerWaalsContact C-N 3.3Å; D143-R145 PolarHBondContact O-N 3.32Å; D143-R146 PolarHBondContact O-N 3.4Å; D143-R146 IonicContact OD1-NH1 3.69Å; D143-L147 PolarHBondContact O-N 3.19Å; D143-V563 HydrophobicContact CB-CG1 3.57Å; D143-C564 WeakPolarHBondContact CB-SG 3.35Å
144	T	81.4	Confident	75.3	Confident	69 Å²	69	86.2 Å²	86.2	42%	0.423	46%	0.462	S	S	.	.	H	α-helix	trans	-61.3	-43.2	171.8	-51.7	0	0	0	0	110.4	C139 G140 L147 A148	C139-T144 PolarHBondContact SG-N 3.04Å; C139-T144 VanDerWaalsContact SG-N 3.4Å; C139-T144 PolarHBondContact SG-OG1 3.5Å; G140-T144 PolarHBondContact O-N 3.43Å; G140-T144 PolarHBondContact O-OG1 3.02Å; T144-L147 WeakPolarHBondContact O-CB 3.44Å; T144-L147 PolarHBondContact O-N 3.4Å; T144-A148 PolarHBondContact O-N 3.27Å
145	R	80.8	Confident	77.6	Confident	145 Å²	145	83.2 Å²	83.2	55%	0.547	44%	0.44	S	S	.	.	H	α-helix	trans	-64.4	-42.9	176.3	-172.6	178.5	-177.8	168.6	3.9	111.7	R141 E142 D143 L147 A148 D149	R141-R145 WeakPolarHBondContact O-CB 3.35Å; R141-R145 PolarHBondContact O-N 2.89Å; R141-R145 VanDerWaalsContact O-N 3.12Å; E142-R145 WeakPolarHBondContact O-CB 3.36Å; E142-R145 PolarHBondContact O-N 2.83Å; D143-R145 VanDerWaalsContact C-N 3.3Å; D143-R145 PolarHBondContact O-N 3.32Å; R145-L147 VanDerWaalsContact C-N 3.31Å; R145-L147 PolarHBondContact O-N 2.83Å; R145-A148 PolarHBondContact O-N 3.41Å; R145-A148 VanDerWaalsContact O-N 3.14Å; R145-D149 WeakPolarHBondContact O-CB 3.47Å; R145-D149 VanDerWaalsContact O-CG 3.28Å; R145-D149 PolarHBondContact O-N 3.08Å
146	R	79.6	Confident	80.2	Confident	82 Å²	82	80.8 Å²	80.8	31%	0.309	42%	0.42	S	S	.	.	H	α-helix	trans	-58.7	-40.5	174.1	-72	173.2	-178	178.3	-0.9	112.1	E142 D143 D149 T150	E142-R146 WeakPolarHBondContact O-CG 3.48Å; E142-R146 PolarHBondContact O-N 3.29Å; E142-R146 IonicContact OE1-CZ 3.66Å; E142-R146 IonicContact OE1-NE 3.78Å; E142-R146 IonicContact OE1-NH2 3.9Å; E142-R146 PolarHBondContact OE1-NH2 3.4Å; D143-R146 PolarHBondContact O-N 3.4Å; D143-R146 IonicContact OD1-NH1 3.69Å; R146-D149 PolarHBondContact O-N 3.02Å; R146-T150 WeakPolarHBondContact O-CB 3.33Å; R146-T150 PolarHBondContact O-N 3.3Å; R146-T150 PolarHBondContact O-OG1 3.31Å; R146-T150 VanDerWaalsContact O-OG1 3.12Å
147	L	83.1	Confident	82.5	Confident	24 Å²	24	75.1 Å²	75.1	13%	0.126	38%	0.383	C	S	.	.	H	α-helix	trans	-60.2	-47.1	172.8	-112	78.1	0	0	0	112.5	D143 T144 R145 T151 V563 C564 R566 F568	D143-L147 PolarHBondContact O-N 3.19Å; T144-L147 WeakPolarHBondContact O-CB 3.44Å; T144-L147 PolarHBondContact O-N 3.4Å; R145-L147 VanDerWaalsContact C-N 3.31Å; R145-L147 PolarHBondContact O-N 2.83Å; L147-T151 WeakPolarHBondContact O-CB 3.35Å; L147-T151 PolarHBondContact O-N 3.2Å; L147-T151 PolarHBondContact O-OG1 3.04Å; L147-V563 HydrophobicContact CD1-CB 3.86Å; L147-V563 HydrophobicContact CD1-CG1 3.62Å; L147-V563 WeakPolarHBondContact CD1-O 3.48Å; L147-C564 HydrophobicContact CD1-CB 4.39Å; L147-R566 HydrophobicContact CD2-CG 4.1Å; L147-F568 HydrophobicContact CD1-CE2 3.48Å; L147-F568 VanDerWaalsContact CD1-CE2 3.48Å; L147-F568 HydrophobicContact CD1-CZ 3.62Å; L147-F568 HydrophobicContact CG-CE2 4.17Å; L147-F568 HydrophobicContact CG-CZ 4.19Å
148	A	84.8	Confident	84.6	Confident	59 Å²	59	67.9 Å²	67.9	49%	0.488	35%	0.351	S	S	.	.	H	α-helix	trans	-63.2	-44.2	178.6	0	0	0	0	0	111.1	T144 R145 T151 L152	T144-A148 PolarHBondContact O-N 3.27Å; R145-A148 PolarHBondContact O-N 3.41Å; R145-A148 VanDerWaalsContact O-N 3.14Å; A148-T151 PolarHBondContact O-N 3.03Å; A148-L152 WeakPolarHBondContact O-CB 3.47Å; A148-L152 PolarHBondContact O-N 3.21Å
149	D	85.8	Confident	86.4	Confident	55 Å²	55	67.4 Å²	67.4	29%	0.294	34%	0.339	S	S	.	.	H	α-helix	trans	-62.6	-47.5	178.3	-70.4	-14.6	0	0	0	111.1	R145 R146 T151 L152 V153	R145-D149 WeakPolarHBondContact O-CB 3.47Å; R145-D149 VanDerWaalsContact O-CG 3.28Å; R145-D149 PolarHBondContact O-N 3.08Å; R146-D149 PolarHBondContact O-N 3.02Å; D149-T151 VanDerWaalsContact C-N 3.29Å; D149-T151 PolarHBondContact O-N 3.25Å; D149-L152 PolarHBondContact O-N 3.46Å; D149-V153 WeakPolarHBondContact O-CB 3.47Å; D149-V153 VanDerWaalsContact O-CG2 3.22Å; D149-V153 WeakPolarHBondContact O-CG2 3.33Å; D149-V153 PolarHBondContact O-N 3Å
150	T	88	Confident	87.5	Confident	24 Å²	24	65.1 Å²	65.1	15%	0.147	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-40.4	175.8	-64	0	0	0	0	111.9	Y52 L54 R146 W154 F568	Y52-T150 WeakPolarHBondContact O-CG2 3.38Å; Y52-T150 PolarHBondContact O-OG1 3.4Å; L54-T150 HydrophobicContact CD2-CG2 3.72Å; R146-T150 WeakPolarHBondContact O-CB 3.33Å; R146-T150 PolarHBondContact O-N 3.3Å; R146-T150 PolarHBondContact O-OG1 3.31Å; R146-T150 VanDerWaalsContact O-OG1 3.12Å; T150-W154 WeakPolarHBondContact O-CB 3.46Å; T150-W154 PolarHBondContact O-N 3.07Å; T150-F568 HydrophobicContact CG2-CE1 4.28Å; T150-F568 WeakPolarHBondContact OG1-CE1 3.46Å
151	T	89.6	Confident	88.3	Confident	65 Å²	65	63.5 Å²	63.5	40%	0.399	31%	0.307	S	S	.	.	H	α-helix	trans	-66.5	-44.1	177.8	-52.8	0	0	0	0	111.3	L147 A148 D149 W154 I155	L147-T151 WeakPolarHBondContact O-CB 3.35Å; L147-T151 PolarHBondContact O-N 3.2Å; L147-T151 PolarHBondContact O-OG1 3.04Å; A148-T151 PolarHBondContact O-N 3.03Å; D149-T151 VanDerWaalsContact C-N 3.29Å; D149-T151 PolarHBondContact O-N 3.25Å; T151-W154 WeakPolarHBondContact O-CB 3.37Å; T151-W154 PolarHBondContact O-N 3.29Å; T151-I155 HydrophobicContact CG2-CD1 4.12Å; T151-I155 WeakPolarHBondContact O-CG1 3.22Å; T151-I155 PolarHBondContact O-N 3.09Å
152	L	90.9	Very high	89.2	Confident	90 Å²	90	55.1 Å²	55.1	47%	0.471	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-45.3	177.4	-178.7	150.3	0	0	0	111.4	A148 D149 W154 I155 L156	A148-L152 WeakPolarHBondContact O-CB 3.47Å; A148-L152 PolarHBondContact O-N 3.21Å; D149-L152 PolarHBondContact O-N 3.46Å; L152-W154 VanDerWaalsContact C-N 3.31Å; L152-W154 PolarHBondContact O-N 3.34Å; L152-I155 PolarHBondContact O-N 3.05Å; L152-L156 WeakPolarHBondContact O-CB 3.42Å; L152-L156 PolarHBondContact O-N 3.32Å
153	V	92.3	Very high	90.2	Very high	4 Å²	4	52 Å²	52	2%	0.024	27%	0.267	C	S	.	.	H	α-helix	trans	-59.9	-43.9	176.9	171	0	0	0	0	110.6	Y52 P107 D149 L156 M157	Y52-V153 HydrophobicContact CD1-CB 4.41Å; Y52-V153 HydrophobicContact CD1-CG1 4.14Å; Y52-V153 HydrophobicContact CD1-CG2 3.89Å; Y52-V153 HydrophobicContact CD2-CG1 3.82Å; Y52-V153 HydrophobicContact CE1-CG1 4.32Å; Y52-V153 HydrophobicContact CE1-CG2 3.81Å; Y52-V153 HydrophobicContact CE2-CG1 3.99Å; Y52-V153 HydrophobicContact CG-CG1 3.88Å; Y52-V153 HydrophobicContact CG-CG2 4.46Å; P107-V153 HydrophobicContact CB-CG1 4.01Å; P107-V153 HydrophobicContact CB-CG2 4.09Å; P107-V153 HydrophobicContact CG-CG1 4.35Å; D149-V153 WeakPolarHBondContact O-CB 3.47Å; D149-V153 VanDerWaalsContact O-CG2 3.22Å; D149-V153 WeakPolarHBondContact O-CG2 3.33Å; D149-V153 PolarHBondContact O-N 3Å; V153-L156 PolarHBondContact O-N 3.36Å; V153-M157 HydrophobicContact CG1-CG 4.3Å; V153-M157 HydrophobicContact CG1-SD 3.88Å; V153-M157 WeakPolarHBondContact O-CB 3.5Å; V153-M157 VanDerWaalsContact O-CG 3.23Å; V153-M157 WeakPolarHBondContact O-CG 3.43Å; V153-M157 PolarHBondContact O-N 3.45Å
154	W	93.8	Very high	91.2	Very high	90 Å²	90	49.6 Å²	49.6	34%	0.341	25%	0.253	S	S	.	.	H	α-helix	trans	-58.8	-49.9	177.5	-171	95	0	0	0	112.2	S58 I62 T150 T151 L152 L156 M157 A158	S58-W154 PolarHBondContact OG-NE1 3.45Å; I62-W154 VanDerWaalsContact CD1-CD1 3.43Å; I62-W154 HydrophobicContact CD1-CG 4.12Å; T150-W154 WeakPolarHBondContact O-CB 3.46Å; T150-W154 PolarHBondContact O-N 3.07Å; T151-W154 WeakPolarHBondContact O-CB 3.37Å; T151-W154 PolarHBondContact O-N 3.29Å; L152-W154 VanDerWaalsContact C-N 3.31Å; L152-W154 PolarHBondContact O-N 3.34Å; W154-L156 VanDerWaalsContact C-N 3.35Å; W154-L156 PolarHBondContact O-N 3.01Å; W154-M157 PolarHBondContact O-N 3.46Å; W154-A158 HydrophobicContact CE3-CB 4.28Å; W154-A158 HydrophobicContact CH2-CB 4.39Å; W154-A158 HydrophobicContact CZ3-CB 4.08Å; W154-A158 WeakPolarHBondContact O-CB 3.32Å; W154-A158 PolarHBondContact O-N 3.49Å
155	I	95.1	Very high	91.8	Very high	85 Å²	85	46.3 Å²	46.3	44%	0.436	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-44.7	-179.7	-67.3	168.7	0	0	0	110.5	T151 L152 M157 A158 I159	T151-I155 HydrophobicContact CG2-CD1 4.12Å; T151-I155 WeakPolarHBondContact O-CG1 3.22Å; T151-I155 PolarHBondContact O-N 3.09Å; L152-I155 PolarHBondContact O-N 3.05Å; I155-M157 PolarHBondContact O-N 2.63Å; I155-A158 WeakPolarHBondContact O-CB 3.49Å; I155-A158 PolarHBondContact O-N 3.48Å; I155-I159 HydrophobicContact CG2-CD1 3.86Å; I155-I159 HydrophobicContact CG2-CG1 4.49Å; I155-I159 WeakPolarHBondContact O-CG1 3.16Å; I155-I159 PolarHBondContact O-N 3.16Å
156	L	95.1	Very high	92.6	Very high	31 Å²	31	42 Å²	42	16%	0.162	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-44.1	-179.2	-163	100.4	0	0	0	111.8	L103 L106 P107 L152 V153 W154 A158 I159 A160	L103-L156 HydrophobicContact CD1-CD1 4.19Å; L103-L156 HydrophobicContact CD1-CD2 4.39Å; L103-L156 HydrophobicContact CD1-CG 4.31Å; L103-L156 HydrophobicContact CG-CG 4.5Å; L103-L156 WeakPolarHBondContact O-CD2 3.29Å; L106-L156 HydrophobicContact CB-CD2 3.9Å; L106-L156 HydrophobicContact CD2-CD1 4.15Å; L106-L156 HydrophobicContact CD2-CD2 4.12Å; L106-L156 HydrophobicContact CG-CD2 4.3Å; P107-L156 HydrophobicContact CG-CD2 3.45Å; P107-L156 VanDerWaalsContact CG-CD2 3.45Å; L152-L156 WeakPolarHBondContact O-CB 3.42Å; L152-L156 PolarHBondContact O-N 3.32Å; V153-L156 PolarHBondContact O-N 3.36Å; W154-L156 VanDerWaalsContact C-N 3.35Å; W154-L156 PolarHBondContact O-N 3.01Å; L156-A158 VanDerWaalsContact C-N 3.32Å; L156-A158 PolarHBondContact O-N 3.38Å; L156-I159 PolarHBondContact O-N 3.33Å; L156-A160 WeakPolarHBondContact O-CB 3.19Å; L156-A160 PolarHBondContact O-N 2.91Å
157	M	95.6	Very high	93.3	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-37.7	175.8	-68.7	-176.7	79.8	0	0	111.9	F41 I48 I62 L104 P107 V153 W154 I155 A160 Q161	F41-M157 HydrophobicContact CE2-CE 3.58Å; F41-M157 HydrophobicContact CZ-CE 3.67Å; I48-M157 HydrophobicContact CD1-CE 3.83Å; I48-M157 HydrophobicContact CG2-CE 3.86Å; I48-M157 HydrophobicContact CG2-SD 3.94Å; I62-M157 HydrophobicContact CD1-CB 4.33Å; I62-M157 HydrophobicContact CD1-SD 4.48Å; I62-M157 HydrophobicContact CG2-CB 3.96Å; I62-M157 HydrophobicContact CG2-CE 4.31Å; L104-M157 HydrophobicContact CD1-CB 4.04Å; L104-M157 HydrophobicContact CD1-CE 3.99Å; L104-M157 HydrophobicContact CD1-CG 3.98Å; P107-M157 HydrophobicContact CG-CG 4.22Å; V153-M157 HydrophobicContact CG1-CG 4.3Å; V153-M157 HydrophobicContact CG1-SD 3.88Å; V153-M157 WeakPolarHBondContact O-CB 3.5Å; V153-M157 VanDerWaalsContact O-CG 3.23Å; V153-M157 WeakPolarHBondContact O-CG 3.43Å; V153-M157 PolarHBondContact O-N 3.45Å; W154-M157 PolarHBondContact O-N 3.46Å; I155-M157 PolarHBondContact O-N 2.63Å; M157-A160 PolarHBondContact O-N 2.82Å; M157-Q161 VanDerWaalsContact O-CG 3.29Å; M157-Q161 WeakPolarHBondContact O-CG 3.25Å; M157-Q161 PolarHBondContact O-N 3.4Å
158	A	96.7	Very high	93.8	Very high	8 Å²	8	37.3 Å²	37.3	7%	0.066	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-46.8	175.6	0	0	0	0	0	111.8	L65 W154 I155 L156 A160 Q161 L162	L65-A158 HydrophobicContact CD1-CB 3.41Å; L65-A158 VanDerWaalsContact CD1-CB 3.41Å; W154-A158 HydrophobicContact CE3-CB 4.28Å; W154-A158 HydrophobicContact CH2-CB 4.39Å; W154-A158 HydrophobicContact CZ3-CB 4.08Å; W154-A158 WeakPolarHBondContact O-CB 3.32Å; W154-A158 PolarHBondContact O-N 3.49Å; I155-A158 WeakPolarHBondContact O-CB 3.49Å; I155-A158 PolarHBondContact O-N 3.48Å; L156-A158 VanDerWaalsContact C-N 3.32Å; L156-A158 PolarHBondContact O-N 3.38Å; A158-A160 PolarHBondContact O-N 2.9Å; A158-Q161 PolarHBondContact O-N 2.86Å; A158-L162 WeakPolarHBondContact O-CG 3.14Å; A158-L162 PolarHBondContact O-N 2.83Å
159	I	97	Very high	94.2	Very high	91 Å²	91	34.6 Å²	34.6	47%	0.467	18%	0.182	S	C	.	.	H	α-helix	trans	-60.8	-45.1	175.9	-67.5	167.3	0	0	0	110.6	L103 I155 L156 Q161 L162 L163	L103-I159 HydrophobicContact CD2-CG2 4.11Å; I155-I159 HydrophobicContact CG2-CD1 3.86Å; I155-I159 HydrophobicContact CG2-CG1 4.49Å; I155-I159 WeakPolarHBondContact O-CG1 3.16Å; I155-I159 PolarHBondContact O-N 3.16Å; L156-I159 PolarHBondContact O-N 3.33Å; I159-Q161 VanDerWaalsContact C-N 3.35Å; I159-Q161 PolarHBondContact O-N 3.42Å; I159-L162 PolarHBondContact O-N 3.04Å; I159-L163 WeakPolarHBondContact O-CB 3.34Å; I159-L163 PolarHBondContact O-N 3.34Å
160	A	97.3	Very high	94.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.4	-43.5	177.4	0	0	0	0	0	112.2	S100 L103 L104 L156 M157 A158 L163 F164	S100-A160 WeakPolarHBondContact CB-O 3.41Å; L103-A160 HydrophobicContact CB-CB 4.16Å; L103-A160 HydrophobicContact CD2-CB 4.07Å; L103-A160 HydrophobicContact CG-CB 4.09Å; L104-A160 HydrophobicContact CB-CB 4.18Å; L104-A160 HydrophobicContact CD1-CB 3.82Å; L156-A160 WeakPolarHBondContact O-CB 3.19Å; L156-A160 PolarHBondContact O-N 2.91Å; M157-A160 PolarHBondContact O-N 2.82Å; A158-A160 PolarHBondContact O-N 2.9Å; A160-L163 PolarHBondContact O-N 3.01Å; A160-F164 WeakPolarHBondContact O-CB 3.48Å; A160-F164 PolarHBondContact O-N 2.88Å
161	Q	96.8	Very high	94.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-67.7	-40.9	178.3	-69.2	-66.7	-24.9	0	0	112.4	Y37 F41 I62 L65 H66 M157 A158 I159 L163 F164 G165	Y37-Q161 PolarHBondContact OH-NE2 3.2Å; F41-Q161 VanDerWaalsContact CD1-NE2 3.26Å; F41-Q161 HydrophobicContact CE1-CG 4.4Å; I62-Q161 HydrophobicContact CG2-CG 3.93Å; I62-Q161 WeakPolarHBondContact O-CG 3.21Å; L65-Q161 HydrophobicContact CB-CB 3.88Å; H66-Q161 WeakPolarHBondContact CA-O 3.39Å; H66-Q161 WeakPolarHBondContact CB-O 3.26Å; M157-Q161 VanDerWaalsContact O-CG 3.29Å; M157-Q161 WeakPolarHBondContact O-CG 3.25Å; M157-Q161 PolarHBondContact O-N 3.4Å; A158-Q161 PolarHBondContact O-N 2.86Å; I159-Q161 VanDerWaalsContact C-N 3.35Å; I159-Q161 PolarHBondContact O-N 3.42Å; Q161-L163 VanDerWaalsContact C-N 3.33Å; Q161-L163 PolarHBondContact O-N 3.01Å; Q161-F164 PolarHBondContact O-N 2.95Å; Q161-G165 PolarHBondContact O-N 3.34Å
162	L	96.9	Very high	94.5	Very high	61 Å²	61	30.9 Å²	30.9	32%	0.319	16%	0.158	S	C	.	.	H	α-helix	trans	-60.4	-44.6	173.8	-71	170.5	0	0	0	111	L65 V68 S69 A158 I159 G165 V166	L65-L162 HydrophobicContact CB-CD2 4.32Å; L65-L162 HydrophobicContact CB-CG 4.42Å; L65-L162 HydrophobicContact CD2-CD2 4.39Å; L65-L162 WeakPolarHBondContact O-CD2 3.27Å; V68-L162 HydrophobicContact CB-CD2 4.17Å; V68-L162 HydrophobicContact CG1-CD2 4.49Å; S69-L162 VanDerWaalsContact CB-O 3.31Å; S69-L162 WeakPolarHBondContact CB-O 3.32Å; S69-L162 VanDerWaalsContact OG-CA 3.28Å; S69-L162 WeakPolarHBondContact OG-CA 3.34Å; S69-L162 WeakPolarHBondContact OG-CD2 3.08Å; S69-L162 PolarHBondContact OG-O 2.94Å; A158-L162 WeakPolarHBondContact O-CG 3.14Å; A158-L162 PolarHBondContact O-N 2.83Å; I159-L162 PolarHBondContact O-N 3.04Å; L162-G165 WeakPolarHBondContact O-CA 3.39Å; L162-G165 PolarHBondContact O-N 3.37Å; L162-G165 VanDerWaalsContact O-N 3.14Å; L162-V166 WeakPolarHBondContact O-CG2 3.38Å; L162-V166 PolarHBondContact O-N 3.42Å
163	L	97.1	Very high	94.3	Very high	51 Å²	51	28.6 Å²	28.6	27%	0.267	15%	0.148	S	C	.	.	H	α-helix	trans	-65.4	-40.7	179.6	-164.7	66.2	0	0	0	112.2	L96 V99 I159 A160 Q161 G165 V166 G167	L96-L163 HydrophobicContact CD1-CD1 3.76Å; L96-L163 HydrophobicContact CD1-CD2 4.18Å; L96-L163 HydrophobicContact CD1-CG 3.92Å; L96-L163 HydrophobicContact CD2-CD1 4.11Å; L96-L163 HydrophobicContact CD2-CG 4.47Å; L96-L163 HydrophobicContact CG-CD1 4.06Å; L96-L163 HydrophobicContact CG-CG 4Å; V99-L163 HydrophobicContact CG1-CD2 4.48Å; I159-L163 WeakPolarHBondContact O-CB 3.34Å; I159-L163 PolarHBondContact O-N 3.34Å; A160-L163 PolarHBondContact O-N 3.01Å; Q161-L163 VanDerWaalsContact C-N 3.33Å; Q161-L163 PolarHBondContact O-N 3.01Å; L163-G165 VanDerWaalsContact C-N 3.28Å; L163-G165 PolarHBondContact O-N 2.74Å; L163-V166 PolarHBondContact O-N 3.04Å; L163-G167 PolarHBondContact O-N 3.38Å; L163-G167 VanDerWaalsContact O-N 3.1Å
164	F	96.9	Very high	94.2	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.018	15%	0.149	C	C	.	.	H	α-helix	trans	-58.4	-43.2	171.1	-172.3	-88.5	0	0	0	111.3	Q34 Y37 H66 M97 S100 A160 Q161 V166 G167 S168 L253	Q34-F164 HydrophobicContact CG-CZ 4.43Å; Y37-F164 HydrophobicContact CD1-CD1 4.09Å; Y37-F164 AromaticContact CD1-CD2 3.7Å; Y37-F164 HydrophobicContact CD1-CD2 3.7Å; Y37-F164 AromaticContact CD1-CE1 3.54Å; Y37-F164 HydrophobicContact CD1-CE1 3.54Å; Y37-F164 AromaticContact CD1-CE2 3.08Å; Y37-F164 HydrophobicContact CD1-CE2 3.08Å; Y37-F164 HydrophobicContact CD1-CG 4.16Å; Y37-F164 AromaticContact CD1-CZ 2.98Å; Y37-F164 HydrophobicContact CD1-CZ 2.98Å; Y37-F164 HydrophobicContact CD2-CD2 4.37Å; Y37-F164 AromaticContact CD2-CE2 3.92Å; Y37-F164 HydrophobicContact CD2-CE2 3.92Å; Y37-F164 HydrophobicContact CE1-CB 4.45Å; Y37-F164 AromaticContact CE1-CD1 3.68Å; Y37-F164 HydrophobicContact CE1-CD1 3.68Å; Y37-F164 AromaticContact CE1-CD2 3.36Å; Y37-F164 HydrophobicContact CE1-CD2 3.36Å; Y37-F164 AromaticContact CE1-CE1 3.63Å; Y37-F164 HydrophobicContact CE1-CE1 3.63Å; Y37-F164 AromaticContact CE1-CE2 3.31Å; Y37-F164 HydrophobicContact CE1-CE2 3.31Å; Y37-F164 AromaticContact CE1-CG 3.55Å; Y37-F164 HydrophobicContact CE1-CG 3.55Å; Y37-F164 AromaticContact CE1-CZ 3.44Å; Y37-F164 HydrophobicContact CE1-CZ 3.44Å; Y37-F164 VanDerWaalsContact CE1-CZ 3.44Å; Y37-F164 HydrophobicContact CE2-CD2 4.1Å; Y37-F164 HydrophobicContact CE2-CE2 4.11Å; Y37-F164 HydrophobicContact CG-CD2 4.16Å; Y37-F164 AromaticContact CG-CE2 3.39Å; Y37-F164 HydrophobicContact CG-CE2 3.39Å; Y37-F164 AromaticContact CG-CZ 3.61Å; Y37-F164 HydrophobicContact CG-CZ 3.61Å; Y37-F164 AromaticContact CZ-CD2 3.55Å; Y37-F164 AromaticContact CZ-CE2 3.8Å; Y37-F164 AromaticContact CZ-CG 3.95Å; H66-F164 HydrophobicContact CB-CD1 4.24Å; M97-F164 HydrophobicContact CB-CD2 3.86Å; M97-F164 HydrophobicContact CB-CE2 3.8Å; M97-F164 HydrophobicContact CE-CD2 4.32Å; M97-F164 HydrophobicContact CE-CE1 3.97Å; M97-F164 HydrophobicContact CE-CE2 3.42Å; M97-F164 VanDerWaalsContact CE-CE2 3.42Å; M97-F164 HydrophobicContact CE-CZ 3.2Å; M97-F164 HydrophobicContact CG-CD2 3.9Å; M97-F164 HydrophobicContact CG-CE2 3.9Å; M97-F164 HydrophobicContact CG-CG 4.36Å; M97-F164 HydrophobicContact CG-CZ 4.38Å; M97-F164 HydrophobicContact SD-CE2 4.49Å; M97-F164 HydrophobicContact SD-CZ 4.5Å; S100-F164 WeakPolarHBondContact OG-CA 3.38Å; S100-F164 VanDerWaalsContact OG-CB 3.32Å; S100-F164 WeakPolarHBondContact OG-CB 3.45Å; S100-F164 WeakPolarHBondContact OG-CD2 3.34Å; A160-F164 WeakPolarHBondContact O-CB 3.48Å; A160-F164 PolarHBondContact O-N 2.88Å; Q161-F164 PolarHBondContact O-N 2.95Å; F164-V166 PolarHBondContact O-N 3.35Å; F164-G167 PolarHBondContact O-N 3.07Å; F164-S168 WeakPolarHBondContact O-CB 3.46Å; F164-S168 PolarHBondContact O-N 3.22Å; F164-S168 PolarHBondContact O-OG 2.92Å; F164-L253 HydrophobicContact CE2-CD1 4.44Å
165	G	95.5	Very high	94	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-54	-52	173.7	0	0	0	0	0	112	H66 Q161 L162 L163 G167 S168 V169	H66-G165 VanDerWaalsContact O-CA 3.29Å; H66-G165 WeakPolarHBondContact O-CA 3.05Å; Q161-G165 PolarHBondContact O-N 3.34Å; L162-G165 WeakPolarHBondContact O-CA 3.39Å; L162-G165 PolarHBondContact O-N 3.37Å; L162-G165 VanDerWaalsContact O-N 3.14Å; L163-G165 VanDerWaalsContact C-N 3.28Å; L163-G165 PolarHBondContact O-N 2.74Å; G165-G167 PolarHBondContact O-N 3.17Å; G165-S168 PolarHBondContact O-N 3.36Å; G165-S168 PolarHBondContact O-OG 3.49Å; G165-V169 WeakPolarHBondContact O-CG2 3.33Å; G165-V169 PolarHBondContact O-N 3.24Å
166	V	95.8	Very high	93.6	Very high	56 Å²	56	22.5 Å²	22.5	34%	0.339	12%	0.122	S	C	.	.	H	α-helix	trans	-54.8	-47.5	177.6	177.8	0	0	0	0	112.1	L73 L96 L162 L163 F164 S168	L73-V166 HydrophobicContact CD1-CB 3.92Å; L73-V166 HydrophobicContact CD1-CG1 3.72Å; L73-V166 HydrophobicContact CD1-CG2 3.68Å; L96-V166 HydrophobicContact CD2-CB 3.98Å; L96-V166 HydrophobicContact CD2-CG1 3.67Å; L162-V166 WeakPolarHBondContact O-CG2 3.38Å; L162-V166 PolarHBondContact O-N 3.42Å; L163-V166 PolarHBondContact O-N 3.04Å; F164-V166 PolarHBondContact O-N 3.35Å; V166-S168 VanDerWaalsContact C-N 3.32Å; V166-S168 PolarHBondContact O-N 3.43Å
167	G	95.3	Very high	93.2	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-68.8	-30	-178.9	0	0	0	0	0	113.6	G93 L163 F164 G165 P170	G93-G167 CarbonylContact C-O 3.55Å; G93-G167 VanDerWaalsContact CA-O 3.32Å; G93-G167 WeakPolarHBondContact CA-O 3.48Å; G93-G167 CarbonylContact O-C 3.58Å; G93-G167 VanDerWaalsContact O-CA 3.29Å; G93-G167 WeakPolarHBondContact O-CA 3.25Å; L163-G167 PolarHBondContact O-N 3.38Å; L163-G167 VanDerWaalsContact O-N 3.1Å; F164-G167 PolarHBondContact O-N 3.07Å; G165-G167 PolarHBondContact O-N 3.17Å; G167-P170 WeakPolarHBondContact O-CD 3.47Å
168	S	94.2	Very high	92.8	Very high	5 Å²	5	22.6 Å²	22.6	4%	0.035	13%	0.126	C	C	.	.	H	α-helix	trans	-77.9	-23.1	-176.9	74.5	0	0	0	0	115	N70 F164 G165 V166 I171	N70-S168 PolarHBondContact ND2-OG 3.34Å; F164-S168 WeakPolarHBondContact O-CB 3.46Å; F164-S168 PolarHBondContact O-N 3.22Å; F164-S168 PolarHBondContact O-OG 2.92Å; G165-S168 PolarHBondContact O-N 3.36Å; G165-S168 PolarHBondContact O-OG 3.49Å; V166-S168 VanDerWaalsContact C-N 3.32Å; V166-S168 PolarHBondContact O-N 3.43Å; S168-I171 PolarHBondContact O-N 3.38Å
169	V	91.8	Very high	92.4	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.012	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-51.6	-173.1	-168.4	0	0	0	0	113.7	N70 L73 I74 V77 G165 I171 P173	N70-V169 HydrophobicContact CB-CG2 4.13Å; L73-V169 HydrophobicContact CB-CB 4.4Å; L73-V169 HydrophobicContact CB-CG1 4.11Å; L73-V169 HydrophobicContact CB-CG2 3.97Å; L73-V169 HydrophobicContact CD1-CG2 4.37Å; I74-V169 HydrophobicContact CB-CG1 4.05Å; I74-V169 HydrophobicContact CD1-CG1 3.73Å; V77-V169 HydrophobicContact CB-CG1 4.16Å; V77-V169 HydrophobicContact CG2-CB 4.24Å; V77-V169 HydrophobicContact CG2-CG1 3.61Å; G165-V169 WeakPolarHBondContact O-CG2 3.33Å; G165-V169 PolarHBondContact O-N 3.24Å; V169-I171 VanDerWaalsContact C-N 3.27Å; V169-I171 PolarHBondContact O-N 2.97Å; V169-P173 WeakPolarHBondContact O-CD 3.29Å
170	P	90.3	Very high	91.8	Very high	10 Å²	10	22.3 Å²	22.3	7%	0.065	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-19	-174.5	28.8	-36.5	0	0	0	113.6	V77 V89 G167 F174	V77-P170 HydrophobicContact CG1-CB 4.47Å; V77-P170 HydrophobicContact CG2-CB 4.46Å; V89-P170 HydrophobicContact CG1-CB 3.9Å; V89-P170 HydrophobicContact CG1-CG 4.16Å; G167-P170 WeakPolarHBondContact O-CD 3.47Å; P170-F174 HydrophobicContact CB-CD2 3.58Å; P170-F174 HydrophobicContact CB-CE2 3.69Å; P170-F174 HydrophobicContact CB-CG 4.42Å; P170-F174 WeakPolarHBondContact O-CB 3.41Å; P170-F174 WeakPolarHBondContact O-CG 3.17Å; P170-F174 PolarHBondContact O-N 3.25Å
171	I	91.5	Very high	91.2	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-59.5	-167.8	-62	-178.4	0	0	0	110.9	H27 L30 Q31 I90 M97 S168 V169 G175	H27-I171 PolarHBondContact CE1-O 2.95Å; L30-I171 HydrophobicContact CD2-CD1 4.23Å; L30-I171 HydrophobicContact CD2-CG1 4.44Å; L30-I171 HydrophobicContact CD2-CG2 3.93Å; L30-I171 HydrophobicContact CG-CD1 4.42Å; L30-I171 HydrophobicContact CG-CG2 4.28Å; Q31-I171 HydrophobicContact CG-CG2 4.25Å; I90-I171 HydrophobicContact CG2-CG1 4.38Å; I90-I171 HydrophobicContact CG2-CG2 4.45Å; M97-I171 HydrophobicContact CE-CD1 4.2Å; M97-I171 HydrophobicContact SD-CD1 3.23Å; M97-I171 WeakPolarHBondContact SD-CD1 3.44Å; S168-I171 PolarHBondContact O-N 3.38Å; V169-I171 VanDerWaalsContact C-N 3.27Å; V169-I171 PolarHBondContact O-N 2.97Å; I171-G175 WeakPolarHBondContact O-CA 3.38Å; I171-G175 PolarHBondContact O-N 3.5Å
172	Q	88.5	Confident	90.6	Very high	56 Å²	56	27.1 Å²	27.1	26%	0.262	15%	0.149	S	C	.	.	H	α-helix	trans	-72	-46.9	-173.1	-170	170.7	-2.2	0	0	113.4	G175 I176	Q172-G175 PolarHBondContact O-N 2.99Å; Q172-I176 HydrophobicContact CG-CD1 3.8Å; Q172-I176 WeakPolarHBondContact O-CG1 3.44Å; Q172-I176 PolarHBondContact O-N 2.88Å
173	P	87.1	Confident	90.1	Very high	43 Å²	43	24.4 Å²	24.4	28%	0.279	14%	0.135	S	C	.	.	H	α-helix	trans	-63.5	-44	178.7	-21.6	34.1	0	0	0	113	I74 V77 V169 S177	I74-P173 HydrophobicContact CD1-CG 3.76Å; V77-P173 HydrophobicContact CG1-CB 4.2Å; V77-P173 HydrophobicContact CG1-CG 4.25Å; V169-P173 WeakPolarHBondContact O-CD 3.29Å; P173-S177 WeakPolarHBondContact O-CB 3.36Å; P173-S177 PolarHBondContact O-N 3.48Å; P173-S177 VanDerWaalsContact O-N 3.08Å; P173-S177 PolarHBondContact O-OG 3.34Å
174	F	89.2	Confident	89.4	Confident	6 Å²	6	22.3 Å²	22.3	3%	0.026	13%	0.126	C	C	.	.	H	α-helix	trans	-74.9	-32.4	179.5	-64.4	-14.8	0	0	0	112.5	V77 V84 R86 V89 I90 P170 S177 Y178	V77-F174 HydrophobicContact CB-CZ 4.34Å; V77-F174 HydrophobicContact CG1-CD1 4.11Å; V77-F174 HydrophobicContact CG1-CE1 3.47Å; V77-F174 VanDerWaalsContact CG1-CE1 3.47Å; V77-F174 HydrophobicContact CG1-CE2 4.21Å; V77-F174 HydrophobicContact CG1-CZ 3.56Å; V77-F174 VanDerWaalsContact O-CE1 3.23Å; V77-F174 WeakPolarHBondContact O-CE1 3.48Å; V77-F174 WeakPolarHBondContact O-CZ 3.21Å; V84-F174 HydrophobicContact CG2-CE2 3.95Å; V84-F174 HydrophobicContact CG2-CZ 4.07Å; R86-F174 HydrophobicContact CB-CB 4.1Å; R86-F174 HydrophobicContact CB-CG 4.37Å; R86-F174 HydrophobicContact CG-CB 4.25Å; R86-F174 HydrophobicContact CG-CD1 4.37Å; R86-F174 HydrophobicContact CG-CG 4.15Å; V89-F174 HydrophobicContact CB-CD2 4.21Å; V89-F174 HydrophobicContact CB-CE2 4.11Å; V89-F174 HydrophobicContact CG1-CD2 4.19Å; V89-F174 HydrophobicContact CG1-CE2 3.8Å; I90-F174 HydrophobicContact CD1-CB 3.76Å; I90-F174 HydrophobicContact CG1-CB 3.82Å; P170-F174 HydrophobicContact CB-CD2 3.58Å; P170-F174 HydrophobicContact CB-CE2 3.69Å; P170-F174 HydrophobicContact CB-CG 4.42Å; P170-F174 WeakPolarHBondContact O-CB 3.41Å; P170-F174 WeakPolarHBondContact O-CG 3.17Å; P170-F174 PolarHBondContact O-N 3.25Å; F174-S177 WeakPolarHBondContact CA-OG 3.36Å; F174-S177 PolarHBondContact O-OG 3.19Å; F174-Y178 WeakPolarHBondContact O-CB 3.26Å; F174-Y178 PolarHBondContact O-N 3.5Å
175	G	89.9	Confident	88.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-50.1	174.6	0	0	0	0	0	112.4	H27 I171 Q172 Y178 I179	H27-G175 VanDerWaalsContact CE1-CA 3.49Å; H27-G175 WeakPolarHBondContact CE1-CA 3.49Å; I171-G175 WeakPolarHBondContact O-CA 3.38Å; I171-G175 PolarHBondContact O-N 3.5Å; Q172-G175 PolarHBondContact O-N 2.99Å; G175-Y178 PolarHBondContact O-N 2.93Å; G175-I179 WeakPolarHBondContact O-CD1 3.34Å; G175-I179 VanDerWaalsContact O-CG1 3.32Å; G175-I179 WeakPolarHBondContact O-CG1 3.49Å; G175-I179 PolarHBondContact O-N 3.35Å
176	I	86.9	Confident	87.5	Confident	44 Å²	44	36.2 Å²	36.2	23%	0.226	20%	0.199	C	C	.	.	H	α-helix	trans	-65.5	-49.2	-179.7	-65.7	170.5	0	0	0	110.5	Q172 Y178 I179 D180 I192 F196	Q172-I176 HydrophobicContact CG-CD1 3.8Å; Q172-I176 WeakPolarHBondContact O-CG1 3.44Å; Q172-I176 PolarHBondContact O-N 2.88Å; I176-Y178 VanDerWaalsContact C-N 3.31Å; I176-Y178 PolarHBondContact O-N 2.97Å; I176-I179 PolarHBondContact O-N 2.97Å; I176-I179 VanDerWaalsContact O-N 3.14Å; I176-D180 WeakPolarHBondContact O-CB 3.39Å; I176-D180 PolarHBondContact O-N 2.83Å; I176-I192 HydrophobicContact CG2-CD1 4.01Å; I176-I192 HydrophobicContact CG2-CG1 4.38Å; I176-F196 HydrophobicContact CD1-CE2 4.42Å; I176-F196 HydrophobicContact CD1-CZ 3.93Å
177	S	86	Confident	86.9	Confident	34 Å²	34	36.6 Å²	36.6	24%	0.238	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-35.6	178.4	55.4	0	0	0	0	112.9	R86 P173 F174 D180 D181	R86-S177 PolarHBondContact NH1-O 3.19Å; R86-S177 VanDerWaalsContact NH1-O 3.16Å; R86-S177 PolarHBondContact NH1-OG 3.48Å; P173-S177 WeakPolarHBondContact O-CB 3.36Å; P173-S177 PolarHBondContact O-N 3.48Å; P173-S177 VanDerWaalsContact O-N 3.08Å; P173-S177 PolarHBondContact O-OG 3.34Å; F174-S177 WeakPolarHBondContact CA-OG 3.36Å; F174-S177 PolarHBondContact O-OG 3.19Å; S177-D180 PolarHBondContact O-N 2.88Å; S177-D181 WeakPolarHBondContact O-CB 3.27Å; S177-D181 PolarHBondContact O-N 3.33Å
178	Y	87.2	Confident	86.3	Confident	1 Å²	1	36.7 Å²	36.7	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-67.4	-37.8	174.6	-169.8	-84.6	0	0	0	111.9	I20 F23 R86 P87 F174 G175 I176 F182 P264	I20-Y178 HydrophobicContact CD1-CD1 4.43Å; I20-Y178 HydrophobicContact CD1-CE1 4.37Å; F23-Y178 AromaticContact CD1-CD1 3.75Å; F23-Y178 HydrophobicContact CD1-CD1 3.75Å; F23-Y178 HydrophobicContact CD1-CE1 4.23Å; F23-Y178 AromaticContact CD2-CD1 3.87Å; F23-Y178 HydrophobicContact CD2-CD1 3.87Å; F23-Y178 AromaticContact CD2-CE1 3.73Å; F23-Y178 HydrophobicContact CD2-CE1 3.73Å; F23-Y178 AromaticContact CE1-CD1 3.52Å; F23-Y178 HydrophobicContact CE1-CD1 3.52Å; F23-Y178 HydrophobicContact CE1-CE1 4.34Å; F23-Y178 HydrophobicContact CE1-CG 4.15Å; F23-Y178 AromaticContact CE2-CD1 3.62Å; F23-Y178 HydrophobicContact CE2-CD1 3.62Å; F23-Y178 AromaticContact CE2-CE1 3.83Å; F23-Y178 HydrophobicContact CE2-CE1 3.83Å; F23-Y178 HydrophobicContact CE2-CG 4.16Å; F23-Y178 AromaticContact CG-CD1 3.92Å; F23-Y178 HydrophobicContact CG-CD1 3.92Å; F23-Y178 AromaticContact CG-CE1 3.93Å; F23-Y178 HydrophobicContact CG-CE1 3.93Å; F23-Y178 AromaticContact CZ-CD1 3.44Å; F23-Y178 HydrophobicContact CZ-CD1 3.44Å; F23-Y178 VanDerWaalsContact CZ-CD1 3.44Å; F23-Y178 HydrophobicContact CZ-CE1 4.15Å; F23-Y178 AromaticContact CZ-CG 3.8Å; F23-Y178 HydrophobicContact CZ-CG 3.8Å; R86-Y178 HydrophobicContact CB-CD2 4.27Å; P87-Y178 HydrophobicContact CG-CD2 3.88Å; P87-Y178 HydrophobicContact CG-CE2 3.45Å; P87-Y178 VanDerWaalsContact CG-CE2 3.45Å; F174-Y178 WeakPolarHBondContact O-CB 3.26Å; F174-Y178 PolarHBondContact O-N 3.5Å; G175-Y178 PolarHBondContact O-N 2.93Å; I176-Y178 VanDerWaalsContact C-N 3.31Å; I176-Y178 PolarHBondContact O-N 2.97Å; Y178-F182 AromaticContact CD1-CD2 3.81Å; Y178-F182 HydrophobicContact CD1-CD2 3.81Å; Y178-F182 HydrophobicContact CD1-CE2 4.29Å; Y178-F182 AromaticContact CD2-CD2 3.91Å; Y178-F182 HydrophobicContact CD2-CD2 3.91Å; Y178-F182 AromaticContact CD2-CE2 3.52Å; Y178-F182 HydrophobicContact CD2-CE2 3.52Å; Y178-F182 AromaticContact CE1-CD2 3.64Å; Y178-F182 HydrophobicContact CE1-CD2 3.64Å; Y178-F182 HydrophobicContact CE1-CE2 4.09Å; Y178-F182 AromaticContact CE2-CD2 3.75Å; Y178-F182 HydrophobicContact CE2-CD2 3.75Å; Y178-F182 AromaticContact CE2-CE2 3.29Å; Y178-F182 HydrophobicContact CE2-CE2 3.29Å; Y178-F182 HydrophobicContact CE2-CZ 4.31Å; Y178-F182 AromaticContact CG-CD2 3.93Å; Y178-F182 HydrophobicContact CG-CD2 3.93Å; Y178-F182 HydrophobicContact CG-CE2 4.02Å; Y178-F182 AromaticContact CZ-CD2 3.59Å; Y178-F182 AromaticContact CZ-CE2 3.59Å; Y178-F182 WeakPolarHBondContact O-CD2 3.49Å; Y178-F182 PolarHBondContact O-N 2.84Å; Y178-P264 PolarHBondContact OH-O 3.2Å
179	I	88.6	Confident	85.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-43.2	175.1	-68.9	162.3	0	0	0	110.6	F23 V24 G175 I176 F182 A183 Y191 I192 L195	F23-I179 HydrophobicContact CD1-CD1 4.33Å; F23-I179 HydrophobicContact CD1-CG1 3.8Å; F23-I179 HydrophobicContact CE1-CD1 4.25Å; F23-I179 HydrophobicContact CE1-CG1 3.83Å; V24-I179 HydrophobicContact CG2-CD1 3.94Å; V24-I179 HydrophobicContact CG2-CG1 3.99Å; V24-I179 HydrophobicContact CG2-CG2 4.41Å; G175-I179 WeakPolarHBondContact O-CD1 3.34Å; G175-I179 VanDerWaalsContact O-CG1 3.32Å; G175-I179 WeakPolarHBondContact O-CG1 3.49Å; G175-I179 PolarHBondContact O-N 3.35Å; I176-I179 PolarHBondContact O-N 2.97Å; I176-I179 VanDerWaalsContact O-N 3.14Å; I179-F182 PolarHBondContact O-N 3.5Å; I179-A183 HydrophobicContact CG2-CB 4.33Å; I179-A183 WeakPolarHBondContact O-CB 3.45Å; I179-A183 PolarHBondContact O-N 3.46Å; I179-Y191 HydrophobicContact CG2-CD2 4.3Å; I179-I192 HydrophobicContact CG2-CG1 4.17Å; I179-L195 HydrophobicContact CD1-CD1 3.43Å; I179-L195 VanDerWaalsContact CD1-CD1 3.43Å
180	D	85.1	Confident	85.4	Confident	93 Å²	93	45.1 Å²	45.1	50%	0.497	25%	0.248	S	C	.	.	H	α-helix	trans	-65.7	-40.3	-177.9	-158.3	48.9	0	0	0	112.5	I176 S177 F182 S188	I176-D180 WeakPolarHBondContact O-CB 3.39Å; I176-D180 PolarHBondContact O-N 2.83Å; S177-D180 PolarHBondContact O-N 2.88Å; D180-F182 VanDerWaalsContact C-N 3.34Å; D180-F182 PolarHBondContact O-N 3.24Å; D180-S188 WeakPolarHBondContact OD1-CB 3.3Å; D180-S188 PolarHBondContact OD1-OG 3.43Å
181	D	84.4	Confident	85.2	Confident	79 Å²	79	45.7 Å²	45.7	42%	0.422	25%	0.249	S	C	.	.	H	α-helix	trans	-68.9	-27.8	180	-69.5	1.6	0	0	0	113.5	R86 S177	R86-D181 IonicContact CZ-OD2 3.15Å; R86-D181 IonicContact NH1-OD2 2.65Å; R86-D181 PolarHBondContact NH1-OD2 3.18Å; R86-D181 IonicContact NH2-OD2 2.8Å; R86-D181 PolarHBondContact NH2-OD2 3.23Å; S177-D181 WeakPolarHBondContact O-CB 3.27Å; S177-D181 PolarHBondContact O-N 3.33Å
182	F	85.1	Confident	84.9	Confident	24 Å²	24	47.1 Å²	47.1	11%	0.105	26%	0.257	C	S	.	.	H	α-helix	trans	-114.9	-18.3	-171.3	-63	-59.7	0	0	0	115	I20 Y178 I179 D180 Q266 M267 E270	I20-F182 HydrophobicContact CD1-CB 3.99Å; Y178-F182 AromaticContact CD1-CD2 3.81Å; Y178-F182 HydrophobicContact CD1-CD2 3.81Å; Y178-F182 HydrophobicContact CD1-CE2 4.29Å; Y178-F182 AromaticContact CD2-CD2 3.91Å; Y178-F182 HydrophobicContact CD2-CD2 3.91Å; Y178-F182 AromaticContact CD2-CE2 3.52Å; Y178-F182 HydrophobicContact CD2-CE2 3.52Å; Y178-F182 AromaticContact CE1-CD2 3.64Å; Y178-F182 HydrophobicContact CE1-CD2 3.64Å; Y178-F182 HydrophobicContact CE1-CE2 4.09Å; Y178-F182 AromaticContact CE2-CD2 3.75Å; Y178-F182 HydrophobicContact CE2-CD2 3.75Å; Y178-F182 AromaticContact CE2-CE2 3.29Å; Y178-F182 HydrophobicContact CE2-CE2 3.29Å; Y178-F182 HydrophobicContact CE2-CZ 4.31Å; Y178-F182 AromaticContact CG-CD2 3.93Å; Y178-F182 HydrophobicContact CG-CD2 3.93Å; Y178-F182 HydrophobicContact CG-CE2 4.02Å; Y178-F182 AromaticContact CZ-CD2 3.59Å; Y178-F182 AromaticContact CZ-CE2 3.59Å; Y178-F182 WeakPolarHBondContact O-CD2 3.49Å; Y178-F182 PolarHBondContact O-N 2.84Å; I179-F182 PolarHBondContact O-N 3.5Å; D180-F182 VanDerWaalsContact C-N 3.34Å; D180-F182 PolarHBondContact O-N 3.24Å; F182-Q266 HydrophobicContact CE1-CB 4.41Å; F182-Q266 HydrophobicContact CZ-CB 4.28Å; F182-Q266 HydrophobicContact CZ-CG 4.45Å; F182-M267 HydrophobicContact CB-CB 4.42Å; F182-M267 HydrophobicContact CD1-CB 3.85Å; F182-M267 WeakPolarHBondContact CD1-O 3.2Å; F182-M267 HydrophobicContact CD2-CB 4.35Å; F182-M267 HydrophobicContact CE1-CB 4.24Å; F182-M267 WeakPolarHBondContact CE1-O 3.35Å; F182-M267 HydrophobicContact CG-CB 3.94Å; F182-E270 PolarHBondContact O-N 2.88Å
183	A	86.1	Confident	84.6	Confident	4 Å²	4	47 Å²	47	3%	0.033	27%	0.266	C	S	.	.	S	Bend	trans	-81.5	150.4	172.2	0	0	0	0	0	110.7	I20 I179 Y191	I20-A183 HydrophobicContact CG1-CB 4.38Å; I179-A183 HydrophobicContact CG2-CB 4.33Å; I179-A183 WeakPolarHBondContact O-CB 3.45Å; I179-A183 PolarHBondContact O-N 3.46Å; A183-Y191 HydrophobicContact CB-CD2 3.6Å; A183-Y191 HydrophobicContact CB-CE2 3.79Å
184	G	80.9	Confident	84.6	Confident	7 Å²	7	48.6 Å²	48.6	7%	0.072	27%	0.271	C	S	.	.			trans	-60.7	145.8	172.6	0	0	0	0	0	111.1	K186 N187 S188 E270	G184-K186 PolarHBondContact O-N 2.96Å; G184-N187 CarbonylContact O-C 3.2Å; G184-N187 WeakPolarHBondContact O-CA 3.41Å; G184-N187 PolarHBondContact O-N 3.38Å; G184-S188 PolarHBondContact O-N 3.48Å; G184-E270 PolarHBondContact N-OE2 3.34Å
185	S	75.3	Confident	84.5	Confident	104 Å²	104	48.3 Å²	48.3	73%	0.727	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.9	-178.4	57.8	0	0	0	0	113.9	P189	S185-P189 WeakPolarHBondContact O-CD 3.25Å
186	K	78.6	Confident	84.2	Confident	192 Å²	192	52.3 Å²	52.3	84%	0.835	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-28.5	174	-64	-178.9	-178.6	175.9	0	113.6	G184	G184-K186 PolarHBondContact O-N 2.96Å
187	N	82.9	Confident	84.2	Confident	64 Å²	64	51.5 Å²	51.5	34%	0.342	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-28.2	-174.4	-65	-27.4	0	0	0	113.3	G184 L190 Y191 E270	G184-N187 CarbonylContact O-C 3.2Å; G184-N187 WeakPolarHBondContact O-CA 3.41Å; G184-N187 PolarHBondContact O-N 3.38Å; N187-L190 WeakPolarHBondContact O-CB 3.46Å; N187-L190 PolarHBondContact O-N 3.34Å; N187-Y191 HydrophobicContact CB-CD2 4.48Å; N187-Y191 HydrophobicContact CB-CE2 4.02Å; N187-Y191 PolarHBondContact O-N 2.98Å; N187-E270 PolarHBondContact ND2-OE2 3.31Å
188	S	82.9	Confident	84.3	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.014	29%	0.292	C	S	.	.	H	α-helix	trans	-51.2	-50.6	-179	169	0	0	0	0	112.7	D180 G184 L190 Y191 I192	D180-S188 WeakPolarHBondContact OD1-CB 3.3Å; D180-S188 PolarHBondContact OD1-OG 3.43Å; G184-S188 PolarHBondContact O-N 3.48Å; S188-L190 VanDerWaalsContact C-N 3.25Å; S188-L190 PolarHBondContact O-N 3.05Å; S188-Y191 PolarHBondContact O-N 3Å; S188-I192 WeakPolarHBondContact O-CG1 3.44Å; S188-I192 PolarHBondContact O-N 2.95Å; S188-I192 WeakPolarHBondContact OG-CD1 3.12Å
189	P	81.5	Confident	84.3	Confident	83 Å²	83	52.7 Å²	52.7	54%	0.539	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-33.2	179.3	-23.6	34.6	0	0	0	113.4	S185 A193	S185-P189 WeakPolarHBondContact O-CD 3.25Å; P189-A193 VanDerWaalsContact O-CB 3.29Å; P189-A193 WeakPolarHBondContact O-CB 3.27Å; P189-A193 PolarHBondContact O-N 3.31Å
190	L	84.8	Confident	84.1	Confident	101 Å²	101	53.8 Å²	53.8	53%	0.529	30%	0.3	S	S	.	.	H	α-helix	trans	-68.6	-47.1	177.6	-179.2	69.8	0	0	0	110.9	N187 S188 I192 A193 I194	N187-L190 WeakPolarHBondContact O-CB 3.46Å; N187-L190 PolarHBondContact O-N 3.34Å; S188-L190 VanDerWaalsContact C-N 3.25Å; S188-L190 PolarHBondContact O-N 3.05Å; L190-I192 PolarHBondContact O-N 2.95Å; L190-A193 PolarHBondContact O-N 3.05Å; L190-I194 HydrophobicContact CD1-CD1 4.48Å; L190-I194 HydrophobicContact CG-CD1 4.11Å; L190-I194 WeakPolarHBondContact O-CG1 3.39Å; L190-I194 PolarHBondContact O-N 3.26Å
191	Y	87.3	Confident	84.4	Confident	22 Å²	22	53.3 Å²	53.3	9%	0.086	29%	0.293	C	S	.	.	H	α-helix	trans	-63.1	-41.5	177.9	-65.9	-26.3	0	0	0	112.1	I20 K21 V24 I179 A183 N187 S188 A193 I194 L195 E270	I20-Y191 HydrophobicContact CG1-CE2 4.5Å; I20-Y191 HydrophobicContact CG2-CE2 4.04Å; K21-Y191 WeakPolarHBondContact CE-OH 3.42Å; V24-Y191 HydrophobicContact CG2-CD2 4.28Å; V24-Y191 HydrophobicContact CG2-CG 4.05Å; I179-Y191 HydrophobicContact CG2-CD2 4.3Å; A183-Y191 HydrophobicContact CB-CD2 3.6Å; A183-Y191 HydrophobicContact CB-CE2 3.79Å; N187-Y191 HydrophobicContact CB-CD2 4.48Å; N187-Y191 HydrophobicContact CB-CE2 4.02Å; N187-Y191 PolarHBondContact O-N 2.98Å; S188-Y191 PolarHBondContact O-N 3Å; Y191-A193 VanDerWaalsContact C-N 3.35Å; Y191-A193 PolarHBondContact O-N 3.03Å; Y191-I194 PolarHBondContact O-N 3.49Å; Y191-L195 WeakPolarHBondContact O-CB 3.46Å; Y191-L195 PolarHBondContact O-N 3.03Å; Y191-E270 PolarHBondContact OH-OE1 3.12Å; Y191-E270 VanDerWaalsContact OH-OE1 3.04Å
192	I	83.8	Confident	84.8	Confident	31 Å²	31	49.5 Å²	49.5	16%	0.159	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-41.8	175.2	-65.8	167	0	0	0	110.7	I176 I179 S188 L190 L195 F196	I176-I192 HydrophobicContact CG2-CD1 4.01Å; I176-I192 HydrophobicContact CG2-CG1 4.38Å; I179-I192 HydrophobicContact CG2-CG1 4.17Å; S188-I192 WeakPolarHBondContact O-CG1 3.44Å; S188-I192 PolarHBondContact O-N 2.95Å; S188-I192 WeakPolarHBondContact OG-CD1 3.12Å; L190-I192 PolarHBondContact O-N 2.95Å; I192-L195 WeakPolarHBondContact O-CB 3.4Å; I192-L195 PolarHBondContact O-N 3.25Å; I192-F196 HydrophobicContact CG2-CD2 3.76Å; I192-F196 HydrophobicContact CG2-CE2 3.49Å; I192-F196 VanDerWaalsContact CG2-CE2 3.49Å; I192-F196 WeakPolarHBondContact O-CD2 3.49Å; I192-F196 PolarHBondContact O-N 3.04Å
193	A	83	Confident	85.2	Confident	54 Å²	54	49.2 Å²	49.2	45%	0.446	27%	0.274	S	S	.	.	H	α-helix	trans	-63.7	-42.2	176.4	0	0	0	0	0	112.6	P189 L190 Y191 L195 F196 A197	P189-A193 VanDerWaalsContact O-CB 3.29Å; P189-A193 WeakPolarHBondContact O-CB 3.27Å; P189-A193 PolarHBondContact O-N 3.31Å; L190-A193 PolarHBondContact O-N 3.05Å; Y191-A193 VanDerWaalsContact C-N 3.35Å; Y191-A193 PolarHBondContact O-N 3.03Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-F196 PolarHBondContact O-N 3.06Å; A193-A197 WeakPolarHBondContact O-CB 3.43Å; A193-A197 PolarHBondContact O-N 3.04Å
194	I	86.9	Confident	85.6	Confident	75 Å²	75	49.1 Å²	49.1	39%	0.385	27%	0.273	S	S	.	.	H	α-helix	trans	-61.8	-43.4	175.3	-69	165.6	0	0	0	110.7	L190 Y191 F196 A197 V198	L190-I194 HydrophobicContact CD1-CD1 4.48Å; L190-I194 HydrophobicContact CG-CD1 4.11Å; L190-I194 WeakPolarHBondContact O-CG1 3.39Å; L190-I194 PolarHBondContact O-N 3.26Å; Y191-I194 PolarHBondContact O-N 3.49Å; I194-F196 PolarHBondContact O-N 2.78Å; I194-A197 WeakPolarHBondContact O-CA 3.5Å; I194-A197 VanDerWaalsContact O-CB 3.32Å; I194-A197 WeakPolarHBondContact O-CB 3.36Å; I194-A197 PolarHBondContact O-N 2.87Å; I194-A197 VanDerWaalsContact O-N 3.09Å; I194-V198 HydrophobicContact CG2-CG2 4.44Å; I194-V198 WeakPolarHBondContact O-CG2 3.44Å; I194-V198 PolarHBondContact O-N 2.9Å
195	L	88.3	Confident	86.3	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-59.1	-46.4	177.1	169.8	170.6	0	0	0	111.5	H27 I179 Y191 I192 A193 A197 S199	H27-L195 WeakPolarHBondContact CD2-CD1 3.11Å; I179-L195 HydrophobicContact CD1-CD1 3.43Å; I179-L195 VanDerWaalsContact CD1-CD1 3.43Å; Y191-L195 WeakPolarHBondContact O-CB 3.46Å; Y191-L195 PolarHBondContact O-N 3.03Å; I192-L195 WeakPolarHBondContact O-CB 3.4Å; I192-L195 PolarHBondContact O-N 3.25Å; A193-L195 VanDerWaalsContact C-N 3.34Å; L195-A197 VanDerWaalsContact C-N 3.31Å; L195-A197 PolarHBondContact O-N 3.06Å; L195-S199 WeakPolarHBondContact O-CB 3.45Å; L195-S199 PolarHBondContact O-N 3.09Å; L195-S199 VanDerWaalsContact O-N 3.13Å; L195-S199 PolarHBondContact O-OG 3.36Å
196	F	83.7	Confident	87.3	Confident	83 Å²	83	47.5 Å²	47.5	36%	0.364	25%	0.254	S	S	.	.	H	α-helix	trans	-65	-36.3	173.6	-76.7	-62.2	0	0	0	112.1	I176 I192 A193 I194 V200 Y363	I176-F196 HydrophobicContact CD1-CE2 4.42Å; I176-F196 HydrophobicContact CD1-CZ 3.93Å; I192-F196 HydrophobicContact CG2-CD2 3.76Å; I192-F196 HydrophobicContact CG2-CE2 3.49Å; I192-F196 VanDerWaalsContact CG2-CE2 3.49Å; I192-F196 WeakPolarHBondContact O-CD2 3.49Å; I192-F196 PolarHBondContact O-N 3.04Å; A193-F196 PolarHBondContact O-N 3.06Å; I194-F196 PolarHBondContact O-N 2.78Å; F196-V200 WeakPolarHBondContact O-CB 3.22Å; F196-V200 WeakPolarHBondContact O-CG2 3.48Å; F196-V200 PolarHBondContact O-N 2.94Å; F196-Y363 PolarHBondContact O-OH 3.3Å
197	A	84.9	Confident	88.1	Confident	28 Å²	28	38.7 Å²	38.7	23%	0.231	22%	0.215	C	C	.	.	H	α-helix	trans	-58.1	-50.8	176.1	0	0	0	0	0	113	A193 I194 L195 F201 Y363	A193-A197 WeakPolarHBondContact O-CB 3.43Å; A193-A197 PolarHBondContact O-N 3.04Å; I194-A197 WeakPolarHBondContact O-CA 3.5Å; I194-A197 VanDerWaalsContact O-CB 3.32Å; I194-A197 WeakPolarHBondContact O-CB 3.36Å; I194-A197 PolarHBondContact O-N 2.87Å; I194-A197 VanDerWaalsContact O-N 3.09Å; L195-A197 VanDerWaalsContact C-N 3.31Å; L195-A197 PolarHBondContact O-N 3.06Å; A197-F201 VanDerWaalsContact O-CD2 3.28Å; A197-F201 WeakPolarHBondContact O-CD2 3.49Å; A197-F201 WeakPolarHBondContact O-CE2 3.47Å; A197-Y363 VanDerWaalsContact CA-OH 3.24Å; A197-Y363 WeakPolarHBondContact CA-OH 3.23Å; A197-Y363 HydrophobicContact CB-CE1 3.86Å
198	V	89.1	Confident	88.7	Confident	56 Å²	56	38.1 Å²	38.1	34%	0.339	21%	0.212	S	C	.	.	H	α-helix	trans	-66.3	-45.4	-179.1	173.3	0	0	0	0	111.2	L32 I194 V200 F201	L32-V198 HydrophobicContact CB-CG1 4.42Å; L32-V198 HydrophobicContact CD1-CG1 3.97Å; I194-V198 HydrophobicContact CG2-CG2 4.44Å; I194-V198 WeakPolarHBondContact O-CG2 3.44Å; I194-V198 PolarHBondContact O-N 2.9Å; V198-V200 PolarHBondContact O-N 3.31Å; V198-F201 PolarHBondContact O-N 3.16Å; V198-F201 VanDerWaalsContact O-N 3.17Å
199	S	87	Confident	89.4	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-63.7	-32.3	-173.4	-56.9	0	0	0	0	112.7	Q31 L35 L195 F201 G202	Q31-S199 WeakPolarHBondContact CB-OG 3.01Å; Q31-S199 PolarHBondContact OE1-OG 2.73Å; L35-S199 WeakPolarHBondContact CD1-O 3.45Å; L195-S199 WeakPolarHBondContact O-CB 3.45Å; L195-S199 PolarHBondContact O-N 3.09Å; L195-S199 VanDerWaalsContact O-N 3.13Å; L195-S199 PolarHBondContact O-OG 3.36Å; S199-F201 PolarHBondContact O-N 3.11Å; S199-G202 PolarHBondContact O-N 2.82Å
200	V	84.8	Confident	90.1	Very high	24 Å²	24	35.7 Å²	35.7	15%	0.145	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.6	179.6	161.7	0	0	0	0	113.8	F196 V198 G202 P203 Y359 Y363	F196-V200 WeakPolarHBondContact O-CB 3.22Å; F196-V200 WeakPolarHBondContact O-CG2 3.48Å; F196-V200 PolarHBondContact O-N 2.94Å; V198-V200 PolarHBondContact O-N 3.31Å; V200-G202 VanDerWaalsContact C-N 3.29Å; V200-P203 WeakPolarHBondContact O-CD 3.29Å; V200-Y359 HydrophobicContact CB-CD1 4.44Å; V200-Y359 VanDerWaalsContact CG1-CB 3.46Å; V200-Y359 HydrophobicContact CG1-CD1 3.1Å; V200-Y359 HydrophobicContact CG1-CD2 3.48Å; V200-Y359 VanDerWaalsContact CG1-CD2 3.48Å; V200-Y359 HydrophobicContact CG1-CE1 3.5Å; V200-Y359 HydrophobicContact CG1-CE2 3.84Å; V200-Y359 HydrophobicContact CG1-CG 3.07Å; V200-Y359 HydrophobicContact CG2-CE1 4.43Å; V200-Y359 VanDerWaalsContact O-CD2 3.32Å; V200-Y359 WeakPolarHBondContact O-CD2 3.2Å; V200-Y359 WeakPolarHBondContact O-CE2 3.36Å; V200-Y363 HydrophobicContact CB-CE2 4.29Å; V200-Y363 WeakPolarHBondContact CB-OH 3.46Å; V200-Y363 HydrophobicContact CG1-CE2 3.81Å; V200-Y363 WeakPolarHBondContact CG1-OH 3.29Å; V200-Y363 VanDerWaalsContact CG2-OH 3.23Å; V200-Y363 WeakPolarHBondContact CG2-OH 3.22Å
201	F	90.4	Very high	90.5	Very high	82 Å²	82	31 Å²	31	36%	0.36	17%	0.17	S	C	.	.	H	α-helix	trans	-73.8	-21.2	171.3	-70	-80.4	0	0	0	113.1	A197 V198 S199 S204 L205	A197-F201 VanDerWaalsContact O-CD2 3.28Å; A197-F201 WeakPolarHBondContact O-CD2 3.49Å; A197-F201 WeakPolarHBondContact O-CE2 3.47Å; V198-F201 PolarHBondContact O-N 3.16Å; V198-F201 VanDerWaalsContact O-N 3.17Å; S199-F201 PolarHBondContact O-N 3.11Å; F201-S204 WeakPolarHBondContact O-CB 3.38Å; F201-S204 PolarHBondContact O-N 3.17Å; F201-L205 WeakPolarHBondContact O-CG 3.35Å; F201-L205 PolarHBondContact O-N 2.91Å
202	G	93.8	Very high	90.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-51.3	-53.3	-178.5	0	0	0	0	0	113.5	L36 S199 V200 S204 L205 G206	L36-G202 WeakPolarHBondContact CA-O 3.35Å; S199-G202 PolarHBondContact O-N 2.82Å; V200-G202 VanDerWaalsContact C-N 3.29Å; G202-S204 VanDerWaalsContact C-N 3.34Å; G202-S204 PolarHBondContact O-N 3.04Å; G202-L205 PolarHBondContact O-N 3.23Å; G202-G206 PolarHBondContact O-N 2.85Å
203	P	93.4	Very high	91.4	Very high	18 Å²	18	32.8 Å²	32.8	12%	0.117	18%	0.183	C	C	.	.	H	α-helix	trans	-59.3	-40.6	179.6	-27.8	37.3	0	0	0	114.1	L35 A39 V200 G206 Y207 V355 Y359	L35-P203 HydrophobicContact CB-CG 4.06Å; A39-P203 VanDerWaalsContact CB-CA 3.41Å; A39-P203 HydrophobicContact CB-CB 3.88Å; A39-P203 VanDerWaalsContact CB-O 3.26Å; A39-P203 WeakPolarHBondContact CB-O 3.23Å; V200-P203 WeakPolarHBondContact O-CD 3.29Å; P203-G206 PolarHBondContact O-N 3.41Å; P203-Y207 VanDerWaalsContact O-CD2 3.28Å; P203-Y207 WeakPolarHBondContact O-CD2 3.49Å; P203-Y207 PolarHBondContact O-N 3.14Å; P203-V355 HydrophobicContact CB-CG1 4.12Å; P203-Y359 HydrophobicContact CB-CE2 4.45Å
204	S	93.7	Very high	91.8	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-48.6	176.8	-54.9	0	0	0	0	111.1	F201 G202 G206 Y207 L208 L356	F201-S204 WeakPolarHBondContact O-CB 3.38Å; F201-S204 PolarHBondContact O-N 3.17Å; G202-S204 VanDerWaalsContact C-N 3.34Å; G202-S204 PolarHBondContact O-N 3.04Å; S204-G206 VanDerWaalsContact C-N 3.27Å; S204-G206 PolarHBondContact O-N 3.38Å; S204-Y207 PolarHBondContact O-N 3.4Å; S204-L208 VanDerWaalsContact O-CG 3.24Å; S204-L208 WeakPolarHBondContact O-CG 3.43Å; S204-L208 PolarHBondContact O-N 3.28Å; S204-L356 VanDerWaalsContact OG-CA 3.32Å; S204-L356 WeakPolarHBondContact OG-CA 3.31Å; S204-L356 PolarHBondContact OG-N 3.48Å
205	L	95.9	Very high	92	Very high	78 Å²	78	33.5 Å²	33.5	41%	0.408	17%	0.169	S	C	.	.	H	α-helix	trans	-62	-36.1	176.7	-67.5	174.7	0	0	0	111.6	L32 L36 F201 G202 L208 L209	L32-L205 HydrophobicContact CD1-CD1 4.31Å; L32-L205 HydrophobicContact CD2-CD1 4.24Å; L36-L205 HydrophobicContact CD1-CB 3.36Å; F201-L205 WeakPolarHBondContact O-CG 3.35Å; F201-L205 PolarHBondContact O-N 2.91Å; G202-L205 PolarHBondContact O-N 3.23Å; L205-L208 PolarHBondContact O-N 3.03Å; L205-L209 VanDerWaalsContact O-CB 3.27Å; L205-L209 WeakPolarHBondContact O-CB 3.21Å; L205-L209 PolarHBondContact O-N 3.24Å
206	G	96.7	Very high	91.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-45.7	179.3	0	0	0	0	0	112.2	G202 P203 S204 L209 G210	G202-G206 PolarHBondContact O-N 2.85Å; P203-G206 PolarHBondContact O-N 3.41Å; S204-G206 VanDerWaalsContact C-N 3.27Å; S204-G206 PolarHBondContact O-N 3.38Å; G206-L209 PolarHBondContact O-N 3.09Å; G206-G210 PolarHBondContact O-N 3.06Å
207	Y	96	Very high	92.1	Very high	6 Å²	6	36.1 Å²	36.1	2%	0.024	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-41.7	173.1	-83.2	-71.7	0	0	0	112.5	A39 P203 S204 G210 S211 A329 T348 V351 G352 V355	A39-Y207 HydrophobicContact CB-CD2 3.87Å; A39-Y207 HydrophobicContact CB-CE2 3.9Å; P203-Y207 VanDerWaalsContact O-CD2 3.28Å; P203-Y207 WeakPolarHBondContact O-CD2 3.49Å; P203-Y207 PolarHBondContact O-N 3.14Å; S204-Y207 PolarHBondContact O-N 3.4Å; Y207-G210 PolarHBondContact O-N 3.43Å; Y207-S211 PolarHBondContact O-N 3.36Å; Y207-A329 PolarHBondContact OH-O 3.27Å; Y207-T348 HydrophobicContact CD1-CG2 4.04Å; Y207-T348 VanDerWaalsContact O-CG2 3.24Å; Y207-T348 WeakPolarHBondContact O-CG2 3.37Å; Y207-V351 HydrophobicContact CD1-CB 4.06Å; Y207-V351 HydrophobicContact CD1-CG1 3.74Å; Y207-V351 HydrophobicContact CD2-CG1 4.07Å; Y207-V351 HydrophobicContact CE1-CB 4.16Å; Y207-V351 HydrophobicContact CE1-CG1 3.52Å; Y207-V351 HydrophobicContact CE2-CG1 3.88Å; Y207-V351 HydrophobicContact CG-CB 4.49Å; Y207-V351 HydrophobicContact CG-CG1 4.02Å; Y207-G352 VanDerWaalsContact CB-CA 3.42Å; Y207-V355 HydrophobicContact CD2-CG2 4.35Å; Y207-V355 HydrophobicContact CE2-CG2 4.38Å
208	L	95.9	Very high	92.1	Very high	53 Å²	53	34.8 Å²	34.8	28%	0.277	17%	0.169	S	C	.	.	H	α-helix	trans	-62.8	-44.8	177.1	-69.6	173.1	0	0	0	111.5	S204 L205 G210 S211 V212 L349	S204-L208 VanDerWaalsContact O-CG 3.24Å; S204-L208 WeakPolarHBondContact O-CG 3.43Å; S204-L208 PolarHBondContact O-N 3.28Å; L205-L208 PolarHBondContact O-N 3.03Å; L208-G210 VanDerWaalsContact C-N 3.34Å; L208-G210 PolarHBondContact O-N 3.28Å; L208-S211 WeakPolarHBondContact O-CB 3.38Å; L208-S211 PolarHBondContact O-N 2.9Å; L208-V212 WeakPolarHBondContact O-CG2 3.21Å; L208-V212 PolarHBondContact O-N 2.99Å; L208-V212 VanDerWaalsContact O-N 3.12Å; L208-L349 HydrophobicContact CD2-CD1 3.65Å
209	L	96.6	Very high	91.7	Very high	34 Å²	34	32.6 Å²	32.6	18%	0.178	16%	0.156	C	C	.	.	H	α-helix	trans	-60.8	-43.8	174.3	-178.1	61.2	0	0	0	111	Y40 L205 G206 S211 V212 M213 I248 I249	Y40-L209 HydrophobicContact CD2-CB 4.16Å; Y40-L209 HydrophobicContact CD2-CD2 4.08Å; Y40-L209 HydrophobicContact CD2-CG 3.95Å; Y40-L209 HydrophobicContact CE2-CD2 4.37Å; Y40-L209 HydrophobicContact CE2-CG 3.98Å; L205-L209 VanDerWaalsContact O-CB 3.27Å; L205-L209 WeakPolarHBondContact O-CB 3.21Å; L205-L209 PolarHBondContact O-N 3.24Å; G206-L209 PolarHBondContact O-N 3.09Å; L209-S211 PolarHBondContact O-N 3.13Å; L209-V212 PolarHBondContact O-N 3.21Å; L209-M213 HydrophobicContact CD1-CE 4.07Å; L209-M213 HydrophobicContact CD1-CG 4.11Å; L209-M213 HydrophobicContact CG-CG 4.33Å; L209-M213 VanDerWaalsContact O-CG 3.31Å; L209-M213 WeakPolarHBondContact O-CG 3.37Å; L209-M213 PolarHBondContact O-N 3.04Å; L209-I248 HydrophobicContact CD1-CD1 4.32Å; L209-I249 HydrophobicContact CD2-CD1 4.09Å; L209-I249 HydrophobicContact CD2-CG1 3.98Å
210	G	95.3	Very high	91.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-54.3	-49.2	172.7	0	0	0	0	0	112.2	G206 Y207 L208 V212 M213 L214	G206-G210 PolarHBondContact O-N 3.06Å; Y207-G210 PolarHBondContact O-N 3.43Å; L208-G210 VanDerWaalsContact C-N 3.34Å; L208-G210 PolarHBondContact O-N 3.28Å; G210-V212 VanDerWaalsContact C-N 3.31Å; G210-V212 PolarHBondContact O-N 2.85Å; G210-M213 PolarHBondContact O-N 3.4Å; G210-L214 VanDerWaalsContact O-CB 3.3Å; G210-L214 WeakPolarHBondContact O-CB 3.37Å; G210-L214 WeakPolarHBondContact O-CG 3.12Å; G210-L214 PolarHBondContact O-N 3.25Å
211	S	95.1	Very high	91	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.014	19%	0.185	C	C	.	.	H	α-helix	trans	-56	-42.5	176.5	155.8	0	0	0	0	112.8	Y207 L208 L209 R215 A345 L349	Y207-S211 PolarHBondContact O-N 3.36Å; L208-S211 WeakPolarHBondContact O-CB 3.38Å; L208-S211 PolarHBondContact O-N 2.9Å; L209-S211 PolarHBondContact O-N 3.13Å; S211-R215 WeakPolarHBondContact O-CG 3.41Å; S211-A345 WeakPolarHBondContact CB-O 3.49Å; S211-A345 WeakPolarHBondContact O-CB 3.19Å; S211-A345 PolarHBondContact OG-O 3.4Å; S211-L349 WeakPolarHBondContact OG-CB 3.4Å
212	V	95.2	Very high	90.2	Very high	69 Å²	69	38.1 Å²	38.1	42%	0.418	18%	0.184	S	C	.	.	H	α-helix	trans	-69.4	-49.1	179.2	-178.7	0	0	0	0	110.6	L208 L209 G210 L214 R215 F216	L208-V212 WeakPolarHBondContact O-CG2 3.21Å; L208-V212 PolarHBondContact O-N 2.99Å; L208-V212 VanDerWaalsContact O-N 3.12Å; L209-V212 PolarHBondContact O-N 3.21Å; G210-V212 VanDerWaalsContact C-N 3.31Å; G210-V212 PolarHBondContact O-N 2.85Å; V212-L214 VanDerWaalsContact C-N 3.31Å; V212-L214 PolarHBondContact O-N 3.36Å; V212-R215 WeakPolarHBondContact O-CB 3.43Å; V212-R215 PolarHBondContact O-N 2.93Å; V212-F216 HydrophobicContact CG1-CE2 4.43Å
213	M	94.3	Very high	88.5	Confident	21 Å²	21	40 Å²	40	10%	0.103	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-35.1	-176.6	-64.1	-59.8	107.4	0	0	112.4	Y40 L209 G210 R215 F216 M244 I248	Y40-M213 HydrophobicContact CE2-CB 4.31Å; Y40-M213 HydrophobicContact CE2-CG 4.1Å; L209-M213 HydrophobicContact CD1-CE 4.07Å; L209-M213 HydrophobicContact CD1-CG 4.11Å; L209-M213 HydrophobicContact CG-CG 4.33Å; L209-M213 VanDerWaalsContact O-CG 3.31Å; L209-M213 WeakPolarHBondContact O-CG 3.37Å; L209-M213 PolarHBondContact O-N 3.04Å; G210-M213 PolarHBondContact O-N 3.4Å; M213-R215 PolarHBondContact O-N 3.24Å; M213-F216 PolarHBondContact O-N 3.3Å; M213-F216 VanDerWaalsContact O-N 3.15Å; M213-M244 HydrophobicContact CG-CB 4.46Å; M213-M244 HydrophobicContact SD-CB 3.75Å; M213-I248 HydrophobicContact CE-CD1 4.42Å; M213-I248 HydrophobicContact SD-CD1 4.13Å
214	L	91.8	Very high	86.5	Confident	2 Å²	2	42 Å²	42	1%	0.01	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-8.5	179.5	-67.6	176.9	0	0	0	114.3	T44 T47 G210 V212 F216 W238 G240 W242 V344 A345	T44-L214 HydrophobicContact CG2-CD2 4.27Å; T47-L214 HydrophobicContact CG2-CD1 4.46Å; T47-L214 HydrophobicContact CG2-CD2 3.62Å; G210-L214 VanDerWaalsContact O-CB 3.3Å; G210-L214 WeakPolarHBondContact O-CB 3.37Å; G210-L214 WeakPolarHBondContact O-CG 3.12Å; G210-L214 PolarHBondContact O-N 3.25Å; V212-L214 VanDerWaalsContact C-N 3.31Å; V212-L214 PolarHBondContact O-N 3.36Å; L214-F216 VanDerWaalsContact C-N 3.34Å; L214-W238 PolarHBondContact O-NE1 3.46Å; L214-G240 WeakPolarHBondContact O-CA 3.22Å; L214-W242 HydrophobicContact CD2-CB 4.34Å; L214-V344 HydrophobicContact CD1-CG1 3.93Å; L214-A345 HydrophobicContact CB-CB 4.22Å
215	R	89.3	Confident	84.2	Confident	142 Å²	142	48.3 Å²	48.3	54%	0.536	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-16.8	170.7	-66.5	176.5	-176.3	-161	-0.8	113.4	S211 V212 M213 W238 A345	S211-R215 WeakPolarHBondContact O-CG 3.41Å; V212-R215 WeakPolarHBondContact O-CB 3.43Å; V212-R215 PolarHBondContact O-N 2.93Å; M213-R215 PolarHBondContact O-N 3.24Å; R215-W238 WeakPolarHBondContact O-CZ2 2.9Å; R215-A345 HydrophobicContact CG-CB 3.76Å
216	F	88.2	Confident	81.8	Confident	111 Å²	111	47.3 Å²	47.3	49%	0.487	27%	0.273	S	S	.	.	S	Bend	trans	-89.4	141.9	173.2	-63.3	-78.1	0	0	0	109.6	V212 M213 L214 W238 G240 A241	V212-F216 HydrophobicContact CG1-CE2 4.43Å; M213-F216 PolarHBondContact O-N 3.3Å; M213-F216 VanDerWaalsContact O-N 3.15Å; L214-F216 VanDerWaalsContact C-N 3.34Å; F216-W238 VanDerWaalsContact C-CZ2 3.49Å; F216-G240 CarbonylContact O-C 3.33Å; F216-G240 VanDerWaalsContact O-CA 3.28Å; F216-G240 WeakPolarHBondContact O-CA 3.31Å; F216-A241 HydrophobicContact CB-CB 4.05Å; F216-A241 PolarHBondContact O-N 3.45Å
217	Y	85.9	Confident	79.4	Confident	29 Å²	29	53.5 Å²	53.5	11%	0.114	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-68.1	144.6	177.9	-174.5	-106.2	0	0	0	110.8	Y114 D219 V220 V228 W238	Y114-Y217 WeakPolarHBondContact CD1-OH 3.33Å; Y217-D219 VanDerWaalsContact C-N 3.29Å; Y217-D219 HydrophobicContact CD1-CB 4.31Å; Y217-D219 HydrophobicContact CE1-CB 4.1Å; Y217-D219 PolarHBondContact O-N 2.98Å; Y217-V220 WeakPolarHBondContact O-CB 3.22Å; Y217-V220 PolarHBondContact O-N 3.38Å; Y217-V228 HydrophobicContact CD1-CG1 4.04Å; Y217-V228 HydrophobicContact CD1-CG2 4.31Å; Y217-V228 HydrophobicContact CD2-CG1 4.22Å; Y217-V228 HydrophobicContact CE1-CG1 4.16Å; Y217-V228 HydrophobicContact CE1-CG2 4.3Å; Y217-V228 HydrophobicContact CE2-CG1 4.34Å; Y217-V228 HydrophobicContact CG-CG1 4.05Å; Y217-W238 HydrophobicContact CD2-CD2 4.42Å; Y217-W238 HydrophobicContact CD2-CE3 4.02Å; Y217-W238 HydrophobicContact CD2-CH2 4.32Å; Y217-W238 AromaticContact CD2-CZ3 3.97Å; Y217-W238 HydrophobicContact CD2-CZ3 3.97Å
218	V	85.1	Confident	77.2	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-34.9	-168.8	69.4	0	0	0	0	114.8	R51 H108 Y114 V239 W243	R51-V218 VanDerWaalsContact NH1-CG1 3.34Å; H108-V218 PolarHBondContact CE1-O 2.87Å; Y114-V218 HydrophobicContact CD1-CG1 4.26Å; Y114-V218 HydrophobicContact CG-CG1 4.3Å; V218-V239 HydrophobicContact CB-CB 4.1Å; V218-V239 HydrophobicContact CB-CG1 3.8Å; V218-V239 WeakPolarHBondContact CB-O 3.49Å; V218-V239 HydrophobicContact CG1-CB 3.93Å; V218-V239 HydrophobicContact CG1-CG1 3.99Å; V218-V239 HydrophobicContact CG2-CG1 3.96Å; V218-V239 PolarHBondContact N-O 2.99Å; V218-W243 PolarHBondContact O-NE1 3.27Å
219	D	82.3	Confident	74.9	Confident	9 Å²	9	57.8 Å²	57.8	5%	0.048	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	32.4	-177.2	-64	-25.2	0	0	0	113.1	R51 H108 Y114 Y217 N221 R222 S223	R51-D219 IonicContact CZ-OD1 2.8Å; R51-D219 IonicContact NH1-OD1 3.64Å; R51-D219 PolarHBondContact NH1-OD1 3.27Å; R51-D219 IonicContact NH2-OD1 3.71Å; H108-D219 IonicContact CE1-OD1 3.32Å; H108-D219 PolarHBondContact CE1-OD1 3.09Å; H108-D219 VanDerWaalsContact CE1-OD1 3.25Å; H108-D219 IonicContact ND1-OD1 2.64Å; Y114-D219 WeakPolarHBondContact CB-OD2 3.46Å; Y114-D219 PolarHBondContact N-OD2 3.47Å; Y217-D219 VanDerWaalsContact C-N 3.29Å; Y217-D219 HydrophobicContact CD1-CB 4.31Å; Y217-D219 HydrophobicContact CE1-CB 4.1Å; Y217-D219 PolarHBondContact O-N 2.98Å; D219-N221 PolarHBondContact O-N 3.11Å; D219-R222 HydrophobicContact CB-CB 4.48Å; D219-R222 PolarHBondContact O-N 3.3Å; D219-R222 IonicContact OD1-NH1 3.1Å; D219-S223 PolarHBondContact O-N 3.05Å; D219-S223 PolarHBondContact O-OG 3.49Å
220	V	80.8	Confident	72.8	Confident	69 Å²	69	57.8 Å²	57.8	42%	0.418	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-24	176.2	66	0	0	0	0	114.2	Y217 W243	Y217-V220 WeakPolarHBondContact O-CB 3.22Å; Y217-V220 PolarHBondContact O-N 3.38Å; V220-W243 HydrophobicContact CG1-CZ2 4.03Å
221	N	75.6	Confident	71	Confident	67 Å²	67	60 Å²	60	36%	0.358	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-16.6	178.3	59.5	-6.3	0	0	0	114.3	H108 D219 W243	H108-N221 PolarHBondContact NE2-ND2 3.48Å; D219-N221 PolarHBondContact O-N 3.11Å; N221-W243 HydrophobicContact CB-CH2 4.18Å; N221-W243 HydrophobicContact CB-CZ2 4.15Å
222	R	72.4	Confident	69.4	Low	90 Å²	90	62.3 Å²	62.3	34%	0.34	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-21	-174.9	-69.8	-179.9	-174.5	94.4	-14.4	112.8	H108 F109 D219 G224	H108-R222 PolarHBondContact CE1-NH1 2.87Å; H108-R222 PolarHBondContact NE2-NH1 2.84Å; H108-R222 PolarHBondContact O-NH2 3.48Å; F109-R222 PolarHBondContact O-NH2 3.33Å; D219-R222 HydrophobicContact CB-CB 4.48Å; D219-R222 PolarHBondContact O-N 3.3Å; D219-R222 IonicContact OD1-NH1 3.1Å; R222-G224 PolarHBondContact O-N 3.45Å
223	S	59	Low	67.9	Low	40 Å²	40	61.3 Å²	61.3	28%	0.28	37%	0.371	S	S	.	.			trans	-79.5	107.4	173.9	41.1	0	0	0	0	110.4	D219 S225	D219-S223 PolarHBondContact O-N 3.05Å; D219-S223 PolarHBondContact O-OG 3.49Å; S223-S225 PolarHBondContact O-N 3.05Å
224	G	52.3	Low	66.3	Low	58 Å²	58	64.9 Å²	64.9	60%	0.598	39%	0.394	S	S	*	.			trans	-52.7	138.1	154	0	0	0	0	0	108.4	R222 G226	R222-G224 PolarHBondContact O-N 3.45Å; G224-G226 PolarHBondContact O-N 3.42Å
225	S	43.7	Very low	64.8	Low	134 Å²	134	67.5 Å²	67.5	94%	0.937	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	14.4	-164.8	-52.1	0	0	0	0	118.8	S223	S223-S225 PolarHBondContact O-N 3.05Å
226	G	45.8	Very low	63.4	Low	58 Å²	58	63.6 Å²	63.6	60%	0.598	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.3	-6.5	-174.2	0	0	0	0	0	118.1	G224	G224-G226 PolarHBondContact O-N 3.42Å
227	V	47.7	Very low	62.3	Low	129 Å²	129	58.3 Å²	58.3	78%	0.782	38%	0.377	S	S	*	.	S	Bend	trans	-103	-18	-169.7	-177	0	0	0	0	115
228	V	50	Low	62	Low	45 Å²	45	58 Å²	58	27%	0.273	38%	0.376	S	S	.	.			trans	-112.6	29.4	-173.5	-156.3	0	0	0	0	113.3	Y217 G230 L231	Y217-V228 HydrophobicContact CD1-CG1 4.04Å; Y217-V228 HydrophobicContact CD1-CG2 4.31Å; Y217-V228 HydrophobicContact CD2-CG1 4.22Å; Y217-V228 HydrophobicContact CE1-CG1 4.16Å; Y217-V228 HydrophobicContact CE1-CG2 4.3Å; Y217-V228 HydrophobicContact CE2-CG1 4.34Å; Y217-V228 HydrophobicContact CG-CG1 4.05Å; V228-G230 PolarHBondContact O-N 2.94Å; V228-L231 HydrophobicContact CG1-CD1 4.29Å
229	T	46.8	Very low	62	Low	105 Å²	105	58 Å²	58	64%	0.644	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	35.7	171.5	51.5	0	0	0	0	112.3	F461	T229-F461 WeakPolarHBondContact O-CE2 3.49Å; T229-F461 VanDerWaalsContact O-CZ 3.24Å; T229-F461 WeakPolarHBondContact O-CZ 3.35Å
230	G	51.8	Low	62.3	Low	34 Å²	34	57.5 Å²	57.5	35%	0.351	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.7	-16.9	-165.4	0	0	0	0	0	115.8	V228 F461	V228-G230 PolarHBondContact O-N 2.94Å; G230-F461 WeakPolarHBondContact O-CE1 3.45Å
231	L	58.5	Low	62.8	Low	45 Å²	45	54.2 Å²	54.2	24%	0.236	35%	0.354	C	S	.	.			trans	-121	131.1	-179.4	-71.7	109.9	0	0	0	110.7	V228 D235 W238	V228-L231 HydrophobicContact CG1-CD1 4.29Å; L231-D235 WeakPolarHBondContact CA-OD2 3.26Å; L231-D235 HydrophobicContact CD2-CB 4.27Å; L231-W238 HydrophobicContact CB-CE3 4.07Å; L231-W238 HydrophobicContact CB-CZ3 4.44Å; L231-W238 VanDerWaalsContact O-CZ3 3.28Å; L231-W238 WeakPolarHBondContact O-CZ3 3.39Å
232	S	62	Low	63.7	Low	52 Å²	52	51 Å²	51	36%	0.364	34%	0.337	S	S	.	.			trans	-93.5	153.7	171.2	176.3	0	0	0	0	110.3	V234 D235	S232-V234 PolarHBondContact O-N 3.3Å; S232-D235 PolarHBondContact N-OD2 3.5Å; S232-D235 WeakPolarHBondContact O-CB 3.48Å; S232-D235 PolarHBondContact O-N 3.04Å
233	P	62	Low	64.7	Low	47 Å²	47	47.5 Å²	47.5	31%	0.305	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-12.4	170.7	-27.3	35.8	0	0	0	115.8	W238	P233-W238 HydrophobicContact CB-CD2 4.33Å; P233-W238 HydrophobicContact CG-CD2 4.38Å; P233-W238 HydrophobicContact CG-CH2 4.26Å; P233-W238 HydrophobicContact CG-CZ2 4.05Å
234	V	61.2	Low	66.4	Low	97 Å²	97	48.8 Å²	48.8	59%	0.588	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-18	175.9	-170.8	0	0	0	0	111.8	S232 P343	S232-V234 PolarHBondContact O-N 3.3Å; V234-P343 HydrophobicContact CG2-CG 3.95Å
235	D	60.5	Low	68.4	Low	57 Å²	57	46 Å²	46	31%	0.305	30%	0.297	S	S	.	.	S	Bend	trans	-76	147.3	-172	-69.3	-32.7	0	0	0	113.2	R50 L231 S232 G237 W238	R50-D235 PolarHBondContact NH2-O 3.25Å; L231-D235 WeakPolarHBondContact CA-OD2 3.26Å; L231-D235 HydrophobicContact CD2-CB 4.27Å; S232-D235 PolarHBondContact N-OD2 3.5Å; S232-D235 WeakPolarHBondContact O-CB 3.48Å; S232-D235 PolarHBondContact O-N 3.04Å; D235-G237 PolarHBondContact O-N 2.97Å; D235-G237 VanDerWaalsContact O-N 3.15Å; D235-W238 VanDerWaalsContact O-CB 3.27Å; D235-W238 WeakPolarHBondContact O-CB 3.39Å; D235-W238 PolarHBondContact O-N 2.78Å
236	P	59.9	Low	70.9	Confident	60 Å²	60	39.6 Å²	39.6	39%	0.39	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.9	178.7	23.7	-33.3	0	0	0	113.9	R50 W238	R50-P236 PolarHBondContact NH2-O 3.39Å; P236-W238 VanDerWaalsContact C-N 3.34Å
237	G	65.6	Low	73.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-4.6	174.1	0	0	0	0	0	115.3	Y114 H116 D235 V239	Y114-G237 WeakPolarHBondContact CE1-O 3.5Å; H116-G237 WeakPolarHBondContact CD2-CA 3.32Å; H116-G237 WeakPolarHBondContact NE2-CA 3.4Å; D235-G237 PolarHBondContact O-N 2.97Å; D235-G237 VanDerWaalsContact O-N 3.15Å; G237-V239 PolarHBondContact O-N 3.23Å
238	W	78.8	Confident	75.7	Confident	21 Å²	21	37.1 Å²	37.1	8%	0.08	22%	0.22	C	C	.	.			trans	-74.1	116.6	-174.6	-173.7	-90.5	0	0	0	111.5	R50 L214 R215 F216 Y217 L231 P233 D235 P236	R50-W238 PolarHBondContact NH2-O 3.01Å; R50-W238 VanDerWaalsContact NH2-O 3.15Å; L214-W238 PolarHBondContact O-NE1 3.46Å; R215-W238 WeakPolarHBondContact O-CZ2 2.9Å; F216-W238 VanDerWaalsContact C-CZ2 3.49Å; Y217-W238 HydrophobicContact CD2-CD2 4.42Å; Y217-W238 HydrophobicContact CD2-CE3 4.02Å; Y217-W238 HydrophobicContact CD2-CH2 4.32Å; Y217-W238 AromaticContact CD2-CZ3 3.97Å; Y217-W238 HydrophobicContact CD2-CZ3 3.97Å; L231-W238 HydrophobicContact CB-CE3 4.07Å; L231-W238 HydrophobicContact CB-CZ3 4.44Å; L231-W238 VanDerWaalsContact O-CZ3 3.28Å; L231-W238 WeakPolarHBondContact O-CZ3 3.39Å; P233-W238 HydrophobicContact CB-CD2 4.33Å; P233-W238 HydrophobicContact CG-CD2 4.38Å; P233-W238 HydrophobicContact CG-CH2 4.26Å; P233-W238 HydrophobicContact CG-CZ2 4.05Å; D235-W238 VanDerWaalsContact O-CB 3.27Å; D235-W238 WeakPolarHBondContact O-CB 3.39Å; D235-W238 PolarHBondContact O-N 2.78Å; P236-W238 VanDerWaalsContact C-N 3.34Å
239	V	85.3	Confident	77.9	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.207	C	C	.	.			trans	-112.4	120.4	166.6	-178.6	0	0	0	0	107.2	R51 Y114 V218 G237	R51-V239 HydrophobicContact CB-CG1 4Å; Y114-V239 HydrophobicContact CD1-CB 4.48Å; Y114-V239 HydrophobicContact CD1-CG2 4.2Å; Y114-V239 HydrophobicContact CD2-CG2 4.4Å; Y114-V239 HydrophobicContact CE1-CB 4.33Å; Y114-V239 HydrophobicContact CE1-CG2 3.68Å; Y114-V239 HydrophobicContact CE2-CG2 3.89Å; V218-V239 HydrophobicContact CB-CB 4.1Å; V218-V239 HydrophobicContact CB-CG1 3.8Å; V218-V239 WeakPolarHBondContact CB-O 3.49Å; V218-V239 HydrophobicContact CG1-CB 3.93Å; V218-V239 HydrophobicContact CG1-CG1 3.99Å; V218-V239 HydrophobicContact CG2-CG1 3.96Å; V218-V239 PolarHBondContact N-O 2.99Å; G237-V239 PolarHBondContact O-N 3.23Å
240	G	88.1	Confident	80.3	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-76.9	156.1	177.8	0	0	0	0	0	112.9	L214 F216 W242	L214-G240 WeakPolarHBondContact O-CA 3.22Å; F216-G240 CarbonylContact O-C 3.33Å; F216-G240 VanDerWaalsContact O-CA 3.28Å; F216-G240 WeakPolarHBondContact O-CA 3.31Å; G240-W242 VanDerWaalsContact C-N 3.26Å; G240-W242 PolarHBondContact O-N 3.43Å
241	A	91.7	Very high	82.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.178	C	C	.	.			trans	-71.6	72.4	179.3	0	0	0	0	0	113	F216 W243 M244	F216-A241 HydrophobicContact CB-CB 4.05Å; F216-A241 PolarHBondContact O-N 3.45Å; A241-W243 PolarHBondContact O-N 3.43Å; A241-M244 HydrophobicContact CB-CG 4.04Å; A241-M244 PolarHBondContact O-N 3.49Å
242	W	93.9	Very high	84.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.5	-178.9	63	-92.6	0	0	0	114.8	Y40 T44 I48 Y52 L104 P107 H108 L214 G240 L246	Y40-W242 VanDerWaalsContact CE1-O 3.32Å; Y40-W242 WeakPolarHBondContact CE1-O 3.4Å; Y40-W242 PolarHBondContact OH-O 3.25Å; T44-W242 HydrophobicContact CG2-CB 3.74Å; I48-W242 HydrophobicContact CD1-CD2 4.27Å; I48-W242 HydrophobicContact CD1-CE3 4Å; I48-W242 HydrophobicContact CG1-CB 4.45Å; I48-W242 HydrophobicContact CG1-CD2 3.81Å; I48-W242 HydrophobicContact CG1-CE3 4.05Å; I48-W242 HydrophobicContact CG1-CG 3.98Å; Y52-W242 AromaticContact CE2-CZ2 3.81Å; Y52-W242 HydrophobicContact CE2-CZ2 3.81Å; L104-W242 WeakPolarHBondContact O-CH2 3.38Å; L104-W242 VanDerWaalsContact O-CZ3 3.28Å; L104-W242 WeakPolarHBondContact O-CZ3 3.27Å; P107-W242 HydrophobicContact CB-CH2 4.34Å; H108-W242 HydrophobicContact CB-CH2 4.17Å; H108-W242 HydrophobicContact CB-CZ2 3.76Å; L214-W242 HydrophobicContact CD2-CB 4.34Å; G240-W242 VanDerWaalsContact C-N 3.26Å; G240-W242 PolarHBondContact O-N 3.43Å; W242-L246 HydrophobicContact CE3-CD1 4.01Å; W242-L246 HydrophobicContact CZ3-CD1 3.89Å
243	W	94.5	Very high	86	Confident	15 Å²	15	29.7 Å²	29.7	6%	0.057	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-26.9	-176.9	59	-91.8	0	0	0	112.9	T105 H108 F109 V218 V220 N221 A241 G245 L246 L247	T105-W243 HydrophobicContact CG2-CB 4.32Å; T105-W243 WeakPolarHBondContact CG2-O 3.46Å; H108-W243 HydrophobicContact CB-CB 4.13Å; H108-W243 HydrophobicContact CB-CG 4.11Å; H108-W243 AromaticContact CD2-CD1 3.49Å; H108-W243 VanDerWaalsContact CD2-CD1 3.49Å; H108-W243 AromaticContact CD2-CD2 3.72Å; H108-W243 AromaticContact CD2-CE2 3.57Å; H108-W243 AromaticContact CD2-CG 3.69Å; H108-W243 AromaticContact CD2-NE1 3.43Å; H108-W243 PolarHBondContact CD2-NE1 3.36Å; H108-W243 AromaticContact CE1-CD1 3.66Å; H108-W243 AromaticContact CE1-NE1 3.29Å; H108-W243 PolarHBondContact CE1-NE1 3.45Å; H108-W243 VanDerWaalsContact CE1-NE1 3.29Å; H108-W243 AromaticContact CG-CD1 3.37Å; H108-W243 AromaticContact CG-CG 3.75Å; H108-W243 AromaticContact CG-NE1 3.72Å; H108-W243 AromaticContact ND1-CD1 3.5Å; H108-W243 AromaticContact ND1-NE1 3.65Å; H108-W243 AromaticContact NE2-CD1 3.7Å; H108-W243 AromaticContact NE2-CE2 3.43Å; H108-W243 AromaticContact NE2-CZ2 3.82Å; H108-W243 AromaticContact NE2-NE1 3.17Å; H108-W243 PolarHBondContact NE2-NE1 3.41Å; H108-W243 VanDerWaalsContact NE2-NE1 3.17Å; F109-W243 HydrophobicContact CE2-CE3 4.38Å; F109-W243 AromaticContact CZ-CE3 3.9Å; F109-W243 HydrophobicContact CZ-CE3 3.9Å; F109-W243 AromaticContact CZ-CZ3 3.87Å; F109-W243 HydrophobicContact CZ-CZ3 3.87Å; V218-W243 PolarHBondContact O-NE1 3.27Å; V220-W243 HydrophobicContact CG1-CZ2 4.03Å; N221-W243 HydrophobicContact CB-CH2 4.18Å; N221-W243 HydrophobicContact CB-CZ2 4.15Å; A241-W243 PolarHBondContact O-N 3.43Å; W243-G245 PolarHBondContact O-N 3.29Å; W243-L246 WeakPolarHBondContact O-CB 3.19Å; W243-L246 PolarHBondContact O-N 2.88Å; W243-L247 HydrophobicContact CE3-CD1 3.75Å; W243-L247 HydrophobicContact CE3-CG 4.48Å; W243-L247 HydrophobicContact CZ3-CD1 3.66Å; W243-L247 PolarHBondContact O-N 3.28Å
244	M	94.1	Very high	87.7	Confident	67 Å²	67	29.6 Å²	29.6	33%	0.33	17%	0.166	S	C	.	.	H	α-helix	trans	-61.8	-44.8	-174.2	-79.9	-72.2	-72.9	0	0	112.6	M213 A241 L246 L247 I248	M213-M244 HydrophobicContact CG-CB 4.46Å; M213-M244 HydrophobicContact SD-CB 3.75Å; A241-M244 HydrophobicContact CB-CG 4.04Å; A241-M244 PolarHBondContact O-N 3.49Å; M244-L246 VanDerWaalsContact C-N 3.31Å; M244-L246 PolarHBondContact O-N 2.92Å; M244-L247 PolarHBondContact O-N 2.66Å; M244-I248 PolarHBondContact O-N 2.91Å
245	G	94.9	Very high	89.4	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-70.9	-27.7	-179.2	0	0	0	0	0	112.8	Y40 W243 L247 I248 I249	Y40-G245 VanDerWaalsContact OH-CA 3.26Å; Y40-G245 WeakPolarHBondContact OH-CA 3.46Å; Y40-G245 PolarHBondContact OH-N 3.18Å; W243-G245 PolarHBondContact O-N 3.29Å; G245-L247 VanDerWaalsContact C-N 3.29Å; G245-L247 PolarHBondContact O-N 3.2Å; G245-I248 PolarHBondContact O-N 3.19Å; G245-I249 WeakPolarHBondContact O-CB 3.46Å; G245-I249 VanDerWaalsContact O-CD1 3.29Å; G245-I249 WeakPolarHBondContact O-CD1 3.44Å; G245-I249 WeakPolarHBondContact O-CG1 3.3Å; G245-I249 PolarHBondContact O-N 3.07Å
246	L	96.6	Very high	91.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-34.8	173.7	-66.5	170.9	0	0	0	112	Y37 Y40 L104 T105 W242 W243 M244 I249 S250	Y37-L246 HydrophobicContact CD2-CD2 4.06Å; Y37-L246 HydrophobicContact CE2-CD2 3.85Å; Y40-L246 HydrophobicContact CD1-CD2 3.71Å; Y40-L246 HydrophobicContact CD1-CG 4.04Å; Y40-L246 HydrophobicContact CE1-CD2 3.96Å; Y40-L246 HydrophobicContact CE1-CG 3.74Å; L104-L246 HydrophobicContact CB-CD1 4.11Å; L104-L246 HydrophobicContact CD2-CD1 3.79Å; L104-L246 HydrophobicContact CD2-CD2 3.98Å; L104-L246 HydrophobicContact CG-CD1 4.01Å; T105-L246 HydrophobicContact CG2-CB 3.42Å; T105-L246 VanDerWaalsContact CG2-CB 3.42Å; T105-L246 HydrophobicContact CG2-CD1 3.89Å; T105-L246 HydrophobicContact CG2-CG 4.29Å; W242-L246 HydrophobicContact CE3-CD1 4.01Å; W242-L246 HydrophobicContact CZ3-CD1 3.89Å; W243-L246 WeakPolarHBondContact O-CB 3.19Å; W243-L246 PolarHBondContact O-N 2.88Å; M244-L246 VanDerWaalsContact C-N 3.31Å; M244-L246 PolarHBondContact O-N 2.92Å; L246-I249 PolarHBondContact O-N 2.85Å; L246-S250 WeakPolarHBondContact O-CB 3.49Å; L246-S250 PolarHBondContact O-N 3.34Å
247	L	96.3	Very high	92.8	Very high	68 Å²	68	24.5 Å²	24.5	36%	0.356	13%	0.132	S	C	.	.	H	α-helix	trans	-67	-44.2	174.4	-63.2	178.3	0	0	0	111.8	T105 W243 M244 G245 I249 S250 G251	T105-L247 HydrophobicContact CG2-CD2 3.93Å; T105-L247 HydrophobicContact CG2-CG 4.15Å; W243-L247 HydrophobicContact CE3-CD1 3.75Å; W243-L247 HydrophobicContact CE3-CG 4.48Å; W243-L247 HydrophobicContact CZ3-CD1 3.66Å; W243-L247 PolarHBondContact O-N 3.28Å; M244-L247 PolarHBondContact O-N 2.66Å; G245-L247 VanDerWaalsContact C-N 3.29Å; G245-L247 PolarHBondContact O-N 3.2Å; L247-I249 VanDerWaalsContact C-N 3.31Å; L247-I249 PolarHBondContact O-N 2.97Å; L247-S250 PolarHBondContact O-N 3.01Å; L247-G251 PolarHBondContact O-N 3.08Å
248	I	96.8	Very high	94.2	Very high	67 Å²	67	28.3 Å²	28.3	34%	0.344	15%	0.152	S	C	.	.	H	α-helix	trans	-59.2	-46.3	175.7	-62.4	171.7	0	0	0	110.1	L209 M213 M244 G245 G251 F252	L209-I248 HydrophobicContact CD1-CD1 4.32Å; M213-I248 HydrophobicContact CE-CD1 4.42Å; M213-I248 HydrophobicContact SD-CD1 4.13Å; M244-I248 PolarHBondContact O-N 2.91Å; G245-I248 PolarHBondContact O-N 3.19Å; I248-G251 PolarHBondContact O-N 3.48Å; I248-F252 HydrophobicContact CG2-CD2 4.19Å; I248-F252 HydrophobicContact CG2-CE2 3.72Å; I248-F252 HydrophobicContact CG2-CZ 4.22Å; I248-F252 PolarHBondContact O-N 3.25Å
249	I	97.4	Very high	94.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.8	-40.8	179.7	-67.5	164.5	0	0	0	111.2	L36 Y37 Y40 L209 G245 L246 L247 G251 F252 L253	L36-I249 HydrophobicContact CD2-CD1 4.46Å; L36-I249 HydrophobicContact CD2-CG1 3.68Å; L36-I249 HydrophobicContact CD2-CG2 4.48Å; L36-I249 HydrophobicContact CG-CD1 4.47Å; L36-I249 HydrophobicContact CG-CG1 4.2Å; Y37-I249 HydrophobicContact CD2-CG2 4.07Å; Y37-I249 HydrophobicContact CG-CG2 4.36Å; Y40-I249 HydrophobicContact CD1-CD1 3.71Å; Y40-I249 HydrophobicContact CD2-CD1 3.92Å; Y40-I249 HydrophobicContact CG-CD1 3.35Å; L209-I249 HydrophobicContact CD2-CD1 4.09Å; L209-I249 HydrophobicContact CD2-CG1 3.98Å; G245-I249 WeakPolarHBondContact O-CB 3.46Å; G245-I249 VanDerWaalsContact O-CD1 3.29Å; G245-I249 WeakPolarHBondContact O-CD1 3.44Å; G245-I249 WeakPolarHBondContact O-CG1 3.3Å; G245-I249 PolarHBondContact O-N 3.07Å; L246-I249 PolarHBondContact O-N 2.85Å; L247-I249 VanDerWaalsContact C-N 3.31Å; L247-I249 PolarHBondContact O-N 2.97Å; I249-G251 VanDerWaalsContact C-N 3.28Å; I249-G251 PolarHBondContact O-N 2.84Å; I249-F252 PolarHBondContact O-N 2.92Å; I249-L253 HydrophobicContact CG2-CD1 4.01Å; I249-L253 HydrophobicContact CG2-CG 4.42Å; I249-L253 WeakPolarHBondContact O-CG 3.49Å; I249-L253 PolarHBondContact O-N 2.94Å
250	S	97.5	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-38.2	174.5	-175.7	0	0	0	0	111.9	A98 M102 L246 L247 L253 T254	A98-S250 PolarHBondContact O-OG 3.41Å; M102-S250 WeakPolarHBondContact CE-OG 3.28Å; M102-S250 VanDerWaalsContact CG-OG 3.26Å; M102-S250 WeakPolarHBondContact CG-OG 3.19Å; L246-S250 WeakPolarHBondContact O-CB 3.49Å; L246-S250 PolarHBondContact O-N 3.34Å; L247-S250 PolarHBondContact O-N 3.01Å; S250-L253 PolarHBondContact O-N 3.09Å; S250-T254 WeakPolarHBondContact O-CB 3.39Å; S250-T254 PolarHBondContact O-N 3.48Å; S250-T254 PolarHBondContact O-OG1 3.39Å
251	G	97.4	Very high	95.6	Very high	38 Å²	38	32.2 Å²	32.2	39%	0.392	17%	0.172	S	C	.	.	H	α-helix	trans	-59.2	-47.8	170.9	0	0	0	0	0	112.7	L247 I248 I249 T254 L255	L247-G251 PolarHBondContact O-N 3.08Å; I248-G251 PolarHBondContact O-N 3.48Å; I249-G251 VanDerWaalsContact C-N 3.28Å; I249-G251 PolarHBondContact O-N 2.84Å; G251-T254 PolarHBondContact O-N 3.32Å; G251-L255 WeakPolarHBondContact O-CB 3.29Å; G251-L255 PolarHBondContact O-N 3.17Å
252	F	96.9	Very high	95.6	Very high	86 Å²	86	37.9 Å²	37.9	38%	0.377	20%	0.197	S	C	.	.	H	α-helix	trans	-64.6	-39.7	176.3	-68.7	-37.4	0	0	0	113.3	F29 L36 I248 I249 L255 S256	F29-F252 HydrophobicContact CZ-CD1 4.18Å; L36-F252 HydrophobicContact CD2-CD2 3.98Å; I248-F252 HydrophobicContact CG2-CD2 4.19Å; I248-F252 HydrophobicContact CG2-CE2 3.72Å; I248-F252 HydrophobicContact CG2-CZ 4.22Å; I248-F252 PolarHBondContact O-N 3.25Å; I249-F252 PolarHBondContact O-N 2.92Å; F252-L255 PolarHBondContact O-N 3.14Å; F252-S256 VanDerWaalsContact O-CB 3.27Å; F252-S256 WeakPolarHBondContact O-CB 3.41Å; F252-S256 PolarHBondContact O-N 3.24Å; F252-S256 PolarHBondContact O-OG 3.32Å
253	L	97.3	Very high	95.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63	-42.9	174.6	-74	168.1	0	0	0	111.3	L30 M97 A98 F164 I249 S250 S256 S257	L30-L253 HydrophobicContact CD1-CD2 4.39Å; M97-L253 HydrophobicContact CB-CD1 4.14Å; M97-L253 HydrophobicContact CB-CD2 4.48Å; M97-L253 HydrophobicContact CE-CD2 3.95Å; A98-L253 HydrophobicContact CB-CB 3.82Å; F164-L253 HydrophobicContact CE2-CD1 4.44Å; I249-L253 HydrophobicContact CG2-CD1 4.01Å; I249-L253 HydrophobicContact CG2-CG 4.42Å; I249-L253 WeakPolarHBondContact O-CG 3.49Å; I249-L253 PolarHBondContact O-N 2.94Å; S250-L253 PolarHBondContact O-N 3.09Å; L253-S256 WeakPolarHBondContact CA-OG 3.09Å; L253-S256 PolarHBondContact O-OG 3.13Å; L253-S257 VanDerWaalsContact O-CB 3.28Å; L253-S257 WeakPolarHBondContact O-CB 3.39Å; L253-S257 PolarHBondContact O-N 3.35Å; L253-S257 PolarHBondContact O-OG 3.23Å
254	T	97.3	Very high	95.1	Very high	45 Å²	45	39.1 Å²	39.1	28%	0.276	21%	0.207	S	C	.	.	H	α-helix	trans	-63.6	-49.2	176.8	-55.3	0	0	0	0	110.9	L95 A98 S250 G251 S256 S257 I258	L95-T254 HydrophobicContact CD2-CG2 4.08Å; A98-T254 WeakPolarHBondContact CB-OG1 3.45Å; S250-T254 WeakPolarHBondContact O-CB 3.39Å; S250-T254 PolarHBondContact O-N 3.48Å; S250-T254 PolarHBondContact O-OG1 3.39Å; G251-T254 PolarHBondContact O-N 3.32Å; T254-S256 PolarHBondContact O-N 3.21Å; T254-S257 PolarHBondContact O-N 3.12Å; T254-S257 VanDerWaalsContact O-N 3.14Å; T254-I258 HydrophobicContact CG2-CD1 4.34Å; T254-I258 WeakPolarHBondContact O-CG1 3.45Å; T254-I258 PolarHBondContact O-N 3.21Å
255	L	96.7	Very high	94.7	Very high	105 Å²	105	41.8 Å²	41.8	55%	0.55	21%	0.213	S	C	.	.	H	α-helix	trans	-62	-41.7	-179.6	-177.9	61.9	0	0	0	112.3	G251 F252 S257 P259	G251-L255 WeakPolarHBondContact O-CB 3.29Å; G251-L255 PolarHBondContact O-N 3.17Å; F252-L255 PolarHBondContact O-N 3.14Å; L255-S257 VanDerWaalsContact C-N 3.28Å; L255-S257 PolarHBondContact O-N 2.88Å; L255-P259 WeakPolarHBondContact O-CD 3.41Å
256	S	95.4	Very high	93.9	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-70.9	-21.7	177.3	56.4	0	0	0	0	113.6	F29 L30 F252 L253 T254 Y260	F29-S256 VanDerWaalsContact CD1-CB 3.41Å; L30-S256 VanDerWaalsContact CD1-OG 3.3Å; L30-S256 WeakPolarHBondContact CD1-OG 3.42Å; F252-S256 VanDerWaalsContact O-CB 3.27Å; F252-S256 WeakPolarHBondContact O-CB 3.41Å; F252-S256 PolarHBondContact O-N 3.24Å; F252-S256 PolarHBondContact O-OG 3.32Å; L253-S256 WeakPolarHBondContact CA-OG 3.09Å; L253-S256 PolarHBondContact O-OG 3.13Å; T254-S256 PolarHBondContact O-N 3.21Å; S256-Y260 WeakPolarHBondContact O-CD2 3.15Å; S256-Y260 WeakPolarHBondContact O-CE2 3.49Å
257	S	96.2	Very high	93.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-85.8	-31.5	-178.4	-60.1	0	0	0	0	113.8	G94 L95 L253 T254 L255 Y260	G94-S257 WeakPolarHBondContact CA-OG 3.28Å; L95-S257 PolarHBondContact N-OG 3.5Å; L253-S257 VanDerWaalsContact O-CB 3.28Å; L253-S257 WeakPolarHBondContact O-CB 3.39Å; L253-S257 PolarHBondContact O-N 3.35Å; L253-S257 PolarHBondContact O-OG 3.23Å; T254-S257 PolarHBondContact O-N 3.12Å; T254-S257 VanDerWaalsContact O-N 3.14Å; L255-S257 VanDerWaalsContact C-N 3.28Å; L255-S257 PolarHBondContact O-N 2.88Å; S257-Y260 WeakPolarHBondContact O-CB 3.45Å; S257-Y260 PolarHBondContact O-N 3.28Å
258	I	95	Very high	91.9	Very high	79 Å²	79	50 Å²	50	41%	0.405	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-56.7	-44	-178.4	-69.1	162.1	0	0	0	113.7	T254 Y260 F261 F262	T254-I258 HydrophobicContact CG2-CD1 4.34Å; T254-I258 WeakPolarHBondContact O-CG1 3.45Å; T254-I258 PolarHBondContact O-N 3.21Å; I258-Y260 PolarHBondContact O-N 2.89Å; I258-F261 WeakPolarHBondContact O-CD2 3.39Å; I258-F261 PolarHBondContact O-N 2.93Å; I258-F262 HydrophobicContact CG2-CE2 3.92Å
259	P	94.4	Very high	90.5	Very high	24 Å²	24	48 Å²	48	16%	0.156	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-52.2	-31.1	178.3	-32.2	38.5	0	0	0	114.7	W17 C26 L255 F261 F262 F263	W17-P259 HydrophobicContact CH2-CB 4.04Å; W17-P259 HydrophobicContact CZ3-CB 3.78Å; W17-P259 WeakPolarHBondContact CZ3-O 3.44Å; C26-P259 HydrophobicContact CB-CB 4.39Å; L255-P259 WeakPolarHBondContact O-CD 3.41Å; P259-F261 PolarHBondContact O-N 3.24Å; P259-F262 PolarHBondContact O-N 3.13Å; P259-F262 VanDerWaalsContact O-N 3.15Å; P259-F263 HydrophobicContact CB-CE2 4.3Å; P259-F263 VanDerWaalsContact O-CD2 3.24Å; P259-F263 WeakPolarHBondContact O-CD2 3.16Å
260	Y	93.8	Very high	89.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-64.9	-22.7	-176.3	-78.4	-80.6	0	0	0	115.2	F23 H27 L30 P87 I90 S256 S257 I258 F262	F23-Y260 HydrophobicContact CD2-CE1 4.32Å; F23-Y260 HydrophobicContact CE2-CD1 4.17Å; F23-Y260 AromaticContact CE2-CE1 3.59Å; F23-Y260 HydrophobicContact CE2-CE1 3.59Å; F23-Y260 AromaticContact CZ-CE1 3.98Å; F23-Y260 HydrophobicContact CZ-CE1 3.98Å; H27-Y260 WeakPolarHBondContact CA-OH 3.32Å; H27-Y260 WeakPolarHBondContact CB-OH 3.32Å; H27-Y260 PolarHBondContact N-OH 2.7Å; H27-Y260 AromaticContact ND1-CZ 3.92Å; H27-Y260 PolarHBondContact ND1-OH 2.98Å; L30-Y260 HydrophobicContact CB-CE2 4.27Å; L30-Y260 HydrophobicContact CD2-CD2 4.3Å; L30-Y260 HydrophobicContact CD2-CE2 3.55Å; L30-Y260 HydrophobicContact CG-CE2 4.48Å; P87-Y260 HydrophobicContact CB-CD1 4.16Å; P87-Y260 WeakPolarHBondContact O-CB 3.22Å; P87-Y260 WeakPolarHBondContact O-CD1 3.45Å; I90-Y260 HydrophobicContact CB-CD1 3.9Å; I90-Y260 HydrophobicContact CB-CE1 3.98Å; I90-Y260 HydrophobicContact CB-CG 4.43Å; I90-Y260 HydrophobicContact CD1-CE1 4.08Å; I90-Y260 HydrophobicContact CG2-CD1 3.8Å; I90-Y260 HydrophobicContact CG2-CD2 4.29Å; I90-Y260 HydrophobicContact CG2-CE1 3.51Å; I90-Y260 HydrophobicContact CG2-CE2 4.02Å; I90-Y260 HydrophobicContact CG2-CG 4.18Å; S256-Y260 WeakPolarHBondContact O-CD2 3.15Å; S256-Y260 WeakPolarHBondContact O-CE2 3.49Å; S257-Y260 WeakPolarHBondContact O-CB 3.45Å; S257-Y260 PolarHBondContact O-N 3.28Å; I258-Y260 PolarHBondContact O-N 2.89Å; Y260-F262 VanDerWaalsContact C-N 3.26Å; Y260-F262 PolarHBondContact O-N 3.47Å
261	F	93.5	Very high	87.1	Confident	80 Å²	80	54.4 Å²	54.4	35%	0.351	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-75.2	-18.6	177.9	-65.2	-77.7	0	0	0	113	V92 L95 I258 P259	V92-F261 HydrophobicContact CG2-CE1 4.06Å; V92-F261 HydrophobicContact CG2-CZ 4.12Å; L95-F261 HydrophobicContact CD1-CE2 3.76Å; L95-F261 HydrophobicContact CD1-CZ 3.72Å; L95-F261 HydrophobicContact CG-CE2 4.46Å; I258-F261 WeakPolarHBondContact O-CD2 3.39Å; I258-F261 PolarHBondContact O-N 2.93Å; P259-F261 PolarHBondContact O-N 3.24Å
262	F	92.6	Very high	84.8	Confident	119 Å²	119	58.2 Å²	58.2	52%	0.522	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-16.5	-179.1	-57.8	-77.9	0	0	0	113.6	W17 I258 P259 Y260	W17-F262 HydrophobicContact CD2-CB 3.45Å; W17-F262 VanDerWaalsContact CD2-CB 3.45Å; W17-F262 HydrophobicContact CD2-CG 4.35Å; W17-F262 HydrophobicContact CE3-CB 3.65Å; W17-F262 HydrophobicContact CG-CB 3.91Å; W17-F262 HydrophobicContact CH2-CB 4.13Å; W17-F262 AromaticContact CH2-CD2 3.91Å; W17-F262 HydrophobicContact CH2-CD2 3.91Å; W17-F262 HydrophobicContact CH2-CG 4.28Å; W17-F262 HydrophobicContact CZ2-CB 3.96Å; W17-F262 AromaticContact CZ2-CD2 3.93Å; W17-F262 HydrophobicContact CZ2-CD2 3.93Å; W17-F262 AromaticContact CZ2-CG 3.98Å; W17-F262 HydrophobicContact CZ2-CG 3.98Å; W17-F262 HydrophobicContact CZ3-CB 3.98Å; W17-F262 HydrophobicContact CZ3-CD2 4.39Å; I258-F262 HydrophobicContact CG2-CE2 3.92Å; P259-F262 PolarHBondContact O-N 3.13Å; P259-F262 VanDerWaalsContact O-N 3.15Å; Y260-F262 VanDerWaalsContact C-N 3.26Å; Y260-F262 PolarHBondContact O-N 3.47Å
263	F	90.9	Very high	82.4	Confident	3 Å²	3	61.6 Å²	61.6	1%	0.013	31%	0.314	C	S	.	.	S	Bend	trans	-72.3	137.3	176.4	-76.7	-76.4	0	0	0	111.4	W17 L22 F23 C26 H85 P87 P259 M267	W17-F263 HydrophobicContact CE3-CD2 4.17Å; W17-F263 HydrophobicContact CE3-CE1 4.26Å; W17-F263 AromaticContact CE3-CE2 3.91Å; W17-F263 HydrophobicContact CE3-CE2 3.91Å; W17-F263 HydrophobicContact CE3-CG 4.49Å; W17-F263 AromaticContact CE3-CZ 3.95Å; W17-F263 HydrophobicContact CE3-CZ 3.95Å; W17-F263 HydrophobicContact CZ3-CD2 4.38Å; W17-F263 AromaticContact CZ3-CE2 3.9Å; W17-F263 HydrophobicContact CZ3-CE2 3.9Å; W17-F263 HydrophobicContact CZ3-CZ 4.2Å; W17-F263 WeakPolarHBondContact O-CD1 3.47Å; L22-F263 HydrophobicContact CB-CZ 4.44Å; L22-F263 HydrophobicContact CD2-CZ 4.24Å; L22-F263 HydrophobicContact CG-CZ 4.03Å; F23-F263 HydrophobicContact CB-CD1 4.35Å; F23-F263 HydrophobicContact CB-CE1 3.75Å; F23-F263 HydrophobicContact CB-CZ 3.94Å; F23-F263 HydrophobicContact CD2-CD1 4.04Å; F23-F263 HydrophobicContact CD2-CD2 4.12Å; F23-F263 HydrophobicContact CD2-CE1 4.14Å; F23-F263 HydrophobicContact CD2-CE2 4.2Å; F23-F263 HydrophobicContact CD2-CG 4.04Å; F23-F263 HydrophobicContact CD2-CZ 4.21Å; F23-F263 HydrophobicContact CG-CE1 4.48Å; C26-F263 HydrophobicContact CB-CE2 4.38Å; H85-F263 PolarHBondContact CE1-O 2.89Å; H85-F263 VanDerWaalsContact CE1-O 3.29Å; P87-F263 HydrophobicContact CB-CB 3.86Å; P87-F263 HydrophobicContact CG-CB 4.11Å; P259-F263 HydrophobicContact CB-CE2 4.3Å; P259-F263 VanDerWaalsContact O-CD2 3.24Å; P259-F263 WeakPolarHBondContact O-CD2 3.16Å; F263-M267 HydrophobicContact CD1-CE 4.17Å
264	P	86.9	Confident	79.6	Confident	38 Å²	38	66.1 Å²	66.1	25%	0.247	35%	0.346	C	S	.	.			trans	-70.7	163.4	179.2	31	-36	0	0	0	111.9	W17 Y178 Q266 M267	W17-P264 WeakPolarHBondContact O-CD 3.36Å; Y178-P264 PolarHBondContact OH-O 3.2Å; P264-Q266 VanDerWaalsContact C-N 3.32Å; P264-Q266 WeakPolarHBondContact CB-O 3.42Å; P264-M267 HydrophobicContact CG-CE 4.37Å
265	R	85	Confident	76.8	Confident	122 Å²	122	71.7 Å²	71.7	46%	0.46	37%	0.369	S	S	.	.	S	Bend	trans	-65	-38.3	175.5	-172.9	178.7	179.5	173.6	2.6	112.1	R83 H85	R83-R265 PolarHBondContact O-NH2 2.86Å; H85-R265 PolarHBondContact CE1-N 3.43Å; H85-R265 PolarHBondContact NE2-N 3.35Å
266	Q	78.6	Confident	73.9	Confident	150 Å²	150	72.5 Å²	72.5	70%	0.701	38%	0.379	S	S	*	.	S	Bend	trans	-131.8	135.9	179.7	-69.7	175.2	-18.2	0	0	108.1	F182 P264	F182-Q266 HydrophobicContact CE1-CB 4.41Å; F182-Q266 HydrophobicContact CZ-CB 4.28Å; F182-Q266 HydrophobicContact CZ-CG 4.45Å; P264-Q266 VanDerWaalsContact C-N 3.32Å; P264-Q266 WeakPolarHBondContact CB-O 3.42Å
267	M	78.6	Confident	71.5	Confident	15 Å²	15	80.8 Å²	80.8	7%	0.074	42%	0.417	C	S	.	.			trans	-109.1	154.2	173.9	-168.7	170.4	-70.6	0	0	109	W17 C18 I20 F182 F263 P264 S269	W17-M267 WeakPolarHBondContact O-CE 3.4Å; C18-M267 VanDerWaalsContact CA-CE 3.46Å; I20-M267 HydrophobicContact CB-SD 4.24Å; I20-M267 PolarHBondContact N-SD 3.37Å; F182-M267 HydrophobicContact CB-CB 4.42Å; F182-M267 HydrophobicContact CD1-CB 3.85Å; F182-M267 WeakPolarHBondContact CD1-O 3.2Å; F182-M267 HydrophobicContact CD2-CB 4.35Å; F182-M267 HydrophobicContact CE1-CB 4.24Å; F182-M267 WeakPolarHBondContact CE1-O 3.35Å; F182-M267 HydrophobicContact CG-CB 3.94Å; F263-M267 HydrophobicContact CD1-CE 4.17Å; P264-M267 HydrophobicContact CG-CE 4.37Å; M267-S269 PolarHBondContact O-N 2.88Å
268	S	70.9	Confident	68.7	Low	77 Å²	77	87.2 Å²	87.2	54%	0.538	46%	0.457	S	S	.	.			trans	-64.9	117.6	168.7	55.6	0	0	0	0	108.5
269	S	67.4	Low	66	Low	24 Å²	24	89.4 Å²	89.4	17%	0.168	47%	0.469	C	S	.	.			trans	-56.9	144.2	174.9	178.9	0	0	0	0	110.3	M267 V271 N272	M267-S269 PolarHBondContact O-N 2.88Å; S269-V271 PolarHBondContact O-N 3.05Å; S269-V271 PolarHBondContact OG-N 3.15Å; S269-N272 PolarHBondContact O-N 3.49Å; S269-N272 VanDerWaalsContact O-N 3.11Å
270	E	68	Low	63.4	Low	70 Å²	70	92.6 Å²	92.6	33%	0.327	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-22.3	174.3	-71.2	-178	162.2	0	0	112.1	I20 F182 G184 N187 Y191	I20-E270 HydrophobicContact CG2-CG 4.37Å; I20-E270 WeakPolarHBondContact CG2-OE1 3.24Å; F182-E270 PolarHBondContact O-N 2.88Å; G184-E270 PolarHBondContact N-OE2 3.34Å; N187-E270 PolarHBondContact ND2-OE2 3.31Å; Y191-E270 PolarHBondContact OH-OE1 3.12Å; Y191-E270 VanDerWaalsContact OH-OE1 3.04Å
271	V	56.5	Low	60.8	Low	64 Å²	64	98.8 Å²	98.8	39%	0.388	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-21.8	-177.3	-172.7	0	0	0	0	113.6	S269 M273 S274	S269-V271 PolarHBondContact O-N 3.05Å; S269-V271 PolarHBondContact OG-N 3.15Å; V271-M273 PolarHBondContact O-N 3.4Å; V271-S274 PolarHBondContact O-N 2.99Å
272	N	48.2	Very low	58.4	Low	119 Å²	119	100.4 Å²	100.4	64%	0.636	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	17.4	-177.3	-72	9.1	0	0	0	114.2	S269	S269-N272 PolarHBondContact O-N 3.49Å; S269-N272 VanDerWaalsContact O-N 3.11Å
273	M	46.8	Very low	56.1	Low	156 Å²	156	99.9 Å²	99.9	77%	0.768	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-2.5	167.8	-76.2	-69.9	-52.1	0	0	112.8	V271	V271-M273 PolarHBondContact O-N 3.4Å
274	S	39.5	Very low	53.8	Low	96 Å²	96	104.7 Å²	104.7	67%	0.671	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.5	-16	-176.7	54.8	0	0	0	0	119.5	V271	V271-S274 PolarHBondContact O-N 2.99Å
275	E	37	Very low	51.7	Low	161 Å²	161	112.5 Å²	112.5	75%	0.752	59%	0.59	S	S	*	*			trans	-138.8	131.5	-179.7	-72.6	179.7	166.5	0	0	113.2
276	T	37.2	Very low	50	Low	123 Å²	123	113.5 Å²	113.5	76%	0.755	60%	0.6	S	S	*	*			trans	-74	142.6	-175.3	-25.9	0	0	0	0	111.9	T278	T276-T278 PolarHBondContact O-N 3.12Å
277	E	44.5	Very low	48.6	Very low	177 Å²	177	110.9 Å²	110.9	83%	0.827	59%	0.586	S	S	*	*	S	Bend	trans	8	98.4	151.7	-59.4	178.5	166.3	0	0	118.7
278	T	36.6	Very low	47.3	Very low	135 Å²	135	116.7 Å²	116.7	83%	0.828	62%	0.617	S	S	*	*			trans	-152.4	9.3	151.4	47.6	0	0	0	0	116.2	T276	T276-T278 PolarHBondContact O-N 3.12Å
279	D	39.3	Very low	46.9	Very low	125 Å²	125	119.8 Å²	119.8	67%	0.668	62%	0.617	S	S	*	*			trans	-113.3	17.6	-170.5	-129.5	16.2	0	0	0	115.2	N283	D279-N283 PolarHBondContact O-ND2 2.94Å
280	S	40.7	Very low	47.4	Very low	91 Å²	91	121.7 Å²	121.7	64%	0.636	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-19.7	-175.2	40.2	0	0	0	0	114.6	L284	S280-L284 WeakPolarHBondContact O-CD1 3.2Å
281	D	37.3	Very low	47.7	Very low	129 Å²	129	121.3 Å²	121.3	69%	0.69	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-28.8	-168.3	-133.3	12.4	0	0	0	114.4
282	D	43.1	Very low	48.6	Very low	114 Å²	114	123.3 Å²	123.3	61%	0.61	64%	0.638	S	S	*	*	H	α-helix	trans	-78.5	-30.9	178.2	-94.1	-19.8	0	0	0	113.2	L284 R285	D282-L284 VanDerWaalsContact C-N 3.28Å; D282-L284 PolarHBondContact O-N 2.95Å; D282-R285 PolarHBondContact O-N 3.25Å
283	N	45.8	Very low	50.2	Low	108 Å²	108	122.3 Å²	122.3	58%	0.578	63%	0.63	S	S	*	*	H	α-helix	trans	-70.9	-21	177.5	-80.8	-56.3	0	0	0	113.7	D279	D279-N283 PolarHBondContact O-ND2 2.94Å
284	L	41.6	Very low	51.7	Low	105 Å²	105	117.1 Å²	117.1	55%	0.55	60%	0.603	S	S	.	*	H	α-helix	trans	-74.7	-34	176	-99.6	137.4	0	0	0	111.6	S280 D282 E286 K287	S280-L284 WeakPolarHBondContact O-CD1 3.2Å; D282-L284 VanDerWaalsContact C-N 3.28Å; D282-L284 PolarHBondContact O-N 2.95Å; L284-E286 PolarHBondContact O-N 2.97Å; L284-K287 PolarHBondContact O-N 3.3Å
285	R	42.2	Very low	53.7	Low	201 Å²	201	116 Å²	116	76%	0.758	59%	0.589	S	S	*	*	H	α-helix	trans	-70	-30.2	-178.9	-82.6	178.2	152.3	-176.5	-3.9	114.7	D282 K287	D282-R285 PolarHBondContact O-N 3.25Å; R285-K287 VanDerWaalsContact C-N 3.31Å
286	E	50.8	Low	55.8	Low	143 Å²	143	115.5 Å²	115.5	67%	0.668	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-75.2	-21.1	174.8	-84.5	-164.6	146.3	0	0	113.4	L284 D288	L284-E286 PolarHBondContact O-N 2.97Å; E286-D288 VanDerWaalsContact C-N 3.33Å; E286-D288 PolarHBondContact O-N 3.3Å
287	K	49.3	Very low	57.9	Low	95 Å²	95	112.3 Å²	112.3	41%	0.413	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-81.7	-7.6	-171.9	-141.6	175.8	-172.1	174.2	0	114.3	R83 L284 R285	R83-K287 PolarHBondContact NH1-O 3.3Å; R83-K287 PolarHBondContact NH2-O 3.41Å; L284-K287 PolarHBondContact O-N 3.3Å; R285-K287 VanDerWaalsContact C-N 3.31Å
288	D	50.3	Low	59.7	Low	137 Å²	137	105.9 Å²	105.9	73%	0.733	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-108	-3.9	-174.1	-74.7	-18.9	0	0	0	115.2	E286 S290	E286-D288 VanDerWaalsContact C-N 3.33Å; E286-D288 PolarHBondContact O-N 3.3Å; D288-S290 PolarHBondContact O-N 2.67Å
289	R	62.1	Low	62	Low	143 Å²	143	102.2 Å²	102.2	54%	0.54	51%	0.51	S	S	.	.			trans	-66.4	126.8	174.6	-70.4	-170.9	-173.4	173.1	4.7	111.4	Y79 R83	Y79-R289 PolarHBondContact OH-O 1.99Å; R83-R289 PolarHBondContact NH2-O 3.16Å
290	S	78.8	Confident	64.2	Low	63 Å²	63	105.8 Å²	105.8	44%	0.441	51%	0.514	S	S	.	.			trans	-62.3	143.6	175.6	164.6	0	0	0	0	110.9	D288 L292 E293 F294	D288-S290 PolarHBondContact O-N 2.67Å; S290-L292 PolarHBondContact O-N 3.35Å; S290-L292 PolarHBondContact OG-N 3.01Å; S290-E293 WeakPolarHBondContact O-CB 3.47Å; S290-E293 PolarHBondContact O-N 2.79Å; S290-F294 PolarHBondContact O-N 3.36Å
291	L	75.3	Confident	66.1	Low	62 Å²	62	105 Å²	105	33%	0.325	50%	0.501	S	S	.	.	H	α-helix	trans	-48.7	-41.3	172	-90.9	171.7	0	0	0	111.9	Y79 F80 E293 F294 L295	Y79-L291 HydrophobicContact CD1-CD2 3.11Å; Y79-L291 HydrophobicContact CD1-CG 3.88Å; Y79-L291 HydrophobicContact CD2-CD2 3.9Å; Y79-L291 HydrophobicContact CE1-CB 4.48Å; Y79-L291 HydrophobicContact CE1-CD1 4.22Å; Y79-L291 HydrophobicContact CE1-CD2 3.14Å; Y79-L291 HydrophobicContact CE1-CG 3.33Å; Y79-L291 HydrophobicContact CE2-CD2 3.92Å; Y79-L291 HydrophobicContact CE2-CG 4.16Å; Y79-L291 HydrophobicContact CG-CD2 3.5Å; Y79-L291 VanDerWaalsContact CG-CD2 3.5Å; Y79-L291 HydrophobicContact CG-CG 4.49Å; Y79-L291 VanDerWaalsContact CZ-CG 3.48Å; Y79-L291 PolarHBondContact OH-N 3.24Å; F80-L291 HydrophobicContact CE1-CD1 4.48Å; F80-L291 HydrophobicContact CZ-CD1 4.06Å; F80-L291 HydrophobicContact CZ-CD2 4.22Å; L291-E293 VanDerWaalsContact C-N 3.31Å; L291-E293 PolarHBondContact O-N 3.28Å; L291-F294 PolarHBondContact O-N 3.13Å; L291-L295 WeakPolarHBondContact O-CB 3.4Å; L291-L295 WeakPolarHBondContact O-CG 3.34Å; L291-L295 PolarHBondContact O-N 3.49Å
292	L	75.3	Confident	68.4	Low	106 Å²	106	101.1 Å²	101.1	56%	0.555	48%	0.479	S	S	*	.	H	α-helix	trans	-67.3	-35.4	-179.2	-171.5	71.3	0	0	0	111.6	S290 K296	S290-L292 PolarHBondContact O-N 3.35Å; S290-L292 PolarHBondContact OG-N 3.01Å; L292-K296 WeakPolarHBondContact O-CB 3.33Å; L292-K296 VanDerWaalsContact O-CG 3.27Å; L292-K296 WeakPolarHBondContact O-CG 3.09Å; L292-K296 PolarHBondContact O-N 3Å
293	E	81	Confident	70.4	Confident	98 Å²	98	102.1 Å²	102.1	46%	0.458	48%	0.478	S	S	.	.	H	α-helix	trans	-72	-42.9	178.6	-163.4	179.8	-175.7	0	0	111	S290 L291 L295 K296 L297	S290-E293 WeakPolarHBondContact O-CB 3.47Å; S290-E293 PolarHBondContact O-N 2.79Å; L291-E293 VanDerWaalsContact C-N 3.31Å; L291-E293 PolarHBondContact O-N 3.28Å; E293-L295 PolarHBondContact O-N 2.87Å; E293-K296 PolarHBondContact O-N 3.27Å; E293-L297 HydrophobicContact CG-CD1 4.19Å; E293-L297 WeakPolarHBondContact O-CB 2.99Å; E293-L297 WeakPolarHBondContact O-CD1 3.5Å; E293-L297 VanDerWaalsContact O-CG 3.3Å; E293-L297 WeakPolarHBondContact O-CG 3.49Å; E293-L297 PolarHBondContact O-N 3.26Å
294	F	78.8	Confident	72.3	Confident	47 Å²	47	102.6 Å²	102.6	21%	0.206	48%	0.476	C	S	.	.	H	α-helix	trans	-59.8	-45.8	171.8	177.5	-101	0	0	0	112.1	V75 Y79 S290 L291 K296 L297 F298	V75-F294 HydrophobicContact CG1-CE1 4.04Å; Y79-F294 HydrophobicContact CD2-CB 3.83Å; Y79-F294 AromaticContact CD2-CD1 3.92Å; Y79-F294 HydrophobicContact CD2-CD1 3.92Å; Y79-F294 HydrophobicContact CD2-CD2 4.42Å; Y79-F294 AromaticContact CD2-CG 3.8Å; Y79-F294 HydrophobicContact CD2-CG 3.8Å; Y79-F294 HydrophobicContact CE2-CB 4.09Å; Y79-F294 HydrophobicContact CG-CD1 4.4Å; S290-F294 PolarHBondContact O-N 3.36Å; L291-F294 PolarHBondContact O-N 3.13Å; F294-K296 VanDerWaalsContact C-N 3.29Å; F294-K296 PolarHBondContact O-N 2.81Å; F294-L297 PolarHBondContact O-N 3.13Å; F294-F298 HydrophobicContact CZ-CD2 4.43Å; F294-F298 WeakPolarHBondContact O-CB 2.97Å; F294-F298 PolarHBondContact O-N 2.85Å
295	L	80.1	Confident	74.3	Confident	72 Å²	72	97.7 Å²	97.7	38%	0.377	45%	0.451	S	S	.	.	H	α-helix	trans	-64.7	-30.2	177	-77.8	166.8	0	0	0	113	L291 E293 P299	L291-L295 WeakPolarHBondContact O-CB 3.4Å; L291-L295 WeakPolarHBondContact O-CG 3.34Å; L291-L295 PolarHBondContact O-N 3.49Å; E293-L295 PolarHBondContact O-N 2.87Å; L295-P299 WeakPolarHBondContact O-CD 3.4Å
296	K	82.5	Confident	76.4	Confident	151 Å²	151	89.6 Å²	89.6	66%	0.657	42%	0.422	S	S	*	.	H	α-helix	trans	-73.8	-35.1	172.5	-78.2	175.6	-179.9	-179.1	0	112.5	L292 E293 F294	L292-K296 WeakPolarHBondContact O-CB 3.33Å; L292-K296 VanDerWaalsContact O-CG 3.27Å; L292-K296 WeakPolarHBondContact O-CG 3.09Å; L292-K296 PolarHBondContact O-N 3Å; E293-K296 PolarHBondContact O-N 3.27Å; F294-K296 VanDerWaalsContact C-N 3.29Å; F294-K296 PolarHBondContact O-N 2.81Å
297	L	80.1	Confident	78.2	Confident	57 Å²	57	87.1 Å²	87.1	30%	0.298	42%	0.421	S	S	.	.	H	α-helix	trans	-75.7	-32.9	179.3	-73.2	160.2	0	0	0	112.6	E293 F294 R300 M301	E293-L297 HydrophobicContact CG-CD1 4.19Å; E293-L297 WeakPolarHBondContact O-CB 2.99Å; E293-L297 WeakPolarHBondContact O-CD1 3.5Å; E293-L297 VanDerWaalsContact O-CG 3.3Å; E293-L297 WeakPolarHBondContact O-CG 3.49Å; E293-L297 PolarHBondContact O-N 3.26Å; F294-L297 PolarHBondContact O-N 3.13Å; L297-R300 WeakPolarHBondContact O-CB 3.44Å; L297-R300 PolarHBondContact O-N 2.85Å; L297-M301 PolarHBondContact O-N 2.93Å; L297-M301 VanDerWaalsContact O-N 3.09Å
298	F	82.9	Confident	80	Confident	41 Å²	41	85 Å²	85	18%	0.18	41%	0.413	C	S	.	.	H	α-helix	trans	-57.6	-49.7	-174.7	-179.1	-85.5	0	0	0	114	V75 F294 R300 M301 F302 F528	V75-F298 HydrophobicContact CG1-CD2 4.07Å; V75-F298 HydrophobicContact CG1-CE2 4.09Å; V75-F298 HydrophobicContact CG1-CG 4.39Å; V75-F298 HydrophobicContact CG1-CZ 4.42Å; V75-F298 HydrophobicContact CG2-CE1 4.36Å; V75-F298 HydrophobicContact CG2-CE2 4.09Å; V75-F298 HydrophobicContact CG2-CZ 3.82Å; F294-F298 HydrophobicContact CZ-CD2 4.43Å; F294-F298 WeakPolarHBondContact O-CB 2.97Å; F294-F298 PolarHBondContact O-N 2.85Å; F298-R300 VanDerWaalsContact C-N 3.28Å; F298-R300 PolarHBondContact O-N 3.19Å; F298-M301 PolarHBondContact O-N 3.3Å; F298-F302 HydrophobicContact CE1-CB 4.36Å; F298-F302 HydrophobicContact CE1-CD2 4.2Å; F298-F302 HydrophobicContact CZ-CD2 4.39Å; F298-F302 VanDerWaalsContact O-CB 3.26Å; F298-F302 WeakPolarHBondContact O-CB 3.39Å; F298-F302 PolarHBondContact O-N 2.86Å; F298-F528 AromaticContact CD2-CE2 3.88Å; F298-F528 HydrophobicContact CD2-CE2 3.88Å; F298-F528 HydrophobicContact CD2-CZ 4.29Å; F298-F528 AromaticContact CE2-CE2 3.77Å; F298-F528 HydrophobicContact CE2-CE2 3.77Å; F298-F528 HydrophobicContact CE2-CZ 4.15Å
299	P	85.5	Confident	81.7	Confident	58 Å²	58	80.7 Å²	80.7	38%	0.377	39%	0.393	S	S	.	.	H	α-helix	trans	-57.9	-40.2	176.7	-25.3	33.6	0	0	0	112.5	L295 F302 F303	L295-P299 WeakPolarHBondContact O-CD 3.4Å; P299-F302 WeakPolarHBondContact O-CB 3.46Å; P299-F302 PolarHBondContact O-N 3Å; P299-F303 HydrophobicContact CB-CD2 4.42Å; P299-F303 HydrophobicContact CB-CE2 4.47Å; P299-F303 WeakPolarHBondContact O-CB 3.44Å; P299-F303 WeakPolarHBondContact O-CD2 2.87Å; P299-F303 PolarHBondContact O-N 2.82Å
300	R	84.8	Confident	82.8	Confident	200 Å²	200	75.8 Å²	75.8	76%	0.755	38%	0.377	S	S	*	.	H	α-helix	trans	-63.4	-46.8	179.9	-173.1	178.1	179.6	178	-0	111.4	L297 F298 H304	L297-R300 WeakPolarHBondContact O-CB 3.44Å; L297-R300 PolarHBondContact O-N 2.85Å; F298-R300 VanDerWaalsContact C-N 3.28Å; F298-R300 PolarHBondContact O-N 3.19Å; R300-H304 VanDerWaalsContact O-CB 3.31Å; R300-H304 WeakPolarHBondContact O-CB 3.35Å; R300-H304 PolarHBondContact O-N 3.15Å
301	M	79.9	Confident	83.2	Confident	74 Å²	74	72.8 Å²	72.8	37%	0.365	36%	0.356	S	S	.	.	H	α-helix	trans	-66.4	-40.2	176.7	-63.1	-172.4	-59	0	0	111.8	L297 F298 H304 L305 F528	L297-M301 PolarHBondContact O-N 2.93Å; L297-M301 VanDerWaalsContact O-N 3.09Å; F298-M301 PolarHBondContact O-N 3.3Å; M301-H304 PolarHBondContact O-N 3.21Å; M301-L305 WeakPolarHBondContact O-CB 3.36Å; M301-L305 PolarHBondContact O-N 2.87Å; M301-F528 HydrophobicContact CB-CD1 4.35Å; M301-F528 HydrophobicContact CB-CE1 3.64Å; M301-F528 HydrophobicContact CB-CE2 4.34Å; M301-F528 HydrophobicContact CB-CZ 3.63Å; M301-F528 HydrophobicContact CE-CD2 4.31Å; M301-F528 HydrophobicContact CE-CE2 3.93Å; M301-F528 HydrophobicContact CE-CZ 4.31Å
302	F	85.9	Confident	83.9	Confident	49 Å²	49	72.6 Å²	72.6	22%	0.215	36%	0.356	C	S	.	.	H	α-helix	trans	-57.8	-52.3	175.1	178.5	-82.8	0	0	0	111.4	F298 P299 L305 M306 L532	F298-F302 HydrophobicContact CE1-CB 4.36Å; F298-F302 HydrophobicContact CE1-CD2 4.2Å; F298-F302 HydrophobicContact CZ-CD2 4.39Å; F298-F302 VanDerWaalsContact O-CB 3.26Å; F298-F302 WeakPolarHBondContact O-CB 3.39Å; F298-F302 PolarHBondContact O-N 2.86Å; P299-F302 WeakPolarHBondContact O-CB 3.46Å; P299-F302 PolarHBondContact O-N 3Å; F302-L305 PolarHBondContact O-N 3.44Å; F302-M306 HydrophobicContact CD1-CG 4.09Å; F302-M306 HydrophobicContact CE1-CG 3.77Å; F302-M306 HydrophobicContact CZ-CG 4.06Å; F302-M306 HydrophobicContact CZ-SD 4.48Å; F302-M306 WeakPolarHBondContact O-CB 3.28Å; F302-M306 VanDerWaalsContact O-CG 3.24Å; F302-M306 WeakPolarHBondContact O-CG 3.36Å; F302-M306 PolarHBondContact O-N 2.85Å; F302-L532 HydrophobicContact CD2-CD1 3.35Å; F302-L532 HydrophobicContact CD2-CD2 4.32Å; F302-L532 HydrophobicContact CD2-CG 4.49Å; F302-L532 HydrophobicContact CE2-CD1 3.2Å; F302-L532 HydrophobicContact CG-CD1 4.48Å; F302-L532 HydrophobicContact CZ-CD1 4.23Å
303	F	85.9	Confident	84.6	Confident	135 Å²	135	68.9 Å²	68.9	59%	0.592	34%	0.336	S	S	*	.	H	α-helix	trans	-68.7	-34.7	-179.9	-78	-65.7	0	0	0	112.5	P299 M306 S307	P299-F303 HydrophobicContact CB-CD2 4.42Å; P299-F303 HydrophobicContact CB-CE2 4.47Å; P299-F303 WeakPolarHBondContact O-CB 3.44Å; P299-F303 WeakPolarHBondContact O-CD2 2.87Å; P299-F303 PolarHBondContact O-N 2.82Å; F303-M306 PolarHBondContact O-N 3.08Å; F303-S307 WeakPolarHBondContact O-CB 3.01Å; F303-S307 PolarHBondContact O-N 3.34Å; F303-S307 PolarHBondContact O-OG 3.47Å
304	H	85.9	Confident	84.9	Confident	117 Å²	117	64.2 Å²	64.2	54%	0.542	31%	0.314	S	S	.	.	H	α-helix	trans	-58.5	-50.6	173.5	-175.3	68.4	0	0	0	111	R300 M301 M306 S307 E525	R300-H304 VanDerWaalsContact O-CB 3.31Å; R300-H304 WeakPolarHBondContact O-CB 3.35Å; R300-H304 PolarHBondContact O-N 3.15Å; M301-H304 PolarHBondContact O-N 3.21Å; H304-M306 PolarHBondContact O-N 3.18Å; H304-S307 WeakPolarHBondContact O-CB 3.45Å; H304-S307 PolarHBondContact O-N 2.92Å; H304-S307 VanDerWaalsContact O-N 3.12Å; H304-E525 IonicContact CD2-OE1 3.53Å; H304-E525 PolarHBondContact CD2-OE1 2.84Å; H304-E525 IonicContact NE2-OE1 3.25Å
305	L	83.6	Confident	85.5	Confident	3 Å²	3	62 Å²	62	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-70.7	-35	-178.1	-162.2	65.8	0	0	0	112.4	M301 F302 S307 N308 F311 V521 F528 A529 L532	M301-L305 WeakPolarHBondContact O-CB 3.36Å; M301-L305 PolarHBondContact O-N 2.87Å; F302-L305 PolarHBondContact O-N 3.44Å; L305-S307 PolarHBondContact O-N 3.35Å; L305-N308 WeakPolarHBondContact O-CB 3.47Å; L305-N308 PolarHBondContact O-N 3.34Å; L305-F311 HydrophobicContact CD2-CD1 4.39Å; L305-F311 HydrophobicContact CD2-CE1 3.86Å; L305-F311 HydrophobicContact CD2-CE2 4.39Å; L305-F311 HydrophobicContact CD2-CZ 3.86Å; L305-F311 HydrophobicContact CG-CD1 3.89Å; L305-F311 HydrophobicContact CG-CE1 3.83Å; L305-F311 HydrophobicContact CG-CG 4.35Å; L305-F311 HydrophobicContact CG-CZ 4.25Å; L305-V521 HydrophobicContact CD1-CG1 4.19Å; L305-V521 HydrophobicContact CD1-CG2 4.29Å; L305-F528 HydrophobicContact CD2-CD1 3.99Å; L305-F528 HydrophobicContact CD2-CE1 4.31Å; L305-A529 HydrophobicContact CD1-CB 4.38Å; L305-A529 VanDerWaalsContact CD2-CA 3.41Å; L305-A529 HydrophobicContact CD2-CB 3.47Å; L305-A529 VanDerWaalsContact CD2-CB 3.47Å; L305-L532 HydrophobicContact CB-CD2 4.07Å; L305-L532 HydrophobicContact CD2-CB 4.34Å; L305-L532 HydrophobicContact CD2-CD2 3.66Å; L305-L532 HydrophobicContact CG-CD2 4.18Å
306	M	86.6	Confident	86.1	Confident	30 Å²	30	61.2 Å²	61.2	15%	0.148	30%	0.301	C	S	.	.	H	α-helix	trans	-68.5	-20.7	171.7	-69.5	-75.4	76.2	0	0	113.9	F302 F303 H304 N308 F311 L312 L532 L536	F302-M306 HydrophobicContact CD1-CG 4.09Å; F302-M306 HydrophobicContact CE1-CG 3.77Å; F302-M306 HydrophobicContact CZ-CG 4.06Å; F302-M306 HydrophobicContact CZ-SD 4.48Å; F302-M306 WeakPolarHBondContact O-CB 3.28Å; F302-M306 VanDerWaalsContact O-CG 3.24Å; F302-M306 WeakPolarHBondContact O-CG 3.36Å; F302-M306 PolarHBondContact O-N 2.85Å; F303-M306 PolarHBondContact O-N 3.08Å; H304-M306 PolarHBondContact O-N 3.18Å; M306-N308 VanDerWaalsContact C-N 3.29Å; M306-F311 HydrophobicContact CE-CD1 3.49Å; M306-F311 VanDerWaalsContact CE-CD1 3.49Å; M306-F311 HydrophobicContact CE-CE1 3.37Å; M306-L312 HydrophobicContact CE-CB 4.38Å; M306-L312 HydrophobicContact CE-CD1 3.77Å; M306-L312 HydrophobicContact SD-CD1 3.79Å; M306-L532 HydrophobicContact CE-CD2 4.05Å; M306-L532 HydrophobicContact CG-CD2 4.25Å; M306-L532 HydrophobicContact SD-CD2 4.48Å; M306-L536 HydrophobicContact CE-CD1 3.6Å; M306-L536 HydrophobicContact SD-CD1 3.63Å; M306-L536 HydrophobicContact SD-CD2 4.37Å
307	S	88.2	Confident	86.4	Confident	92 Å²	92	54 Å²	54	64%	0.643	27%	0.269	S	S	*	.	H	α-helix	trans	-77.3	-16.4	173.6	-59	0	0	0	0	112.5	F303 H304 L305 P309	F303-S307 WeakPolarHBondContact O-CB 3.01Å; F303-S307 PolarHBondContact O-N 3.34Å; F303-S307 PolarHBondContact O-OG 3.47Å; H304-S307 WeakPolarHBondContact O-CB 3.45Å; H304-S307 PolarHBondContact O-N 2.92Å; H304-S307 VanDerWaalsContact O-N 3.12Å; L305-S307 PolarHBondContact O-N 3.35Å; S307-P309 WeakPolarHBondContact O-CD 3.41Å
308	N	87.3	Confident	86.8	Confident	49 Å²	49	51.8 Å²	51.8	26%	0.262	26%	0.257	S	S	.	.			trans	-72.9	109.1	171.5	-176.9	-23	0	0	0	109.5	L305 M306 L310 F311 L312 C520	L305-N308 WeakPolarHBondContact O-CB 3.47Å; L305-N308 PolarHBondContact O-N 3.34Å; M306-N308 VanDerWaalsContact C-N 3.29Å; N308-L310 VanDerWaalsContact C-N 3.3Å; N308-L310 PolarHBondContact O-N 3.09Å; N308-L310 PolarHBondContact OD1-N 3.48Å; N308-L310 VanDerWaalsContact OD1-N 3.09Å; N308-F311 HydrophobicContact CB-CB 4.04Å; N308-F311 PolarHBondContact O-N 3.4Å; N308-F311 PolarHBondContact OD1-N 2.88Å; N308-L312 PolarHBondContact O-N 3.31Å; N308-C520 PolarHBondContact ND2-O 3.27Å
309	P	86	Confident	87.3	Confident	47 Å²	47	50 Å²	50	31%	0.305	25%	0.25	S	S	.	.	H	α-helix	trans	-69.5	-27.8	-172	29.1	-35.7	0	0	0	113	S307 L313 K603	S307-P309 WeakPolarHBondContact O-CD 3.41Å; P309-L313 VanDerWaalsContact O-CB 3.31Å; P309-L313 WeakPolarHBondContact O-CB 3.42Å; P309-L313 WeakPolarHBondContact O-CD1 3.11Å; P309-L313 WeakPolarHBondContact O-CG 3.43Å; P309-L313 PolarHBondContact O-N 3.09Å; P309-L313 VanDerWaalsContact O-N 3.09Å; P309-K603 HydrophobicContact CB-CD 4.2Å; P309-K603 HydrophobicContact CG-CD 4.28Å; P309-K603 VanDerWaalsContact CG-CE 3.41Å
310	L	85.1	Confident	87.6	Confident	40 Å²	40	48 Å²	48	21%	0.209	24%	0.237	C	C	.	.	H	α-helix	trans	-71	-43.4	178.1	-62.8	178	0	0	0	110.2	N308 L314 L600 K603	N308-L310 VanDerWaalsContact C-N 3.3Å; N308-L310 PolarHBondContact O-N 3.09Å; N308-L310 PolarHBondContact OD1-N 3.48Å; N308-L310 VanDerWaalsContact OD1-N 3.09Å; L310-L314 WeakPolarHBondContact O-CB 3.31Å; L310-L314 PolarHBondContact O-N 3.46Å; L310-L314 VanDerWaalsContact O-N 3.11Å; L310-L600 HydrophobicContact CB-CD1 4.09Å; L310-L600 HydrophobicContact CD2-CD1 3.61Å; L310-L600 HydrophobicContact CG-CD1 4.47Å; L310-L600 WeakPolarHBondContact O-CD1 2.99Å; L310-K603 HydrophobicContact CD2-CB 4.31Å; L310-K603 HydrophobicContact CD2-CD 4.39Å; L310-K603 HydrophobicContact CD2-CG 4.17Å
311	F	86.9	Confident	87.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.9	-51.1	175.4	179.3	-101.1	0	0	0	111.3	L305 M306 N308 L313 L314 V315 V517 V521 A529 L532	L305-F311 HydrophobicContact CD2-CD1 4.39Å; L305-F311 HydrophobicContact CD2-CE1 3.86Å; L305-F311 HydrophobicContact CD2-CE2 4.39Å; L305-F311 HydrophobicContact CD2-CZ 3.86Å; L305-F311 HydrophobicContact CG-CD1 3.89Å; L305-F311 HydrophobicContact CG-CE1 3.83Å; L305-F311 HydrophobicContact CG-CG 4.35Å; L305-F311 HydrophobicContact CG-CZ 4.25Å; M306-F311 HydrophobicContact CE-CD1 3.49Å; M306-F311 VanDerWaalsContact CE-CD1 3.49Å; M306-F311 HydrophobicContact CE-CE1 3.37Å; N308-F311 HydrophobicContact CB-CB 4.04Å; N308-F311 PolarHBondContact O-N 3.4Å; N308-F311 PolarHBondContact OD1-N 2.88Å; F311-L313 PolarHBondContact O-N 3.03Å; F311-L314 PolarHBondContact O-N 3.41Å; F311-V315 HydrophobicContact CD1-CG2 4.29Å; F311-V315 HydrophobicContact CD2-CG2 4.24Å; F311-V315 HydrophobicContact CE1-CG2 3.9Å; F311-V315 HydrophobicContact CE2-CG2 3.85Å; F311-V315 HydrophobicContact CG-CG2 4.45Å; F311-V315 HydrophobicContact CZ-CG2 3.67Å; F311-V315 WeakPolarHBondContact O-CG2 3.4Å; F311-V315 PolarHBondContact O-N 3.07Å; F311-V517 HydrophobicContact CD2-CG1 4.13Å; F311-V517 HydrophobicContact CE2-CG1 3.75Å; F311-V521 HydrophobicContact CD2-CG2 3.8Å; F311-V521 HydrophobicContact CE2-CG2 4.3Å; F311-A529 HydrophobicContact CE2-CB 3.88Å; F311-A529 HydrophobicContact CZ-CB 4.22Å; F311-L532 HydrophobicContact CE1-CD2 3.85Å; F311-L532 HydrophobicContact CE1-CG 4.28Å; F311-L532 HydrophobicContact CZ-CD2 4.34Å; F311-L532 HydrophobicContact CZ-CG 4.44Å
312	L	90.8	Very high	88.2	Confident	59 Å²	59	36.6 Å²	36.6	31%	0.309	19%	0.192	S	C	.	.	H	α-helix	trans	-59.5	-48.7	-179	179.8	64	0	0	0	112.3	M306 N308 L314 V315 L316	M306-L312 HydrophobicContact CE-CB 4.38Å; M306-L312 HydrophobicContact CE-CD1 3.77Å; M306-L312 HydrophobicContact SD-CD1 3.79Å; N308-L312 PolarHBondContact O-N 3.31Å; L312-L314 VanDerWaalsContact C-N 3.29Å; L312-L314 PolarHBondContact O-N 3.19Å; L312-V315 PolarHBondContact O-N 3.43Å; L312-L316 HydrophobicContact CD1-CD1 3.99Å; L312-L316 HydrophobicContact CD1-CG 4.07Å; L312-L316 HydrophobicContact CG-CD1 3.9Å; L312-L316 HydrophobicContact CG-CG 4.37Å; L312-L316 WeakPolarHBondContact O-CB 3.49Å; L312-L316 VanDerWaalsContact O-CG 3.26Å; L312-L316 WeakPolarHBondContact O-CG 3.32Å; L312-L316 PolarHBondContact O-N 3.47Å
313	L	89.5	Confident	88.6	Confident	28 Å²	28	34.4 Å²	34.4	15%	0.147	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-40.3	178.8	-74.6	171	0	0	0	112	P309 F311 A317 L596 I599 L600 K603	P309-L313 VanDerWaalsContact O-CB 3.31Å; P309-L313 WeakPolarHBondContact O-CB 3.42Å; P309-L313 WeakPolarHBondContact O-CD1 3.11Å; P309-L313 WeakPolarHBondContact O-CG 3.43Å; P309-L313 PolarHBondContact O-N 3.09Å; P309-L313 VanDerWaalsContact O-N 3.09Å; F311-L313 PolarHBondContact O-N 3.03Å; L313-A317 WeakPolarHBondContact O-CB 3.07Å; L313-A317 PolarHBondContact O-N 3.16Å; L313-L596 HydrophobicContact CD2-CD2 3.78Å; L313-I599 HydrophobicContact CD1-CG2 3.83Å; L313-I599 HydrophobicContact CD2-CG2 4.3Å; L313-L600 HydrophobicContact CB-CB 4.47Å; L313-L600 HydrophobicContact CB-CD1 4.08Å; L313-L600 HydrophobicContact CD1-CD1 4.46Å; L313-K603 HydrophobicContact CD1-CD 4.49Å
314	L	87.1	Confident	88.8	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.7	-44.2	179.7	-173.5	63.2	0	0	0	111.8	L310 F311 L312 A317 Q318 L513 M516 V517 L597 L600	L310-L314 WeakPolarHBondContact O-CB 3.31Å; L310-L314 PolarHBondContact O-N 3.46Å; L310-L314 VanDerWaalsContact O-N 3.11Å; F311-L314 PolarHBondContact O-N 3.41Å; L312-L314 VanDerWaalsContact C-N 3.29Å; L312-L314 PolarHBondContact O-N 3.19Å; L314-A317 PolarHBondContact O-N 3.25Å; L314-Q318 PolarHBondContact O-N 3.43Å; L314-L513 HydrophobicContact CD1-CD2 3.73Å; L314-M516 HydrophobicContact CD1-CB 4.28Å; L314-M516 HydrophobicContact CD2-CB 3.68Å; L314-V517 HydrophobicContact CD2-CB 4.09Å; L314-V517 HydrophobicContact CD2-CG2 3.37Å; L314-V517 VanDerWaalsContact CD2-N 3.34Å; L314-V517 HydrophobicContact CG-CG2 3.81Å; L314-L597 HydrophobicContact CD1-CD2 4.33Å; L314-L600 HydrophobicContact CB-CD2 4.28Å; L314-L600 HydrophobicContact CD1-CD2 3.82Å
315	V	90.4	Very high	89	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-65.1	-44.2	176.1	175.8	0	0	0	0	111	F311 L312 A317 Q318 C319 Q533 L536	F311-V315 HydrophobicContact CD1-CG2 4.29Å; F311-V315 HydrophobicContact CD2-CG2 4.24Å; F311-V315 HydrophobicContact CE1-CG2 3.9Å; F311-V315 HydrophobicContact CE2-CG2 3.85Å; F311-V315 HydrophobicContact CG-CG2 4.45Å; F311-V315 HydrophobicContact CZ-CG2 3.67Å; F311-V315 WeakPolarHBondContact O-CG2 3.4Å; F311-V315 PolarHBondContact O-N 3.07Å; L312-V315 PolarHBondContact O-N 3.43Å; V315-A317 VanDerWaalsContact C-N 3.32Å; V315-A317 PolarHBondContact O-N 3.27Å; V315-Q318 WeakPolarHBondContact O-CB 3.49Å; V315-Q318 PolarHBondContact O-N 2.95Å; V315-Q318 VanDerWaalsContact O-N 3.13Å; V315-C319 PolarHBondContact O-N 3.43Å; V315-C319 PolarHBondContact O-SG 3.46Å; V315-Q533 HydrophobicContact CG2-CB 4.37Å; V315-Q533 HydrophobicContact CG2-CG 4.29Å; V315-L536 HydrophobicContact CG1-CB 3.79Å; V315-L536 HydrophobicContact CG1-CD1 3.73Å; V315-L536 HydrophobicContact CG1-CG 4.43Å
316	L	92.3	Very high	89.4	Confident	55 Å²	55	25.1 Å²	25.1	29%	0.288	14%	0.143	S	C	.	.	H	α-helix	trans	-61.6	-39.1	176.8	-71.7	174.6	0	0	0	112.4	L312 Q318 C319 C320 L540 L596	L312-L316 HydrophobicContact CD1-CD1 3.99Å; L312-L316 HydrophobicContact CD1-CG 4.07Å; L312-L316 HydrophobicContact CG-CD1 3.9Å; L312-L316 HydrophobicContact CG-CG 4.37Å; L312-L316 WeakPolarHBondContact O-CB 3.49Å; L312-L316 VanDerWaalsContact O-CG 3.26Å; L312-L316 WeakPolarHBondContact O-CG 3.32Å; L312-L316 PolarHBondContact O-N 3.47Å; L316-Q318 VanDerWaalsContact C-N 3.35Å; L316-C319 WeakPolarHBondContact O-CB 3.39Å; L316-C319 PolarHBondContact O-N 3.44Å; L316-C320 PolarHBondContact O-N 2.89Å; L316-C320 VanDerWaalsContact O-N 3.09Å; L316-C320 PolarHBondContact O-SG 2.99Å; L316-L540 HydrophobicContact CD2-CD1 3.96Å; L316-L596 HydrophobicContact CB-CD1 3.8Å
317	A	89.8	Confident	89.7	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.4	-43.3	173.8	0	0	0	0	0	111.3	L313 L314 V315 C320 F321 L596 L597	L313-A317 WeakPolarHBondContact O-CB 3.07Å; L313-A317 PolarHBondContact O-N 3.16Å; L314-A317 PolarHBondContact O-N 3.25Å; V315-A317 VanDerWaalsContact C-N 3.32Å; V315-A317 PolarHBondContact O-N 3.27Å; A317-C320 WeakPolarHBondContact O-CB 3.1Å; A317-C320 PolarHBondContact O-N 3.38Å; A317-F321 WeakPolarHBondContact O-CD2 3.46Å; A317-F321 PolarHBondContact O-N 3.24Å; A317-L596 HydrophobicContact CB-CB 4.04Å; A317-L596 HydrophobicContact CB-CD1 4.49Å; A317-L597 HydrophobicContact CB-CD2 3.83Å; A317-L597 HydrophobicContact CB-CG 3.96Å
318	Q	89.1	Confident	89.8	Confident	9 Å²	9	20.1 Å²	20.1	4%	0.042	11%	0.109	C	C	.	.	H	α-helix	trans	-65.5	-37.7	176.8	-163.4	-177.4	-24.2	0	0	112.6	L314 V315 L316 C320 F321 S322 M537	L314-Q318 PolarHBondContact O-N 3.43Å; V315-Q318 WeakPolarHBondContact O-CB 3.49Å; V315-Q318 PolarHBondContact O-N 2.95Å; V315-Q318 VanDerWaalsContact O-N 3.13Å; L316-Q318 VanDerWaalsContact C-N 3.35Å; Q318-C320 VanDerWaalsContact C-N 3.32Å; Q318-C320 PolarHBondContact O-N 2.91Å; Q318-F321 PolarHBondContact O-N 2.91Å; Q318-S322 WeakPolarHBondContact O-CB 3.32Å; Q318-S322 PolarHBondContact O-N 3.18Å; Q318-S322 PolarHBondContact O-OG 2.93Å; Q318-M537 VanDerWaalsContact C-SD 3.57Å; Q318-M537 HydrophobicContact CB-CE 4.41Å; Q318-M537 HydrophobicContact CB-SD 3.88Å; Q318-M537 HydrophobicContact CG-CE 3.73Å; Q318-M537 HydrophobicContact CG-SD 3.77Å
319	C	93.3	Very high	90	Very high	5 Å²	5	18.9 Å²	18.9	3%	0.034	11%	0.106	C	C	.	.	H	α-helix	trans	-57	-47.2	172.5	-70.5	0	0	0	0	110.3	V315 L316 F321 S322 S323 M537 L540 A541	V315-C319 PolarHBondContact O-N 3.43Å; V315-C319 PolarHBondContact O-SG 3.46Å; L316-C319 WeakPolarHBondContact O-CB 3.39Å; L316-C319 PolarHBondContact O-N 3.44Å; C319-F321 PolarHBondContact O-N 2.91Å; C319-S322 PolarHBondContact O-N 2.93Å; C319-S323 PolarHBondContact O-N 3.17Å; C319-S323 PolarHBondContact O-OG 3.08Å; C319-M537 HydrophobicContact CB-SD 4.24Å; C319-M537 PolarHBondContact N-SD 2.86Å; C319-M537 VanDerWaalsContact N-SD 3.4Å; C319-L540 HydrophobicContact CB-CB 4.33Å; C319-A541 HydrophobicContact CB-CB 4.33Å; C319-A541 WeakPolarHBondContact O-CB 3.38Å
320	C	91.6	Very high	90.3	Very high	15 Å²	15	16.7 Å²	16.7	10%	0.101	9%	0.092	C	C	.	.	H	α-helix	trans	-58.2	-46.8	178	-66.7	0	0	0	0	112.5	L316 A317 Q318 S322 S323 Y589	L316-C320 PolarHBondContact O-N 2.89Å; L316-C320 VanDerWaalsContact O-N 3.09Å; L316-C320 PolarHBondContact O-SG 2.99Å; A317-C320 WeakPolarHBondContact O-CB 3.1Å; A317-C320 PolarHBondContact O-N 3.38Å; Q318-C320 VanDerWaalsContact C-N 3.32Å; Q318-C320 PolarHBondContact O-N 2.91Å; C320-S322 VanDerWaalsContact C-N 3.33Å; C320-S322 PolarHBondContact O-N 2.91Å; C320-S323 PolarHBondContact O-N 3.29Å; C320-Y589 WeakPolarHBondContact CB-O 3.26Å
321	F	87.6	Confident	90.8	Very high	30 Å²	30	14.9 Å²	14.9	13%	0.132	8%	0.082	C	C	.	.	H	α-helix	trans	-65.7	-36.7	177.4	-67.8	-61.2	0	0	0	112.6	A317 Q318 C319 V324 I325 L513 K590 I594 L597	A317-F321 WeakPolarHBondContact O-CD2 3.46Å; A317-F321 PolarHBondContact O-N 3.24Å; Q318-F321 PolarHBondContact O-N 2.91Å; C319-F321 PolarHBondContact O-N 2.91Å; F321-V324 PolarHBondContact O-N 3.14Å; F321-I325 PolarHBondContact O-N 3.47Å; F321-L513 HydrophobicContact CD2-CD1 4.05Å; F321-L513 HydrophobicContact CE2-CD1 4.17Å; F321-K590 HydrophobicContact CD1-CG 4.49Å; F321-K590 HydrophobicContact CE1-CG 4.44Å; F321-I594 HydrophobicContact CZ-CG1 4.4Å; F321-L597 HydrophobicContact CE2-CD1 3.87Å; F321-L597 HydrophobicContact CZ-CD1 4.14Å
322	S	89.9	Confident	91	Very high	5 Å²	5	15.1 Å²	15.1	4%	0.035	8%	0.083	C	C	.	.	H	α-helix	trans	-76.1	-27	179	-70.3	0	0	0	0	113.8	Q318 C319 C320 V324 I325 A326 M537	Q318-S322 WeakPolarHBondContact O-CB 3.32Å; Q318-S322 PolarHBondContact O-N 3.18Å; Q318-S322 PolarHBondContact O-OG 2.93Å; C319-S322 PolarHBondContact O-N 2.93Å; C320-S322 VanDerWaalsContact C-N 3.33Å; C320-S322 PolarHBondContact O-N 2.91Å; S322-V324 PolarHBondContact O-N 3.19Å; S322-I325 PolarHBondContact O-N 2.89Å; S322-I325 VanDerWaalsContact O-N 3.08Å; S322-A326 WeakPolarHBondContact O-CB 3.28Å; S322-A326 PolarHBondContact O-N 3.25Å; S322-M537 WeakPolarHBondContact OG-CE 3.45Å
323	S	93.4	Very high	91.1	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.014	7%	0.069	C	C	.	.	H	α-helix	trans	-59.1	-37.2	170.9	-64.4	0	0	0	0	111.6	C319 C320 A326 G327 A541	C319-S323 PolarHBondContact O-N 3.17Å; C319-S323 PolarHBondContact O-OG 3.08Å; C320-S323 PolarHBondContact O-N 3.29Å; S323-A326 PolarHBondContact O-N 3.43Å; S323-G327 PolarHBondContact O-N 3.44Å; S323-A541 WeakPolarHBondContact OG-CA 3.25Å; S323-A541 WeakPolarHBondContact OG-CB 3.41Å
324	V	90.9	Very high	91.1	Very high	9 Å²	9	11.2 Å²	11.2	6%	0.055	6%	0.063	C	C	.	.	H	α-helix	trans	-64.7	-43.6	173.7	179.6	0	0	0	0	111.1	F321 S322 G327 L328 Q586 Y589 K590	F321-V324 PolarHBondContact O-N 3.14Å; S322-V324 PolarHBondContact O-N 3.19Å; V324-G327 PolarHBondContact O-N 3.42Å; V324-L328 HydrophobicContact CG1-CD1 4.02Å; V324-L328 HydrophobicContact CG1-CG 4.47Å; V324-L328 WeakPolarHBondContact O-CB 3.49Å; V324-L328 WeakPolarHBondContact O-CG 3.27Å; V324-L328 PolarHBondContact O-N 2.73Å; V324-Q586 HydrophobicContact CG1-CB 4.09Å; V324-Q586 HydrophobicContact CG1-CG 4.04Å; V324-Q586 HydrophobicContact CG2-CB 4.37Å; V324-Y589 HydrophobicContact CG2-CG 4.46Å; V324-K590 HydrophobicContact CG2-CG 4.34Å
325	I	89.3	Confident	91.3	Very high	52 Å²	52	11.3 Å²	11.3	27%	0.267	6%	0.063	S	C	.	.	H	α-helix	trans	-63.8	-44.6	178.1	-63	170.3	0	0	0	110.5	F321 S322 L328 A329 W542	F321-I325 PolarHBondContact O-N 3.47Å; S322-I325 PolarHBondContact O-N 2.89Å; S322-I325 VanDerWaalsContact O-N 3.08Å; I325-L328 PolarHBondContact O-N 3.02Å; I325-A329 WeakPolarHBondContact O-CB 3.48Å; I325-A329 PolarHBondContact O-N 2.99Å; I325-W542 HydrophobicContact CG2-CH2 4.37Å; I325-W542 HydrophobicContact CG2-CZ2 4.44Å
326	A	91.9	Very high	91.2	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-63.6	-40.9	178.2	0	0	0	0	0	112.1	S322 S323 A329 S330 W542 A545	S322-A326 WeakPolarHBondContact O-CB 3.28Å; S322-A326 PolarHBondContact O-N 3.25Å; S323-A326 PolarHBondContact O-N 3.43Å; A326-A329 PolarHBondContact O-N 3.23Å; A326-S330 WeakPolarHBondContact O-CB 3.28Å; A326-S330 PolarHBondContact O-N 2.95Å; A326-S330 VanDerWaalsContact O-N 3.13Å; A326-S330 PolarHBondContact O-OG 3.49Å; A326-W542 HydrophobicContact CB-CD2 4.07Å; A326-W542 HydrophobicContact CB-CE3 3.91Å; A326-W542 HydrophobicContact CB-CZ3 4.3Å; A326-A545 HydrophobicContact CB-CB 3.94Å
327	G	92.8	Very high	91	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63	-51.2	174.7	0	0	0	0	0	112.7	S323 V324 A329 S330 F331	S323-G327 PolarHBondContact O-N 3.44Å; V324-G327 PolarHBondContact O-N 3.42Å; G327-A329 VanDerWaalsContact C-N 3.33Å; G327-A329 PolarHBondContact O-N 3.29Å; G327-S330 PolarHBondContact O-N 2.83Å; G327-S330 VanDerWaalsContact O-N 3.08Å; G327-F331 PolarHBondContact O-N 3.39Å
328	L	91.3	Very high	90.7	Very high	17 Å²	17	12.1 Å²	12.1	9%	0.089	6%	0.063	C	C	.	.	H	α-helix	trans	-58.9	-44.2	175.3	-73.2	172.7	0	0	0	111.5	V324 I325 S330 L332	V324-L328 HydrophobicContact CG1-CD1 4.02Å; V324-L328 HydrophobicContact CG1-CG 4.47Å; V324-L328 WeakPolarHBondContact O-CB 3.49Å; V324-L328 WeakPolarHBondContact O-CG 3.27Å; V324-L328 PolarHBondContact O-N 2.73Å; I325-L328 PolarHBondContact O-N 3.02Å; L328-S330 PolarHBondContact O-N 2.89Å; L328-L332 HydrophobicContact CD2-CD1 4.12Å; L328-L332 HydrophobicContact CD2-CD2 4.45Å; L328-L332 WeakPolarHBondContact O-CB 3.46Å; L328-L332 PolarHBondContact O-N 2.9Å; L328-L332 VanDerWaalsContact O-N 3.09Å
329	A	90.6	Very high	90.4	Very high	23 Å²	23	11.7 Å²	11.7	19%	0.19	6%	0.061	C	C	.	.	H	α-helix	trans	-67	-15.1	178.4	0	0	0	0	0	113.6	R42 Y207 I325 A326 G327	R42-A329 VanDerWaalsContact CB-O 3.28Å; R42-A329 WeakPolarHBondContact CB-O 3.42Å; R42-A329 WeakPolarHBondContact CD-O 3.24Å; Y207-A329 PolarHBondContact OH-O 3.27Å; I325-A329 WeakPolarHBondContact O-CB 3.48Å; I325-A329 PolarHBondContact O-N 2.99Å; A326-A329 PolarHBondContact O-N 3.23Å; G327-A329 VanDerWaalsContact C-N 3.33Å; G327-A329 PolarHBondContact O-N 3.29Å
330	S	93.1	Very high	89.9	Confident	1 Å²	1	11.6 Å²	11.6	1%	0.007	6%	0.06	C	C	.	.	H	α-helix	trans	-101.1	-38.3	-178.8	-53.2	0	0	0	0	112.4	R42 A326 G327 L328	R42-S330 PolarHBondContact NH1-OG 3.37Å; A326-S330 WeakPolarHBondContact O-CB 3.28Å; A326-S330 PolarHBondContact O-N 2.95Å; A326-S330 VanDerWaalsContact O-N 3.13Å; A326-S330 PolarHBondContact O-OG 3.49Å; G327-S330 PolarHBondContact O-N 2.83Å; G327-S330 VanDerWaalsContact O-N 3.08Å; L328-S330 PolarHBondContact O-N 2.89Å
331	F	94.4	Very high	89.3	Confident	1 Å²	1	13.1 Å²	13.1	0%	0.004	8%	0.078	C	C	.	.	H	α-helix	trans	-129.8	6.3	-167.7	-67.2	-72	0	0	0	115	I45 S56 G327 S333 K334 F335 P546 F549 I553 Y582	I45-F331 HydrophobicContact CG2-CD1 4.48Å; I45-F331 HydrophobicContact CG2-CE1 3.85Å; S56-F331 WeakPolarHBondContact O-CZ 3.39Å; G327-F331 PolarHBondContact O-N 3.39Å; F331-S333 VanDerWaalsContact C-N 3.34Å; F331-S333 PolarHBondContact O-N 3.06Å; F331-K334 HydrophobicContact CD1-CB 4.42Å; F331-K334 HydrophobicContact CD1-CD 3.96Å; F331-K334 HydrophobicContact CE1-CD 4.44Å; F331-K334 PolarHBondContact O-N 2.92Å; F331-F335 WeakPolarHBondContact O-CB 3.45Å; F331-F335 PolarHBondContact O-N 3.24Å; F331-P546 VanDerWaalsContact CE2-O 3.25Å; F331-P546 WeakPolarHBondContact CE2-O 3.41Å; F331-F549 HydrophobicContact CD2-CB 3.89Å; F331-F549 HydrophobicContact CE2-CB 4.33Å; F331-I553 HydrophobicContact CB-CD1 3.84Å; F331-I553 HydrophobicContact CD1-CD1 3.43Å; F331-I553 VanDerWaalsContact CD1-CD1 3.43Å; F331-I553 HydrophobicContact CD2-CD1 3.85Å; F331-I553 HydrophobicContact CE1-CD1 3.84Å; F331-I553 HydrophobicContact CE2-CD1 4.25Å; F331-I553 HydrophobicContact CG-CD1 3.41Å; F331-I553 VanDerWaalsContact CG-CD1 3.41Å; F331-I553 HydrophobicContact CZ-CD1 4.23Å; F331-Y582 HydrophobicContact CB-CE2 3.87Å
332	L	92.3	Very high	89	Confident	6 Å²	6	12.1 Å²	12.1	3%	0.031	8%	0.075	C	C	.	.	H	α-helix	trans	-62.1	-40.1	177.9	-178.9	60.2	0	0	0	112.2	L328 K334 F335 L336 V351 Y354 I499 Y582	L328-L332 HydrophobicContact CD2-CD1 4.12Å; L328-L332 HydrophobicContact CD2-CD2 4.45Å; L328-L332 WeakPolarHBondContact O-CB 3.46Å; L328-L332 PolarHBondContact O-N 2.9Å; L328-L332 VanDerWaalsContact O-N 3.09Å; L332-K334 PolarHBondContact O-N 3.28Å; L332-F335 HydrophobicContact CD1-CD1 4.33Å; L332-F335 WeakPolarHBondContact O-CB 3.26Å; L332-F335 PolarHBondContact O-N 2.87Å; L332-L336 HydrophobicContact CD1-CG 4.34Å; L332-L336 HydrophobicContact CG-CD1 4.48Å; L332-L336 WeakPolarHBondContact O-CG 3.28Å; L332-L336 PolarHBondContact O-N 3.27Å; L332-V351 HydrophobicContact CB-CG2 4.15Å; L332-V351 HydrophobicContact CD2-CG1 4.32Å; L332-V351 HydrophobicContact CD2-CG2 3.79Å; L332-V351 HydrophobicContact CG-CG2 3.73Å; L332-Y354 HydrophobicContact CD2-CD1 4.27Å; L332-Y354 HydrophobicContact CD2-CE1 4.25Å; L332-I499 HydrophobicContact CD1-CD1 4.16Å; L332-Y582 PolarHBondContact N-OH 3.22Å
333	S	91.9	Very high	88.8	Confident	1 Å²	1	13.6 Å²	13.6	1%	0.007	9%	0.085	C	C	.	.	H	α-helix	trans	-60.3	-45.4	175.5	53.8	0	0	0	0	111.7	F331 L336 E337 S347	F331-S333 VanDerWaalsContact C-N 3.34Å; F331-S333 PolarHBondContact O-N 3.06Å; S333-L336 PolarHBondContact O-N 2.8Å; S333-E337 WeakPolarHBondContact O-CB 3.45Å; S333-E337 PolarHBondContact O-N 3.28Å; S333-S347 WeakPolarHBondContact O-CB 3.32Å
334	K	91.3	Very high	88.6	Confident	4 Å²	4	13.8 Å²	13.8	2%	0.017	9%	0.086	C	C	.	.	H	α-helix	trans	-62.6	-40	175.2	-175.1	174.4	-177.8	170.7	0	112.2	E49 S56 F331 L332 E337 R338 Y573	E49-K334 VanDerWaalsContact CD-NZ 3.32Å; E49-K334 IonicContact OE1-NZ 2.82Å; E49-K334 PolarHBondContact OE1-NZ 3.36Å; E49-K334 WeakPolarHBondContact OE2-CE 3.45Å; E49-K334 IonicContact OE2-NZ 3.29Å; E49-K334 PolarHBondContact OE2-NZ 2.85Å; S56-K334 PolarHBondContact OG-NZ 3.35Å; F331-K334 HydrophobicContact CD1-CB 4.42Å; F331-K334 HydrophobicContact CD1-CD 3.96Å; F331-K334 HydrophobicContact CE1-CD 4.44Å; F331-K334 PolarHBondContact O-N 2.92Å; L332-K334 PolarHBondContact O-N 3.28Å; K334-E337 PolarHBondContact O-N 3.09Å; K334-R338 HydrophobicContact CG-CG 4.46Å; K334-R338 WeakPolarHBondContact O-CG 3.49Å; K334-R338 PolarHBondContact O-N 3.06Å; K334-Y573 PolarHBondContact NZ-OH 2.79Å
335	F	90.8	Very high	88.6	Confident	1 Å²	1	13.7 Å²	13.7	0%	0.004	9%	0.086	C	C	.	.	H	α-helix	trans	-60.5	-47.1	175.6	176.7	-98.3	0	0	0	111.2	F331 L332 R338 Q339 Y340 F578 R579 Y582 L583	F331-F335 WeakPolarHBondContact O-CB 3.45Å; F331-F335 PolarHBondContact O-N 3.24Å; L332-F335 HydrophobicContact CD1-CD1 4.33Å; L332-F335 WeakPolarHBondContact O-CB 3.26Å; L332-F335 PolarHBondContact O-N 2.87Å; F335-R338 PolarHBondContact O-N 3.28Å; F335-Q339 HydrophobicContact CE2-CB 4.43Å; F335-Q339 HydrophobicContact CZ-CB 4.33Å; F335-Q339 HydrophobicContact CZ-CG 4.19Å; F335-Q339 WeakPolarHBondContact O-CB 3.38Å; F335-Q339 PolarHBondContact O-N 3.15Å; F335-Y340 HydrophobicContact CE1-CE2 4.21Å; F335-F578 HydrophobicContact CB-CE1 4.48Å; F335-F578 HydrophobicContact CB-CZ 4.32Å; F335-F578 HydrophobicContact CD2-CD1 4.37Å; F335-F578 AromaticContact CD2-CE1 3.67Å; F335-F578 HydrophobicContact CD2-CE1 3.67Å; F335-F578 AromaticContact CD2-CZ 3.85Å; F335-F578 HydrophobicContact CD2-CZ 3.85Å; F335-F578 HydrophobicContact CE2-CE1 4.35Å; F335-F578 HydrophobicContact CG-CE1 4.45Å; F335-R579 HydrophobicContact CE2-CB 4.45Å; F335-Y582 HydrophobicContact CB-CD1 4.36Å; F335-Y582 HydrophobicContact CB-CE1 3.95Å; F335-Y582 HydrophobicContact CD1-CE1 4.41Å; F335-Y582 AromaticContact CD2-CD1 3.43Å; F335-Y582 HydrophobicContact CD2-CD1 3.43Å; F335-Y582 VanDerWaalsContact CD2-CD1 3.43Å; F335-Y582 AromaticContact CD2-CE1 3.86Å; F335-Y582 HydrophobicContact CD2-CE1 3.86Å; F335-Y582 AromaticContact CD2-CG 3.94Å; F335-Y582 HydrophobicContact CD2-CG 3.94Å; F335-Y582 AromaticContact CE2-CD1 3.82Å; F335-Y582 HydrophobicContact CE2-CD1 3.82Å; F335-Y582 HydrophobicContact CE2-CG 4.43Å; F335-Y582 AromaticContact CG-CD1 3.88Å; F335-Y582 HydrophobicContact CG-CD1 3.88Å; F335-Y582 AromaticContact CG-CE1 3.8Å; F335-Y582 HydrophobicContact CG-CE1 3.8Å; F335-L583 HydrophobicContact CZ-CD1 4.33Å; F335-L583 HydrophobicContact CZ-CD2 4.49Å; F335-L583 HydrophobicContact CZ-CG 4.35Å
336	L	88.7	Confident	88.7	Confident	1 Å²	1	15.8 Å²	15.8	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-66	-39.4	177.9	-62.1	177.4	0	0	0	112.3	L332 S333 Y340 V351 L492 I496	L332-L336 HydrophobicContact CD1-CG 4.34Å; L332-L336 HydrophobicContact CG-CD1 4.48Å; L332-L336 WeakPolarHBondContact O-CG 3.28Å; L332-L336 PolarHBondContact O-N 3.27Å; S333-L336 PolarHBondContact O-N 2.8Å; L336-Y340 HydrophobicContact CD2-CD2 3.98Å; L336-Y340 HydrophobicContact CD2-CE2 3.94Å; L336-Y340 PolarHBondContact O-N 3.31Å; L336-V351 HydrophobicContact CD1-CG2 4.15Å; L336-L492 HydrophobicContact CB-CD1 4.28Å; L336-L492 HydrophobicContact CD2-CD1 3.81Å; L336-L492 HydrophobicContact CG-CD1 4.45Å; L336-I496 HydrophobicContact CD1-CD1 3.69Å; L336-I496 HydrophobicContact CD1-CG1 4.2Å; L336-I496 HydrophobicContact CD2-CD1 4.04Å; L336-I496 HydrophobicContact CD2-CG1 4Å
337	E	86.4	Confident	88.7	Confident	14 Å²	14	15.8 Å²	15.8	7%	0.065	9%	0.091	C	C	.	.	H	α-helix	trans	-57.1	-51.2	174.6	179.1	-174.3	167.7	0	0	111.4	S46 R50 S333 K334 G341 A342 V344 S347	S46-E337 WeakPolarHBondContact CB-OE2 3.38Å; S46-E337 PolarHBondContact OG-OE2 3.32Å; R50-E337 IonicContact CZ-OE1 2.89Å; R50-E337 IonicContact NH1-OE1 3.97Å; R50-E337 PolarHBondContact NH1-OE1 3.41Å; S333-E337 WeakPolarHBondContact O-CB 3.45Å; S333-E337 PolarHBondContact O-N 3.28Å; K334-E337 PolarHBondContact O-N 3.09Å; E337-G341 WeakPolarHBondContact O-CA 3.17Å; E337-G341 PolarHBondContact O-N 3.09Å; E337-A342 WeakPolarHBondContact CA-O 3.23Å; E337-V344 HydrophobicContact CG-CG2 4.35Å; E337-S347 PolarHBondContact N-OG 2.97Å
338	R	84.3	Confident	88.8	Confident	59 Å²	59	15.8 Å²	15.8	22%	0.223	9%	0.091	C	C	.	.	H	α-helix	trans	-81.6	-37.3	-173.5	-61.8	-58.5	178.8	156.4	2.1	113.9	K334 F335 E571 Y573 F578	K334-R338 HydrophobicContact CG-CG 4.46Å; K334-R338 WeakPolarHBondContact O-CG 3.49Å; K334-R338 PolarHBondContact O-N 3.06Å; F335-R338 PolarHBondContact O-N 3.28Å; R338-E571 PolarHBondContact NH1-O 2.92Å; R338-Y573 HydrophobicContact CG-CD2 4.44Å; R338-F578 HydrophobicContact CB-CD1 4.32Å; R338-F578 HydrophobicContact CB-CE1 3.9Å
339	Q	83	Confident	88.9	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-76.9	-37.9	-176.7	-167.7	64.7	14.7	0	0	112.7	F335 C399 N575	F335-Q339 HydrophobicContact CE2-CB 4.43Å; F335-Q339 HydrophobicContact CZ-CB 4.33Å; F335-Q339 HydrophobicContact CZ-CG 4.19Å; F335-Q339 WeakPolarHBondContact O-CB 3.38Å; F335-Q339 PolarHBondContact O-N 3.15Å; Q339-C399 PolarHBondContact NE2-O 3.27Å; Q339-N575 PolarHBondContact OE1-O 2.62Å
340	Y	82.6	Confident	89	Confident	3 Å²	3	16 Å²	16	1%	0.012	9%	0.089	C	C	.	.	H	α-helix	trans	-113.4	-0.5	-174.1	-55.2	-76	0	0	0	113.5	F335 L336 A342 Q397 N486 L492 V495	F335-Y340 HydrophobicContact CE1-CE2 4.21Å; L336-Y340 HydrophobicContact CD2-CD2 3.98Å; L336-Y340 HydrophobicContact CD2-CE2 3.94Å; L336-Y340 PolarHBondContact O-N 3.31Å; Y340-A342 PolarHBondContact O-N 2.93Å; Y340-Q397 PolarHBondContact OH-O 3.46Å; Y340-N486 VanDerWaalsContact CA-ND2 3.32Å; Y340-N486 WeakPolarHBondContact CA-ND2 3.2Å; Y340-N486 PolarHBondContact O-ND2 3.24Å; Y340-L492 HydrophobicContact CD1-CB 4.18Å; Y340-L492 HydrophobicContact CD2-CD1 3.51Å; Y340-L492 HydrophobicContact CE2-CD1 4.28Å; Y340-L492 HydrophobicContact CG-CB 4.03Å; Y340-L492 HydrophobicContact CG-CD1 3.73Å; Y340-L492 HydrophobicContact CG-CG 4.47Å; Y340-V495 VanDerWaalsContact OH-CG2 3.29Å; Y340-V495 WeakPolarHBondContact OH-CG2 3.32Å
341	G	78	Confident	89	Confident	47 Å²	47	16 Å²	16	49%	0.485	9%	0.089	S	C	.	.			trans	64.9	20.9	179.5	0	0	0	0	0	112.8	E337 N486	E337-G341 WeakPolarHBondContact O-CA 3.17Å; E337-G341 PolarHBondContact O-N 3.09Å; G341-N486 PolarHBondContact N-ND2 3.38Å
342	A	83	Confident	88.9	Confident	8 Å²	8	16 Å²	16	7%	0.066	9%	0.089	C	C	.	.			trans	-74.5	138.5	-179.8	0	0	0	0	0	110.4	E337 Y340 Y346 S347 L492	E337-A342 WeakPolarHBondContact CA-O 3.23Å; Y340-A342 PolarHBondContact O-N 2.93Å; A342-Y346 HydrophobicContact CB-CD1 4.22Å; A342-S347 WeakPolarHBondContact CB-OG 3.28Å; A342-L492 HydrophobicContact CB-CD2 4.09Å
343	P	85.6	Confident	88.8	Confident	37 Å²	37	21.5 Å²	21.5	24%	0.24	11%	0.113	C	C	.	.			trans	-55.6	145.4	175.5	-27.2	36	0	0	0	112.1	V234 A345 Y346 S347	V234-P343 HydrophobicContact CG2-CG 3.95Å; P343-A345 VanDerWaalsContact C-N 3.27Å; P343-A345 PolarHBondContact O-N 3.2Å; P343-Y346 PolarHBondContact O-N 3.24Å; P343-S347 PolarHBondContact O-N 3.39Å; P343-S347 PolarHBondContact O-OG 3.33Å
344	V	88	Confident	88.6	Confident	5 Å²	5	22.2 Å²	22.2	3%	0.03	12%	0.116	C	C	.	.	H	α-helix	trans	-55.3	-42.6	-175.5	-165.1	0	0	0	0	112.2	S46 T47 L214 E337 Y346 T348	S46-V344 WeakPolarHBondContact OG-CG1 3.05Å; T47-V344 HydrophobicContact CG2-CB 4.4Å; T47-V344 HydrophobicContact CG2-CG1 3.88Å; T47-V344 HydrophobicContact CG2-CG2 4.4Å; L214-V344 HydrophobicContact CD1-CG1 3.93Å; E337-V344 HydrophobicContact CG-CG2 4.35Å; V344-Y346 PolarHBondContact O-N 2.85Å; V344-T348 VanDerWaalsContact O-CB 3.24Å; V344-T348 WeakPolarHBondContact O-CB 3Å; V344-T348 PolarHBondContact O-N 2.95Å; V344-T348 PolarHBondContact O-OG1 3.35Å
345	A	91.4	Very high	88.4	Confident	8 Å²	8	22.5 Å²	22.5	7%	0.066	12%	0.118	C	C	.	.	H	α-helix	trans	-62.1	-40.3	176.7	0	0	0	0	0	112.5	S211 L214 R215 P343 L349	S211-A345 WeakPolarHBondContact CB-O 3.49Å; S211-A345 WeakPolarHBondContact O-CB 3.19Å; S211-A345 PolarHBondContact OG-O 3.4Å; L214-A345 HydrophobicContact CB-CB 4.22Å; R215-A345 HydrophobicContact CG-CB 3.76Å; P343-A345 VanDerWaalsContact C-N 3.27Å; P343-A345 PolarHBondContact O-N 3.2Å; A345-L349 WeakPolarHBondContact O-CB 3.41Å; A345-L349 PolarHBondContact O-N 3.06Å
346	Y	91.3	Very high	88.3	Confident	95 Å²	95	25.3 Å²	25.3	37%	0.373	13%	0.132	S	C	.	.	H	α-helix	trans	-73.1	-43	-179.5	-174.6	-116.3	0	0	0	112.2	A342 P343 V344 T348 L349 L350 L492	A342-Y346 HydrophobicContact CB-CD1 4.22Å; P343-Y346 PolarHBondContact O-N 3.24Å; V344-Y346 PolarHBondContact O-N 2.85Å; Y346-T348 VanDerWaalsContact C-N 3.28Å; Y346-T348 PolarHBondContact O-N 3.46Å; Y346-L349 HydrophobicContact CD2-CD2 4.32Å; Y346-L349 WeakPolarHBondContact O-CB 3.35Å; Y346-L349 PolarHBondContact O-N 2.63Å; Y346-L350 HydrophobicContact CD1-CD1 3.86Å; Y346-L350 HydrophobicContact CE1-CD1 3.55Å; Y346-L350 HydrophobicContact CE1-CG 4.37Å; Y346-L350 HydrophobicContact CE2-CD1 4.48Å; Y346-L350 HydrophobicContact CE2-CG 4.48Å; Y346-L350 HydrophobicContact CG-CD1 4.46Å; Y346-L350 WeakPolarHBondContact O-CG 3.19Å; Y346-L350 PolarHBondContact O-N 3.45Å; Y346-L492 HydrophobicContact CD1-CD2 4.24Å; Y346-L492 HydrophobicContact CE1-CD2 3.68Å
347	S	92.1	Very high	88.1	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.2	-45.3	172.3	-64.5	0	0	0	0	111.2	S333 E337 A342 P343 L350 V351	S333-S347 WeakPolarHBondContact O-CB 3.32Å; E337-S347 PolarHBondContact N-OG 2.97Å; A342-S347 WeakPolarHBondContact CB-OG 3.28Å; P343-S347 PolarHBondContact O-N 3.39Å; P343-S347 PolarHBondContact O-OG 3.33Å; S347-L350 PolarHBondContact O-N 3.3Å; S347-V351 WeakPolarHBondContact O-CG2 3.24Å; S347-V351 PolarHBondContact O-N 2.81Å; S347-V351 VanDerWaalsContact O-N 3.1Å
348	T	93.9	Very high	87.9	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.4	-40	178.2	-61	0	0	0	0	112.5	Y207 V344 Y346 L350 V351 G352	Y207-T348 HydrophobicContact CD1-CG2 4.04Å; Y207-T348 VanDerWaalsContact O-CG2 3.24Å; Y207-T348 WeakPolarHBondContact O-CG2 3.37Å; V344-T348 VanDerWaalsContact O-CB 3.24Å; V344-T348 WeakPolarHBondContact O-CB 3Å; V344-T348 PolarHBondContact O-N 2.95Å; V344-T348 PolarHBondContact O-OG1 3.35Å; Y346-T348 VanDerWaalsContact C-N 3.28Å; Y346-T348 PolarHBondContact O-N 3.46Å; T348-L350 VanDerWaalsContact C-N 3.33Å; T348-L350 PolarHBondContact O-N 3.04Å; T348-V351 PolarHBondContact O-N 3.33Å; T348-G352 PolarHBondContact O-N 2.94Å
349	L	94.6	Very high	87.7	Confident	30 Å²	30	28.7 Å²	28.7	16%	0.157	15%	0.15	C	C	.	.	H	α-helix	trans	-59.4	-44.9	174.8	-179.8	62.8	0	0	0	111.6	L208 S211 A345 Y346 G352 K353	L208-L349 HydrophobicContact CD2-CD1 3.65Å; S211-L349 WeakPolarHBondContact OG-CB 3.4Å; A345-L349 WeakPolarHBondContact O-CB 3.41Å; A345-L349 PolarHBondContact O-N 3.06Å; Y346-L349 HydrophobicContact CD2-CD2 4.32Å; Y346-L349 WeakPolarHBondContact O-CB 3.35Å; Y346-L349 PolarHBondContact O-N 2.63Å; L349-G352 PolarHBondContact O-N 2.93Å; L349-K353 WeakPolarHBondContact O-CG 3.46Å; L349-K353 PolarHBondContact O-N 3.14Å
350	L	92.4	Very high	87.4	Confident	14 Å²	14	32.1 Å²	32.1	7%	0.073	17%	0.168	C	C	.	.	H	α-helix	trans	-65.3	-40.6	-179.6	-68.8	164.2	0	0	0	111.5	Y346 S347 T348 K353 Y354 L492 L493 I496	Y346-L350 HydrophobicContact CD1-CD1 3.86Å; Y346-L350 HydrophobicContact CE1-CD1 3.55Å; Y346-L350 HydrophobicContact CE1-CG 4.37Å; Y346-L350 HydrophobicContact CE2-CD1 4.48Å; Y346-L350 HydrophobicContact CE2-CG 4.48Å; Y346-L350 HydrophobicContact CG-CD1 4.46Å; Y346-L350 WeakPolarHBondContact O-CG 3.19Å; Y346-L350 PolarHBondContact O-N 3.45Å; S347-L350 PolarHBondContact O-N 3.3Å; T348-L350 VanDerWaalsContact C-N 3.33Å; T348-L350 PolarHBondContact O-N 3.04Å; L350-K353 PolarHBondContact O-N 3.48Å; L350-Y354 WeakPolarHBondContact O-CB 3.42Å; L350-Y354 PolarHBondContact O-N 3.06Å; L350-L492 HydrophobicContact CD1-CD1 4.43Å; L350-L492 HydrophobicContact CD1-CD2 3.99Å; L350-L492 HydrophobicContact CD1-CG 4.26Å; L350-L493 HydrophobicContact CD2-CD2 4.21Å; L350-I496 HydrophobicContact CB-CD1 3.76Å; L350-I496 HydrophobicContact CD1-CD1 3.54Å; L350-I496 HydrophobicContact CD2-CD1 4.26Å; L350-I496 HydrophobicContact CG-CD1 4.05Å
351	V	92.3	Very high	86.9	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.018	18%	0.176	C	C	.	.	H	α-helix	trans	-60.9	-45.4	173.4	178.1	0	0	0	0	110.9	Y207 L332 L336 S347 T348 K353 Y354 V355	Y207-V351 HydrophobicContact CD1-CB 4.06Å; Y207-V351 HydrophobicContact CD1-CG1 3.74Å; Y207-V351 HydrophobicContact CD2-CG1 4.07Å; Y207-V351 HydrophobicContact CE1-CB 4.16Å; Y207-V351 HydrophobicContact CE1-CG1 3.52Å; Y207-V351 HydrophobicContact CE2-CG1 3.88Å; Y207-V351 HydrophobicContact CG-CB 4.49Å; Y207-V351 HydrophobicContact CG-CG1 4.02Å; L332-V351 HydrophobicContact CB-CG2 4.15Å; L332-V351 HydrophobicContact CD2-CG1 4.32Å; L332-V351 HydrophobicContact CD2-CG2 3.79Å; L332-V351 HydrophobicContact CG-CG2 3.73Å; L336-V351 HydrophobicContact CD1-CG2 4.15Å; S347-V351 WeakPolarHBondContact O-CG2 3.24Å; S347-V351 PolarHBondContact O-N 2.81Å; S347-V351 VanDerWaalsContact O-N 3.1Å; T348-V351 PolarHBondContact O-N 3.33Å; V351-K353 PolarHBondContact O-N 2.64Å; V351-Y354 WeakPolarHBondContact O-CB 3.12Å; V351-Y354 PolarHBondContact O-N 3.35Å; V351-V355 HydrophobicContact CG1-CG2 4.21Å; V351-V355 VanDerWaalsContact O-CG2 3.31Å; V351-V355 WeakPolarHBondContact O-CG2 3.48Å; V351-V355 PolarHBondContact O-N 2.52Å
352	G	92.4	Very high	86.6	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.9	-43.4	177.3	0	0	0	0	0	113.4	Y207 T348 L349 V355 L356	Y207-G352 VanDerWaalsContact CB-CA 3.42Å; T348-G352 PolarHBondContact O-N 2.94Å; L349-G352 PolarHBondContact O-N 2.93Å; G352-V355 PolarHBondContact O-N 2.92Å; G352-L356 WeakPolarHBondContact O-CB 3.43Å; G352-L356 PolarHBondContact O-N 3.47Å; G352-L356 VanDerWaalsContact O-N 3.08Å
353	K	90.6	Very high	86	Confident	122 Å²	122	37 Å²	37	53%	0.53	18%	0.175	S	C	.	.	H	α-helix	trans	-64.1	-43.7	174.8	-71.5	179.3	177.9	-174	0	112.5	L349 L350 V351 L356 L357	L349-K353 WeakPolarHBondContact O-CG 3.46Å; L349-K353 PolarHBondContact O-N 3.14Å; L350-K353 PolarHBondContact O-N 3.48Å; V351-K353 PolarHBondContact O-N 2.64Å; K353-L356 PolarHBondContact O-N 3.32Å; K353-L357 PolarHBondContact O-N 3.21Å
354	Y	87.7	Confident	85.1	Confident	16 Å²	16	40.9 Å²	40.9	6%	0.063	19%	0.193	C	C	.	.	H	α-helix	trans	-58.8	-47.3	176.3	151.3	-100.1	0	0	0	111.7	L332 L350 V351 L356 L357 R358 I499 S503	L332-Y354 HydrophobicContact CD2-CD1 4.27Å; L332-Y354 HydrophobicContact CD2-CE1 4.25Å; L350-Y354 WeakPolarHBondContact O-CB 3.42Å; L350-Y354 PolarHBondContact O-N 3.06Å; V351-Y354 WeakPolarHBondContact O-CB 3.12Å; V351-Y354 PolarHBondContact O-N 3.35Å; Y354-L356 VanDerWaalsContact C-N 3.33Å; Y354-L356 PolarHBondContact O-N 3.04Å; Y354-L357 PolarHBondContact O-N 3.42Å; Y354-R358 WeakPolarHBondContact O-CB 3.46Å; Y354-R358 PolarHBondContact O-N 3.49Å; Y354-I499 HydrophobicContact CD2-CG2 4.49Å; Y354-I499 HydrophobicContact CE2-CG2 3.88Å; Y354-S503 WeakPolarHBondContact CE2-OG 3.12Å; Y354-S503 WeakPolarHBondContact OH-CB 3.34Å
355	V	87.6	Confident	83.7	Confident	10 Å²	10	42.6 Å²	42.6	6%	0.061	20%	0.202	C	C	.	.	H	α-helix	trans	-62.6	-42.4	179.4	173.2	0	0	0	0	110.7	P203 Y207 V351 G352 R358 Y359	P203-V355 HydrophobicContact CB-CG1 4.12Å; Y207-V355 HydrophobicContact CD2-CG2 4.35Å; Y207-V355 HydrophobicContact CE2-CG2 4.38Å; V351-V355 HydrophobicContact CG1-CG2 4.21Å; V351-V355 VanDerWaalsContact O-CG2 3.31Å; V351-V355 WeakPolarHBondContact O-CG2 3.48Å; V351-V355 PolarHBondContact O-N 2.52Å; G352-V355 PolarHBondContact O-N 2.92Å; V355-R358 WeakPolarHBondContact O-CB 3.16Å; V355-R358 PolarHBondContact O-N 2.83Å; V355-Y359 HydrophobicContact CG1-CD2 3.71Å; V355-Y359 HydrophobicContact CG1-CE2 3.19Å; V355-Y359 WeakPolarHBondContact O-CD2 3.36Å; V355-Y359 PolarHBondContact O-N 3.48Å
356	L	88.5	Confident	82.1	Confident	60 Å²	60	44.2 Å²	44.2	31%	0.314	22%	0.22	S	C	.	.	H	α-helix	trans	-61.2	-46.6	176.7	-174.6	139	0	0	0	112.2	S204 G352 K353 Y354 R358 Y359 I360	S204-L356 VanDerWaalsContact OG-CA 3.32Å; S204-L356 WeakPolarHBondContact OG-CA 3.31Å; S204-L356 PolarHBondContact OG-N 3.48Å; G352-L356 WeakPolarHBondContact O-CB 3.43Å; G352-L356 PolarHBondContact O-N 3.47Å; G352-L356 VanDerWaalsContact O-N 3.08Å; K353-L356 PolarHBondContact O-N 3.32Å; Y354-L356 VanDerWaalsContact C-N 3.33Å; Y354-L356 PolarHBondContact O-N 3.04Å; L356-R358 VanDerWaalsContact C-N 3.35Å; L356-R358 PolarHBondContact O-N 2.72Å; L356-Y359 PolarHBondContact O-N 3.08Å; L356-I360 HydrophobicContact CD2-CD1 3.5Å; L356-I360 VanDerWaalsContact CD2-CD1 3.5Å; L356-I360 HydrophobicContact CD2-CG1 4.48Å; L356-I360 HydrophobicContact CG-CD1 4.26Å; L356-I360 WeakPolarHBondContact O-CG1 3.25Å; L356-I360 PolarHBondContact O-N 3.13Å; L356-I360 VanDerWaalsContact O-N 3.11Å
357	L	83.9	Confident	80.2	Confident	79 Å²	79	41.5 Å²	41.5	41%	0.414	22%	0.221	S	C	.	.	H	α-helix	trans	-62	-43.1	178.1	-174.4	63.3	0	0	0	111.7	K353 Y354 Y359 I360 I361	K353-L357 PolarHBondContact O-N 3.21Å; Y354-L357 PolarHBondContact O-N 3.42Å; L357-Y359 PolarHBondContact O-N 3.25Å; L357-I360 PolarHBondContact O-N 3.14Å; L357-I361 HydrophobicContact CD1-CD1 3.85Å; L357-I361 HydrophobicContact CD1-CG1 4.4Å; L357-I361 HydrophobicContact CG-CD1 3.83Å; L357-I361 VanDerWaalsContact O-CG1 3.29Å; L357-I361 WeakPolarHBondContact O-CG1 3.38Å; L357-I361 PolarHBondContact O-N 3.48Å
358	R	83.2	Confident	78.2	Confident	33 Å²	33	46 Å²	46	13%	0.125	25%	0.248	C	C	.	.	H	α-helix	trans	-54.6	-42.2	177	-174.4	-176.7	75.7	169	2.1	111.6	Y354 V355 L356 L362 C507	Y354-R358 WeakPolarHBondContact O-CB 3.46Å; Y354-R358 PolarHBondContact O-N 3.49Å; V355-R358 WeakPolarHBondContact O-CB 3.16Å; V355-R358 PolarHBondContact O-N 2.83Å; L356-R358 VanDerWaalsContact C-N 3.35Å; L356-R358 PolarHBondContact O-N 2.72Å; R358-L362 PolarHBondContact O-N 2.58Å; R358-L362 VanDerWaalsContact O-N 3.1Å; R358-C507 WeakPolarHBondContact CG-SG 3.39Å
359	Y	79.5	Confident	76.2	Confident	32 Å²	32	50.3 Å²	50.3	13%	0.125	27%	0.27	C	S	.	.	H	α-helix	trans	-77.2	-41.5	-176.8	-67.7	-51.9	0	0	0	114	V200 P203 V355 L356 L357 I361 L362 Y363	V200-Y359 HydrophobicContact CB-CD1 4.44Å; V200-Y359 VanDerWaalsContact CG1-CB 3.46Å; V200-Y359 HydrophobicContact CG1-CD1 3.1Å; V200-Y359 HydrophobicContact CG1-CD2 3.48Å; V200-Y359 VanDerWaalsContact CG1-CD2 3.48Å; V200-Y359 HydrophobicContact CG1-CE1 3.5Å; V200-Y359 HydrophobicContact CG1-CE2 3.84Å; V200-Y359 HydrophobicContact CG1-CG 3.07Å; V200-Y359 HydrophobicContact CG2-CE1 4.43Å; V200-Y359 VanDerWaalsContact O-CD2 3.32Å; V200-Y359 WeakPolarHBondContact O-CD2 3.2Å; V200-Y359 WeakPolarHBondContact O-CE2 3.36Å; P203-Y359 HydrophobicContact CB-CE2 4.45Å; V355-Y359 HydrophobicContact CG1-CD2 3.71Å; V355-Y359 HydrophobicContact CG1-CE2 3.19Å; V355-Y359 WeakPolarHBondContact O-CD2 3.36Å; V355-Y359 PolarHBondContact O-N 3.48Å; L356-Y359 PolarHBondContact O-N 3.08Å; L357-Y359 PolarHBondContact O-N 3.25Å; Y359-I361 PolarHBondContact O-N 2.94Å; Y359-L362 HydrophobicContact CD1-CD2 4.32Å; Y359-L362 WeakPolarHBondContact O-CB 3.4Å; Y359-L362 PolarHBondContact O-N 3.2Å; Y359-L362 VanDerWaalsContact O-N 3.08Å; Y359-Y363 WeakPolarHBondContact O-CD2 3.14Å; Y359-Y363 PolarHBondContact O-N 3.24Å
360	I	77.8	Confident	73.9	Confident	73 Å²	73	59.2 Å²	59.2	37%	0.374	30%	0.302	S	S	.	.	H	α-helix	trans	-53.5	-43.6	174.2	-68.6	171.2	0	0	0	110.1	L356 L357 Y363 L364	L356-I360 HydrophobicContact CD2-CD1 3.5Å; L356-I360 VanDerWaalsContact CD2-CD1 3.5Å; L356-I360 HydrophobicContact CD2-CG1 4.48Å; L356-I360 HydrophobicContact CG-CD1 4.26Å; L356-I360 WeakPolarHBondContact O-CG1 3.25Å; L356-I360 PolarHBondContact O-N 3.13Å; L356-I360 VanDerWaalsContact O-N 3.11Å; L357-I360 PolarHBondContact O-N 3.14Å; I360-Y363 PolarHBondContact O-N 3.42Å; I360-L364 HydrophobicContact CG2-CD1 4.12Å; I360-L364 WeakPolarHBondContact O-CG 3.23Å; I360-L364 PolarHBondContact O-N 3.45Å; I360-L364 VanDerWaalsContact O-N 3.13Å
361	I	70.9	Confident	71.6	Confident	35 Å²	35	67.3 Å²	67.3	18%	0.179	33%	0.333	C	S	.	.	H	α-helix	trans	-73.8	-32.4	-178.3	-58.9	171.2	0	0	0	111.8	L357 Y359 Y363 L364 N365 L504	L357-I361 HydrophobicContact CD1-CD1 3.85Å; L357-I361 HydrophobicContact CD1-CG1 4.4Å; L357-I361 HydrophobicContact CG-CD1 3.83Å; L357-I361 VanDerWaalsContact O-CG1 3.29Å; L357-I361 WeakPolarHBondContact O-CG1 3.38Å; L357-I361 PolarHBondContact O-N 3.48Å; Y359-I361 PolarHBondContact O-N 2.94Å; I361-Y363 VanDerWaalsContact C-N 3.34Å; I361-Y363 PolarHBondContact O-N 3.47Å; I361-L364 PolarHBondContact O-N 2.96Å; I361-N365 WeakPolarHBondContact CG2-ND2 3.45Å; I361-N365 WeakPolarHBondContact O-CB 3.34Å; I361-N365 PolarHBondContact O-N 3.33Å; I361-N365 VanDerWaalsContact O-N 3.1Å; I361-N365 PolarHBondContact O-ND2 3.29Å; I361-L504 HydrophobicContact CB-CD1 4.49Å; I361-L504 HydrophobicContact CB-CG 4.42Å; I361-L504 HydrophobicContact CD1-CD1 3.38Å; I361-L504 HydrophobicContact CD1-CG 4.14Å; I361-L504 HydrophobicContact CG1-CD1 4.42Å; I361-L504 HydrophobicContact CG2-CD1 3.84Å; I361-L504 HydrophobicContact CG2-CD2 4.28Å; I361-L504 HydrophobicContact CG2-CG 3.63Å
362	L	71.6	Confident	69.7	Low	37 Å²	37	70.6 Å²	70.6	19%	0.194	37%	0.367	C	S	.	.	H	α-helix	trans	-59	-44.2	170.6	178	66.8	0	0	0	111.5	R358 Y359 G366 C507	R358-L362 PolarHBondContact O-N 2.58Å; R358-L362 VanDerWaalsContact O-N 3.1Å; Y359-L362 HydrophobicContact CD1-CD2 4.32Å; Y359-L362 WeakPolarHBondContact O-CB 3.4Å; Y359-L362 PolarHBondContact O-N 3.2Å; Y359-L362 VanDerWaalsContact O-N 3.08Å; L362-G366 PolarHBondContact O-N 2.95Å; L362-G366 VanDerWaalsContact O-N 3.14Å; L362-C507 HydrophobicContact CD1-CB 4.05Å
363	Y	70.4	Confident	67.1	Low	88 Å²	88	79.9 Å²	79.9	35%	0.345	41%	0.408	S	S	.	.	H	α-helix	trans	-66.5	-43.8	178.8	-73.9	-68	0	0	0	112.7	F196 A197 V200 Y359 I360 I361 N365 G366	F196-Y363 PolarHBondContact O-OH 3.3Å; A197-Y363 VanDerWaalsContact CA-OH 3.24Å; A197-Y363 WeakPolarHBondContact CA-OH 3.23Å; A197-Y363 HydrophobicContact CB-CE1 3.86Å; V200-Y363 HydrophobicContact CB-CE2 4.29Å; V200-Y363 WeakPolarHBondContact CB-OH 3.46Å; V200-Y363 HydrophobicContact CG1-CE2 3.81Å; V200-Y363 WeakPolarHBondContact CG1-OH 3.29Å; V200-Y363 VanDerWaalsContact CG2-OH 3.23Å; V200-Y363 WeakPolarHBondContact CG2-OH 3.22Å; Y359-Y363 WeakPolarHBondContact O-CD2 3.14Å; Y359-Y363 PolarHBondContact O-N 3.24Å; I360-Y363 PolarHBondContact O-N 3.42Å; I361-Y363 VanDerWaalsContact C-N 3.34Å; I361-Y363 PolarHBondContact O-N 3.47Å; Y363-N365 VanDerWaalsContact C-N 3.32Å; Y363-N365 PolarHBondContact O-N 2.96Å; Y363-G366 PolarHBondContact O-N 3.27Å
364	L	66.3	Low	64.7	Low	118 Å²	118	79.3 Å²	79.3	62%	0.618	41%	0.41	S	S	*	.	H	α-helix	trans	-61.1	-41	178.3	-69.3	170.6	0	0	0	111.9	I360 I361 G367	I360-L364 HydrophobicContact CG2-CD1 4.12Å; I360-L364 WeakPolarHBondContact O-CG 3.23Å; I360-L364 PolarHBondContact O-N 3.45Å; I360-L364 VanDerWaalsContact O-N 3.13Å; I361-L364 PolarHBondContact O-N 2.96Å; L364-G367 PolarHBondContact O-N 3.42Å
365	N	60.3	Low	62.5	Low	41 Å²	41	80.8 Å²	80.8	22%	0.219	43%	0.43	C	S	.	.	H	α-helix	trans	-76.8	-20.9	-179.7	-71.8	-61.7	0	0	0	114.1	I361 Y363 G367 V368 I369 L508	I361-N365 WeakPolarHBondContact CG2-ND2 3.45Å; I361-N365 WeakPolarHBondContact O-CB 3.34Å; I361-N365 PolarHBondContact O-N 3.33Å; I361-N365 VanDerWaalsContact O-N 3.1Å; I361-N365 PolarHBondContact O-ND2 3.29Å; Y363-N365 VanDerWaalsContact C-N 3.32Å; Y363-N365 PolarHBondContact O-N 2.96Å; N365-G367 PolarHBondContact O-N 2.93Å; N365-V368 PolarHBondContact O-N 3.43Å; N365-I369 WeakPolarHBondContact O-CG1 3.44Å; N365-I369 PolarHBondContact O-N 3.41Å; N365-L508 HydrophobicContact CB-CD2 3.47Å; N365-L508 VanDerWaalsContact CB-CD2 3.47Å
366	G	57.1	Low	60.6	Low	43 Å²	43	87.4 Å²	87.4	44%	0.443	46%	0.464	S	S	.	.	H	α-helix	trans	-59.9	-29	172.4	0	0	0	0	0	113.2	L362 Y363	L362-G366 PolarHBondContact O-N 2.95Å; L362-G366 VanDerWaalsContact O-N 3.14Å; Y363-G366 PolarHBondContact O-N 3.27Å
367	G	51.3	Low	58.8	Low	38 Å²	38	88 Å²	88	39%	0.392	47%	0.474	S	S	.	.	H	α-helix	trans	-80.1	-39.3	173	0	0	0	0	0	113.7	L364 N365 I369 R370 Y371	L364-G367 PolarHBondContact O-N 3.42Å; N365-G367 PolarHBondContact O-N 2.93Å; G367-I369 PolarHBondContact O-N 3.47Å; G367-R370 WeakPolarHBondContact O-CB 3.34Å; G367-R370 PolarHBondContact O-N 3.24Å; G367-Y371 WeakPolarHBondContact O-CD2 3.2Å
368	V	50.4	Low	57.1	Low	93 Å²	93	88.7 Å²	88.7	56%	0.564	48%	0.477	S	S	*	.	H	α-helix	trans	-70.9	-30.8	-174.8	179.5	0	0	0	0	112.7	N365 R370 Y371	N365-V368 PolarHBondContact O-N 3.43Å; V368-R370 PolarHBondContact O-N 3.26Å; V368-R370 VanDerWaalsContact O-N 3.14Å; V368-Y371 PolarHBondContact O-N 3.3Å
369	I	52.2	Low	55.5	Low	91 Å²	91	90.7 Å²	90.7	47%	0.467	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-19.2	176.3	-65.6	166.2	0	0	0	112	N365 G367	N365-I369 WeakPolarHBondContact O-CG1 3.44Å; N365-I369 PolarHBondContact O-N 3.41Å; G367-I369 PolarHBondContact O-N 3.47Å
370	R	46.4	Very low	54.5	Low	217 Å²	217	91.8 Å²	91.8	82%	0.819	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-24.2	-179.9	-133.3	178.6	-160.6	170.8	4.7	113.8	G367 V368	G367-R370 WeakPolarHBondContact O-CB 3.34Å; G367-R370 PolarHBondContact O-N 3.24Å; V368-R370 PolarHBondContact O-N 3.26Å; V368-R370 VanDerWaalsContact O-N 3.14Å
371	Y	44.1	Very low	53.7	Low	185 Å²	185	96.4 Å²	96.4	73%	0.725	51%	0.513	S	S	*	.	S	Bend	trans	-113.1	92.8	-177.3	-62.1	-80.6	0	0	0	108.2	G367 V368	G367-Y371 WeakPolarHBondContact O-CD2 3.2Å; V368-Y371 PolarHBondContact O-N 3.3Å
372	G	51.4	Low	53.1	Low	71 Å²	71	102.7 Å²	102.7	73%	0.732	53%	0.534	S	S	*	.			trans	-52.9	143.1	-166.8	0	0	0	0	0	115.2
373	F	37.9	Very low	52.6	Low	195 Å²	195	101.8 Å²	101.8	86%	0.855	53%	0.531	S	S	*	.			trans	-161.7	-12.6	153.3	-158.8	-113.3	0	0	0	116.1
374	L	39.8	Very low	52.3	Low	110 Å²	110	99.1 Å²	99.1	58%	0.576	52%	0.522	S	S	*	.	S	Bend	trans	-122.2	116.4	177.7	-84.3	87.5	0	0	0	111.6	L376 L379	L374-L376 PolarHBondContact O-N 3.31Å; L374-L379 HydrophobicContact CB-CD1 4.36Å; L374-L379 HydrophobicContact CB-CD2 4.25Å; L374-L379 HydrophobicContact CD2-CD1 3.64Å
375	G	43	Very low	52.3	Low	47 Å²	47	101.3 Å²	101.3	49%	0.485	52%	0.522	S	S	.	.			trans	-44.1	119.8	-176.9	0	0	0	0	0	113.6	S377 I378 L379	G375-S377 PolarHBondContact O-N 3.12Å; G375-I378 PolarHBondContact O-N 3.4Å; G375-I378 VanDerWaalsContact O-N 3.09Å; G375-L379 PolarHBondContact O-N 2.68Å
376	L	46.8	Very low	52.6	Low	149 Å²	149	104 Å²	104	78%	0.78	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-19.6	-179.7	-115	75.6	0	0	0	114	L374 P380	L374-L376 PolarHBondContact O-N 3.31Å; L376-P380 WeakPolarHBondContact O-CD 3.31Å
377	S	51.2	Low	53	Low	74 Å²	74	102.2 Å²	102.2	52%	0.517	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-20.8	-177.8	53.2	0	0	0	0	114.6	G375	G375-S377 PolarHBondContact O-N 3.12Å
378	I	46.6	Very low	53.9	Low	93 Å²	93	103.5 Å²	103.5	48%	0.477	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-31.4	-170.1	-60.7	159.4	0	0	0	112	G375 R381 R382	G375-I378 PolarHBondContact O-N 3.4Å; G375-I378 VanDerWaalsContact O-N 3.09Å; I378-R381 PolarHBondContact O-N 3.36Å; I378-R382 PolarHBondContact O-N 2.93Å
379	L	51	Low	54.8	Low	75 Å²	75	101.5 Å²	101.5	39%	0.393	51%	0.505	S	S	.	.	H	α-helix	trans	-63.7	-45.1	-176.8	-158.5	65.2	0	0	0	113.6	L374 G375 R381 R382 V383	L374-L379 HydrophobicContact CB-CD1 4.36Å; L374-L379 HydrophobicContact CB-CD2 4.25Å; L374-L379 HydrophobicContact CD2-CD1 3.64Å; G375-L379 PolarHBondContact O-N 2.68Å; L379-R381 VanDerWaalsContact C-N 3.3Å; L379-R381 PolarHBondContact O-N 2.9Å; L379-R382 PolarHBondContact O-N 3.05Å; L379-V383 HydrophobicContact CD1-CG2 4.46Å; L379-V383 HydrophobicContact CG-CG2 4.16Å; L379-V383 WeakPolarHBondContact O-CB 3.07Å; L379-V383 WeakPolarHBondContact O-CG2 3.43Å; L379-V383 PolarHBondContact O-N 3.41Å
380	P	57.3	Low	55.5	Low	54 Å²	54	97.7 Å²	97.7	35%	0.351	49%	0.487	S	S	.	.	H	α-helix	trans	-62.1	-37.5	-178.8	-19.3	30.7	0	0	0	112.3	L376 I384	L376-P380 WeakPolarHBondContact O-CD 3.31Å; P380-I384 WeakPolarHBondContact O-CB 3.32Å; P380-I384 WeakPolarHBondContact O-CD1 3.26Å; P380-I384 WeakPolarHBondContact O-CG1 3.29Å; P380-I384 PolarHBondContact O-N 3.31Å
381	R	61.4	Low	56.6	Low	171 Å²	171	87.7 Å²	87.7	65%	0.645	45%	0.449	S	S	*	.	H	α-helix	trans	-68.6	-39.5	-177.9	-62	179.5	-173.5	161.8	2.3	112.3	I378 L379 R385	I378-R381 PolarHBondContact O-N 3.36Å; L379-R381 VanDerWaalsContact C-N 3.3Å; L379-R381 PolarHBondContact O-N 2.9Å; R381-R385 VanDerWaalsContact O-CG 3.31Å; R381-R385 WeakPolarHBondContact O-CG 3.43Å; R381-R385 PolarHBondContact O-N 3.02Å; R381-R385 PolarHBondContact O-NE 3.21Å
382	R	57.8	Low	58	Low	166 Å²	166	81.8 Å²	81.8	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-72.6	-41.9	176.6	-68.7	-174.3	-179.7	-169.5	0.6	111.7	I378 L379 R385 L386	I378-R382 PolarHBondContact O-N 2.93Å; L379-R382 PolarHBondContact O-N 3.05Å; R382-R385 PolarHBondContact O-N 3.49Å; R382-L386 WeakPolarHBondContact O-CB 3.13Å; R382-L386 PolarHBondContact O-N 3.19Å
383	V	61.9	Low	58.8	Low	19 Å²	19	80.3 Å²	80.3	12%	0.115	41%	0.411	C	S	.	.	H	α-helix	trans	-60.3	-47.3	175.5	156.6	0	0	0	0	111.5	L379 L386 T387 I505 T509	L379-V383 HydrophobicContact CD1-CG2 4.46Å; L379-V383 HydrophobicContact CG-CG2 4.16Å; L379-V383 WeakPolarHBondContact O-CB 3.07Å; L379-V383 WeakPolarHBondContact O-CG2 3.43Å; L379-V383 PolarHBondContact O-N 3.41Å; V383-L386 PolarHBondContact O-N 3.49Å; V383-T387 WeakPolarHBondContact O-CG2 3.45Å; V383-T387 PolarHBondContact O-N 2.88Å; V383-I505 HydrophobicContact CB-CG2 3.77Å; V383-I505 HydrophobicContact CG1-CG2 3.16Å; V383-I505 HydrophobicContact CG2-CG2 4.1Å; V383-I505 WeakPolarHBondContact O-CG2 3.34Å; V383-T509 HydrophobicContact CG1-CG2 3.51Å
384	I	64.6	Low	60.2	Low	32 Å²	32	71.1 Å²	71.1	16%	0.164	37%	0.371	C	S	.	.	H	α-helix	trans	-61.2	-48.5	176.5	-74.1	167	0	0	0	110.9	P380 L386 T387 F388 I594	P380-I384 WeakPolarHBondContact O-CB 3.32Å; P380-I384 WeakPolarHBondContact O-CD1 3.26Å; P380-I384 WeakPolarHBondContact O-CG1 3.29Å; P380-I384 PolarHBondContact O-N 3.31Å; I384-L386 VanDerWaalsContact C-N 3.32Å; I384-L386 PolarHBondContact O-N 3.46Å; I384-T387 PolarHBondContact O-N 3.32Å; I384-T387 PolarHBondContact O-OG1 2.95Å; I384-F388 WeakPolarHBondContact O-CB 3.44Å; I384-F388 PolarHBondContact O-N 3.03Å; I384-I594 HydrophobicContact CG2-CD1 3.27Å; I384-I594 HydrophobicContact CG2-CG1 3.54Å; I384-I594 HydrophobicContact CG2-CG2 4.23Å
385	R	66.6	Low	61.6	Low	163 Å²	163	67.6 Å²	67.6	62%	0.615	35%	0.352	S	S	*	.	H	α-helix	trans	-59.8	-40.4	177.5	-74.1	-174.9	-62.9	-157.5	6.8	112.4	R381 R382 F388 A389	R381-R385 VanDerWaalsContact O-CG 3.31Å; R381-R385 WeakPolarHBondContact O-CG 3.43Å; R381-R385 PolarHBondContact O-N 3.02Å; R381-R385 PolarHBondContact O-NE 3.21Å; R382-R385 PolarHBondContact O-N 3.49Å; R385-F388 PolarHBondContact O-N 2.88Å; R385-A389 WeakPolarHBondContact O-CB 3.42Å; R385-A389 PolarHBondContact O-N 3.34Å
386	L	65.4	Low	62.8	Low	97 Å²	97	73.4 Å²	73.4	51%	0.508	37%	0.365	S	S	.	.	H	α-helix	trans	-67.6	-41.9	178	-173.6	61.8	0	0	0	112.3	R382 V383 I384 F388 A389 A390 I505	R382-L386 WeakPolarHBondContact O-CB 3.13Å; R382-L386 PolarHBondContact O-N 3.19Å; V383-L386 PolarHBondContact O-N 3.49Å; I384-L386 VanDerWaalsContact C-N 3.32Å; I384-L386 PolarHBondContact O-N 3.46Å; L386-F388 VanDerWaalsContact C-N 3.32Å; L386-F388 PolarHBondContact O-N 2.88Å; L386-A389 PolarHBondContact O-N 3.34Å; L386-A390 WeakPolarHBondContact O-CB 3.29Å; L386-A390 PolarHBondContact O-N 3.17Å; L386-I505 HydrophobicContact CB-CD1 4.47Å; L386-I505 HydrophobicContact CD2-CD1 3.58Å; L386-I505 HydrophobicContact CG-CD1 3.85Å
387	T	66.1	Low	63.7	Low	7 Å²	7	69.2 Å²	69.2	4%	0.043	34%	0.341	C	S	.	.	H	α-helix	trans	-64.9	-37.3	174.7	61.1	0	0	0	0	112.7	V383 I384 M391 A502 I505	V383-T387 WeakPolarHBondContact O-CG2 3.45Å; V383-T387 PolarHBondContact O-N 2.88Å; I384-T387 PolarHBondContact O-N 3.32Å; I384-T387 PolarHBondContact O-OG1 2.95Å; T387-M391 WeakPolarHBondContact O-CB 3.35Å; T387-M391 VanDerWaalsContact O-CG 3.26Å; T387-M391 WeakPolarHBondContact O-CG 3.33Å; T387-M391 PolarHBondContact O-N 3.01Å; T387-M391 VanDerWaalsContact O-N 3.08Å; T387-A502 WeakPolarHBondContact CG2-O 3.49Å; T387-I505 HydrophobicContact CG2-CB 3.5Å; T387-I505 HydrophobicContact CG2-CD1 4.34Å; T387-I505 HydrophobicContact CG2-CG2 3.32Å
388	F	69.4	Low	64.1	Low	64 Å²	64	66.3 Å²	66.3	28%	0.281	32%	0.323	S	S	.	.	H	α-helix	trans	-67.1	-45	177.5	-173.5	-104.3	0	0	0	110.8	I384 R385 L386 A390 M391 L392 V587 I591	I384-F388 WeakPolarHBondContact O-CB 3.44Å; I384-F388 PolarHBondContact O-N 3.03Å; R385-F388 PolarHBondContact O-N 2.88Å; L386-F388 VanDerWaalsContact C-N 3.32Å; L386-F388 PolarHBondContact O-N 2.88Å; F388-A390 PolarHBondContact O-N 2.97Å; F388-M391 PolarHBondContact O-N 3.22Å; F388-L392 HydrophobicContact CD1-CD1 3.57Å; F388-L392 HydrophobicContact CD1-CG 4.31Å; F388-L392 HydrophobicContact CE1-CD1 3.3Å; F388-L392 HydrophobicContact CE1-CG 4.11Å; F388-L392 HydrophobicContact CG-CD1 4.44Å; F388-L392 HydrophobicContact CZ-CD1 3.98Å; F388-L392 HydrophobicContact CZ-CG 4.37Å; F388-L392 WeakPolarHBondContact O-CB 3.35Å; F388-L392 WeakPolarHBondContact O-CG 3.48Å; F388-L392 PolarHBondContact O-N 2.83Å; F388-V587 HydrophobicContact CD2-CG1 4.33Å; F388-V587 HydrophobicContact CE2-CG1 3.54Å; F388-V587 HydrophobicContact CZ-CG1 4.17Å; F388-I591 HydrophobicContact CD2-CG1 4.48Å; F388-I591 HydrophobicContact CE2-CD1 3.84Å; F388-I591 HydrophobicContact CE2-CG1 3.56Å; F388-I591 HydrophobicContact CZ-CD1 4.09Å; F388-I591 HydrophobicContact CZ-CG1 4.16Å
389	A	69.9	Low	65	Low	51 Å²	51	62.4 Å²	62.4	42%	0.421	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-42.8	175.4	0	0	0	0	0	112.7	R385 L386 M391 L392 A393	R385-A389 WeakPolarHBondContact O-CB 3.42Å; R385-A389 PolarHBondContact O-N 3.34Å; L386-A389 PolarHBondContact O-N 3.34Å; A389-M391 PolarHBondContact O-N 3.18Å; A389-L392 PolarHBondContact O-N 2.92Å; A389-A393 WeakPolarHBondContact O-CB 3.31Å; A389-A393 PolarHBondContact O-N 3.22Å
390	A	67.4	Low	65.4	Low	11 Å²	11	66.3 Å²	66.3	9%	0.091	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-39.8	176.9	0	0	0	0	0	112.5	L386 F388 A393 C394 A502	L386-A390 WeakPolarHBondContact O-CB 3.29Å; L386-A390 PolarHBondContact O-N 3.17Å; F388-A390 PolarHBondContact O-N 2.97Å; A390-A393 PolarHBondContact O-N 3.06Å; A390-C394 PolarHBondContact O-N 2.95Å; A390-C394 VanDerWaalsContact O-N 3.1Å; A390-C394 PolarHBondContact O-SG 3.24Å; A390-A502 HydrophobicContact CB-CB 4.27Å
391	M	69.3	Low	65.2	Low	7 Å²	7	64.4 Å²	64.4	3%	0.034	31%	0.31	C	S	.	.	H	α-helix	trans	-69.9	-39.2	176.2	-72	-65	-69	0	0	112.2	T387 F388 A389 A393 C394 I395 L583 Q586 V587	T387-M391 WeakPolarHBondContact O-CB 3.35Å; T387-M391 VanDerWaalsContact O-CG 3.26Å; T387-M391 WeakPolarHBondContact O-CG 3.33Å; T387-M391 PolarHBondContact O-N 3.01Å; T387-M391 VanDerWaalsContact O-N 3.08Å; F388-M391 PolarHBondContact O-N 3.22Å; A389-M391 PolarHBondContact O-N 3.18Å; M391-A393 VanDerWaalsContact C-N 3.34Å; M391-C394 WeakPolarHBondContact O-CB 3.37Å; M391-C394 PolarHBondContact O-N 3.44Å; M391-I395 PolarHBondContact O-N 2.93Å; M391-L583 HydrophobicContact CE-CD2 4.32Å; M391-Q586 HydrophobicContact CE-CB 3.73Å; M391-Q586 HydrophobicContact CE-CG 4.37Å; M391-V587 HydrophobicContact CB-CG2 4.09Å
392	L	72.8	Confident	64.8	Low	62 Å²	62	59.1 Å²	59.1	33%	0.325	29%	0.294	S	S	.	.	H	α-helix	trans	-61.3	-42.4	171.7	-77.4	172.3	0	0	0	111.3	F388 A389 C394 I395 F396	F388-L392 HydrophobicContact CD1-CD1 3.57Å; F388-L392 HydrophobicContact CD1-CG 4.31Å; F388-L392 HydrophobicContact CE1-CD1 3.3Å; F388-L392 HydrophobicContact CE1-CG 4.11Å; F388-L392 HydrophobicContact CG-CD1 4.44Å; F388-L392 HydrophobicContact CZ-CD1 3.98Å; F388-L392 HydrophobicContact CZ-CG 4.37Å; F388-L392 WeakPolarHBondContact O-CB 3.35Å; F388-L392 WeakPolarHBondContact O-CG 3.48Å; F388-L392 PolarHBondContact O-N 2.83Å; A389-L392 PolarHBondContact O-N 2.92Å; L392-C394 VanDerWaalsContact C-N 3.27Å; L392-C394 PolarHBondContact O-N 3.44Å; L392-I395 HydrophobicContact CD2-CD1 4.27Å; L392-I395 WeakPolarHBondContact O-CB 3.41Å; L392-I395 PolarHBondContact O-N 3.31Å; L392-F396 WeakPolarHBondContact O-CD2 3.41Å
393	A	68.7	Low	64.1	Low	40 Å²	40	57.8 Å²	57.8	33%	0.331	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-37.4	175.3	0	0	0	0	0	112.2	A389 A390 M391 I395 F396 Q397	A389-A393 WeakPolarHBondContact O-CB 3.31Å; A389-A393 PolarHBondContact O-N 3.22Å; A390-A393 PolarHBondContact O-N 3.06Å; M391-A393 VanDerWaalsContact C-N 3.34Å; A393-I395 VanDerWaalsContact C-N 3.27Å; A393-I395 PolarHBondContact O-N 3.19Å; A393-F396 PolarHBondContact O-N 3.49Å; A393-F396 VanDerWaalsContact O-N 3.13Å; A393-Q397 PolarHBondContact O-N 3.3Å; A393-Q397 VanDerWaalsContact O-N 3.1Å
394	C	66.5	Low	63.3	Low	1 Å²	1	57.9 Å²	57.9	1%	0.007	30%	0.299	C	S	.	.	H	α-helix	trans	-64.5	-28.3	175	-65.9	0	0	0	0	113	A390 M391 L392 F396 Q397 L583	A390-C394 PolarHBondContact O-N 2.95Å; A390-C394 VanDerWaalsContact O-N 3.1Å; A390-C394 PolarHBondContact O-SG 3.24Å; M391-C394 WeakPolarHBondContact O-CB 3.37Å; M391-C394 PolarHBondContact O-N 3.44Å; L392-C394 VanDerWaalsContact C-N 3.27Å; L392-C394 PolarHBondContact O-N 3.44Å; C394-F396 VanDerWaalsContact C-N 3.27Å; C394-F396 PolarHBondContact O-N 3.28Å; C394-Q397 PolarHBondContact O-N 2.88Å; C394-L583 HydrophobicContact CB-CD1 3.98Å; C394-L583 WeakPolarHBondContact O-CD1 3.43Å
395	I	70.6	Confident	62.2	Low	37 Å²	37	61.9 Å²	61.9	19%	0.19	33%	0.325	C	S	.	.	H	α-helix	trans	-64.3	-36	174.7	-63.3	177.9	0	0	0	110.4	M391 L392 A393 R579 L583 V587	M391-I395 PolarHBondContact O-N 2.93Å; L392-I395 HydrophobicContact CD2-CD1 4.27Å; L392-I395 WeakPolarHBondContact O-CB 3.41Å; L392-I395 PolarHBondContact O-N 3.31Å; A393-I395 VanDerWaalsContact C-N 3.27Å; A393-I395 PolarHBondContact O-N 3.19Å; I395-R579 WeakPolarHBondContact O-CD 3.34Å; I395-R579 PolarHBondContact O-NE 2.87Å; I395-R579 PolarHBondContact O-NH1 2.99Å; I395-L583 HydrophobicContact CG1-CB 3.92Å; I395-L583 HydrophobicContact CG1-CD1 4.23Å; I395-V587 HydrophobicContact CD1-CG2 4.14Å
396	F	67.4	Low	60.8	Low	169 Å²	169	59.6 Å²	59.6	74%	0.741	32%	0.319	S	S	*	.	H	α-helix	trans	-80.8	-30.4	178.7	-63.3	-76.2	0	0	0	112.7	L392 A393 C394 G398 R579	L392-F396 WeakPolarHBondContact O-CD2 3.41Å; A393-F396 PolarHBondContact O-N 3.49Å; A393-F396 VanDerWaalsContact O-N 3.13Å; C394-F396 VanDerWaalsContact C-N 3.27Å; C394-F396 PolarHBondContact O-N 3.28Å; F396-G398 PolarHBondContact O-N 2.84Å; F396-R579 PolarHBondContact O-NH1 3.35Å
397	Q	65	Low	59.3	Low	60 Å²	60	61.5 Å²	61.5	28%	0.28	33%	0.33	S	S	.	.	S	Bend	trans	-86.6	79.7	-179.4	-72.3	177.1	-24.4	0	0	113.8	Y340 A393 C394 V495	Y340-Q397 PolarHBondContact OH-O 3.46Å; A393-Q397 PolarHBondContact O-N 3.3Å; A393-Q397 VanDerWaalsContact O-N 3.1Å; C394-Q397 PolarHBondContact O-N 2.88Å; Q397-V495 HydrophobicContact CB-CG2 3.91Å
398	G	60.8	Low	57.8	Low	14 Å²	14	67.2 Å²	67.2	14%	0.144	36%	0.359	C	S	.	.	S	Bend	trans	-162.4	157.9	178	0	0	0	0	0	111.9	F396 Q400 R579	F396-G398 PolarHBondContact O-N 2.84Å; G398-Q400 PolarHBondContact O-N 3.37Å; G398-R579 PolarHBondContact O-NH1 2.91Å
399	C	65.3	Low	55.9	Low	11 Å²	11	69.1 Å²	69.1	7%	0.074	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-68.4	130.5	-179.4	-145.5	0	0	0	0	111.1	Q339 G401 N486 C488	Q339-C399 PolarHBondContact NE2-O 3.27Å; C399-G401 PolarHBondContact O-N 3.12Å; C399-N486 PolarHBondContact SG-OD1 3.29Å; C399-C488 WeakPolarHBondContact CA-SG 3.48Å; C399-C488 HydrophobicContact CB-CB 3.39Å; C399-C488 WeakPolarHBondContact CB-SG 3.46Å; C399-C488 WeakPolarHBondContact SG-CB 3.32Å; C399-C488 CovalentContact SG-SG 2.03Å; C399-C488 PolarHBondContact SG-SG 2.62Å
400	Q	58.8	Low	54	Low	157 Å²	157	72.2 Å²	72.2	73%	0.734	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-64.6	123.3	155.8	-70.4	-176.4	-12.8	0	0	106.2	G398	G398-Q400 PolarHBondContact O-N 3.37Å
401	G	54.1	Low	52.3	Low	14 Å²	14	74.9 Å²	74.9	14%	0.144	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-57.1	161.9	175.5	0	0	0	0	0	111	C399 N403	C399-G401 PolarHBondContact O-N 3.12Å; G401-N403 PolarHBondContact O-N 3.27Å
402	I	51.9	Low	50.4	Low	59 Å²	59	77.9 Å²	77.9	30%	0.303	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-62.3	127.1	173.5	-55.9	160.8	0	0	0	107.1	L404 T439 C484 Y572	I402-L404 VanDerWaalsContact C-N 3.35Å; I402-L404 PolarHBondContact O-N 2.73Å; I402-T439 HydrophobicContact CD1-CG2 4.13Å; I402-T439 HydrophobicContact CG2-CG2 4.19Å; I402-T439 WeakPolarHBondContact CG2-OG1 3.24Å; I402-C484 HydrophobicContact CD1-CB 3.75Å; I402-Y572 WeakPolarHBondContact CB-OH 3.44Å; I402-Y572 PolarHBondContact O-OH 3.49Å
403	N	44.6	Very low	48.4	Very low	138 Å²	138	82.4 Å²	82.4	74%	0.738	49%	0.489	S	S	*	.			trans	-63.3	97.2	175	-78.3	-28.3	0	0	0	108.6	G401 V405	G401-N403 PolarHBondContact O-N 3.27Å; N403-V405 PolarHBondContact O-N 3Å
404	L	44.6	Very low	46.6	Very low	21 Å²	21	85.9 Å²	85.9	11%	0.11	51%	0.511	C	S	.	.			trans	-77.5	115.6	168.7	-159.5	76.9	0	0	0	106.6	I402 K406 I558 Y572	I402-L404 VanDerWaalsContact C-N 3.35Å; I402-L404 PolarHBondContact O-N 2.73Å; L404-K406 PolarHBondContact O-N 3.3Å; L404-I558 HydrophobicContact CD2-CG2 4.02Å; L404-Y572 HydrophobicContact CB-CE1 4.31Å; L404-Y572 HydrophobicContact CD2-CD1 4.22Å; L404-Y572 HydrophobicContact CD2-CE1 4.31Å
405	V	41.2	Very low	45.2	Very low	117 Å²	117	88.6 Å²	88.6	71%	0.709	54%	0.539	S	S	*	.			trans	-59.3	103.2	175.5	-178.9	0	0	0	0	107.8	N403	N403-V405 PolarHBondContact O-N 3Å
406	K	37	Very low	43.7	Very low	115 Å²	115	92.1 Å²	92.1	50%	0.5	56%	0.558	S	S	.	*			trans	-95.6	-20.5	-171.3	-101.4	178.5	173.2	176.9	0	113.8	L404	L404-K406 PolarHBondContact O-N 3.3Å
407	N	33.1	Very low	42.3	Very low	136 Å²	136	85 Å²	85	73%	0.727	53%	0.529	S	S	*	.			trans	-126.5	118.5	-173.8	-68.4	-23	0	0	0	110	P409	N407-P409 WeakPolarHBondContact O-CD 3.28Å
408	L	36.2	Very low	41	Very low	127 Å²	127	86.5 Å²	86.5	67%	0.665	54%	0.542	S	S	*	.			trans	-87.3	105.1	156	-93	76.5	0	0	0	107.1	L416	L408-L416 HydrophobicContact CD1-CD2 4.13Å; L408-L416 HydrophobicContact CD2-CD2 4.37Å; L408-L416 HydrophobicContact CG-CD2 4.31Å
409	P	27.9	Very low	39.8	Very low	104 Å²	104	88.6 Å²	88.6	68%	0.675	56%	0.555	S	S	*	*			trans	-68.7	132	149.3	21.5	-16	0	0	0	108.1	N407 G411	N407-P409 WeakPolarHBondContact O-CD 3.28Å; P409-G411 VanDerWaalsContact C-N 3.3Å; P409-G411 PolarHBondContact O-N 2.99Å
410	A	30.7	Very low	38.4	Very low	117 Å²	117	93.4 Å²	93.4	97%	0.967	59%	0.588	S	S	*	*	S	Bend	trans	-64.8	93.6	167.6	0	0	0	0	0	108.2
411	G	32.4	Very low	37.4	Very low	66 Å²	66	93.2 Å²	93.2	68%	0.68	59%	0.592	S	S	*	*	S	Bend	trans	123.7	112	175	0	0	0	0	0	112.9	P409	P409-G411 VanDerWaalsContact C-N 3.3Å; P409-G411 PolarHBondContact O-N 2.99Å
412	G	29	Very low	36.7	Very low	71 Å²	71	97.4 Å²	97.4	73%	0.732	61%	0.608	S	S	*	*			trans	127.3	100.9	159.6	0	0	0	0	0	116
413	L	30.4	Very low	35.9	Very low	156 Å²	156	102.1 Å²	102.1	82%	0.817	64%	0.639	S	S	*	*			trans	76.1	105.4	151.8	-94.4	76.2	0	0	0	120.8
414	S	32	Very low	35.5	Very low	114 Å²	114	100.2 Å²	100.2	80%	0.797	64%	0.637	S	S	*	*	S	Bend		47.9	83.3	128.3	56	0	0	0	0	117.4
415	G	36.9	Very low	35	Very low	58 Å²	58	101.1 Å²	101.1	60%	0.598	65%	0.645	S	S	*	*			trans	158.2	21.2	166.1	0	0	0	0	0	116.5
416	L	38.6	Very low	34.9	Very low	111 Å²	111	102.8 Å²	102.8	58%	0.581	64%	0.643	S	S	*	*			trans	-120.3	121.7	-172.2	-88.4	124.9	0	0	0	113.2	L408 V418	L408-L416 HydrophobicContact CD1-CD2 4.13Å; L408-L416 HydrophobicContact CD2-CD2 4.37Å; L408-L416 HydrophobicContact CG-CD2 4.31Å; L416-V418 VanDerWaalsContact C-N 3.35Å; L416-V418 HydrophobicContact CB-CG2 4.38Å; L416-V418 HydrophobicContact CD2-CG2 4.03Å; L416-V418 PolarHBondContact O-N 3.41Å
417	C	38.1	Very low	35.2	Very low	20 Å²	20	100.4 Å²	100.4	14%	0.135	64%	0.638	C	S	.	*			trans	-81.4	84.6	161.4	-97.2	0	0	0	0	109.1	L442 Q449 C471	C417-L442 HydrophobicContact CB-CD2 4.1Å; C417-Q449 VanDerWaalsContact CB-OE1 3.26Å; C417-Q449 PolarHBondContact SG-OE1 3.46Å; C417-C471 WeakPolarHBondContact CA-SG 3.49Å; C417-C471 HydrophobicContact CB-CB 3.43Å; C417-C471 VanDerWaalsContact CB-CB 3.43Å; C417-C471 WeakPolarHBondContact CB-SG 3.37Å; C417-C471 PolarHBondContact N-SG 2.93Å; C417-C471 WeakPolarHBondContact SG-CB 3.48Å; C417-C471 CovalentContact SG-SG 1.96Å; C417-C471 PolarHBondContact SG-SG 3.09Å
418	V	37.8	Very low	35.5	Very low	90 Å²	90	97.2 Å²	97.2	55%	0.545	62%	0.624	S	S	.	*			trans	-111.5	106.4	161.1	179.2	0	0	0	0	105.5	L416 S420	L416-V418 VanDerWaalsContact C-N 3.35Å; L416-V418 HydrophobicContact CB-CG2 4.38Å; L416-V418 HydrophobicContact CD2-CG2 4.03Å; L416-V418 PolarHBondContact O-N 3.41Å; V418-S420 PolarHBondContact O-N 3.47Å
419	S	35.8	Very low	35.8	Very low	59 Å²	59	92.4 Å²	92.4	41%	0.413	60%	0.6	S	S	.	*			trans	-66.1	114.2	163.5	47.2	0	0	0	0	107	N421	S419-N421 PolarHBondContact O-N 3.08Å
420	S	36.1	Very low	36.5	Very low	111 Å²	111	90.6 Å²	90.6	78%	0.776	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	11.4	-167.1	50.3	0	0	0	0	116.2	V418	V418-S420 PolarHBondContact O-N 3.47Å
421	N	37.4	Very low	37.2	Very low	153 Å²	153	85.3 Å²	85.3	82%	0.818	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.1	14.3	-169.8	-100.2	4.5	0	0	0	117.4	S419	S419-N421 PolarHBondContact O-N 3.08Å
422	Q	38.7	Very low	37.8	Very low	103 Å²	103	83.2 Å²	83.2	48%	0.481	52%	0.516	S	S	.	.			trans	-136.8	101.9	173.5	-73.6	-177.6	-8.4	0	0	111.7	S424	Q422-S424 VanDerWaalsContact C-N 3.34Å; Q422-S424 PolarHBondContact O-N 3.25Å
423	T	35.6	Very low	38.8	Very low	157 Å²	157	80.1 Å²	80.1	96%	0.963	48%	0.482	S	S	*	.			trans	-87	9.3	-177.6	41.3	0	0	0	0	114.4
424	S	36.8	Very low	39.3	Very low	98 Å²	98	79 Å²	79	69%	0.685	47%	0.471	S	S	*	.			trans	-124.6	41.9	-173.2	-151.6	0	0	0	0	114	Q422	Q422-S424 VanDerWaalsContact C-N 3.34Å; Q422-S424 PolarHBondContact O-N 3.25Å
425	C	34	Very low	39.6	Very low	40 Å²	40	77.3 Å²	77.3	27%	0.27	47%	0.472	S	S	.	.			trans	-114.6	121.1	176.4	-141.8	0	0	0	0	112.1	C127 P427 A443	C127-C425 HydrophobicContact CB-CB 4.26Å; C127-C425 WeakPolarHBondContact CB-SG 3.49Å; C127-C425 WeakPolarHBondContact SG-CA 3.3Å; C127-C425 WeakPolarHBondContact SG-CB 3.49Å; C127-C425 CovalentContact SG-SG 2Å; C127-C425 PolarHBondContact SG-SG 2.65Å; C425-P427 WeakPolarHBondContact O-CD 3.13Å; C425-A443 WeakPolarHBondContact CB-O 3.3Å
426	K	38.4	Very low	39.9	Very low	153 Å²	153	78.1 Å²	78.1	67%	0.665	46%	0.46	S	S	*	.			trans	-73.1	119.3	166.5	-79.6	176.9	179.9	168.6	0	107.3	E137 T428	E137-K426 IonicContact OE1-NZ 3.81Å; E137-K426 PolarHBondContact OE1-NZ 3.1Å; K426-T428 PolarHBondContact O-N 3.46Å
427	P	43.4	Very low	40.1	Very low	64 Å²	64	83.3 Å²	83.3	42%	0.416	47%	0.472	S	S	.	.			trans	-70.4	112.5	179.6	26.3	-31.9	0	0	0	109.9	C425	C425-P427 WeakPolarHBondContact O-CD 3.13Å
428	T	39.9	Very low	40.3	Very low	70 Å²	70	87.4 Å²	87.4	43%	0.429	49%	0.489	S	S	.	.			trans	-110.2	-11.8	-167.1	39.9	0	0	0	0	115.8	K426	K426-T428 PolarHBondContact O-N 3.46Å
429	T	42.5	Very low	40.5	Very low	26 Å²	26	84 Å²	84	16%	0.16	47%	0.468	C	S	.	.			trans	-130.1	128.4	-171	15.3	0	0	0	0	114
430	V	42.8	Very low	40.8	Very low	65 Å²	65	82.9 Å²	82.9	39%	0.394	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.5	169.9	-177.1	0	0	0	0	107.7	T439	V430-T439 HydrophobicContact CG1-CG2 3.77Å
431	L	44.7	Very low	41.1	Very low	6 Å²	6	82 Å²	82	3%	0.031	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	145.1	-178.1	-73.7	165.7	0	0	0	111.9	L440 L442 L446 V479	L431-L440 PolarHBondContact N-O 3.11Å; L431-L442 HydrophobicContact CD1-CD1 3.47Å; L431-L442 VanDerWaalsContact CD1-CD1 3.47Å; L431-L442 HydrophobicContact CD1-CG 4.21Å; L431-L446 HydrophobicContact CD1-CD1 3.28Å; L431-L446 HydrophobicContact CD1-CD2 3.45Å; L431-L446 VanDerWaalsContact CD1-CD2 3.45Å; L431-L446 HydrophobicContact CD1-CG 3.73Å; L431-L446 HydrophobicContact CD2-CD1 4.17Å; L431-L446 HydrophobicContact CG-CD1 4.13Å; L431-V479 HydrophobicContact CB-CG1 3.61Å; L431-V479 HydrophobicContact CD1-CG1 4.04Å; L431-V479 HydrophobicContact CD2-CG1 3.83Å; L431-V479 HydrophobicContact CG-CG1 4.04Å
432	N	45.7	Very low	41.4	Very low	23 Å²	23	75.5 Å²	75.5	12%	0.123	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.6	177.9	-177.3	14.1	0	0	0	110.6	V479 K480 G482 H483 C484	N432-V479 WeakPolarHBondContact O-CA 2.98Å; N432-V479 WeakPolarHBondContact O-CG1 3.43Å; N432-K480 PolarHBondContact N-O 2.91Å; N432-K480 PolarHBondContact O-N 2.83Å; N432-G482 WeakPolarHBondContact CB-O 3.19Å; N432-H483 PolarHBondContact ND2-O 2.75Å; N432-C484 VanDerWaalsContact CG-SG 3.54Å; N432-C484 WeakPolarHBondContact ND2-CA 3.19Å; N432-C484 PolarHBondContact OD1-SG 3.44Å
433	I	48.4	Very low	41.3	Very low	5 Å²	5	73 Å²	73	3%	0.026	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124.6	174.9	-65.1	161.5	0	0	0	108.4	G435 L440 V472 V479	I433-G435 PolarHBondContact O-N 3.26Å; I433-G435 VanDerWaalsContact O-N 3.12Å; I433-L440 HydrophobicContact CD1-CB 4.05Å; I433-L440 HydrophobicContact CD1-CD1 3.16Å; I433-L440 HydrophobicContact CD1-CG 4.12Å; I433-L440 HydrophobicContact CG1-CD1 4.49Å; I433-V472 HydrophobicContact CB-CG1 4.22Å; I433-V472 HydrophobicContact CD1-CB 4.5Å; I433-V472 HydrophobicContact CD1-CG1 4.06Å; I433-V472 HydrophobicContact CD1-CG2 3.93Å; I433-V472 HydrophobicContact CG1-CG1 3.89Å; I433-V472 HydrophobicContact CG1-CG2 3.91Å; I433-V472 HydrophobicContact CG2-CG1 3.34Å; I433-V479 HydrophobicContact CG1-CG2 4.15Å
434	K	40.7	Very low	41.6	Very low	132 Å²	132	66.1 Å²	66.1	57%	0.574	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	113.3	173.7	-152.5	-174.4	-179.4	-159.6	0	108.6	Q478	K434-Q478 WeakPolarHBondContact CB-O 3.4Å; K434-Q478 PolarHBondContact N-O 3.09Å
435	G	39.7	Very low	42	Very low	80 Å²	80	62 Å²	62	83%	0.825	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.6	-1.4	171.9	0	0	0	0	0	117	I433	I433-G435 PolarHBondContact O-N 3.26Å; I433-G435 VanDerWaalsContact O-N 3.12Å
436	Q	41.9	Very low	42.7	Very low	75 Å²	75	60.1 Å²	60.1	35%	0.35	32%	0.317	S	S	.	.	S	Bend	trans	-135.7	149.9	176.6	-79.1	-179	-15.4	0	0	113.1	Q438 S473	Q436-Q438 HydrophobicContact CB-CB 4.47Å; Q436-Q438 PolarHBondContact O-N 3.13Å; Q436-S473 PolarHBondContact NE2-O 2.82Å
437	R	44.2	Very low	43.1	Very low	219 Å²	219	57 Å²	57	83%	0.826	31%	0.305	S	S	*	.	S	Bend	trans	-75	40.8	171.9	-68.3	-176.3	177.7	166.1	1.3	112.1
438	Q	41.8	Very low	43.3	Very low	106 Å²	106	59.8 Å²	59.8	50%	0.495	32%	0.316	S	S	.	.			trans	-135.7	127.3	-173.8	-64.9	-175.5	3.9	0	0	110.5	Q436	Q436-Q438 HydrophobicContact CB-CB 4.47Å; Q436-Q438 PolarHBondContact O-N 3.13Å
439	T	42.3	Very low	43.9	Very low	19 Å²	19	57.6 Å²	57.6	12%	0.117	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	117.3	164.5	42.8	0	0	0	0	108.3	I402 V430 C484	I402-T439 HydrophobicContact CD1-CG2 4.13Å; I402-T439 HydrophobicContact CG2-CG2 4.19Å; I402-T439 WeakPolarHBondContact CG2-OG1 3.24Å; V430-T439 HydrophobicContact CG1-CG2 3.77Å; T439-C484 WeakPolarHBondContact CG2-SG 3.32Å
440	L	42.2	Very low	44.7	Very low	35 Å²	35	57 Å²	57	18%	0.183	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.7	172.1	-102.9	129.7	0	0	0	109.9	L431 I433 C471 V472	L431-L440 PolarHBondContact N-O 3.11Å; I433-L440 HydrophobicContact CD1-CB 4.05Å; I433-L440 HydrophobicContact CD1-CD1 3.16Å; I433-L440 HydrophobicContact CD1-CG 4.12Å; I433-L440 HydrophobicContact CG1-CD1 4.49Å; L440-C471 WeakPolarHBondContact CD1-O 3.4Å; L440-C471 HydrophobicContact CD2-CB 4.42Å; L440-V472 HydrophobicContact CD1-CG2 4.5Å
441	R	42	Very low	45.5	Very low	93 Å²	93	57.3 Å²	57.3	35%	0.351	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	119.7	163.4	-79.8	-178.8	166.7	179.3	-8.1	107.1
442	L	43.8	Very low	46	Very low	16 Å²	16	62.4 Å²	62.4	8%	0.084	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-93.6	120.4	169	-65.9	172.9	0	0	0	107.5	C417 L431 L446	C417-L442 HydrophobicContact CB-CD2 4.1Å; L431-L442 HydrophobicContact CD1-CD1 3.47Å; L431-L442 VanDerWaalsContact CD1-CD1 3.47Å; L431-L442 HydrophobicContact CD1-CG 4.21Å; L442-L446 HydrophobicContact CD1-CD1 4.17Å; L442-L446 HydrophobicContact CD1-CD2 3.46Å; L442-L446 VanDerWaalsContact CD1-CD2 3.46Å; L442-L446 HydrophobicContact CD1-CG 3.5Å; L442-L446 VanDerWaalsContact CD1-CG 3.5Å
443	A	36.7	Very low	46.4	Very low	51 Å²	51	66.7 Å²	66.7	42%	0.421	34%	0.341	S	S	.	.	S	Bend	trans	-83.1	-2.4	172.4	0	0	0	0	0	112.2	C425	C425-A443 WeakPolarHBondContact CB-O 3.3Å
444	A	41	Very low	46.6	Very low	12 Å²	12	71.5 Å²	71.5	10%	0.099	36%	0.363	C	S	.	.	S	Bend	trans	-125.7	163.3	-176.1	0	0	0	0	0	110.8	L446 Q449	A444-L446 PolarHBondContact O-N 3.23Å; A444-Q449 VanDerWaalsContact CB-NE2 3.31Å
445	S	45.3	Very low	46.8	Very low	11 Å²	11	70.6 Å²	70.6	8%	0.077	37%	0.365	C	S	.	.			trans	-56.4	126	176.7	-176.5	0	0	0	0	110.8	L126 E447 D448	L126-S445 WeakPolarHBondContact CD1-OG 3.37Å; S445-E447 PolarHBondContact O-N 3.27Å; S445-E447 VanDerWaalsContact O-N 3.17Å; S445-E447 WeakPolarHBondContact OG-CB 3.24Å; S445-E447 PolarHBondContact OG-N 2.9Å; S445-D448 PolarHBondContact O-N 2.92Å
446	L	49.2	Very low	47	Very low	1 Å²	1	71.5 Å²	71.5	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-58.2	-23.9	172.1	-94.1	136.5	0	0	0	112.9	F123 L431 L442 A444 D448 C450 F466	F123-L446 HydrophobicContact CE1-CB 4.31Å; F123-L446 HydrophobicContact CE1-CD1 3.71Å; L431-L446 HydrophobicContact CD1-CD1 3.28Å; L431-L446 HydrophobicContact CD1-CD2 3.45Å; L431-L446 VanDerWaalsContact CD1-CD2 3.45Å; L431-L446 HydrophobicContact CD1-CG 3.73Å; L431-L446 HydrophobicContact CD2-CD1 4.17Å; L431-L446 HydrophobicContact CG-CD1 4.13Å; L442-L446 HydrophobicContact CD1-CD1 4.17Å; L442-L446 HydrophobicContact CD1-CD2 3.46Å; L442-L446 VanDerWaalsContact CD1-CD2 3.46Å; L442-L446 HydrophobicContact CD1-CG 3.5Å; L442-L446 VanDerWaalsContact CD1-CG 3.5Å; A444-L446 PolarHBondContact O-N 3.23Å; L446-D448 VanDerWaalsContact C-N 3.3Å; L446-C450 HydrophobicContact CD2-CB 4.47Å; L446-C450 WeakPolarHBondContact O-CB 3.24Å; L446-C450 PolarHBondContact O-N 3.22Å; L446-C450 VanDerWaalsContact O-N 3.1Å; L446-F466 HydrophobicContact CB-CD1 4.47Å; L446-F466 HydrophobicContact CB-CE1 4.13Å; L446-F466 HydrophobicContact CD2-CD1 4.15Å; L446-F466 HydrophobicContact CD2-CD2 4.39Å; L446-F466 HydrophobicContact CD2-CE1 4.46Å; L446-F466 HydrophobicContact CD2-CG 4.11Å
447	E	47.6	Very low	46.8	Very low	89 Å²	89	78.5 Å²	78.5	42%	0.416	38%	0.381	S	S	.	.	H	α-helix	trans	-69	-29.3	177.1	-65.8	177.9	165	0	0	112.4	L126 S445 K452	L126-E447 HydrophobicContact CD1-CB 4.49Å; L126-E447 HydrophobicContact CD1-CG 3.67Å; S445-E447 PolarHBondContact O-N 3.27Å; S445-E447 VanDerWaalsContact O-N 3.17Å; S445-E447 WeakPolarHBondContact OG-CB 3.24Å; S445-E447 PolarHBondContact OG-N 2.9Å; E447-K452 VanDerWaalsContact CD-NZ 3.3Å; E447-K452 WeakPolarHBondContact OE1-CE 3.47Å; E447-K452 IonicContact OE1-NZ 2.58Å; E447-K452 PolarHBondContact OE1-NZ 3.36Å
448	D	47.7	Very low	46.3	Very low	122 Å²	122	76.3 Å²	76.3	65%	0.652	38%	0.38	S	S	*	.	H	α-helix	trans	-84.6	-15.1	-179	-68.2	-24.7	0	0	0	113	S445 L446	S445-D448 PolarHBondContact O-N 2.92Å; L446-D448 VanDerWaalsContact C-N 3.3Å
449	Q	52.8	Low	46	Very low	23 Å²	23	83.7 Å²	83.7	11%	0.107	40%	0.403	C	S	.	.	H	α-helix	trans	-124.4	-10.9	-168.1	-61.8	-173	1	0	0	115	C417 A444 C469 K470	C417-Q449 VanDerWaalsContact CB-OE1 3.26Å; C417-Q449 PolarHBondContact SG-OE1 3.46Å; A444-Q449 VanDerWaalsContact CB-NE2 3.31Å; Q449-C469 WeakPolarHBondContact O-CA 3.48Å; Q449-K470 PolarHBondContact O-N 2.99Å
450	C	59	Low	45.7	Very low	13 Å²	13	86.8 Å²	86.8	9%	0.088	43%	0.431	C	S	.	.	S	Bend	trans	-138.3	147.9	-178.3	-56.2	0	0	0	0	111.7	L446 F466 C469	L446-C450 HydrophobicContact CD2-CB 4.47Å; L446-C450 WeakPolarHBondContact O-CB 3.24Å; L446-C450 PolarHBondContact O-N 3.22Å; L446-C450 VanDerWaalsContact O-N 3.1Å; C450-F466 HydrophobicContact CB-CB 3.93Å; C450-F466 HydrophobicContact CB-CD1 4.05Å; C450-F466 HydrophobicContact CB-CG 4.42Å; C450-C469 HydrophobicContact CB-CB 4.14Å; C450-C469 WeakPolarHBondContact CB-SG 3.44Å; C450-C469 WeakPolarHBondContact SG-CA 3.32Å; C450-C469 WeakPolarHBondContact SG-CB 3.26Å; C450-C469 CovalentContact SG-SG 2.03Å; C450-C469 PolarHBondContact SG-SG 3.36Å
451	T	58.2	Low	45.7	Very low	73 Å²	73	90.1 Å²	90.1	45%	0.448	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	127.3	172	-42.8	0	0	0	0	110	T467	T451-T467 PolarHBondContact N-O 3.5Å; T451-T467 PolarHBondContact O-N 3.08Å
452	K	56.5	Low	45.7	Very low	113 Å²	113	95.1 Å²	95.1	49%	0.491	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	124.3	174.4	-73.8	176	172.7	168.8	0	109.9	E447 F466	E447-K452 VanDerWaalsContact CD-NZ 3.3Å; E447-K452 WeakPolarHBondContact OE1-CE 3.47Å; E447-K452 IonicContact OE1-NZ 2.58Å; E447-K452 PolarHBondContact OE1-NZ 3.36Å; K452-F466 HydrophobicContact CG-CD1 4.16Å; K452-F466 HydrophobicContact CG-CE1 3.82Å
453	H	53.5	Low	45.9	Very low	112 Å²	112	98.8 Å²	98.8	52%	0.519	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.7	171.6	-155.6	73.6	0	0	0	111.1	N455 V465 T467	H453-N455 PolarHBondContact O-N 3.23Å; H453-V465 PolarHBondContact N-O 3.1Å; H453-V465 VanDerWaalsContact O-O 3.1Å; H453-T467 HydrophobicContact CB-CG2 4.2Å
454	H	53.3	Low	46.8	Very low	107 Å²	107	99.2 Å²	99.2	50%	0.495	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	98.7	178.8	-160	-55.8	0	0	0	109.2	S456	H454-S456 PolarHBondContact O-N 3.21Å
455	N	43.6	Very low	47.7	Very low	113 Å²	113	99.3 Å²	99.3	60%	0.604	47%	0.474	S	S	*	.			trans	-81	93.8	178.1	-146.6	-10	0	0	0	109.9	H453 R457	H453-N455 PolarHBondContact O-N 3.23Å; N455-R457 PolarHBondContact O-N 3.43Å
456	S	43.8	Very low	48.5	Very low	98 Å²	98	98.9 Å²	98.9	69%	0.685	47%	0.471	S	S	*	.			trans	-80.9	93.4	172.1	176.1	0	0	0	0	109.5	H454	H454-S456 PolarHBondContact O-N 3.21Å
457	R	37.9	Very low	49.3	Very low	222 Å²	222	100 Å²	100	84%	0.838	48%	0.478	S	S	*	.			trans	-163.6	35.9	159.2	-118.4	-179.6	-107.2	-162.9	-2.2	116.7	N455	N455-R457 PolarHBondContact O-N 3.43Å
458	H	34.7	Very low	50	Low	174 Å²	174	101.2 Å²	101.2	81%	0.806	49%	0.487	S	S	*	.	S	Bend	trans	-141.2	114.5	155.2	-86.6	-75.3	0	0	0	109.3	A460	H458-A460 VanDerWaalsContact C-N 3.31Å; H458-A460 PolarHBondContact O-N 3.04Å
459	R	35.2	Very low	50.7	Low	260 Å²	260	96 Å²	96	98%	0.981	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	90.5	175.4	-68.9	-179.7	-169.2	174.2	2.9	109.1
460	A	36.3	Very low	50.9	Low	84 Å²	84	103.2 Å²	103.2	69%	0.694	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	163	-16.4	154.5	0	0	0	0	0	113	H458	H458-A460 VanDerWaalsContact C-N 3.31Å; H458-A460 PolarHBondContact O-N 3.04Å
461	F	42.1	Very low	50.7	Low	106 Å²	106	103.8 Å²	103.8	47%	0.465	50%	0.495	S	S	.	.			trans	-133.1	123.2	-169	-90.8	-100	0	0	0	113.6	T229 G230 I463	T229-F461 WeakPolarHBondContact O-CE2 3.49Å; T229-F461 VanDerWaalsContact O-CZ 3.24Å; T229-F461 WeakPolarHBondContact O-CZ 3.35Å; G230-F461 WeakPolarHBondContact O-CE1 3.45Å; F461-I463 HydrophobicContact CB-CG1 4.48Å; F461-I463 PolarHBondContact O-N 3.4Å
462	R	41.8	Very low	50.5	Low	197 Å²	197	101.3 Å²	101.3	74%	0.743	48%	0.479	S	S	*	.			trans	-89.6	85.3	167.6	-66.6	-171.4	-173.6	179.8	1.7	109.8	Q464	R462-Q464 PolarHBondContact O-N 3.1Å
463	I	48.4	Very low	50.1	Low	94 Å²	94	100.3 Å²	100.3	48%	0.482	49%	0.487	S	S	.	.			trans	-83.6	112.2	169.7	-59.6	169.6	0	0	0	107.6	F461 V465	F461-I463 HydrophobicContact CB-CG1 4.48Å; F461-I463 PolarHBondContact O-N 3.4Å; I463-V465 HydrophobicContact CG2-CG2 4.3Å; I463-V465 PolarHBondContact O-N 3.48Å
464	Q	54.8	Low	50	Low	60 Å²	60	97.3 Å²	97.3	28%	0.28	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	117.2	172.7	-73.3	179.6	-6.5	0	0	109.1	L120 R462 F466 P481	L120-Q464 VanDerWaalsContact CD2-CD 3.48Å; L120-Q464 HydrophobicContact CD2-CG 3.97Å; R462-Q464 PolarHBondContact O-N 3.1Å; Q464-F466 HydrophobicContact CB-CE2 4.28Å; Q464-P481 WeakPolarHBondContact O-CD 3.31Å
465	V	59.8	Low	49.5	Very low	14 Å²	14	97.4 Å²	97.4	9%	0.085	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.3	174.1	-176.7	0	0	0	0	107.5	H453 I463 T467 Q478 K480	H453-V465 PolarHBondContact N-O 3.1Å; H453-V465 VanDerWaalsContact O-O 3.1Å; I463-V465 HydrophobicContact CG2-CG2 4.3Å; I463-V465 PolarHBondContact O-N 3.48Å; V465-T467 HydrophobicContact CG1-CG2 4.18Å; V465-Q478 HydrophobicContact CG1-CB 4.44Å; V465-K480 HydrophobicContact CG1-CG 4.28Å; V465-K480 HydrophobicContact CG2-CG 4.28Å
466	F	63.2	Low	50	Low	2 Å²	2	97.6 Å²	97.6	1%	0.009	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	132.3	173.8	-63.9	-89.2	0	0	0	108.1	F123 L446 C450 K452 Q464 Q478 V479	F123-F466 HydrophobicContact CD1-CZ 4.04Å; F123-F466 HydrophobicContact CE1-CE1 4.34Å; F123-F466 AromaticContact CE1-CE2 3.73Å; F123-F466 HydrophobicContact CE1-CE2 3.73Å; F123-F466 AromaticContact CE1-CZ 3.36Å; F123-F466 HydrophobicContact CE1-CZ 3.36Å; F123-F466 HydrophobicContact CE2-CE2 4.31Å; F123-F466 HydrophobicContact CE2-CZ 4.32Å; F123-F466 AromaticContact CZ-CE2 3.48Å; F123-F466 HydrophobicContact CZ-CE2 3.48Å; F123-F466 VanDerWaalsContact CZ-CE2 3.48Å; F123-F466 AromaticContact CZ-CZ 3.56Å; F123-F466 HydrophobicContact CZ-CZ 3.56Å; L446-F466 HydrophobicContact CB-CD1 4.47Å; L446-F466 HydrophobicContact CB-CE1 4.13Å; L446-F466 HydrophobicContact CD2-CD1 4.15Å; L446-F466 HydrophobicContact CD2-CD2 4.39Å; L446-F466 HydrophobicContact CD2-CE1 4.46Å; L446-F466 HydrophobicContact CD2-CG 4.11Å; C450-F466 HydrophobicContact CB-CB 3.93Å; C450-F466 HydrophobicContact CB-CD1 4.05Å; C450-F466 HydrophobicContact CB-CG 4.42Å; K452-F466 HydrophobicContact CG-CD1 4.16Å; K452-F466 HydrophobicContact CG-CE1 3.82Å; Q464-F466 HydrophobicContact CB-CE2 4.28Å; F466-Q478 CarbonylContact O-C 3.56Å; F466-Q478 VanDerWaalsContact O-CA 3.31Å; F466-Q478 WeakPolarHBondContact O-CA 3.46Å; F466-V479 HydrophobicContact CB-CB 4.21Å; F466-V479 PolarHBondContact N-O 3.13Å; F466-V479 PolarHBondContact O-N 3.27Å
467	T	64.4	Low	50.5	Low	24 Å²	24	93.5 Å²	93.5	15%	0.147	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	164.7	177.8	63.5	0	0	0	0	109.6	T451 H453 V465 C469 G477 Q478	T451-T467 PolarHBondContact N-O 3.5Å; T451-T467 PolarHBondContact O-N 3.08Å; H453-T467 HydrophobicContact CB-CG2 4.2Å; V465-T467 HydrophobicContact CG1-CG2 4.18Å; T467-C469 VanDerWaalsContact C-N 3.29Å; T467-C469 PolarHBondContact O-N 3.32Å; T467-G477 WeakPolarHBondContact CA-O 3.45Å; T467-Q478 HydrophobicContact CG2-CG 3.9Å
468	N	62.5	Low	51.5	Low	115 Å²	115	85.7 Å²	85.7	62%	0.615	45%	0.452	S	S	*	.	S	Bend	trans	53.7	41.2	179.7	-64.8	-17.7	0	0	0	114.3	K470 G477	N468-K470 PolarHBondContact O-N 2.79Å; N468-G477 PolarHBondContact N-O 3.41Å
469	C	62.3	Low	52.5	Low	11 Å²	11	77.5 Å²	77.5	7%	0.074	42%	0.415	C	S	.	.			trans	-72.5	120.7	175.9	-69.5	0	0	0	0	111.5	Q449 C450 T467 C471 V472 V479	Q449-C469 WeakPolarHBondContact O-CA 3.48Å; C450-C469 HydrophobicContact CB-CB 4.14Å; C450-C469 WeakPolarHBondContact CB-SG 3.44Å; C450-C469 WeakPolarHBondContact SG-CA 3.32Å; C450-C469 WeakPolarHBondContact SG-CB 3.26Å; C450-C469 CovalentContact SG-SG 2.03Å; C450-C469 PolarHBondContact SG-SG 3.36Å; T467-C469 VanDerWaalsContact C-N 3.29Å; T467-C469 PolarHBondContact O-N 3.32Å; C469-C471 PolarHBondContact O-N 3.15Å; C469-V472 HydrophobicContact CB-CB 3.97Å; C469-V472 HydrophobicContact CB-CG2 3.56Å; C469-V472 PolarHBondContact O-N 3.25Å; C469-V472 VanDerWaalsContact O-N 3.15Å; C469-V479 HydrophobicContact CB-CG2 4.32Å
470	K	56.8	Low	53.5	Low	176 Å²	176	69.1 Å²	69.1	77%	0.765	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-23	-175.9	-77.5	-178.1	177.6	173.5	0	115.4	Q449 N468	Q449-K470 PolarHBondContact O-N 2.99Å; N468-K470 PolarHBondContact O-N 2.79Å
471	C	56.2	Low	54.1	Low	24 Å²	24	67.4 Å²	67.4	16%	0.162	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	26.1	-178.2	-69.4	0	0	0	0	115	C417 L440 C469	C417-C471 WeakPolarHBondContact CA-SG 3.49Å; C417-C471 HydrophobicContact CB-CB 3.43Å; C417-C471 VanDerWaalsContact CB-CB 3.43Å; C417-C471 WeakPolarHBondContact CB-SG 3.37Å; C417-C471 PolarHBondContact N-SG 2.93Å; C417-C471 WeakPolarHBondContact SG-CB 3.48Å; C417-C471 CovalentContact SG-SG 1.96Å; C417-C471 PolarHBondContact SG-SG 3.09Å; L440-C471 WeakPolarHBondContact CD1-O 3.4Å; L440-C471 HydrophobicContact CD2-CB 4.42Å; C469-C471 PolarHBondContact O-N 3.15Å
472	V	54.3	Low	54.4	Low	21 Å²	21	64.4 Å²	64.4	13%	0.127	37%	0.366	C	S	.	.			trans	-118.6	99.8	176.3	177.9	0	0	0	0	108.3	I433 L440 C469 G474 V479	I433-V472 HydrophobicContact CB-CG1 4.22Å; I433-V472 HydrophobicContact CD1-CB 4.5Å; I433-V472 HydrophobicContact CD1-CG1 4.06Å; I433-V472 HydrophobicContact CD1-CG2 3.93Å; I433-V472 HydrophobicContact CG1-CG1 3.89Å; I433-V472 HydrophobicContact CG1-CG2 3.91Å; I433-V472 HydrophobicContact CG2-CG1 3.34Å; L440-V472 HydrophobicContact CD1-CG2 4.5Å; C469-V472 HydrophobicContact CB-CB 3.97Å; C469-V472 HydrophobicContact CB-CG2 3.56Å; C469-V472 PolarHBondContact O-N 3.25Å; C469-V472 VanDerWaalsContact O-N 3.15Å; V472-G474 PolarHBondContact O-N 2.72Å; V472-V479 HydrophobicContact CG2-CG2 3.76Å
473	S	47.8	Very low	54.8	Low	93 Å²	93	61.6 Å²	61.6	65%	0.65	36%	0.361	S	S	*	.			trans	-85.8	98.8	179.8	-57.4	0	0	0	0	110.4	Q436	Q436-S473 PolarHBondContact NE2-O 2.82Å
474	G	50.1	Low	55.2	Low	48 Å²	48	58.2 Å²	58.2	50%	0.495	35%	0.345	S	S	.	.	S	Bend	trans	173.5	148.9	176.5	0	0	0	0	0	112.2	V472 D476 G477	V472-G474 PolarHBondContact O-N 2.72Å; G474-D476 PolarHBondContact O-N 3.26Å; G474-G477 PolarHBondContact O-N 3.48Å
475	A	43.7	Very low	55.3	Low	109 Å²	109	60.3 Å²	60.3	90%	0.901	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-6.7	-156.8	0	0	0	0	0	118.9
476	D	53.5	Low	55.5	Low	118 Å²	118	62.3 Å²	62.3	63%	0.631	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.5	-6.1	175.8	-74.5	-38.3	0	0	0	114.8	G474 Q478	G474-D476 PolarHBondContact O-N 3.26Å; D476-Q478 HydrophobicContact CB-CG 4.15Å; D476-Q478 VanDerWaalsContact O-CG 3.3Å; D476-Q478 WeakPolarHBondContact O-CG 3.43Å; D476-Q478 PolarHBondContact O-N 3.38Å
477	G	55.7	Low	55.5	Low	11 Å²	11	66 Å²	66	11%	0.113	40%	0.4	C	S	.	.			trans	53	18.4	177.1	0	0	0	0	0	116.1	T467 N468 G474	T467-G477 WeakPolarHBondContact CA-O 3.45Å; N468-G477 PolarHBondContact N-O 3.41Å; G474-G477 PolarHBondContact O-N 3.48Å
478	Q	57.2	Low	55.8	Low	58 Å²	58	65.6 Å²	65.6	27%	0.271	40%	0.398	S	S	.	.			trans	-87.5	123.9	-174.6	-61.7	-168.7	1.7	0	0	111.6	K434 V465 F466 T467 D476	K434-Q478 WeakPolarHBondContact CB-O 3.4Å; K434-Q478 PolarHBondContact N-O 3.09Å; V465-Q478 HydrophobicContact CG1-CB 4.44Å; F466-Q478 CarbonylContact O-C 3.56Å; F466-Q478 VanDerWaalsContact O-CA 3.31Å; F466-Q478 WeakPolarHBondContact O-CA 3.46Å; T467-Q478 HydrophobicContact CG2-CG 3.9Å; D476-Q478 HydrophobicContact CB-CG 4.15Å; D476-Q478 VanDerWaalsContact O-CG 3.3Å; D476-Q478 WeakPolarHBondContact O-CG 3.43Å; D476-Q478 PolarHBondContact O-N 3.38Å
479	V	56.4	Low	56.2	Low	3 Å²	3	63.5 Å²	63.5	2%	0.018	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.9	175.6	179.6	0	0	0	0	108.8	L431 N432 I433 F466 C469 V472	L431-V479 HydrophobicContact CB-CG1 3.61Å; L431-V479 HydrophobicContact CD1-CG1 4.04Å; L431-V479 HydrophobicContact CD2-CG1 3.83Å; L431-V479 HydrophobicContact CG-CG1 4.04Å; N432-V479 WeakPolarHBondContact O-CA 2.98Å; N432-V479 WeakPolarHBondContact O-CG1 3.43Å; I433-V479 HydrophobicContact CG1-CG2 4.15Å; F466-V479 HydrophobicContact CB-CB 4.21Å; F466-V479 PolarHBondContact N-O 3.13Å; F466-V479 PolarHBondContact O-N 3.27Å; C469-V479 HydrophobicContact CB-CG2 4.32Å; V472-V479 HydrophobicContact CG2-CG2 3.76Å
480	K	55.6	Low	57	Low	83 Å²	83	68.4 Å²	68.4	36%	0.361	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.7	177	-65.2	-172	179.7	-173	0	110.2	N432 V465 G482	N432-K480 PolarHBondContact N-O 2.91Å; N432-K480 PolarHBondContact O-N 2.83Å; V465-K480 HydrophobicContact CG1-CG 4.28Å; V465-K480 HydrophobicContact CG2-CG 4.28Å; K480-G482 PolarHBondContact O-N 3.31Å
481	P	48.8	Very low	58.2	Low	48 Å²	48	64.2 Å²	64.2	31%	0.312	40%	0.395	S	S	.	.	S	Bend	trans	-66.4	126.7	168.6	26.4	-30.6	0	0	0	109.3	Q464	Q464-P481 WeakPolarHBondContact O-CD 3.31Å
482	G	49	Very low	59.6	Low	43 Å²	43	63.4 Å²	63.4	44%	0.443	39%	0.388	S	S	.	.	S	Bend	trans	152.4	171	-179.3	0	0	0	0	0	113.1	N432 K480	N432-G482 WeakPolarHBondContact CB-O 3.19Å; K480-G482 PolarHBondContact O-N 3.31Å
483	H	49.3	Very low	61	Low	139 Å²	139	67 Å²	67	64%	0.644	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-68.4	147.2	173	-89.8	70.4	0	0	0	111.3	N432	N432-H483 PolarHBondContact ND2-O 2.75Å
484	C	57.4	Low	62.8	Low	22 Å²	22	64.9 Å²	64.9	15%	0.149	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-63.1	140	165	-65.9	0	0	0	0	109.8	I402 N432 T439 N486	I402-C484 HydrophobicContact CD1-CB 3.75Å; N432-C484 VanDerWaalsContact CG-SG 3.54Å; N432-C484 WeakPolarHBondContact ND2-CA 3.19Å; N432-C484 PolarHBondContact OD1-SG 3.44Å; T439-C484 WeakPolarHBondContact CG2-SG 3.32Å; C484-N486 PolarHBondContact O-N 3.49Å; C484-N486 VanDerWaalsContact O-N 3.16Å
485	P	56.6	Low	64.3	Low	105 Å²	105	62.7 Å²	62.7	68%	0.682	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-58.4	122.7	175.8	23.2	-31.7	0	0	0	109.6	S487	P485-S487 PolarHBondContact O-N 3.21Å; P485-S487 VanDerWaalsContact O-N 3.15Å
486	N	64.4	Low	66.3	Low	56 Å²	56	58.6 Å²	58.6	30%	0.299	33%	0.33	S	S	.	.			trans	-77.2	103.6	-178.7	-167.9	0.6	0	0	0	110.1	Y340 G341 C399 C484 C488 S489	Y340-N486 VanDerWaalsContact CA-ND2 3.32Å; Y340-N486 WeakPolarHBondContact CA-ND2 3.2Å; Y340-N486 PolarHBondContact O-ND2 3.24Å; G341-N486 PolarHBondContact N-ND2 3.38Å; C399-N486 PolarHBondContact SG-OD1 3.29Å; C484-N486 PolarHBondContact O-N 3.49Å; C484-N486 VanDerWaalsContact O-N 3.16Å; N486-C488 PolarHBondContact O-N 2.01Å; N486-C488 PolarHBondContact OD1-N 3.45Å; N486-S489 PolarHBondContact O-N 3.02Å
487	S	62.8	Low	67.7	Low	78 Å²	78	58.4 Å²	58.4	55%	0.545	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-3.3	179.5	-51.3	0	0	0	0	114.2	P485 H490	P485-S487 PolarHBondContact O-N 3.21Å; P485-S487 VanDerWaalsContact O-N 3.15Å; S487-H490 PolarHBondContact O-CE1 3.08Å; S487-H490 PolarHBondContact O-ND1 3.17Å
488	C	70.6	Confident	68.9	Low	16 Å²	16	59.8 Å²	59.8	11%	0.108	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	8.1	-176	-58.2	0	0	0	0	114.3	C399 N486 H490 Y491	C399-C488 WeakPolarHBondContact CA-SG 3.48Å; C399-C488 HydrophobicContact CB-CB 3.39Å; C399-C488 WeakPolarHBondContact CB-SG 3.46Å; C399-C488 WeakPolarHBondContact SG-CB 3.32Å; C399-C488 CovalentContact SG-SG 2.03Å; C399-C488 PolarHBondContact SG-SG 2.62Å; N486-C488 PolarHBondContact O-N 2.01Å; N486-C488 PolarHBondContact OD1-N 3.45Å; C488-H490 PolarHBondContact O-N 3.22Å; C488-H490 VanDerWaalsContact O-N 3.12Å; C488-Y491 HydrophobicContact CB-CD2 4.14Å; C488-Y491 PolarHBondContact O-N 3.35Å; C488-Y491 VanDerWaalsContact O-N 3.07Å
489	S	72.6	Confident	70.1	Confident	71 Å²	71	57.5 Å²	57.5	50%	0.497	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-59.5	-23.8	-178.1	-171.8	0	0	0	0	113.4	N486 Y491 L492	N486-S489 PolarHBondContact O-N 3.02Å; S489-Y491 VanDerWaalsContact C-N 3.28Å; S489-Y491 PolarHBondContact O-N 3.32Å; S489-L492 VanDerWaalsContact O-CB 3.31Å; S489-L492 WeakPolarHBondContact O-CB 3.18Å; S489-L492 PolarHBondContact O-N 2.91Å
490	H	78.8	Confident	71.1	Confident	114 Å²	114	58.2 Å²	58.2	53%	0.528	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-70.1	-21	177.3	62.3	-68.2	0	0	0	113.7	S487 C488 L492 P494	S487-H490 PolarHBondContact O-CE1 3.08Å; S487-H490 PolarHBondContact O-ND1 3.17Å; C488-H490 PolarHBondContact O-N 3.22Å; C488-H490 VanDerWaalsContact O-N 3.12Å; H490-L492 VanDerWaalsContact C-N 3.32Å; H490-P494 WeakPolarHBondContact O-CD 2.93Å; H490-P494 WeakPolarHBondContact O-CG 3.38Å
491	Y	81.6	Confident	72.2	Confident	89 Å²	89	58.1 Å²	58.1	35%	0.349	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-80.1	-11.8	175.9	-67.9	-63.4	0	0	0	113.8	C488 S489 P494 V495	C488-Y491 HydrophobicContact CB-CD2 4.14Å; C488-Y491 PolarHBondContact O-N 3.35Å; C488-Y491 VanDerWaalsContact O-N 3.07Å; S489-Y491 VanDerWaalsContact C-N 3.28Å; S489-Y491 PolarHBondContact O-N 3.32Å; Y491-P494 WeakPolarHBondContact O-CD 3.41Å; Y491-V495 WeakPolarHBondContact O-CB 2.93Å; Y491-V495 WeakPolarHBondContact O-CG2 3.38Å; Y491-V495 PolarHBondContact O-N 3.41Å; Y491-V495 VanDerWaalsContact O-N 3.07Å
492	L	84.9	Confident	73.5	Confident	6 Å²	6	56 Å²	56	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-59.3	-53.7	-177	177.4	66.6	0	0	0	112.5	L336 Y340 A342 Y346 L350 S489 H490 I496	L336-L492 HydrophobicContact CB-CD1 4.28Å; L336-L492 HydrophobicContact CD2-CD1 3.81Å; L336-L492 HydrophobicContact CG-CD1 4.45Å; Y340-L492 HydrophobicContact CD1-CB 4.18Å; Y340-L492 HydrophobicContact CD2-CD1 3.51Å; Y340-L492 HydrophobicContact CE2-CD1 4.28Å; Y340-L492 HydrophobicContact CG-CB 4.03Å; Y340-L492 HydrophobicContact CG-CD1 3.73Å; Y340-L492 HydrophobicContact CG-CG 4.47Å; A342-L492 HydrophobicContact CB-CD2 4.09Å; Y346-L492 HydrophobicContact CD1-CD2 4.24Å; Y346-L492 HydrophobicContact CE1-CD2 3.68Å; L350-L492 HydrophobicContact CD1-CD1 4.43Å; L350-L492 HydrophobicContact CD1-CD2 3.99Å; L350-L492 HydrophobicContact CD1-CG 4.26Å; S489-L492 VanDerWaalsContact O-CB 3.31Å; S489-L492 WeakPolarHBondContact O-CB 3.18Å; S489-L492 PolarHBondContact O-N 2.91Å; H490-L492 VanDerWaalsContact C-N 3.32Å; L492-I496 HydrophobicContact CD1-CD1 3.93Å; L492-I496 HydrophobicContact CG-CD1 4.2Å; L492-I496 WeakPolarHBondContact O-CG1 3.08Å; L492-I496 PolarHBondContact O-N 3.38Å; L492-I496 VanDerWaalsContact O-N 3.16Å
493	L	84.6	Confident	74.7	Confident	96 Å²	96	54.6 Å²	54.6	50%	0.503	30%	0.301	S	S	.	.	H	α-helix	trans	-66.4	-47	-179.1	-69.2	172.2	0	0	0	112.3	L350 V495 I496 L497	L350-L493 HydrophobicContact CD2-CD2 4.21Å; L493-V495 VanDerWaalsContact C-N 3.32Å; L493-V495 PolarHBondContact O-N 3.2Å; L493-I496 PolarHBondContact O-N 3.38Å; L493-L497 WeakPolarHBondContact O-CG 3.4Å; L493-L497 PolarHBondContact O-N 3.19Å
494	P	84.6	Confident	75.7	Confident	50 Å²	50	50.1 Å²	50.1	33%	0.325	28%	0.281	S	S	.	.	H	α-helix	trans	-54.1	-43.4	174	-28.7	34.5	0	0	0	114.2	H490 Y491 L497 L498	H490-P494 WeakPolarHBondContact O-CD 2.93Å; H490-P494 WeakPolarHBondContact O-CG 3.38Å; Y491-P494 WeakPolarHBondContact O-CD 3.41Å; P494-L497 WeakPolarHBondContact O-CB 3.45Å; P494-L497 PolarHBondContact O-N 2.7Å; P494-L498 WeakPolarHBondContact O-CG 3.48Å; P494-L498 PolarHBondContact O-N 2.95Å
495	V	82.9	Confident	76.2	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-68.6	-37.9	-179.5	167.2	0	0	0	0	111.7	Y340 Q397 Y491 L493 L497 L498 I499	Y340-V495 VanDerWaalsContact OH-CG2 3.29Å; Y340-V495 WeakPolarHBondContact OH-CG2 3.32Å; Q397-V495 HydrophobicContact CB-CG2 3.91Å; Y491-V495 WeakPolarHBondContact O-CB 2.93Å; Y491-V495 WeakPolarHBondContact O-CG2 3.38Å; Y491-V495 PolarHBondContact O-N 3.41Å; Y491-V495 VanDerWaalsContact O-N 3.07Å; L493-V495 VanDerWaalsContact C-N 3.32Å; L493-V495 PolarHBondContact O-N 3.2Å; V495-L497 VanDerWaalsContact C-N 3.33Å; V495-L498 PolarHBondContact O-N 3.48Å; V495-I499 HydrophobicContact CG1-CD1 3.77Å; V495-I499 HydrophobicContact CG1-CG1 4.34Å; V495-I499 WeakPolarHBondContact O-CB 3.42Å; V495-I499 VanDerWaalsContact O-CG1 3.28Å; V495-I499 WeakPolarHBondContact O-CG1 3.47Å; V495-I499 PolarHBondContact O-N 2.96Å
496	I	84.8	Confident	76.8	Confident	23 Å²	23	46 Å²	46	12%	0.118	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-38.1	174.9	-67.9	171.5	0	0	0	111	L336 L350 L492 L493 I499 S500	L336-I496 HydrophobicContact CD1-CD1 3.69Å; L336-I496 HydrophobicContact CD1-CG1 4.2Å; L336-I496 HydrophobicContact CD2-CD1 4.04Å; L336-I496 HydrophobicContact CD2-CG1 4Å; L350-I496 HydrophobicContact CB-CD1 3.76Å; L350-I496 HydrophobicContact CD1-CD1 3.54Å; L350-I496 HydrophobicContact CD2-CD1 4.26Å; L350-I496 HydrophobicContact CG-CD1 4.05Å; L492-I496 HydrophobicContact CD1-CD1 3.93Å; L492-I496 HydrophobicContact CG-CD1 4.2Å; L492-I496 WeakPolarHBondContact O-CG1 3.08Å; L492-I496 PolarHBondContact O-N 3.38Å; L492-I496 VanDerWaalsContact O-N 3.16Å; L493-I496 PolarHBondContact O-N 3.38Å; I496-I499 PolarHBondContact O-N 3.06Å; I496-S500 VanDerWaalsContact O-CB 3.25Å; I496-S500 WeakPolarHBondContact O-CB 3.46Å; I496-S500 PolarHBondContact O-N 2.91Å; I496-S500 PolarHBondContact O-OG 3Å
497	L	82.9	Confident	77	Confident	114 Å²	114	44.2 Å²	44.2	60%	0.597	25%	0.248	S	C	*	.	H	α-helix	trans	-61.5	-43.8	172.8	-71.8	173	0	0	0	111.4	L493 P494 V495 S500 L501	L493-L497 WeakPolarHBondContact O-CG 3.4Å; L493-L497 PolarHBondContact O-N 3.19Å; P494-L497 WeakPolarHBondContact O-CB 3.45Å; P494-L497 PolarHBondContact O-N 2.7Å; V495-L497 VanDerWaalsContact C-N 3.33Å; L497-S500 WeakPolarHBondContact CA-OG 3.44Å; L497-S500 WeakPolarHBondContact O-CB 3.43Å; L497-S500 PolarHBondContact O-N 2.97Å; L497-S500 PolarHBondContact O-OG 3.45Å; L497-L501 WeakPolarHBondContact O-CB 3.49Å; L497-L501 PolarHBondContact O-N 2.8Å
498	L	81.8	Confident	77.2	Confident	41 Å²	41	42.8 Å²	42.8	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-66	-43.9	177	-74.8	167.5	0	0	0	112.9	P494 V495 S500 L501 A502	P494-L498 WeakPolarHBondContact O-CG 3.48Å; P494-L498 PolarHBondContact O-N 2.95Å; V495-L498 PolarHBondContact O-N 3.48Å; L498-S500 VanDerWaalsContact C-N 3.26Å; L498-S500 PolarHBondContact O-N 3.28Å; L498-L501 PolarHBondContact O-N 3.42Å; L498-A502 WeakPolarHBondContact O-CB 3.44Å; L498-A502 PolarHBondContact O-N 3.1Å
499	I	81	Confident	77	Confident	9 Å²	9	43.3 Å²	43.3	5%	0.046	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-39.9	173.6	-68.1	169	0	0	0	109.8	L332 Y354 V495 I496 A502 S503	L332-I499 HydrophobicContact CD1-CD1 4.16Å; Y354-I499 HydrophobicContact CD2-CG2 4.49Å; Y354-I499 HydrophobicContact CE2-CG2 3.88Å; V495-I499 HydrophobicContact CG1-CD1 3.77Å; V495-I499 HydrophobicContact CG1-CG1 4.34Å; V495-I499 WeakPolarHBondContact O-CB 3.42Å; V495-I499 VanDerWaalsContact O-CG1 3.28Å; V495-I499 WeakPolarHBondContact O-CG1 3.47Å; V495-I499 PolarHBondContact O-N 2.96Å; I496-I499 PolarHBondContact O-N 3.06Å; I499-A502 PolarHBondContact O-N 2.95Å; I499-S503 VanDerWaalsContact O-CB 3.32Å; I499-S503 WeakPolarHBondContact O-CB 3.43Å; I499-S503 PolarHBondContact O-N 3.46Å; I499-S503 PolarHBondContact O-OG 2.81Å
500	S	79.2	Confident	77	Confident	19 Å²	19	43.1 Å²	43.1	13%	0.133	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-47.8	176.1	82.3	0	0	0	0	112.1	I496 L497 L498 S503 L504	I496-S500 VanDerWaalsContact O-CB 3.25Å; I496-S500 WeakPolarHBondContact O-CB 3.46Å; I496-S500 PolarHBondContact O-N 2.91Å; I496-S500 PolarHBondContact O-OG 3Å; L497-S500 WeakPolarHBondContact CA-OG 3.44Å; L497-S500 WeakPolarHBondContact O-CB 3.43Å; L497-S500 PolarHBondContact O-N 2.97Å; L497-S500 PolarHBondContact O-OG 3.45Å; L498-S500 VanDerWaalsContact C-N 3.26Å; L498-S500 PolarHBondContact O-N 3.28Å; S500-S503 PolarHBondContact O-N 3.12Å; S500-S503 PolarHBondContact O-OG 2.99Å; S500-L504 WeakPolarHBondContact O-CB 3.31Å; S500-L504 PolarHBondContact O-N 3.38Å
501	L	77.2	Confident	76.5	Confident	80 Å²	80	40.5 Å²	40.5	42%	0.419	22%	0.218	S	C	.	.	H	α-helix	trans	-64.2	-43.7	177.9	-176.5	65.4	0	0	0	111.4	L497 L498 S503 L504 I505	L497-L501 WeakPolarHBondContact O-CB 3.49Å; L497-L501 PolarHBondContact O-N 2.8Å; L498-L501 PolarHBondContact O-N 3.42Å; L501-S503 VanDerWaalsContact C-N 3.31Å; L501-S503 PolarHBondContact O-N 3.01Å; L501-L504 WeakPolarHBondContact O-CB 3.17Å; L501-L504 PolarHBondContact O-N 2.84Å; L501-I505 HydrophobicContact CD1-CD1 4.3Å; L501-I505 HydrophobicContact CG-CD1 4.01Å; L501-I505 WeakPolarHBondContact O-CD1 3.41Å; L501-I505 WeakPolarHBondContact O-CG1 3.14Å; L501-I505 PolarHBondContact O-N 3.24Å
502	A	75.9	Confident	75.8	Confident	4 Å²	4	39 Å²	39	3%	0.033	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-37.8	176.8	0	0	0	0	0	112	T387 A390 L498 I499 A506	T387-A502 WeakPolarHBondContact CG2-O 3.49Å; A390-A502 HydrophobicContact CB-CB 4.27Å; L498-A502 WeakPolarHBondContact O-CB 3.44Å; L498-A502 PolarHBondContact O-N 3.1Å; I499-A502 PolarHBondContact O-N 2.95Å; A502-A506 WeakPolarHBondContact O-CB 3.42Å; A502-A506 PolarHBondContact O-N 2.85Å; A502-A506 VanDerWaalsContact O-N 3.08Å
503	S	73.9	Confident	75.1	Confident	14 Å²	14	39.3 Å²	39.3	10%	0.098	22%	0.221	C	C	.	.	H	α-helix	trans	-70.1	-38.4	176.7	81.2	0	0	0	0	112.6	Y354 I499 S500 L501 A506 C507	Y354-S503 WeakPolarHBondContact CE2-OG 3.12Å; Y354-S503 WeakPolarHBondContact OH-CB 3.34Å; I499-S503 VanDerWaalsContact O-CB 3.32Å; I499-S503 WeakPolarHBondContact O-CB 3.43Å; I499-S503 PolarHBondContact O-N 3.46Å; I499-S503 PolarHBondContact O-OG 2.81Å; S500-S503 PolarHBondContact O-N 3.12Å; S500-S503 PolarHBondContact O-OG 2.99Å; L501-S503 VanDerWaalsContact C-N 3.31Å; L501-S503 PolarHBondContact O-N 3.01Å; S503-A506 WeakPolarHBondContact O-CB 3.09Å; S503-A506 PolarHBondContact O-N 3.33Å; S503-C507 PolarHBondContact O-N 3.29Å; S503-C507 PolarHBondContact O-SG 3.09Å
504	L	70.6	Confident	74.5	Confident	44 Å²	44	38.1 Å²	38.1	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-58.7	-50.2	176.1	177.8	165.6	0	0	0	110.1	I361 S500 L501 A506 C507 L508	I361-L504 HydrophobicContact CB-CD1 4.49Å; I361-L504 HydrophobicContact CB-CG 4.42Å; I361-L504 HydrophobicContact CD1-CD1 3.38Å; I361-L504 HydrophobicContact CD1-CG 4.14Å; I361-L504 HydrophobicContact CG1-CD1 4.42Å; I361-L504 HydrophobicContact CG2-CD1 3.84Å; I361-L504 HydrophobicContact CG2-CD2 4.28Å; I361-L504 HydrophobicContact CG2-CG 3.63Å; S500-L504 WeakPolarHBondContact O-CB 3.31Å; S500-L504 PolarHBondContact O-N 3.38Å; L501-L504 WeakPolarHBondContact O-CB 3.17Å; L501-L504 PolarHBondContact O-N 2.84Å; L504-A506 VanDerWaalsContact C-N 3.27Å; L504-A506 PolarHBondContact O-N 3.35Å; L504-C507 WeakPolarHBondContact O-CB 3.21Å; L504-C507 PolarHBondContact O-N 3.44Å; L504-L508 HydrophobicContact CD2-CD1 4.5Å; L504-L508 PolarHBondContact O-N 3.45Å
505	I	68.8	Low	73.9	Confident	11 Å²	11	40.1 Å²	40.1	6%	0.056	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-35.4	178.7	-61.9	162.4	0	0	0	110.5	V383 L386 T387 L501 L508	V383-I505 HydrophobicContact CB-CG2 3.77Å; V383-I505 HydrophobicContact CG1-CG2 3.16Å; V383-I505 HydrophobicContact CG2-CG2 4.1Å; V383-I505 WeakPolarHBondContact O-CG2 3.34Å; L386-I505 HydrophobicContact CB-CD1 4.47Å; L386-I505 HydrophobicContact CD2-CD1 3.58Å; L386-I505 HydrophobicContact CG-CD1 3.85Å; T387-I505 HydrophobicContact CG2-CB 3.5Å; T387-I505 HydrophobicContact CG2-CD1 4.34Å; T387-I505 HydrophobicContact CG2-CG2 3.32Å; L501-I505 HydrophobicContact CD1-CD1 4.3Å; L501-I505 HydrophobicContact CG-CD1 4.01Å; L501-I505 WeakPolarHBondContact O-CD1 3.41Å; L501-I505 WeakPolarHBondContact O-CG1 3.14Å; L501-I505 PolarHBondContact O-N 3.24Å; I505-L508 WeakPolarHBondContact O-CB 3.15Å; I505-L508 PolarHBondContact O-N 2.65Å
506	A	69.8	Low	73.4	Confident	29 Å²	29	44 Å²	44	24%	0.24	24%	0.235	C	C	.	.	H	α-helix	trans	-69.2	-33.6	175.7	0	0	0	0	0	113.3	A502 S503 L504 L508 T509 H510	A502-A506 WeakPolarHBondContact O-CB 3.42Å; A502-A506 PolarHBondContact O-N 2.85Å; A502-A506 VanDerWaalsContact O-N 3.08Å; S503-A506 WeakPolarHBondContact O-CB 3.09Å; S503-A506 PolarHBondContact O-N 3.33Å; L504-A506 VanDerWaalsContact C-N 3.27Å; L504-A506 PolarHBondContact O-N 3.35Å; A506-L508 VanDerWaalsContact C-N 3.28Å; A506-L508 PolarHBondContact O-N 3.42Å; A506-T509 PolarHBondContact O-N 3.15Å; A506-T509 VanDerWaalsContact O-N 3.12Å; A506-T509 PolarHBondContact O-OG1 3.49Å; A506-H510 PolarHBondContact O-N 3.04Å
507	C	68.4	Low	72.8	Confident	20 Å²	20	43 Å²	43	14%	0.135	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-35	175.2	-78	0	0	0	0	112.2	R358 L362 S503 L504 T509 H510	R358-C507 WeakPolarHBondContact CG-SG 3.39Å; L362-C507 HydrophobicContact CD1-CB 4.05Å; S503-C507 PolarHBondContact O-N 3.29Å; S503-C507 PolarHBondContact O-SG 3.09Å; L504-C507 WeakPolarHBondContact O-CB 3.21Å; L504-C507 PolarHBondContact O-N 3.44Å; C507-T509 PolarHBondContact O-N 3.19Å; C507-H510 PolarHBondContact O-N 3.26Å
508	L	66.3	Low	72.1	Confident	47 Å²	47	39.7 Å²	39.7	25%	0.246	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-31.1	174	-65.8	174.5	0	0	0	112.8	N365 L504 I505 A506 P512	N365-L508 HydrophobicContact CB-CD2 3.47Å; N365-L508 VanDerWaalsContact CB-CD2 3.47Å; L504-L508 HydrophobicContact CD2-CD1 4.5Å; L504-L508 PolarHBondContact O-N 3.45Å; I505-L508 WeakPolarHBondContact O-CB 3.15Å; I505-L508 PolarHBondContact O-N 2.65Å; A506-L508 VanDerWaalsContact C-N 3.28Å; A506-L508 PolarHBondContact O-N 3.42Å; L508-P512 WeakPolarHBondContact O-CD 3.28Å; L508-P512 WeakPolarHBondContact O-CG 3.49Å
509	T	66.9	Low	71.8	Confident	27 Å²	27	47.2 Å²	47.2	17%	0.166	24%	0.238	C	C	.	.	H	α-helix	trans	-83.1	-22.2	178.7	55.5	0	0	0	0	113.9	V383 A506 C507 P512 L513	V383-T509 HydrophobicContact CG1-CG2 3.51Å; A506-T509 PolarHBondContact O-N 3.15Å; A506-T509 VanDerWaalsContact O-N 3.12Å; A506-T509 PolarHBondContact O-OG1 3.49Å; C507-T509 PolarHBondContact O-N 3.19Å; T509-P512 WeakPolarHBondContact O-CD 3.31Å; T509-L513 VanDerWaalsContact O-CG 3.31Å; T509-L513 WeakPolarHBondContact O-CG 3.13Å; T509-L513 PolarHBondContact O-N 3.37Å
510	H	71.2	Confident	71.6	Confident	67 Å²	67	48.7 Å²	48.7	31%	0.31	25%	0.249	S	C	.	.	H	α-helix	trans	-68.7	-43	-174.4	-170.8	-86.6	0	0	0	112.8	A506 C507 L513 Y514	A506-H510 PolarHBondContact O-N 3.04Å; C507-H510 PolarHBondContact O-N 3.26Å; H510-L513 PolarHBondContact O-N 3.39Å; H510-Y514 PolarHBondContact O-N 2.69Å; H510-Y514 VanDerWaalsContact O-N 3.09Å
511	N	68.3	Low	71.6	Confident	59 Å²	59	48.4 Å²	48.4	32%	0.316	25%	0.246	S	C	.	.	H	α-helix	trans	-63.6	-47.2	179.5	-74.9	-23.9	0	0	0	113	L513 Y514 M515	N511-L513 VanDerWaalsContact C-N 3.32Å; N511-L513 PolarHBondContact O-N 3.28Å; N511-Y514 PolarHBondContact O-N 2.96Å; N511-M515 WeakPolarHBondContact O-CG 3.4Å; N511-M515 PolarHBondContact O-N 3.01Å
512	P	67.8	Low	71.5	Confident	58 Å²	58	47.4 Å²	47.4	38%	0.377	25%	0.246	S	C	.	.	H	α-helix	trans	-56.5	-42	172.8	-27.6	34	0	0	0	113.7	L508 T509 Y514 M515 M516	L508-P512 WeakPolarHBondContact O-CD 3.28Å; L508-P512 WeakPolarHBondContact O-CG 3.49Å; T509-P512 WeakPolarHBondContact O-CD 3.31Å; P512-Y514 VanDerWaalsContact C-N 3.35Å; P512-Y514 PolarHBondContact O-N 3.23Å; P512-M515 PolarHBondContact O-N 3.38Å; P512-M516 VanDerWaalsContact O-CG 3.31Å; P512-M516 WeakPolarHBondContact O-CG 3.46Å; P512-M516 PolarHBondContact O-N 2.92Å
513	L	70.9	Confident	71.1	Confident	13 Å²	13	54.9 Å²	54.9	7%	0.068	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-43.1	178.2	-71.1	171.4	0	0	0	111.5	L314 F321 T509 H510 N511 M516 V517 L597	L314-L513 HydrophobicContact CD1-CD2 3.73Å; F321-L513 HydrophobicContact CD2-CD1 4.05Å; F321-L513 HydrophobicContact CE2-CD1 4.17Å; T509-L513 VanDerWaalsContact O-CG 3.31Å; T509-L513 WeakPolarHBondContact O-CG 3.13Å; T509-L513 PolarHBondContact O-N 3.37Å; H510-L513 PolarHBondContact O-N 3.39Å; N511-L513 VanDerWaalsContact C-N 3.32Å; N511-L513 PolarHBondContact O-N 3.28Å; L513-M516 PolarHBondContact O-N 2.97Å; L513-V517 PolarHBondContact O-N 3.4Å; L513-L597 HydrophobicContact CD2-CD1 4.24Å; L513-L597 HydrophobicContact CD2-CD2 3.68Å
514	Y	72	Confident	70.8	Confident	70 Å²	70	61.3 Å²	61.3	28%	0.275	31%	0.311	S	S	.	.	H	α-helix	trans	-61.7	-43.8	174.6	-173.4	-98.4	0	0	0	112	H510 N511 P512 M516 V517 L518	H510-Y514 PolarHBondContact O-N 2.69Å; H510-Y514 VanDerWaalsContact O-N 3.09Å; N511-Y514 PolarHBondContact O-N 2.96Å; P512-Y514 VanDerWaalsContact C-N 3.35Å; P512-Y514 PolarHBondContact O-N 3.23Å; Y514-M516 VanDerWaalsContact C-N 3.33Å; Y514-M516 PolarHBondContact O-N 3.15Å; Y514-V517 WeakPolarHBondContact O-CB 3.45Å; Y514-V517 PolarHBondContact O-N 3.15Å; Y514-L518 HydrophobicContact CD1-CD1 4.3Å; Y514-L518 HydrophobicContact CE1-CD1 3.91Å; Y514-L518 HydrophobicContact CE1-CG 4.43Å; Y514-L518 PolarHBondContact O-N 3.46Å
515	M	70.8	Confident	70.8	Confident	93 Å²	93	62.2 Å²	62.2	46%	0.458	32%	0.315	S	S	.	.	H	α-helix	trans	-66	-32.6	177	-69.6	-57.9	-61.8	0	0	113.2	N511 P512 V517 L518 R519	N511-M515 WeakPolarHBondContact O-CG 3.4Å; N511-M515 PolarHBondContact O-N 3.01Å; P512-M515 PolarHBondContact O-N 3.38Å; M515-V517 VanDerWaalsContact C-N 3.32Å; M515-L518 PolarHBondContact O-N 3.05Å; M515-L518 HydrophobicContact SD-CD1 4.11Å; M515-R519 WeakPolarHBondContact O-CG 3.45Å; M515-R519 PolarHBondContact O-N 3.46Å
516	M	72.3	Confident	70.9	Confident	83 Å²	83	64.9 Å²	64.9	41%	0.409	33%	0.326	S	S	.	.	H	α-helix	trans	-64.1	-38.6	174.1	-74	177.6	76.8	0	0	111.2	L314 P512 L513 Y514 L518 R519 C520 L600	L314-M516 HydrophobicContact CD1-CB 4.28Å; L314-M516 HydrophobicContact CD2-CB 3.68Å; P512-M516 VanDerWaalsContact O-CG 3.31Å; P512-M516 WeakPolarHBondContact O-CG 3.46Å; P512-M516 PolarHBondContact O-N 2.92Å; L513-M516 PolarHBondContact O-N 2.97Å; Y514-M516 VanDerWaalsContact C-N 3.33Å; Y514-M516 PolarHBondContact O-N 3.15Å; M516-L518 VanDerWaalsContact C-N 3.32Å; M516-L518 PolarHBondContact O-N 3.31Å; M516-R519 PolarHBondContact O-N 3.04Å; M516-R519 VanDerWaalsContact O-N 3.08Å; M516-C520 PolarHBondContact O-N 3.22Å; M516-C520 PolarHBondContact O-SG 3.19Å; M516-L600 HydrophobicContact CE-CD2 4.08Å
517	V	73.2	Confident	71	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.006	35%	0.349	C	S	.	.	H	α-helix	trans	-58.8	-46.6	176.9	176.4	0	0	0	0	110.4	F311 L314 L513 Y514 M515 R519 C520	F311-V517 HydrophobicContact CD2-CG1 4.13Å; F311-V517 HydrophobicContact CE2-CG1 3.75Å; L314-V517 HydrophobicContact CD2-CB 4.09Å; L314-V517 HydrophobicContact CD2-CG2 3.37Å; L314-V517 VanDerWaalsContact CD2-N 3.34Å; L314-V517 HydrophobicContact CG-CG2 3.81Å; L513-V517 PolarHBondContact O-N 3.4Å; Y514-V517 WeakPolarHBondContact O-CB 3.45Å; Y514-V517 PolarHBondContact O-N 3.15Å; M515-V517 VanDerWaalsContact C-N 3.32Å; V517-R519 PolarHBondContact O-N 2.94Å; V517-C520 PolarHBondContact O-N 3.34Å
518	L	68.9	Low	71.4	Confident	45 Å²	45	70 Å²	70	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-64.3	-22.4	179.1	-62.2	179.6	0	0	0	113.9	Y514 M515 M516 K526 I530	Y514-L518 HydrophobicContact CD1-CD1 4.3Å; Y514-L518 HydrophobicContact CE1-CD1 3.91Å; Y514-L518 HydrophobicContact CE1-CG 4.43Å; Y514-L518 PolarHBondContact O-N 3.46Å; M515-L518 PolarHBondContact O-N 3.05Å; M515-L518 HydrophobicContact SD-CD1 4.11Å; M516-L518 VanDerWaalsContact C-N 3.32Å; M516-L518 PolarHBondContact O-N 3.31Å; L518-K526 WeakPolarHBondContact O-CE 3.33Å; L518-I530 HydrophobicContact CD2-CD1 3.58Å; L518-I530 HydrophobicContact CD2-CG1 3.79Å
519	R	75.4	Confident	72	Confident	199 Å²	199	67.8 Å²	67.8	75%	0.751	34%	0.342	S	S	*	.	H	α-helix	trans	-92.1	-19.6	178.8	-70.7	-179.2	179.4	-173	-0.3	113.3	M515 M516 V517	M515-R519 WeakPolarHBondContact O-CG 3.45Å; M515-R519 PolarHBondContact O-N 3.46Å; M516-R519 PolarHBondContact O-N 3.04Å; M516-R519 VanDerWaalsContact O-N 3.08Å; V517-R519 PolarHBondContact O-N 2.94Å
520	C	75	Confident	72.6	Confident	40 Å²	40	68.5 Å²	68.5	27%	0.27	34%	0.344	S	S	.	.	S	Bend	trans	-87.5	-3.9	-179.5	-70.2	0	0	0	0	113.8	N308 M516 V517	N308-C520 PolarHBondContact ND2-O 3.27Å; M516-C520 PolarHBondContact O-N 3.22Å; M516-C520 PolarHBondContact O-SG 3.19Å; V517-C520 PolarHBondContact O-N 3.34Å
521	V	79.1	Confident	73	Confident	12 Å²	12	67.3 Å²	67.3	7%	0.073	35%	0.35	C	S	.	.	S	Bend	trans	-124.6	141.4	-174.9	-177	0	0	0	0	109.6	L305 F311 E525 A529	L305-V521 HydrophobicContact CD1-CG1 4.19Å; L305-V521 HydrophobicContact CD1-CG2 4.29Å; F311-V521 HydrophobicContact CD2-CG2 3.8Å; F311-V521 HydrophobicContact CE2-CG2 4.3Å; V521-E525 HydrophobicContact CG1-CB 3.5Å; V521-E525 VanDerWaalsContact CG1-CB 3.5Å; V521-A529 HydrophobicContact CB-CB 4.31Å; V521-A529 HydrophobicContact CG1-CB 3.88Å; V521-A529 HydrophobicContact CG2-CB 3.9Å
522	S	76.1	Confident	73.8	Confident	59 Å²	59	64.8 Å²	64.8	41%	0.413	34%	0.336	S	S	.	.			trans	-60.8	154.7	176.5	57.5	0	0	0	0	111.2	D524 E525 K526	S522-D524 PolarHBondContact O-N 3.38Å; S522-E525 PolarHBondContact O-N 3.41Å; S522-E525 VanDerWaalsContact O-N 3.15Å; S522-E525 WeakPolarHBondContact OG-CG 3.38Å; S522-K526 WeakPolarHBondContact O-CG 3.08Å; S522-K526 PolarHBondContact O-N 3.44Å
523	F	66.9	Low	74.7	Confident	161 Å²	161	62 Å²	62	71%	0.706	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-54.9	-41.2	-176.2	-176	-92.5	0	0	0	112.6	E525 K526	F523-E525 VanDerWaalsContact C-N 3.28Å; F523-E525 PolarHBondContact O-N 2.66Å; F523-K526 HydrophobicContact CD2-CD 4.38Å; F523-K526 PolarHBondContact O-N 2.93Å
524	D	67.4	Low	75.4	Confident	149 Å²	149	66.1 Å²	66.1	80%	0.797	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-70.2	-21.6	-175.9	-50.1	-36.8	0	0	0	113.3	S522	S522-D524 PolarHBondContact O-N 3.38Å
525	E	70.6	Confident	76.2	Confident	64 Å²	64	64 Å²	64	30%	0.299	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-103.9	-3.1	-177.3	-64.5	-175.9	156.6	0	0	113.5	H304 V521 S522 F523 S527 F528 A529	H304-E525 IonicContact CD2-OE1 3.53Å; H304-E525 PolarHBondContact CD2-OE1 2.84Å; H304-E525 IonicContact NE2-OE1 3.25Å; V521-E525 HydrophobicContact CG1-CB 3.5Å; V521-E525 VanDerWaalsContact CG1-CB 3.5Å; S522-E525 PolarHBondContact O-N 3.41Å; S522-E525 VanDerWaalsContact O-N 3.15Å; S522-E525 WeakPolarHBondContact OG-CG 3.38Å; F523-E525 VanDerWaalsContact C-N 3.28Å; F523-E525 PolarHBondContact O-N 2.66Å; E525-S527 PolarHBondContact O-N 3.1Å; E525-F528 PolarHBondContact O-N 2.94Å; E525-A529 WeakPolarHBondContact O-CB 3.04Å; E525-A529 PolarHBondContact O-N 3Å
526	K	72.1	Confident	77.1	Confident	66 Å²	66	60.4 Å²	60.4	29%	0.287	31%	0.312	S	S	.	.	H	α-helix	trans	-57.5	-50.3	-172.9	-80	172.2	-173.2	170.9	0	113.6	L518 S522 F523 F528 A529 I530	L518-K526 WeakPolarHBondContact O-CE 3.33Å; S522-K526 WeakPolarHBondContact O-CG 3.08Å; S522-K526 PolarHBondContact O-N 3.44Å; F523-K526 HydrophobicContact CD2-CD 4.38Å; F523-K526 PolarHBondContact O-N 2.93Å; K526-F528 VanDerWaalsContact C-N 3.31Å; K526-F528 PolarHBondContact O-N 3.34Å; K526-A529 PolarHBondContact O-N 2.79Å; K526-I530 VanDerWaalsContact O-CG1 3.25Å; K526-I530 WeakPolarHBondContact O-CG1 3.27Å; K526-I530 PolarHBondContact O-N 3.31Å
527	S	70.7	Confident	78	Confident	104 Å²	104	57 Å²	57	73%	0.727	30%	0.295	S	S	*	.	H	α-helix	trans	-63.6	-39.9	-177.3	-59.2	0	0	0	0	111.6	E525 G531	E525-S527 PolarHBondContact O-N 3.1Å; S527-G531 PolarHBondContact O-N 3.17Å; S527-G531 VanDerWaalsContact O-N 3.09Å
528	F	77.4	Confident	78.9	Confident	53 Å²	53	59.1 Å²	59.1	23%	0.232	30%	0.303	C	S	.	.	H	α-helix	trans	-65.8	-42.4	174.5	-175.5	-104.3	0	0	0	111.5	F298 M301 L305 E525 K526 G531 L532	F298-F528 AromaticContact CD2-CE2 3.88Å; F298-F528 HydrophobicContact CD2-CE2 3.88Å; F298-F528 HydrophobicContact CD2-CZ 4.29Å; F298-F528 AromaticContact CE2-CE2 3.77Å; F298-F528 HydrophobicContact CE2-CE2 3.77Å; F298-F528 HydrophobicContact CE2-CZ 4.15Å; M301-F528 HydrophobicContact CB-CD1 4.35Å; M301-F528 HydrophobicContact CB-CE1 3.64Å; M301-F528 HydrophobicContact CB-CE2 4.34Å; M301-F528 HydrophobicContact CB-CZ 3.63Å; M301-F528 HydrophobicContact CE-CD2 4.31Å; M301-F528 HydrophobicContact CE-CE2 3.93Å; M301-F528 HydrophobicContact CE-CZ 4.31Å; L305-F528 HydrophobicContact CD2-CD1 3.99Å; L305-F528 HydrophobicContact CD2-CE1 4.31Å; E525-F528 PolarHBondContact O-N 2.94Å; K526-F528 VanDerWaalsContact C-N 3.31Å; K526-F528 PolarHBondContact O-N 3.34Å; F528-G531 PolarHBondContact O-N 3.49Å; F528-L532 WeakPolarHBondContact O-CB 3.36Å; F528-L532 PolarHBondContact O-N 3.38Å
529	A	79.4	Confident	80	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-39.2	178.4	0	0	0	0	0	113.7	L305 F311 V521 E525 K526 L532 Q533	L305-A529 HydrophobicContact CD1-CB 4.38Å; L305-A529 VanDerWaalsContact CD2-CA 3.41Å; L305-A529 HydrophobicContact CD2-CB 3.47Å; L305-A529 VanDerWaalsContact CD2-CB 3.47Å; F311-A529 HydrophobicContact CE2-CB 3.88Å; F311-A529 HydrophobicContact CZ-CB 4.22Å; V521-A529 HydrophobicContact CB-CB 4.31Å; V521-A529 HydrophobicContact CG1-CB 3.88Å; V521-A529 HydrophobicContact CG2-CB 3.9Å; E525-A529 WeakPolarHBondContact O-CB 3.04Å; E525-A529 PolarHBondContact O-N 3Å; K526-A529 PolarHBondContact O-N 2.79Å; A529-L532 PolarHBondContact O-N 2.98Å; A529-Q533 VanDerWaalsContact O-CB 3.29Å; A529-Q533 WeakPolarHBondContact O-CB 3.38Å; A529-Q533 PolarHBondContact O-N 3.25Å
530	I	79.4	Confident	80.9	Confident	41 Å²	41	54 Å²	54	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-45.3	173	-65.3	162.4	0	0	0	109.9	L518 K526 L532 Q533 F534	L518-I530 HydrophobicContact CD2-CD1 3.58Å; L518-I530 HydrophobicContact CD2-CG1 3.79Å; K526-I530 VanDerWaalsContact O-CG1 3.25Å; K526-I530 WeakPolarHBondContact O-CG1 3.27Å; K526-I530 PolarHBondContact O-N 3.31Å; I530-L532 VanDerWaalsContact C-N 3.35Å; I530-L532 PolarHBondContact O-N 2.92Å; I530-Q533 WeakPolarHBondContact O-CB 3.39Å; I530-Q533 PolarHBondContact O-N 2.81Å; I530-F534 HydrophobicContact CG2-CD2 3.79Å; I530-F534 HydrophobicContact CG2-CE2 3.58Å; I530-F534 WeakPolarHBondContact O-CD2 3.35Å; I530-F534 PolarHBondContact O-N 3.25Å
531	G	79.9	Confident	81.8	Confident	42 Å²	42	52 Å²	52	43%	0.433	28%	0.279	S	S	.	.	H	α-helix	trans	-58.6	-45.3	175.5	0	0	0	0	0	112.5	S527 F528 F534 L535	S527-G531 PolarHBondContact O-N 3.17Å; S527-G531 VanDerWaalsContact O-N 3.09Å; F528-G531 PolarHBondContact O-N 3.49Å; G531-F534 PolarHBondContact O-N 2.99Å; G531-L535 WeakPolarHBondContact O-CB 3.48Å; G531-L535 PolarHBondContact O-N 3.44Å
532	L	84.9	Confident	82.5	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-42	177	179.4	56.4	0	0	0	112.3	F302 L305 M306 F311 F528 A529 I530 F534 L535 L536	F302-L532 HydrophobicContact CD2-CD1 3.35Å; F302-L532 HydrophobicContact CD2-CD2 4.32Å; F302-L532 HydrophobicContact CD2-CG 4.49Å; F302-L532 HydrophobicContact CE2-CD1 3.2Å; F302-L532 HydrophobicContact CG-CD1 4.48Å; F302-L532 HydrophobicContact CZ-CD1 4.23Å; L305-L532 HydrophobicContact CB-CD2 4.07Å; L305-L532 HydrophobicContact CD2-CB 4.34Å; L305-L532 HydrophobicContact CD2-CD2 3.66Å; L305-L532 HydrophobicContact CG-CD2 4.18Å; M306-L532 HydrophobicContact CE-CD2 4.05Å; M306-L532 HydrophobicContact CG-CD2 4.25Å; M306-L532 HydrophobicContact SD-CD2 4.48Å; F311-L532 HydrophobicContact CE1-CD2 3.85Å; F311-L532 HydrophobicContact CE1-CG 4.28Å; F311-L532 HydrophobicContact CZ-CD2 4.34Å; F311-L532 HydrophobicContact CZ-CG 4.44Å; F528-L532 WeakPolarHBondContact O-CB 3.36Å; F528-L532 PolarHBondContact O-N 3.38Å; A529-L532 PolarHBondContact O-N 2.98Å; I530-L532 VanDerWaalsContact C-N 3.35Å; I530-L532 PolarHBondContact O-N 2.92Å; L532-F534 PolarHBondContact O-N 3.42Å; L532-L535 HydrophobicContact CD1-CD2 4.31Å; L532-L535 WeakPolarHBondContact O-CB 3.4Å; L532-L535 PolarHBondContact O-N 3.31Å; L532-L536 HydrophobicContact CD1-CD1 3.95Å; L532-L536 HydrophobicContact CD1-CG 3.96Å; L532-L536 HydrophobicContact CD2-CD1 4.49Å; L532-L536 HydrophobicContact CG-CD1 3.86Å; L532-L536 HydrophobicContact CG-CG 4.34Å; L532-L536 WeakPolarHBondContact O-CB 3.46Å; L532-L536 WeakPolarHBondContact O-CG 3.48Å; L532-L536 PolarHBondContact O-N 3.2Å
533	Q	86.9	Confident	83.4	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-56.2	-51.8	174.4	176.2	-170.1	4.4	0	0	110.3	V315 A529 I530 L535 L536 M537	V315-Q533 HydrophobicContact CG2-CB 4.37Å; V315-Q533 HydrophobicContact CG2-CG 4.29Å; A529-Q533 VanDerWaalsContact O-CB 3.29Å; A529-Q533 WeakPolarHBondContact O-CB 3.38Å; A529-Q533 PolarHBondContact O-N 3.25Å; I530-Q533 WeakPolarHBondContact O-CB 3.39Å; I530-Q533 PolarHBondContact O-N 2.81Å; Q533-L535 VanDerWaalsContact C-N 3.33Å; Q533-L535 PolarHBondContact O-N 3.26Å; Q533-L536 PolarHBondContact O-N 2.88Å; Q533-M537 HydrophobicContact CG-CG 4.42Å; Q533-M537 WeakPolarHBondContact O-CB 3.47Å; Q533-M537 WeakPolarHBondContact O-CG 3.43Å; Q533-M537 PolarHBondContact O-N 3.45Å
534	F	85.5	Confident	84.8	Confident	98 Å²	98	48.4 Å²	48.4	43%	0.43	26%	0.259	S	S	.	.	H	α-helix	trans	-61.5	-39.7	177.8	-79.5	-67.4	0	0	0	112.9	I530 G531 L532 M537 R538	I530-F534 HydrophobicContact CG2-CD2 3.79Å; I530-F534 HydrophobicContact CG2-CE2 3.58Å; I530-F534 WeakPolarHBondContact O-CD2 3.35Å; I530-F534 PolarHBondContact O-N 3.25Å; G531-F534 PolarHBondContact O-N 2.99Å; L532-F534 PolarHBondContact O-N 3.42Å; F534-M537 PolarHBondContact O-N 2.87Å; F534-R538 WeakPolarHBondContact O-CG 3.17Å; F534-R538 PolarHBondContact O-N 2.88Å
535	L	88.1	Confident	86.1	Confident	25 Å²	25	41.3 Å²	41.3	13%	0.131	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-50.5	175	178.9	66	0	0	0	111.2	C71 I74 G531 L532 Q533 M537 R538 V539	C71-L535 HydrophobicContact CB-CD1 4.01Å; I74-L535 HydrophobicContact CG2-CD1 3.93Å; G531-L535 WeakPolarHBondContact O-CB 3.48Å; G531-L535 PolarHBondContact O-N 3.44Å; L532-L535 HydrophobicContact CD1-CD2 4.31Å; L532-L535 WeakPolarHBondContact O-CB 3.4Å; L532-L535 PolarHBondContact O-N 3.31Å; Q533-L535 VanDerWaalsContact C-N 3.33Å; Q533-L535 PolarHBondContact O-N 3.26Å; L535-M537 VanDerWaalsContact C-N 3.34Å; L535-M537 PolarHBondContact O-N 3.41Å; L535-R538 PolarHBondContact O-N 3.49Å; L535-V539 HydrophobicContact CD1-CG2 4.38Å; L535-V539 WeakPolarHBondContact O-CG2 3.48Å; L535-V539 PolarHBondContact O-N 2.77Å
536	L	90.6	Very high	87.3	Confident	19 Å²	19	38.3 Å²	38.3	10%	0.099	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-39.2	179.5	-71	169.8	0	0	0	112.1	M306 V315 L532 Q533 R538 V539 L540	M306-L536 HydrophobicContact CE-CD1 3.6Å; M306-L536 HydrophobicContact SD-CD1 3.63Å; M306-L536 HydrophobicContact SD-CD2 4.37Å; V315-L536 HydrophobicContact CG1-CB 3.79Å; V315-L536 HydrophobicContact CG1-CD1 3.73Å; V315-L536 HydrophobicContact CG1-CG 4.43Å; L532-L536 HydrophobicContact CD1-CD1 3.95Å; L532-L536 HydrophobicContact CD1-CG 3.96Å; L532-L536 HydrophobicContact CD2-CD1 4.49Å; L532-L536 HydrophobicContact CG-CD1 3.86Å; L532-L536 HydrophobicContact CG-CG 4.34Å; L532-L536 WeakPolarHBondContact O-CB 3.46Å; L532-L536 WeakPolarHBondContact O-CG 3.48Å; L532-L536 PolarHBondContact O-N 3.2Å; Q533-L536 PolarHBondContact O-N 2.88Å; L536-R538 VanDerWaalsContact C-N 3.29Å; L536-R538 PolarHBondContact O-N 3.31Å; L536-V539 PolarHBondContact O-N 3.28Å; L536-L540 HydrophobicContact CD2-CD1 4.21Å; L536-L540 VanDerWaalsContact O-CB 3.27Å; L536-L540 WeakPolarHBondContact O-CB 3.36Å; L536-L540 WeakPolarHBondContact O-CG 3.29Å; L536-L540 PolarHBondContact O-N 2.89Å
537	M	90.4	Very high	88.4	Confident	10 Å²	10	35.8 Å²	35.8	5%	0.049	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-39.7	175.3	-70.2	-68.6	-67.3	0	0	111.7	Q318 C319 S322 Q533 F534 L535 A541 W542	Q318-M537 VanDerWaalsContact C-SD 3.57Å; Q318-M537 HydrophobicContact CB-CE 4.41Å; Q318-M537 HydrophobicContact CB-SD 3.88Å; Q318-M537 HydrophobicContact CG-CE 3.73Å; Q318-M537 HydrophobicContact CG-SD 3.77Å; C319-M537 HydrophobicContact CB-SD 4.24Å; C319-M537 PolarHBondContact N-SD 2.86Å; C319-M537 VanDerWaalsContact N-SD 3.4Å; S322-M537 WeakPolarHBondContact OG-CE 3.45Å; Q533-M537 HydrophobicContact CG-CG 4.42Å; Q533-M537 WeakPolarHBondContact O-CB 3.47Å; Q533-M537 WeakPolarHBondContact O-CG 3.43Å; Q533-M537 PolarHBondContact O-N 3.45Å; F534-M537 PolarHBondContact O-N 2.87Å; L535-M537 VanDerWaalsContact C-N 3.34Å; L535-M537 PolarHBondContact O-N 3.41Å; M537-A541 WeakPolarHBondContact O-CA 3.42Å; M537-A541 WeakPolarHBondContact O-CB 3.28Å; M537-A541 PolarHBondContact O-N 2.92Å; M537-W542 PolarHBondContact O-N 3.03Å; M537-W542 VanDerWaalsContact O-N 3.09Å
538	R	91.9	Very high	89.6	Confident	46 Å²	46	34.3 Å²	34.3	17%	0.174	18%	0.182	C	C	.	.	I	π-helix	trans	-67.9	-49.8	176	-73.2	179.6	165.3	155	-1.3	112.1	E67 N70 C71 F534 L535 L536 W542 L543	E67-R538 WeakPolarHBondContact OE2-CD 3.47Å; E67-R538 VanDerWaalsContact OE2-CG 3.26Å; E67-R538 WeakPolarHBondContact OE2-CG 3.32Å; E67-R538 IonicContact OE2-NE 3.76Å; E67-R538 PolarHBondContact OE2-NE 3.4Å; E67-R538 VanDerWaalsContact OE2-NE 3.1Å; N70-R538 VanDerWaalsContact ND2-CZ 3.31Å; N70-R538 PolarHBondContact ND2-NH1 2.74Å; N70-R538 PolarHBondContact ND2-NH2 3.15Å; N70-R538 VanDerWaalsContact ND2-NH2 3.14Å; N70-R538 PolarHBondContact OD1-NH1 3.08Å; C71-R538 VanDerWaalsContact SG-CB 3.59Å; F534-R538 WeakPolarHBondContact O-CG 3.17Å; F534-R538 PolarHBondContact O-N 2.88Å; L535-R538 PolarHBondContact O-N 3.49Å; L536-R538 VanDerWaalsContact C-N 3.29Å; L536-R538 PolarHBondContact O-N 3.31Å; R538-W542 PolarHBondContact O-N 3.45Å; R538-L543 WeakPolarHBondContact O-CB 3.33Å; R538-L543 PolarHBondContact O-N 3.18Å
539	V	93.1	Very high	90.5	Very high	60 Å²	60	31.8 Å²	31.8	36%	0.364	17%	0.171	S	C	.	.	I	π-helix	trans	-67.8	-42.8	-176.1	176.1	0	0	0	0	112.3	C71 L535 L536 P544	C71-V539 HydrophobicContact CB-CG2 4.13Å; C71-V539 WeakPolarHBondContact SG-CG2 3.46Å; L535-V539 HydrophobicContact CD1-CG2 4.38Å; L535-V539 WeakPolarHBondContact O-CG2 3.48Å; L535-V539 PolarHBondContact O-N 2.77Å; L536-V539 PolarHBondContact O-N 3.28Å; V539-P544 WeakPolarHBondContact O-CD 3.39Å
540	L	94.3	Very high	91.3	Very high	76 Å²	76	31.8 Å²	31.8	40%	0.398	17%	0.171	S	C	.	.	I	π-helix	trans	-96.7	-20.2	-171.2	-59.3	178.4	0	0	0	113.9	L316 C319 L536 P544	L316-L540 HydrophobicContact CD2-CD1 3.96Å; C319-L540 HydrophobicContact CB-CB 4.33Å; L536-L540 HydrophobicContact CD2-CD1 4.21Å; L536-L540 VanDerWaalsContact O-CB 3.27Å; L536-L540 WeakPolarHBondContact O-CB 3.36Å; L536-L540 WeakPolarHBondContact O-CG 3.29Å; L536-L540 PolarHBondContact O-N 2.89Å; L540-P544 VanDerWaalsContact O-CG 3.22Å; L540-P544 WeakPolarHBondContact O-CG 3.21Å
541	A	94.3	Very high	92	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.174	C	C	.	.	I	π-helix	trans	-116	-65.2	-179.9	0	0	0	0	0	112.6	C319 S323 M537 L543 P544 A545	C319-A541 HydrophobicContact CB-CB 4.33Å; C319-A541 WeakPolarHBondContact O-CB 3.38Å; S323-A541 WeakPolarHBondContact OG-CA 3.25Å; S323-A541 WeakPolarHBondContact OG-CB 3.41Å; M537-A541 WeakPolarHBondContact O-CA 3.42Å; M537-A541 WeakPolarHBondContact O-CB 3.28Å; M537-A541 PolarHBondContact O-N 2.92Å; A541-L543 PolarHBondContact O-N 3Å; A541-P544 WeakPolarHBondContact O-CD 3.09Å; A541-A545 WeakPolarHBondContact O-CB 3.3Å; A541-A545 PolarHBondContact O-N 3.23Å
542	W	93.5	Very high	92.7	Very high	68 Å²	68	30.5 Å²	30.5	26%	0.258	16%	0.158	S	C	.	.	I	π-helix	trans	-70.6	-30.6	-169.8	-71.4	85	0	0	0	114.3	E67 I325 A326 M537 R538 P546	E67-W542 HydrophobicContact CG-CB 4.11Å; I325-W542 HydrophobicContact CG2-CH2 4.37Å; I325-W542 HydrophobicContact CG2-CZ2 4.44Å; A326-W542 HydrophobicContact CB-CD2 4.07Å; A326-W542 HydrophobicContact CB-CE3 3.91Å; A326-W542 HydrophobicContact CB-CZ3 4.3Å; M537-W542 PolarHBondContact O-N 3.03Å; M537-W542 VanDerWaalsContact O-N 3.09Å; R538-W542 PolarHBondContact O-N 3.45Å; W542-P546 WeakPolarHBondContact O-CD 3.48Å
543	L	94.1	Very high	93.1	Very high	47 Å²	47	30.2 Å²	30.2	25%	0.246	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-55.9	176.7	-178.8	67.6	0	0	0	112.7	S64 E67 V68 R538 A541	S64-L543 WeakPolarHBondContact CB-O 3.37Å; S64-L543 WeakPolarHBondContact O-CD1 3.39Å; S64-L543 PolarHBondContact OG-O 3.1Å; E67-L543 HydrophobicContact CB-CB 4.4Å; E67-L543 HydrophobicContact CB-CD1 4.36Å; V68-L543 HydrophobicContact CG2-CD1 3.39Å; V68-L543 HydrophobicContact CG2-CD2 4.22Å; V68-L543 HydrophobicContact CG2-CG 4.46Å; R538-L543 WeakPolarHBondContact O-CB 3.33Å; R538-L543 PolarHBondContact O-N 3.18Å; A541-L543 PolarHBondContact O-N 3Å
544	P	95.6	Very high	93.4	Very high	41 Å²	41	30.8 Å²	30.8	27%	0.266	16%	0.16	S	C	.	.	H	α-helix	trans	-81.4	-29.5	-175.7	30.2	-37.2	0	0	0	114	V539 L540 A541 A547 L548	V539-P544 WeakPolarHBondContact O-CD 3.39Å; L540-P544 VanDerWaalsContact O-CG 3.22Å; L540-P544 WeakPolarHBondContact O-CG 3.21Å; A541-P544 WeakPolarHBondContact O-CD 3.09Å; P544-A547 PolarHBondContact O-N 3.32Å; P544-L548 HydrophobicContact CB-CD1 4.21Å; P544-L548 WeakPolarHBondContact O-CG 3.36Å; P544-L548 PolarHBondContact O-N 2.94Å
545	A	95.4	Very high	93.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-48.4	-171.3	0	0	0	0	0	113.1	A326 A541 A547 L548 F549	A326-A545 HydrophobicContact CB-CB 3.94Å; A541-A545 WeakPolarHBondContact O-CB 3.3Å; A541-A545 PolarHBondContact O-N 3.23Å; A545-A547 VanDerWaalsContact C-N 3.3Å; A545-A547 PolarHBondContact O-N 3.08Å; A545-L548 PolarHBondContact O-N 3.41Å; A545-L548 VanDerWaalsContact O-N 3.15Å; A545-F549 HydrophobicContact CB-CD2 4.45Å; A545-F549 VanDerWaalsContact O-CD2 3.28Å; A545-F549 WeakPolarHBondContact O-CD2 3.33Å; A545-F549 PolarHBondContact O-N 3.28Å
546	P	95.1	Very high	93.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57	-42.1	176.9	-27.3	38.4	0	0	0	112.8	G60 F331 W542 G550	G60-P546 WeakPolarHBondContact O-CB 3.38Å; F331-P546 VanDerWaalsContact CE2-O 3.25Å; F331-P546 WeakPolarHBondContact CE2-O 3.41Å; W542-P546 WeakPolarHBondContact O-CD 3.48Å; P546-G550 PolarHBondContact O-N 3.48Å
547	A	95.8	Very high	93.6	Very high	14 Å²	14	31.4 Å²	31.4	12%	0.116	17%	0.167	C	C	.	.	H	α-helix	trans	-64.2	-43.1	176.4	0	0	0	0	0	112.2	F57 P544 A545 G550 T551	F57-A547 HydrophobicContact CD2-CB 4.17Å; F57-A547 HydrophobicContact CE2-CB 4.02Å; P544-A547 PolarHBondContact O-N 3.32Å; A545-A547 VanDerWaalsContact C-N 3.3Å; A545-A547 PolarHBondContact O-N 3.08Å; A547-G550 CarbonylContact O-C 3.42Å; A547-G550 WeakPolarHBondContact O-CA 3.27Å; A547-G550 PolarHBondContact O-N 3.29Å; A547-T551 WeakPolarHBondContact O-CG2 3.48Å; A547-T551 PolarHBondContact O-N 2.96Å
548	L	96.6	Very high	93.1	Very high	73 Å²	73	32.9 Å²	32.9	38%	0.382	17%	0.174	S	C	.	.	H	α-helix	trans	-67.1	-39.4	178.4	-70.4	172.6	0	0	0	113.1	P544 A545 G550 T551 A552 Y589	P544-L548 HydrophobicContact CB-CD1 4.21Å; P544-L548 WeakPolarHBondContact O-CG 3.36Å; P544-L548 PolarHBondContact O-N 2.94Å; A545-L548 PolarHBondContact O-N 3.41Å; A545-L548 VanDerWaalsContact O-N 3.15Å; L548-G550 VanDerWaalsContact C-N 3.3Å; L548-T551 PolarHBondContact O-N 2.92Å; L548-T551 PolarHBondContact O-OG1 2.96Å; L548-A552 WeakPolarHBondContact O-CB 3.46Å; L548-A552 PolarHBondContact O-N 3.39Å; L548-Y589 WeakPolarHBondContact CD1-OH 3.26Å
549	F	96.2	Very high	92.3	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-37.9	171.2	-85	-89.9	0	0	0	110.8	F331 A545 A552 I553 Y582 L585 Q586 Y589	F331-F549 HydrophobicContact CD2-CB 3.89Å; F331-F549 HydrophobicContact CE2-CB 4.33Å; A545-F549 HydrophobicContact CB-CD2 4.45Å; A545-F549 VanDerWaalsContact O-CD2 3.28Å; A545-F549 WeakPolarHBondContact O-CD2 3.33Å; A545-F549 PolarHBondContact O-N 3.28Å; F549-A552 PolarHBondContact O-N 3.47Å; F549-I553 VanDerWaalsContact O-CD1 3.23Å; F549-I553 WeakPolarHBondContact O-CD1 3.38Å; F549-I553 WeakPolarHBondContact O-CG1 3.42Å; F549-I553 PolarHBondContact O-N 3.32Å; F549-Y582 AromaticContact CD1-CD2 3.62Å; F549-Y582 HydrophobicContact CD1-CD2 3.62Å; F549-Y582 AromaticContact CD1-CE2 3.42Å; F549-Y582 HydrophobicContact CD1-CE2 3.42Å; F549-Y582 VanDerWaalsContact CD1-CE2 3.42Å; F549-Y582 HydrophobicContact CE1-CD2 4.13Å; F549-Y582 AromaticContact CE1-CE2 3.98Å; F549-Y582 HydrophobicContact CE1-CE2 3.98Å; F549-Y582 HydrophobicContact CG-CE2 4.44Å; F549-L585 HydrophobicContact CD1-CD2 4.03Å; F549-L585 HydrophobicContact CD2-CD2 3.81Å; F549-L585 HydrophobicContact CE1-CB 4.38Å; F549-L585 HydrophobicContact CE1-CD2 4.02Å; F549-L585 HydrophobicContact CE1-CG 4.39Å; F549-L585 HydrophobicContact CE2-CD2 3.79Å; F549-L585 HydrophobicContact CE2-CG 4.21Å; F549-L585 HydrophobicContact CG-CD2 3.94Å; F549-L585 HydrophobicContact CZ-CB 4.38Å; F549-L585 HydrophobicContact CZ-CD2 3.89Å; F549-L585 HydrophobicContact CZ-CG 4.04Å; F549-Q586 HydrophobicContact CE1-CG 3.65Å; F549-Q586 HydrophobicContact CZ-CG 3.57Å; F549-Y589 HydrophobicContact CE2-CD2 4.41Å; F549-Y589 HydrophobicContact CE2-CE2 4.11Å
550	G	94.8	Very high	91.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55	-51.7	170.8	0	0	0	0	0	113.1	S56 P546 A547 L548 A552 I553 D554	S56-G550 WeakPolarHBondContact CB-O 3.48Å; S56-G550 VanDerWaalsContact O-CA 3.31Å; S56-G550 WeakPolarHBondContact O-CA 3.45Å; P546-G550 PolarHBondContact O-N 3.48Å; A547-G550 CarbonylContact O-C 3.42Å; A547-G550 WeakPolarHBondContact O-CA 3.27Å; A547-G550 PolarHBondContact O-N 3.29Å; L548-G550 VanDerWaalsContact C-N 3.3Å; G550-A552 VanDerWaalsContact C-N 3.35Å; G550-A552 PolarHBondContact O-N 2.9Å; G550-I553 WeakPolarHBondContact O-CB 3.42Å; G550-I553 PolarHBondContact O-N 3.36Å; G550-D554 PolarHBondContact O-N 2.74Å
551	T	95.1	Very high	90.6	Very high	43 Å²	43	35 Å²	35	26%	0.264	17%	0.173	S	C	.	.	H	α-helix	trans	-63.2	-40.8	177	60.6	0	0	0	0	111.9	F57 A547 L548 I553 D554 M555	F57-T551 HydrophobicContact CB-CG2 4.11Å; F57-T551 HydrophobicContact CD2-CG2 3.32Å; F57-T551 HydrophobicContact CE2-CG2 4Å; F57-T551 HydrophobicContact CG-CG2 3.98Å; A547-T551 WeakPolarHBondContact O-CG2 3.48Å; A547-T551 PolarHBondContact O-N 2.96Å; L548-T551 PolarHBondContact O-N 2.92Å; L548-T551 PolarHBondContact O-OG1 2.96Å; T551-I553 VanDerWaalsContact C-N 3.31Å; T551-I553 PolarHBondContact O-N 3.42Å; T551-D554 PolarHBondContact O-N 2.86Å; T551-M555 WeakPolarHBondContact O-CG 3.36Å; T551-M555 PolarHBondContact O-N 3.21Å
552	A	95.3	Very high	89.6	Confident	13 Å²	13	40 Å²	40	11%	0.107	20%	0.2	C	C	.	.	H	α-helix	trans	-60.9	-39.7	177.1	0	0	0	0	0	112.3	L548 F549 G550 R581 L585	L548-A552 WeakPolarHBondContact O-CB 3.46Å; L548-A552 PolarHBondContact O-N 3.39Å; F549-A552 PolarHBondContact O-N 3.47Å; G550-A552 VanDerWaalsContact C-N 3.35Å; G550-A552 PolarHBondContact O-N 2.9Å; A552-R581 HydrophobicContact CB-CB 4.45Å; A552-L585 HydrophobicContact CB-CD2 4.32Å
553	I	93.4	Very high	88.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.7	-54.3	171.6	-63.8	148.8	0	0	0	109.6	S56 F331 F549 G550 T551 M555 S556 Y573 F578 Y582	S56-I553 WeakPolarHBondContact OG-CG2 3.24Å; F331-I553 HydrophobicContact CB-CD1 3.84Å; F331-I553 HydrophobicContact CD1-CD1 3.43Å; F331-I553 VanDerWaalsContact CD1-CD1 3.43Å; F331-I553 HydrophobicContact CD2-CD1 3.85Å; F331-I553 HydrophobicContact CE1-CD1 3.84Å; F331-I553 HydrophobicContact CE2-CD1 4.25Å; F331-I553 HydrophobicContact CG-CD1 3.41Å; F331-I553 VanDerWaalsContact CG-CD1 3.41Å; F331-I553 HydrophobicContact CZ-CD1 4.23Å; F549-I553 VanDerWaalsContact O-CD1 3.23Å; F549-I553 WeakPolarHBondContact O-CD1 3.38Å; F549-I553 WeakPolarHBondContact O-CG1 3.42Å; F549-I553 PolarHBondContact O-N 3.32Å; G550-I553 WeakPolarHBondContact O-CB 3.42Å; G550-I553 PolarHBondContact O-N 3.36Å; T551-I553 VanDerWaalsContact C-N 3.31Å; T551-I553 PolarHBondContact O-N 3.42Å; I553-M555 VanDerWaalsContact C-N 3.33Å; I553-M555 PolarHBondContact O-N 2.98Å; I553-S556 WeakPolarHBondContact O-CB 3.41Å; I553-S556 PolarHBondContact O-N 3.12Å; I553-S556 PolarHBondContact O-OG 3.24Å; I553-Y573 HydrophobicContact CG2-CD1 4.38Å; I553-Y573 HydrophobicContact CG2-CE1 3.58Å; I553-Y573 WeakPolarHBondContact O-CE1 3.47Å; I553-F578 HydrophobicContact CB-CD2 4.5Å; I553-F578 HydrophobicContact CB-CE2 3.96Å; I553-F578 HydrophobicContact CG1-CD2 4.44Å; I553-F578 HydrophobicContact CG1-CE2 3.52Å; I553-F578 HydrophobicContact CG1-CZ 4.27Å; I553-F578 HydrophobicContact CG2-CD2 4.29Å; I553-F578 HydrophobicContact CG2-CE2 3.79Å; I553-Y582 HydrophobicContact CG1-CD2 4.42Å
554	D	93.2	Very high	87.9	Confident	14 Å²	14	37.2 Å²	37.2	8%	0.075	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-35.7	-173.5	-76	-15.2	0	0	0	113.3	N55 S56 F57 G550 T551 S556 C557 W560	N55-D554 WeakPolarHBondContact CB-OD2 3.35Å; S56-D554 WeakPolarHBondContact CB-OD1 3.47Å; S56-D554 VanDerWaalsContact N-CG 3.31Å; S56-D554 PolarHBondContact N-OD1 3.22Å; S56-D554 PolarHBondContact N-OD2 3.05Å; S56-D554 PolarHBondContact OG-OD1 2.92Å; F57-D554 PolarHBondContact N-OD2 3.48Å; G550-D554 PolarHBondContact O-N 2.74Å; T551-D554 PolarHBondContact O-N 2.86Å; D554-S556 PolarHBondContact O-N 3.4Å; D554-C557 WeakPolarHBondContact O-CB 3.34Å; D554-C557 PolarHBondContact O-N 3.05Å; D554-W560 HydrophobicContact CB-CH2 3.73Å; D554-W560 HydrophobicContact CB-CZ2 4.06Å; D554-W560 WeakPolarHBondContact O-CZ2 3.26Å
555	M	91.3	Very high	86.8	Confident	134 Å²	134	38.6 Å²	38.6	66%	0.66	22%	0.215	S	C	*	.	H	α-helix	trans	-62.5	-24.9	176.1	-72.6	-176.1	175.6	0	0	112.7	T551 I553 R581	T551-M555 WeakPolarHBondContact O-CG 3.36Å; T551-M555 PolarHBondContact O-N 3.21Å; I553-M555 VanDerWaalsContact C-N 3.33Å; I553-M555 PolarHBondContact O-N 2.98Å; M555-R581 PolarHBondContact O-NH1 3.32Å
556	S	90.1	Very high	86	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.021	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-0.8	176.9	70.7	0	0	0	0	113.3	I553 D554 I558 Y573 D574 F578	I553-S556 WeakPolarHBondContact O-CB 3.41Å; I553-S556 PolarHBondContact O-N 3.12Å; I553-S556 PolarHBondContact O-OG 3.24Å; D554-S556 PolarHBondContact O-N 3.4Å; S556-I558 PolarHBondContact O-N 3.43Å; S556-Y573 WeakPolarHBondContact OG-CD1 3.49Å; S556-D574 PolarHBondContact O-N 3.35Å; S556-F578 WeakPolarHBondContact OG-CB 3.17Å; S556-F578 WeakPolarHBondContact OG-CD2 3.46Å
557	C	86.8	Confident	85.3	Confident	18 Å²	18	52.5 Å²	52.5	12%	0.122	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	128	178.3	-174	0	0	0	0	111.6	D554 W559 W560 C570 Y573	D554-C557 WeakPolarHBondContact O-CB 3.34Å; D554-C557 PolarHBondContact O-N 3.05Å; C557-W559 PolarHBondContact SG-O 3.21Å; C557-W559 VanDerWaalsContact SG-O 3.35Å; C557-W560 HydrophobicContact CB-CD2 4.29Å; C557-W560 HydrophobicContact CB-CH2 4.36Å; C557-W560 HydrophobicContact CB-CZ2 3.6Å; C557-W560 VanDerWaalsContact SG-CE2 3.51Å; C557-C570 WeakPolarHBondContact CA-SG 3.33Å; C557-C570 HydrophobicContact CB-CB 3.74Å; C557-C570 WeakPolarHBondContact CB-SG 3.36Å; C557-C570 WeakPolarHBondContact SG-CB 3.18Å; C557-C570 CovalentContact SG-SG 2.01Å; C557-C570 PolarHBondContact SG-SG 3.02Å; C557-Y573 HydrophobicContact CB-CD1 4.29Å; C557-Y573 HydrophobicContact CB-CE1 4.23Å
558	I	79.9	Confident	84.7	Confident	40 Å²	40	52.6 Å²	52.6	21%	0.205	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-43.5	172.3	-61.8	-179.4	0	0	0	110	L404 S556 Y572 D574	L404-I558 HydrophobicContact CD2-CG2 4.02Å; S556-I558 PolarHBondContact O-N 3.43Å; I558-Y572 HydrophobicContact CB-CD1 4.13Å; I558-Y572 WeakPolarHBondContact CB-O 3.48Å; I558-Y572 HydrophobicContact CD1-CD1 3.75Å; I558-Y572 HydrophobicContact CD1-CE1 3.76Å; I558-Y572 HydrophobicContact CG1-CD1 4.37Å; I558-Y572 HydrophobicContact CG2-CD1 4.44Å; I558-Y572 PolarHBondContact N-O 3.29Å; I558-D574 HydrophobicContact CD1-CB 3.68Å; I558-D574 HydrophobicContact CG1-CB 3.82Å
559	W	73.9	Confident	84	Confident	92 Å²	92	49.9 Å²	49.9	35%	0.348	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	112.7	-172.8	-163.4	35.1	0	0	0	112.1	C557 C570 E571 Y572	C557-W559 PolarHBondContact SG-O 3.21Å; C557-W559 VanDerWaalsContact SG-O 3.35Å; W559-C570 PolarHBondContact O-SG 3.45Å; W559-E571 HydrophobicContact CE3-CB 4.07Å; W559-E571 HydrophobicContact CE3-CG 4.29Å; W559-E571 HydrophobicContact CZ3-CG 4.42Å; W559-E571 PolarHBondContact O-N 3.16Å; W559-Y572 PolarHBondContact N-O 3.47Å
560	W	78.2	Confident	83.4	Confident	47 Å²	47	50 Å²	50	18%	0.178	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	133.2	174.8	-68.8	94.7	0	0	0	109.8	N55 D554 C557 N562 K567 F568 C570	N55-W560 HydrophobicContact CB-CH2 4.15Å; N55-W560 HydrophobicContact CB-CZ3 3.85Å; D554-W560 HydrophobicContact CB-CH2 3.73Å; D554-W560 HydrophobicContact CB-CZ2 4.06Å; D554-W560 WeakPolarHBondContact O-CZ2 3.26Å; C557-W560 HydrophobicContact CB-CD2 4.29Å; C557-W560 HydrophobicContact CB-CH2 4.36Å; C557-W560 HydrophobicContact CB-CZ2 3.6Å; C557-W560 VanDerWaalsContact SG-CE2 3.51Å; W560-N562 PolarHBondContact O-N 3.4Å; W560-K567 HydrophobicContact CB-CG 4.42Å; W560-K567 HydrophobicContact CD2-CB 4.27Å; W560-K567 HydrophobicContact CD2-CD 4.17Å; W560-K567 HydrophobicContact CD2-CG 4.4Å; W560-K567 HydrophobicContact CE3-CB 4.03Å; W560-K567 HydrophobicContact CG-CD 4.25Å; W560-K567 HydrophobicContact CG-CG 4.3Å; W560-F568 WeakPolarHBondContact CZ3-O 2.96Å; W560-C570 HydrophobicContact CE3-CB 4.34Å; W560-C570 HydrophobicContact CZ3-CB 4.31Å
561	K	74	Confident	82.3	Confident	89 Å²	89	54.8 Å²	54.8	39%	0.387	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	123.9	160.1	-170.5	172.3	-176.2	175.1	0	107	F568 S569	K561-F568 HydrophobicContact CB-CB 4.07Å; K561-F568 HydrophobicContact CG-CB 4.39Å; K561-F568 WeakPolarHBondContact O-CB 3.39Å; K561-F568 PolarHBondContact O-N 3.02Å; K561-S569 WeakPolarHBondContact CB-O 2.86Å; K561-S569 PolarHBondContact N-O 2Å; K561-S569 VanDerWaalsContact N-O 3.09Å
562	N	72.5	Confident	81.4	Confident	104 Å²	104	55.2 Å²	55.2	56%	0.556	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.7	177.9	-71.7	-22.5	0	0	0	108.9	W560 R566	W560-N562 PolarHBondContact O-N 3.4Å; N562-R566 WeakPolarHBondContact CA-O 3.44Å
563	V	74.8	Confident	80.8	Confident	9 Å²	9	55 Å²	55	6%	0.055	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	116.9	174.2	-175.9	0	0	0	0	106.3	D143 L147 G565 R566 F568	D143-V563 HydrophobicContact CB-CG1 3.57Å; L147-V563 HydrophobicContact CD1-CB 3.86Å; L147-V563 HydrophobicContact CD1-CG1 3.62Å; L147-V563 WeakPolarHBondContact CD1-O 3.48Å; V563-G565 VanDerWaalsContact C-N 3.35Å; V563-G565 PolarHBondContact O-N 2.95Å; V563-R566 PolarHBondContact N-O 2.77Å; V563-R566 PolarHBondContact O-N 3.48Å; V563-F568 HydrophobicContact CB-CD2 3.94Å; V563-F568 HydrophobicContact CB-CE2 3.72Å; V563-F568 HydrophobicContact CB-CZ 4.1Å; V563-F568 HydrophobicContact CG2-CD1 4.26Å; V563-F568 HydrophobicContact CG2-CD2 4.02Å; V563-F568 HydrophobicContact CG2-CE1 4.36Å; V563-F568 HydrophobicContact CG2-CE2 4.14Å; V563-F568 HydrophobicContact CG2-CG 4.11Å; V563-F568 HydrophobicContact CG2-CZ 4.31Å
564	C	77.8	Confident	80.3	Confident	47 Å²	47	56.8 Å²	56.8	32%	0.318	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	49.6	-178.9	-56.7	0	0	0	0	114.5	C139 D143 L147 R566	C139-C564 WeakPolarHBondContact CA-SG 3.19Å; C139-C564 HydrophobicContact CB-CB 3.64Å; C139-C564 WeakPolarHBondContact CB-SG 3Å; C139-C564 WeakPolarHBondContact SG-CB 3.44Å; C139-C564 CovalentContact SG-SG 1.99Å; C139-C564 PolarHBondContact SG-SG 2.85Å; D143-C564 WeakPolarHBondContact CB-SG 3.35Å; L147-C564 HydrophobicContact CD1-CB 4.39Å; C564-R566 PolarHBondContact O-N 3.38Å; C564-R566 VanDerWaalsContact O-N 3.13Å
565	G	72.8	Confident	79.8	Confident	70 Å²	70	57.3 Å²	57.3	72%	0.722	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	-3.5	179.2	0	0	0	0	0	115.5	V563	V563-G565 VanDerWaalsContact C-N 3.35Å; V563-G565 PolarHBondContact O-N 2.95Å
566	R	78.4	Confident	79.4	Confident	152 Å²	152	53.7 Å²	53.7	57%	0.574	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	139.9	175.5	-63.2	-161.9	-176.3	-177.6	-2.5	111.9	L147 N562 V563 C564 F568	L147-R566 HydrophobicContact CD2-CG 4.1Å; N562-R566 WeakPolarHBondContact CA-O 3.44Å; V563-R566 PolarHBondContact N-O 2.77Å; V563-R566 PolarHBondContact O-N 3.48Å; C564-R566 PolarHBondContact O-N 3.38Å; C564-R566 VanDerWaalsContact O-N 3.13Å; R566-F568 HydrophobicContact CB-CE2 4.37Å
567	K	80.5	Confident	79.2	Confident	140 Å²	140	56.9 Å²	56.9	61%	0.609	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	125.4	175.3	-64.3	179	-178.3	175.9	0	110.4	W560	W560-K567 HydrophobicContact CB-CG 4.42Å; W560-K567 HydrophobicContact CD2-CB 4.27Å; W560-K567 HydrophobicContact CD2-CD 4.17Å; W560-K567 HydrophobicContact CD2-CG 4.4Å; W560-K567 HydrophobicContact CE3-CB 4.03Å; W560-K567 HydrophobicContact CG-CD 4.25Å; W560-K567 HydrophobicContact CG-CG 4.3Å
568	F	83.6	Confident	79.3	Confident	17 Å²	17	56.1 Å²	56.1	8%	0.075	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-145.3	175.9	-89.1	-121.4	0	0	0	109.9	G53 L147 T150 W560 K561 V563 R566	G53-F568 CarbonylContact O-C 3.47Å; G53-F568 VanDerWaalsContact O-CA 3.24Å; G53-F568 WeakPolarHBondContact O-CA 3.45Å; G53-F568 WeakPolarHBondContact O-CB 2.91Å; L147-F568 HydrophobicContact CD1-CE2 3.48Å; L147-F568 VanDerWaalsContact CD1-CE2 3.48Å; L147-F568 HydrophobicContact CD1-CZ 3.62Å; L147-F568 HydrophobicContact CG-CE2 4.17Å; L147-F568 HydrophobicContact CG-CZ 4.19Å; T150-F568 HydrophobicContact CG2-CE1 4.28Å; T150-F568 WeakPolarHBondContact OG1-CE1 3.46Å; W560-F568 WeakPolarHBondContact CZ3-O 2.96Å; K561-F568 HydrophobicContact CB-CB 4.07Å; K561-F568 HydrophobicContact CG-CB 4.39Å; K561-F568 WeakPolarHBondContact O-CB 3.39Å; K561-F568 PolarHBondContact O-N 3.02Å; V563-F568 HydrophobicContact CB-CD2 3.94Å; V563-F568 HydrophobicContact CB-CE2 3.72Å; V563-F568 HydrophobicContact CB-CZ 4.1Å; V563-F568 HydrophobicContact CG2-CD1 4.26Å; V563-F568 HydrophobicContact CG2-CD2 4.02Å; V563-F568 HydrophobicContact CG2-CE1 4.36Å; V563-F568 HydrophobicContact CG2-CE2 4.14Å; V563-F568 HydrophobicContact CG2-CG 4.11Å; V563-F568 HydrophobicContact CG2-CZ 4.31Å; R566-F568 HydrophobicContact CB-CE2 4.37Å
569	S	82.4	Confident	79.6	Confident	16 Å²	16	55.5 Å²	55.5	11%	0.112	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	146.7	173.2	54.8	0	0	0	0	111.4	G53 K561	G53-S569 PolarHBondContact O-N 3.26Å; K561-S569 WeakPolarHBondContact CB-O 2.86Å; K561-S569 PolarHBondContact N-O 2Å; K561-S569 VanDerWaalsContact N-O 3.09Å
570	C	83.3	Confident	80.3	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.02	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.1	170	-173.5	0	0	0	0	110.6	C557 W559 W560 Y572 Y573	C557-C570 WeakPolarHBondContact CA-SG 3.33Å; C557-C570 HydrophobicContact CB-CB 3.74Å; C557-C570 WeakPolarHBondContact CB-SG 3.36Å; C557-C570 WeakPolarHBondContact SG-CB 3.18Å; C557-C570 CovalentContact SG-SG 2.01Å; C557-C570 PolarHBondContact SG-SG 3.02Å; W559-C570 PolarHBondContact O-SG 3.45Å; W560-C570 HydrophobicContact CE3-CB 4.34Å; W560-C570 HydrophobicContact CZ3-CB 4.31Å; C570-Y572 PolarHBondContact SG-O 3.18Å; C570-Y573 HydrophobicContact CB-CD1 4.42Å; C570-Y573 HydrophobicContact CB-CD2 4.43Å; C570-Y573 HydrophobicContact CB-CE1 3.72Å; C570-Y573 HydrophobicContact CB-CE2 3.73Å; C570-Y573 WeakPolarHBondContact CB-OH 3.32Å
571	E	72.3	Confident	80.9	Confident	99 Å²	99	56.1 Å²	56.1	46%	0.463	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-42.6	179.5	-161.2	65	-156.5	0	0	110.9	R338 W559	R338-E571 PolarHBondContact NH1-O 2.92Å; W559-E571 HydrophobicContact CE3-CB 4.07Å; W559-E571 HydrophobicContact CE3-CG 4.29Å; W559-E571 HydrophobicContact CZ3-CG 4.42Å; W559-E571 PolarHBondContact O-N 3.16Å
572	Y	75.3	Confident	81.7	Confident	53 Å²	53	51.9 Å²	51.9	21%	0.208	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	125.2	-174.6	-165.3	-103.8	0	0	0	112.1	I402 L404 I558 W559 C570	I402-Y572 WeakPolarHBondContact CB-OH 3.44Å; I402-Y572 PolarHBondContact O-OH 3.49Å; L404-Y572 HydrophobicContact CB-CE1 4.31Å; L404-Y572 HydrophobicContact CD2-CD1 4.22Å; L404-Y572 HydrophobicContact CD2-CE1 4.31Å; I558-Y572 HydrophobicContact CB-CD1 4.13Å; I558-Y572 WeakPolarHBondContact CB-O 3.48Å; I558-Y572 HydrophobicContact CD1-CD1 3.75Å; I558-Y572 HydrophobicContact CD1-CE1 3.76Å; I558-Y572 HydrophobicContact CG1-CD1 4.37Å; I558-Y572 HydrophobicContact CG2-CD1 4.44Å; I558-Y572 PolarHBondContact N-O 3.29Å; W559-Y572 PolarHBondContact N-O 3.47Å; C570-Y572 PolarHBondContact SG-O 3.18Å
573	Y	81.6	Confident	82.5	Confident	8 Å²	8	47 Å²	47	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	149.9	-179.5	-67.9	-88.2	0	0	0	111.1	S56 K334 R338 I553 S556 C557 C570 N575	S56-Y573 PolarHBondContact OG-OH 3.15Å; K334-Y573 PolarHBondContact NZ-OH 2.79Å; R338-Y573 HydrophobicContact CG-CD2 4.44Å; I553-Y573 HydrophobicContact CG2-CD1 4.38Å; I553-Y573 HydrophobicContact CG2-CE1 3.58Å; I553-Y573 WeakPolarHBondContact O-CE1 3.47Å; S556-Y573 WeakPolarHBondContact OG-CD1 3.49Å; C557-Y573 HydrophobicContact CB-CD1 4.29Å; C557-Y573 HydrophobicContact CB-CE1 4.23Å; C570-Y573 HydrophobicContact CB-CD1 4.42Å; C570-Y573 HydrophobicContact CB-CD2 4.43Å; C570-Y573 HydrophobicContact CB-CE1 3.72Å; C570-Y573 HydrophobicContact CB-CE2 3.73Å; C570-Y573 WeakPolarHBondContact CB-OH 3.32Å; Y573-N575 PolarHBondContact O-N 3.24Å
574	D	83.8	Confident	83.2	Confident	38 Å²	38	48 Å²	48	20%	0.203	26%	0.256	C	S	.	.			trans	-78.9	103.3	166.2	-171.7	-42.9	0	0	0	108.7	S556 I558 T576 L577 F578	S556-D574 PolarHBondContact O-N 3.35Å; I558-D574 HydrophobicContact CD1-CB 3.68Å; I558-D574 HydrophobicContact CG1-CB 3.82Å; D574-T576 PolarHBondContact O-N 2.64Å; D574-T576 VanDerWaalsContact O-N 3.15Å; D574-T576 WeakPolarHBondContact OD1-CB 3.29Å; D574-T576 PolarHBondContact OD1-N 3.28Å; D574-L577 HydrophobicContact CB-CB 4.05Å; D574-L577 HydrophobicContact CB-CD1 4.06Å; D574-L577 HydrophobicContact CB-CG 4.33Å; D574-L577 PolarHBondContact O-N 3.17Å; D574-L577 PolarHBondContact OD1-N 3.29Å; D574-F578 WeakPolarHBondContact O-CB 3.47Å; D574-F578 PolarHBondContact O-N 3.22Å
575	N	82	Confident	83.9	Confident	24 Å²	24	48.1 Å²	48.1	13%	0.128	25%	0.254	C	S	.	.	H	α-helix	trans	-59.3	-28.1	-176.2	-70.2	-6.7	0	0	0	113.4	Q339 Y573 R579	Q339-N575 PolarHBondContact OE1-O 2.62Å; Y573-N575 PolarHBondContact O-N 3.24Å; N575-R579 VanDerWaalsContact O-CB 3.27Å; N575-R579 WeakPolarHBondContact O-CB 3.43Å; N575-R579 PolarHBondContact O-N 3.19Å
576	T	83.4	Confident	84.7	Confident	59 Å²	59	44.8 Å²	44.8	36%	0.362	22%	0.22	S	C	.	.	H	α-helix	trans	-74.2	-49.3	179.8	-54.9	0	0	0	0	110.6	D574 F578 S580	D574-T576 PolarHBondContact O-N 2.64Å; D574-T576 VanDerWaalsContact O-N 3.15Å; D574-T576 WeakPolarHBondContact OD1-CB 3.29Å; D574-T576 PolarHBondContact OD1-N 3.28Å; T576-F578 VanDerWaalsContact C-N 3.32Å; T576-S580 WeakPolarHBondContact O-CB 3.44Å; T576-S580 PolarHBondContact O-N 3.19Å
577	L	86.6	Confident	85.2	Confident	70 Å²	70	38.1 Å²	38.1	37%	0.366	20%	0.196	S	C	.	.	H	α-helix	trans	-65.6	-38.3	175.1	-71.7	172.3	0	0	0	111.4	D574 S580 R581	D574-L577 HydrophobicContact CB-CB 4.05Å; D574-L577 HydrophobicContact CB-CD1 4.06Å; D574-L577 HydrophobicContact CB-CG 4.33Å; D574-L577 PolarHBondContact O-N 3.17Å; D574-L577 PolarHBondContact OD1-N 3.29Å; L577-S580 PolarHBondContact O-N 2.92Å; L577-R581 VanDerWaalsContact O-CB 3.31Å; L577-R581 WeakPolarHBondContact O-CB 3.24Å; L577-R581 VanDerWaalsContact O-CG 3.3Å; L577-R581 WeakPolarHBondContact O-CG 3.44Å; L577-R581 PolarHBondContact O-N 3.2Å
578	F	88.4	Confident	85.7	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.009	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-52.6	178.7	-179.8	-128.1	0	0	0	110.9	F335 R338 I553 S556 D574 T576 Y582	F335-F578 HydrophobicContact CB-CE1 4.48Å; F335-F578 HydrophobicContact CB-CZ 4.32Å; F335-F578 HydrophobicContact CD2-CD1 4.37Å; F335-F578 AromaticContact CD2-CE1 3.67Å; F335-F578 HydrophobicContact CD2-CE1 3.67Å; F335-F578 AromaticContact CD2-CZ 3.85Å; F335-F578 HydrophobicContact CD2-CZ 3.85Å; F335-F578 HydrophobicContact CE2-CE1 4.35Å; F335-F578 HydrophobicContact CG-CE1 4.45Å; R338-F578 HydrophobicContact CB-CD1 4.32Å; R338-F578 HydrophobicContact CB-CE1 3.9Å; I553-F578 HydrophobicContact CB-CD2 4.5Å; I553-F578 HydrophobicContact CB-CE2 3.96Å; I553-F578 HydrophobicContact CG1-CD2 4.44Å; I553-F578 HydrophobicContact CG1-CE2 3.52Å; I553-F578 HydrophobicContact CG1-CZ 4.27Å; I553-F578 HydrophobicContact CG2-CD2 4.29Å; I553-F578 HydrophobicContact CG2-CE2 3.79Å; S556-F578 WeakPolarHBondContact OG-CB 3.17Å; S556-F578 WeakPolarHBondContact OG-CD2 3.46Å; D574-F578 WeakPolarHBondContact O-CB 3.47Å; D574-F578 PolarHBondContact O-N 3.22Å; T576-F578 VanDerWaalsContact C-N 3.32Å; F578-Y582 WeakPolarHBondContact O-CB 3.12Å; F578-Y582 PolarHBondContact O-N 3.44Å
579	R	87.3	Confident	86.1	Confident	27 Å²	27	34.2 Å²	34.2	10%	0.102	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-50.3	175	177.3	-177.2	58.7	166.3	-4.1	112.6	F335 I395 F396 G398 N575 R581 Y582 L583	F335-R579 HydrophobicContact CE2-CB 4.45Å; I395-R579 WeakPolarHBondContact O-CD 3.34Å; I395-R579 PolarHBondContact O-NE 2.87Å; I395-R579 PolarHBondContact O-NH1 2.99Å; F396-R579 PolarHBondContact O-NH1 3.35Å; G398-R579 PolarHBondContact O-NH1 2.91Å; N575-R579 VanDerWaalsContact O-CB 3.27Å; N575-R579 WeakPolarHBondContact O-CB 3.43Å; N575-R579 PolarHBondContact O-N 3.19Å; R579-R581 PolarHBondContact O-N 3.06Å; R579-Y582 PolarHBondContact O-N 3.13Å; R579-L583 HydrophobicContact CG-CD1 3.84Å; R579-L583 HydrophobicContact CG-CG 4.48Å; R579-L583 WeakPolarHBondContact O-CB 3.17Å; R579-L583 PolarHBondContact O-N 3.35Å
580	S	87.1	Confident	86.2	Confident	63 Å²	63	34.3 Å²	34.3	44%	0.441	18%	0.184	S	C	.	.	H	α-helix	trans	-61.8	-43.7	-176	-176.4	0	0	0	0	111.8	T576 L577 G584	T576-S580 WeakPolarHBondContact O-CB 3.44Å; T576-S580 PolarHBondContact O-N 3.19Å; L577-S580 PolarHBondContact O-N 2.92Å; S580-G584 WeakPolarHBondContact O-CA 3.32Å; S580-G584 PolarHBondContact O-N 3.42Å
581	R	91.4	Very high	86.4	Confident	88 Å²	88	38.2 Å²	38.2	33%	0.332	20%	0.204	S	C	.	.	H	α-helix	trans	-72	-44.7	178.6	-69.1	175.3	177	163.9	-3.5	112.4	A552 M555 L577 R579 L585	A552-R581 HydrophobicContact CB-CB 4.45Å; M555-R581 PolarHBondContact O-NH1 3.32Å; L577-R581 VanDerWaalsContact O-CB 3.31Å; L577-R581 WeakPolarHBondContact O-CB 3.24Å; L577-R581 VanDerWaalsContact O-CG 3.3Å; L577-R581 WeakPolarHBondContact O-CG 3.44Å; L577-R581 PolarHBondContact O-N 3.2Å; R579-R581 PolarHBondContact O-N 3.06Å; R581-L585 VanDerWaalsContact O-CB 3.29Å; R581-L585 WeakPolarHBondContact O-CB 3.44Å; R581-L585 PolarHBondContact O-N 3.21Å
582	Y	91.3	Very high	87.3	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.1	-48.6	-178.4	-176.2	-97.9	0	0	0	112.4	F331 L332 F335 F549 I553 F578 R579	F331-Y582 HydrophobicContact CB-CE2 3.87Å; L332-Y582 PolarHBondContact N-OH 3.22Å; F335-Y582 HydrophobicContact CB-CD1 4.36Å; F335-Y582 HydrophobicContact CB-CE1 3.95Å; F335-Y582 HydrophobicContact CD1-CE1 4.41Å; F335-Y582 AromaticContact CD2-CD1 3.43Å; F335-Y582 HydrophobicContact CD2-CD1 3.43Å; F335-Y582 VanDerWaalsContact CD2-CD1 3.43Å; F335-Y582 AromaticContact CD2-CE1 3.86Å; F335-Y582 HydrophobicContact CD2-CE1 3.86Å; F335-Y582 AromaticContact CD2-CG 3.94Å; F335-Y582 HydrophobicContact CD2-CG 3.94Å; F335-Y582 AromaticContact CE2-CD1 3.82Å; F335-Y582 HydrophobicContact CE2-CD1 3.82Å; F335-Y582 HydrophobicContact CE2-CG 4.43Å; F335-Y582 AromaticContact CG-CD1 3.88Å; F335-Y582 HydrophobicContact CG-CD1 3.88Å; F335-Y582 AromaticContact CG-CE1 3.8Å; F335-Y582 HydrophobicContact CG-CE1 3.8Å; F549-Y582 AromaticContact CD1-CD2 3.62Å; F549-Y582 HydrophobicContact CD1-CD2 3.62Å; F549-Y582 AromaticContact CD1-CE2 3.42Å; F549-Y582 HydrophobicContact CD1-CE2 3.42Å; F549-Y582 VanDerWaalsContact CD1-CE2 3.42Å; F549-Y582 HydrophobicContact CE1-CD2 4.13Å; F549-Y582 AromaticContact CE1-CE2 3.98Å; F549-Y582 HydrophobicContact CE1-CE2 3.98Å; F549-Y582 HydrophobicContact CG-CE2 4.44Å; I553-Y582 HydrophobicContact CG1-CD2 4.42Å; F578-Y582 WeakPolarHBondContact O-CB 3.12Å; F578-Y582 PolarHBondContact O-N 3.44Å; R579-Y582 PolarHBondContact O-N 3.13Å
583	L	88.8	Confident	87.9	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-76.9	-35.8	177.3	-64.1	180	0	0	0	111.8	F335 M391 C394 I395 R579 L585 Q586 V587	F335-L583 HydrophobicContact CZ-CD1 4.33Å; F335-L583 HydrophobicContact CZ-CD2 4.49Å; F335-L583 HydrophobicContact CZ-CG 4.35Å; M391-L583 HydrophobicContact CE-CD2 4.32Å; C394-L583 HydrophobicContact CB-CD1 3.98Å; C394-L583 WeakPolarHBondContact O-CD1 3.43Å; I395-L583 HydrophobicContact CG1-CB 3.92Å; I395-L583 HydrophobicContact CG1-CD1 4.23Å; R579-L583 HydrophobicContact CG-CD1 3.84Å; R579-L583 HydrophobicContact CG-CG 4.48Å; R579-L583 WeakPolarHBondContact O-CB 3.17Å; R579-L583 PolarHBondContact O-N 3.35Å; L583-L585 VanDerWaalsContact C-N 3.32Å; L583-L585 PolarHBondContact O-N 3.05Å; L583-Q586 WeakPolarHBondContact O-CB 3.41Å; L583-Q586 PolarHBondContact O-N 3.35Å; L583-Q586 VanDerWaalsContact O-N 3.12Å; L583-V587 WeakPolarHBondContact O-CG2 3.49Å; L583-V587 PolarHBondContact O-N 2.88Å
584	G	90.3	Very high	88	Confident	29 Å²	29	35.7 Å²	35.7	30%	0.299	20%	0.2	S	C	.	.	H	α-helix	trans	-60.6	-39.2	176.3	0	0	0	0	0	112.5	S580 Q586 V587 G588	S580-G584 WeakPolarHBondContact O-CA 3.32Å; S580-G584 PolarHBondContact O-N 3.42Å; G584-Q586 VanDerWaalsContact C-N 3.33Å; G584-Q586 PolarHBondContact O-N 3.4Å; G584-V587 PolarHBondContact O-N 3.49Å; G584-G588 PolarHBondContact O-N 2.58Å
585	L	92.5	Very high	88.2	Confident	50 Å²	50	39.8 Å²	39.8	26%	0.262	22%	0.216	S	C	.	.	H	α-helix	trans	-61.8	-40.3	173.6	-174.3	62.1	0	0	0	111.8	F549 A552 R581 L583 G588 Y589	F549-L585 HydrophobicContact CD1-CD2 4.03Å; F549-L585 HydrophobicContact CD2-CD2 3.81Å; F549-L585 HydrophobicContact CE1-CB 4.38Å; F549-L585 HydrophobicContact CE1-CD2 4.02Å; F549-L585 HydrophobicContact CE1-CG 4.39Å; F549-L585 HydrophobicContact CE2-CD2 3.79Å; F549-L585 HydrophobicContact CE2-CG 4.21Å; F549-L585 HydrophobicContact CG-CD2 3.94Å; F549-L585 HydrophobicContact CZ-CB 4.38Å; F549-L585 HydrophobicContact CZ-CD2 3.89Å; F549-L585 HydrophobicContact CZ-CG 4.04Å; A552-L585 HydrophobicContact CB-CD2 4.32Å; R581-L585 VanDerWaalsContact O-CB 3.29Å; R581-L585 WeakPolarHBondContact O-CB 3.44Å; R581-L585 PolarHBondContact O-N 3.21Å; L583-L585 VanDerWaalsContact C-N 3.32Å; L583-L585 PolarHBondContact O-N 3.05Å; L585-G588 PolarHBondContact O-N 3.1Å; L585-Y589 HydrophobicContact CD1-CD2 4.25Å; L585-Y589 HydrophobicContact CD1-CE2 3.83Å; L585-Y589 HydrophobicContact CD2-CE2 4.34Å; L585-Y589 HydrophobicContact CG-CD2 4.09Å; L585-Y589 HydrophobicContact CG-CE2 3.82Å; L585-Y589 VanDerWaalsContact O-CD2 3.26Å; L585-Y589 WeakPolarHBondContact O-CD2 3.45Å; L585-Y589 PolarHBondContact O-N 3.1Å
586	Q	89.6	Confident	88.5	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-42.5	175.7	-62.7	179.6	42.7	0	0	112.2	V324 M391 F549 L583 G584 G588 K590	V324-Q586 HydrophobicContact CG1-CB 4.09Å; V324-Q586 HydrophobicContact CG1-CG 4.04Å; V324-Q586 HydrophobicContact CG2-CB 4.37Å; M391-Q586 HydrophobicContact CE-CB 3.73Å; M391-Q586 HydrophobicContact CE-CG 4.37Å; F549-Q586 HydrophobicContact CE1-CG 3.65Å; F549-Q586 HydrophobicContact CZ-CG 3.57Å; L583-Q586 WeakPolarHBondContact O-CB 3.41Å; L583-Q586 PolarHBondContact O-N 3.35Å; L583-Q586 VanDerWaalsContact O-N 3.12Å; G584-Q586 VanDerWaalsContact C-N 3.33Å; G584-Q586 PolarHBondContact O-N 3.4Å; Q586-G588 VanDerWaalsContact C-N 3.35Å; Q586-K590 WeakPolarHBondContact O-CG 3.39Å; Q586-K590 PolarHBondContact O-N 3.5Å; Q586-K590 VanDerWaalsContact O-N 3.1Å
587	V	87.4	Confident	88.5	Confident	12 Å²	12	38.7 Å²	38.7	7%	0.073	21%	0.208	C	C	.	.	H	α-helix	trans	-62.9	-43.9	175.6	173	0	0	0	0	110.3	F388 M391 I395 L583 G584 K590 I591	F388-V587 HydrophobicContact CD2-CG1 4.33Å; F388-V587 HydrophobicContact CE2-CG1 3.54Å; F388-V587 HydrophobicContact CZ-CG1 4.17Å; M391-V587 HydrophobicContact CB-CG2 4.09Å; I395-V587 HydrophobicContact CD1-CG2 4.14Å; L583-V587 WeakPolarHBondContact O-CG2 3.49Å; L583-V587 PolarHBondContact O-N 2.88Å; G584-V587 PolarHBondContact O-N 3.49Å; V587-K590 PolarHBondContact O-N 3.33Å; V587-K590 VanDerWaalsContact O-N 3.17Å; V587-I591 HydrophobicContact CG1-CD1 3.87Å; V587-I591 HydrophobicContact CG1-CG1 4.37Å; V587-I591 WeakPolarHBondContact O-CG1 3.46Å; V587-I591 PolarHBondContact O-N 3.05Å
588	G	90.8	Very high	88.3	Confident	30 Å²	30	40.6 Å²	40.6	31%	0.309	22%	0.217	S	C	.	.	H	α-helix	trans	-56.5	-51.3	175.9	0	0	0	0	0	112.7	G584 L585 Q586 K590 I591 V592	G584-G588 PolarHBondContact O-N 2.58Å; L585-G588 PolarHBondContact O-N 3.1Å; Q586-G588 VanDerWaalsContact C-N 3.35Å; G588-K590 VanDerWaalsContact C-N 3.3Å; G588-K590 PolarHBondContact O-N 3.17Å; G588-I591 PolarHBondContact O-N 3.4Å; G588-V592 WeakPolarHBondContact O-CG2 3.31Å; G588-V592 PolarHBondContact O-N 3.28Å
589	Y	91.6	Very high	88.3	Confident	45 Å²	45	43.1 Å²	43.1	18%	0.176	23%	0.231	C	C	.	.	H	α-helix	trans	-57.5	-41.9	175	-82.9	-61.7	0	0	0	112.6	C320 V324 L548 F549 L585 V592 G593	C320-Y589 WeakPolarHBondContact CB-O 3.26Å; V324-Y589 HydrophobicContact CG2-CG 4.46Å; L548-Y589 WeakPolarHBondContact CD1-OH 3.26Å; F549-Y589 HydrophobicContact CE2-CD2 4.41Å; F549-Y589 HydrophobicContact CE2-CE2 4.11Å; L585-Y589 HydrophobicContact CD1-CD2 4.25Å; L585-Y589 HydrophobicContact CD1-CE2 3.83Å; L585-Y589 HydrophobicContact CD2-CE2 4.34Å; L585-Y589 HydrophobicContact CG-CD2 4.09Å; L585-Y589 HydrophobicContact CG-CE2 3.82Å; L585-Y589 VanDerWaalsContact O-CD2 3.26Å; L585-Y589 WeakPolarHBondContact O-CD2 3.45Å; L585-Y589 PolarHBondContact O-N 3.1Å; Y589-V592 PolarHBondContact O-N 3.07Å; Y589-G593 PolarHBondContact O-N 3.32Å
590	K	85.9	Confident	88.1	Confident	17 Å²	17	42.2 Å²	42.2	7%	0.074	23%	0.228	C	C	.	.	H	α-helix	trans	-64.3	-43	176.8	-75.8	-179.1	175.6	-108.8	0	112.1	F321 V324 Q586 V587 G588 V592 G593 I594	F321-K590 HydrophobicContact CD1-CG 4.49Å; F321-K590 HydrophobicContact CE1-CG 4.44Å; V324-K590 HydrophobicContact CG2-CG 4.34Å; Q586-K590 WeakPolarHBondContact O-CG 3.39Å; Q586-K590 PolarHBondContact O-N 3.5Å; Q586-K590 VanDerWaalsContact O-N 3.1Å; V587-K590 PolarHBondContact O-N 3.33Å; V587-K590 VanDerWaalsContact O-N 3.17Å; G588-K590 VanDerWaalsContact C-N 3.3Å; G588-K590 PolarHBondContact O-N 3.17Å; K590-V592 VanDerWaalsContact C-N 3.35Å; K590-V592 PolarHBondContact O-N 3.4Å; K590-G593 PolarHBondContact O-N 2.87Å; K590-I594 WeakPolarHBondContact O-CB 2.98Å; K590-I594 VanDerWaalsContact O-CD1 3.29Å; K590-I594 WeakPolarHBondContact O-CD1 3.14Å; K590-I594 WeakPolarHBondContact O-CG1 2.96Å; K590-I594 PolarHBondContact O-N 3.12Å
591	I	86.4	Confident	87.8	Confident	86 Å²	86	41.2 Å²	41.2	44%	0.441	23%	0.228	S	C	.	.	H	α-helix	trans	-59.1	-48.4	177.6	-69.1	168.8	0	0	0	110.1	F388 V587 G588 G593 I594 F595	F388-I591 HydrophobicContact CD2-CG1 4.48Å; F388-I591 HydrophobicContact CE2-CD1 3.84Å; F388-I591 HydrophobicContact CE2-CG1 3.56Å; F388-I591 HydrophobicContact CZ-CD1 4.09Å; F388-I591 HydrophobicContact CZ-CG1 4.16Å; V587-I591 HydrophobicContact CG1-CD1 3.87Å; V587-I591 HydrophobicContact CG1-CG1 4.37Å; V587-I591 WeakPolarHBondContact O-CG1 3.46Å; V587-I591 PolarHBondContact O-N 3.05Å; G588-I591 PolarHBondContact O-N 3.4Å; I591-G593 PolarHBondContact O-N 3.35Å; I591-I594 PolarHBondContact O-N 3.07Å; I591-F595 WeakPolarHBondContact O-CB 3.2Å; I591-F595 PolarHBondContact O-N 3.07Å
592	V	91.2	Very high	87.4	Confident	73 Å²	73	44.6 Å²	44.6	44%	0.442	24%	0.24	S	C	.	.	H	α-helix	trans	-61.1	-46.1	178.1	177.1	0	0	0	0	110.9	G588 Y589 K590 I594 F595 L596	G588-V592 WeakPolarHBondContact O-CG2 3.31Å; G588-V592 PolarHBondContact O-N 3.28Å; Y589-V592 PolarHBondContact O-N 3.07Å; K590-V592 VanDerWaalsContact C-N 3.35Å; K590-V592 PolarHBondContact O-N 3.4Å; V592-I594 PolarHBondContact O-N 3.16Å; V592-F595 WeakPolarHBondContact O-CB 3.46Å; V592-F595 PolarHBondContact O-N 3.16Å; V592-L596 HydrophobicContact CG1-CD1 4.17Å; V592-L596 VanDerWaalsContact O-CG 3.32Å; V592-L596 WeakPolarHBondContact O-CG 3.49Å; V592-L596 PolarHBondContact O-N 3.28Å
593	G	88.3	Confident	87	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-42.5	177.3	0	0	0	0	0	113.2	Y589 K590 I591 L596 L597	Y589-G593 PolarHBondContact O-N 3.32Å; K590-G593 PolarHBondContact O-N 2.87Å; I591-G593 PolarHBondContact O-N 3.35Å; G593-L596 PolarHBondContact O-N 3.43Å; G593-L597 WeakPolarHBondContact O-CG 3.46Å; G593-L597 PolarHBondContact O-N 3.42Å; G593-L597 VanDerWaalsContact O-N 3.07Å
594	I	83.9	Confident	86.5	Confident	34 Å²	34	50.1 Å²	50.1	17%	0.174	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-42.8	176.7	-65.4	159.4	0	0	0	110.7	F321 I384 K590 I591 V592 L596 L597 I598	F321-I594 HydrophobicContact CZ-CG1 4.4Å; I384-I594 HydrophobicContact CG2-CD1 3.27Å; I384-I594 HydrophobicContact CG2-CG1 3.54Å; I384-I594 HydrophobicContact CG2-CG2 4.23Å; K590-I594 WeakPolarHBondContact O-CB 2.98Å; K590-I594 VanDerWaalsContact O-CD1 3.29Å; K590-I594 WeakPolarHBondContact O-CD1 3.14Å; K590-I594 WeakPolarHBondContact O-CG1 2.96Å; K590-I594 PolarHBondContact O-N 3.12Å; I591-I594 PolarHBondContact O-N 3.07Å; V592-I594 PolarHBondContact O-N 3.16Å; I594-L596 VanDerWaalsContact C-N 3.33Å; I594-L596 PolarHBondContact O-N 3.19Å; I594-L597 PolarHBondContact O-N 3.42Å; I594-I598 HydrophobicContact CG2-CD1 3.99Å; I594-I598 HydrophobicContact CG2-CG1 4.46Å; I594-I598 WeakPolarHBondContact O-CG1 3.35Å; I594-I598 PolarHBondContact O-N 3.24Å
595	F	87	Confident	86	Confident	123 Å²	123	55 Å²	55	54%	0.539	29%	0.285	S	S	.	.	H	α-helix	trans	-59.4	-44.3	176.7	178.2	-106.7	0	0	0	111.6	I591 V592 L597 I598 I599	I591-F595 WeakPolarHBondContact O-CB 3.2Å; I591-F595 PolarHBondContact O-N 3.07Å; V592-F595 WeakPolarHBondContact O-CB 3.46Å; V592-F595 PolarHBondContact O-N 3.16Å; F595-L597 VanDerWaalsContact C-N 3.34Å; F595-L597 PolarHBondContact O-N 2.03Å; F595-I598 WeakPolarHBondContact O-CB 3.09Å; F595-I598 PolarHBondContact O-N 2.9Å; F595-I598 VanDerWaalsContact O-N 3.16Å; F595-I599 HydrophobicContact CD1-CD1 3.8Å; F595-I599 HydrophobicContact CE1-CD1 3.33Å; F595-I599 HydrophobicContact CE1-CG1 4.36Å; F595-I599 HydrophobicContact CE2-CD1 4.32Å; F595-I599 HydrophobicContact CG-CD1 4.49Å; F595-I599 HydrophobicContact CZ-CD1 3.62Å; F595-I599 HydrophobicContact CZ-CG1 4.33Å; F595-I599 WeakPolarHBondContact O-CG1 3.45Å; F595-I599 PolarHBondContact O-N 3.2Å
596	L	88.6	Confident	85.3	Confident	25 Å²	25	57.9 Å²	57.9	13%	0.131	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-40.5	174.3	-69.2	170.3	0	0	0	112.3	L313 L316 A317 V592 G593 I594 I598 I599 L600	L313-L596 HydrophobicContact CD2-CD2 3.78Å; L316-L596 HydrophobicContact CB-CD1 3.8Å; A317-L596 HydrophobicContact CB-CB 4.04Å; A317-L596 HydrophobicContact CB-CD1 4.49Å; V592-L596 HydrophobicContact CG1-CD1 4.17Å; V592-L596 VanDerWaalsContact O-CG 3.32Å; V592-L596 WeakPolarHBondContact O-CG 3.49Å; V592-L596 PolarHBondContact O-N 3.28Å; G593-L596 PolarHBondContact O-N 3.43Å; I594-L596 VanDerWaalsContact C-N 3.33Å; I594-L596 PolarHBondContact O-N 3.19Å; L596-I598 VanDerWaalsContact C-N 3.35Å; L596-I599 PolarHBondContact O-N 2.9Å; L596-L600 WeakPolarHBondContact O-CB 3.44Å; L596-L600 PolarHBondContact O-N 3.1Å
597	L	83.6	Confident	84.5	Confident	36 Å²	36	60.8 Å²	60.8	19%	0.188	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-32.8	175	-69.2	178.7	0	0	0	113.1	L314 A317 F321 L513 G593 I594 F595 L600 G601	L314-L597 HydrophobicContact CD1-CD2 4.33Å; A317-L597 HydrophobicContact CB-CD2 3.83Å; A317-L597 HydrophobicContact CB-CG 3.96Å; F321-L597 HydrophobicContact CE2-CD1 3.87Å; F321-L597 HydrophobicContact CZ-CD1 4.14Å; L513-L597 HydrophobicContact CD2-CD1 4.24Å; L513-L597 HydrophobicContact CD2-CD2 3.68Å; G593-L597 WeakPolarHBondContact O-CG 3.46Å; G593-L597 PolarHBondContact O-N 3.42Å; G593-L597 VanDerWaalsContact O-N 3.07Å; I594-L597 PolarHBondContact O-N 3.42Å; F595-L597 VanDerWaalsContact C-N 3.34Å; F595-L597 PolarHBondContact O-N 2.03Å; L597-L600 HydrophobicContact CD2-CD2 4.14Å; L597-L600 PolarHBondContact O-N 2.99Å; L597-G601 PolarHBondContact O-N 2.87Å
598	I	83.9	Confident	83.6	Confident	109 Å²	109	66.4 Å²	66.4	56%	0.559	34%	0.336	S	S	*	.	H	α-helix	trans	-65.9	-46.5	173.7	-69.4	166.3	0	0	0	110	I594 F595 L596 L600 G601 W602	I594-I598 HydrophobicContact CG2-CD1 3.99Å; I594-I598 HydrophobicContact CG2-CG1 4.46Å; I594-I598 WeakPolarHBondContact O-CG1 3.35Å; I594-I598 PolarHBondContact O-N 3.24Å; F595-I598 WeakPolarHBondContact O-CB 3.09Å; F595-I598 PolarHBondContact O-N 2.9Å; F595-I598 VanDerWaalsContact O-N 3.16Å; L596-I598 VanDerWaalsContact C-N 3.35Å; I598-L600 VanDerWaalsContact C-N 3.3Å; I598-L600 PolarHBondContact O-N 3.49Å; I598-G601 PolarHBondContact O-N 3.46Å; I598-W602 PolarHBondContact O-N 3.18Å
599	I	86.4	Confident	82.1	Confident	56 Å²	56	69.5 Å²	69.5	29%	0.287	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-44	175.1	-66.1	169.9	0	0	0	110.4	L313 F595 L596 G601 W602 K603	L313-I599 HydrophobicContact CD1-CG2 3.83Å; L313-I599 HydrophobicContact CD2-CG2 4.3Å; F595-I599 HydrophobicContact CD1-CD1 3.8Å; F595-I599 HydrophobicContact CE1-CD1 3.33Å; F595-I599 HydrophobicContact CE1-CG1 4.36Å; F595-I599 HydrophobicContact CE2-CD1 4.32Å; F595-I599 HydrophobicContact CG-CD1 4.49Å; F595-I599 HydrophobicContact CZ-CD1 3.62Å; F595-I599 HydrophobicContact CZ-CG1 4.33Å; F595-I599 WeakPolarHBondContact O-CG1 3.45Å; F595-I599 PolarHBondContact O-N 3.2Å; L596-I599 PolarHBondContact O-N 2.9Å; I599-G601 PolarHBondContact O-N 2.82Å; I599-W602 PolarHBondContact O-N 3.41Å; I599-K603 WeakPolarHBondContact O-CB 3.37Å; I599-K603 PolarHBondContact O-N 3.34Å
600	L	84.8	Confident	80.3	Confident	8 Å²	8	73 Å²	73	4%	0.042	36%	0.356	C	S	.	.	H	α-helix	trans	-58.4	-47.8	176.5	-178.3	73.5	0	0	0	111.2	L310 L313 L314 M516 L596 L597 I598 W602 K603 A604	L310-L600 HydrophobicContact CB-CD1 4.09Å; L310-L600 HydrophobicContact CD2-CD1 3.61Å; L310-L600 HydrophobicContact CG-CD1 4.47Å; L310-L600 WeakPolarHBondContact O-CD1 2.99Å; L313-L600 HydrophobicContact CB-CB 4.47Å; L313-L600 HydrophobicContact CB-CD1 4.08Å; L313-L600 HydrophobicContact CD1-CD1 4.46Å; L314-L600 HydrophobicContact CB-CD2 4.28Å; L314-L600 HydrophobicContact CD1-CD2 3.82Å; M516-L600 HydrophobicContact CE-CD2 4.08Å; L596-L600 WeakPolarHBondContact O-CB 3.44Å; L596-L600 PolarHBondContact O-N 3.1Å; L597-L600 HydrophobicContact CD2-CD2 4.14Å; L597-L600 PolarHBondContact O-N 2.99Å; I598-L600 VanDerWaalsContact C-N 3.3Å; I598-L600 PolarHBondContact O-N 3.49Å; L600-W602 PolarHBondContact O-N 3.06Å; L600-K603 PolarHBondContact O-N 2.03Å; L600-A604 VanDerWaalsContact O-CB 3.27Å; L600-A604 WeakPolarHBondContact O-CB 3.37Å; L600-A604 PolarHBondContact O-N 1.96Å
601	G	81	Confident	78.9	Confident	42 Å²	42	77 Å²	77	43%	0.433	38%	0.378	S	S	.	.	H	α-helix	trans	-62.5	-40.2	177.8	0	0	0	0	0	112.9	L597 I598 I599 K605	L597-G601 PolarHBondContact O-N 2.87Å; I598-G601 PolarHBondContact O-N 3.46Å; I599-G601 PolarHBondContact O-N 2.82Å; G601-K605 WeakPolarHBondContact O-CB 3.03Å; G601-K605 PolarHBondContact O-N 2.95Å
602	W	82.5	Confident	77.3	Confident	159 Å²	159	78.4 Å²	78.4	60%	0.602	39%	0.386	S	S	*	.	H	α-helix	trans	-63.9	-46.2	174.8	179.4	77.6	0	0	0	111.8	I598 I599 L600 K605 R606	I598-W602 PolarHBondContact O-N 3.18Å; I599-W602 PolarHBondContact O-N 3.41Å; L600-W602 PolarHBondContact O-N 3.06Å; W602-K605 PolarHBondContact O-N 3.16Å; W602-R606 VanDerWaalsContact CH2-NH1 3.3Å; W602-R606 WeakPolarHBondContact O-CB 2.88Å; W602-R606 PolarHBondContact O-N 3.15Å
603	K	82.8	Confident	75.6	Confident	76 Å²	76	82.2 Å²	82.2	33%	0.33	40%	0.399	S	S	.	.	H	α-helix	trans	-65.6	-44.2	179.2	-167.9	165.1	-173.3	157.6	0	111.8	P309 L310 L313 I599 L600 K605 R606 T607	P309-K603 HydrophobicContact CB-CD 4.2Å; P309-K603 HydrophobicContact CG-CD 4.28Å; P309-K603 VanDerWaalsContact CG-CE 3.41Å; L310-K603 HydrophobicContact CD2-CB 4.31Å; L310-K603 HydrophobicContact CD2-CD 4.39Å; L310-K603 HydrophobicContact CD2-CG 4.17Å; L313-K603 HydrophobicContact CD1-CD 4.49Å; I599-K603 WeakPolarHBondContact O-CB 3.37Å; I599-K603 PolarHBondContact O-N 3.34Å; L600-K603 PolarHBondContact O-N 2.03Å; K603-K605 PolarHBondContact O-N 3.3Å; K603-R606 PolarHBondContact O-N 3.01Å; K603-T607 PolarHBondContact O-N 3.21Å; K603-T607 PolarHBondContact O-OG1 3.26Å; K603-T607 VanDerWaalsContact O-OG1 3.04Å
604	A	78.8	Confident	73.8	Confident	42 Å²	42	90 Å²	90	35%	0.347	43%	0.433	S	S	.	.	H	α-helix	trans	-61.2	-44	177.3	0	0	0	0	0	112	L600 T607 Q608	L600-A604 VanDerWaalsContact O-CB 3.27Å; L600-A604 WeakPolarHBondContact O-CB 3.37Å; L600-A604 PolarHBondContact O-N 1.96Å; A604-T607 PolarHBondContact O-N 3.18Å; A604-Q608 PolarHBondContact O-N 3.03Å
605	K	78	Confident	71.7	Confident	130 Å²	130	96.4 Å²	96.4	57%	0.565	46%	0.459	S	S	*	.	H	α-helix	trans	-61.6	-45	176.3	-173.3	179.5	176.3	-161.8	0	111.4	G601 W602 K603 T607 Q608 E609	G601-K605 WeakPolarHBondContact O-CB 3.03Å; G601-K605 PolarHBondContact O-N 2.95Å; W602-K605 PolarHBondContact O-N 3.16Å; K603-K605 PolarHBondContact O-N 3.3Å; K605-T607 PolarHBondContact O-N 2.98Å; K605-Q608 PolarHBondContact O-N 2.88Å; K605-E609 WeakPolarHBondContact CE-OE1 3.18Å; K605-E609 IonicContact NZ-OE1 3.47Å; K605-E609 WeakPolarHBondContact O-CG 2.82Å; K605-E609 PolarHBondContact O-N 3.04Å
606	R	78.4	Confident	69.6	Low	111 Å²	111	95.4 Å²	95.4	42%	0.419	47%	0.465	S	S	.	.	H	α-helix	trans	-64.7	-40.1	179.4	-166.8	174.7	-177.7	176.4	-2.3	112.4	W602 K603 Q608 E609 Y610	W602-R606 VanDerWaalsContact CH2-NH1 3.3Å; W602-R606 WeakPolarHBondContact O-CB 2.88Å; W602-R606 PolarHBondContact O-N 3.15Å; K603-R606 PolarHBondContact O-N 3.01Å; R606-Q608 VanDerWaalsContact C-N 3.34Å; R606-E609 PolarHBondContact O-N 3.45Å; R606-Y610 HydrophobicContact CG-CE2 3.79Å; R606-Y610 WeakPolarHBondContact O-CD2 3.19Å; R606-Y610 PolarHBondContact O-N 2.79Å; R606-Y610 HydrophobicContact CG-CD2 4.02Å
607	T	72.6	Confident	67.6	Low	63 Å²	63	103.7 Å²	103.7	39%	0.387	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-40.6	174.6	-56.9	0	0	0	0	111.5	K603 A604 K605 Y610 D611	K603-T607 PolarHBondContact O-N 3.21Å; K603-T607 PolarHBondContact O-OG1 3.26Å; K603-T607 VanDerWaalsContact O-OG1 3.04Å; A604-T607 PolarHBondContact O-N 3.18Å; K605-T607 PolarHBondContact O-N 2.98Å; T607-Y610 PolarHBondContact O-N 3.41Å; T607-D611 PolarHBondContact O-N 2.78Å
608	Q	67.9	Low	65.4	Low	130 Å²	130	112.9 Å²	112.9	61%	0.607	55%	0.55	S	S	*	*	H	α-helix	trans	-65.7	-37.9	176.6	-168.1	178.3	-2.5	0	0	112.6	A604 K605 R606 D611 L612	A604-Q608 PolarHBondContact O-N 3.03Å; K605-Q608 PolarHBondContact O-N 2.88Å; R606-Q608 VanDerWaalsContact C-N 3.34Å; Q608-D611 PolarHBondContact O-N 3.43Å; Q608-L612 HydrophobicContact CG-CD1 4.33Å; Q608-L612 WeakPolarHBondContact O-CD1 3.5Å; Q608-L612 VanDerWaalsContact O-CG 3.3Å; Q608-L612 WeakPolarHBondContact O-CG 3.48Å; Q608-L612 PolarHBondContact O-N 3.12Å; Q608-L612 VanDerWaalsContact O-N 3.07Å
609	E	61	Low	64.5	Low	94 Å²	94	113.1 Å²	113.1	44%	0.439	55%	0.55	S	S	.	.	H	α-helix	trans	-63.9	-43.3	173.7	-74.4	168.9	171.6	0	0	111.5	K605 R606 D611 L612 E613	K605-E609 WeakPolarHBondContact CE-OE1 3.18Å; K605-E609 IonicContact NZ-OE1 3.47Å; K605-E609 WeakPolarHBondContact O-CG 2.82Å; K605-E609 PolarHBondContact O-N 3.04Å; R606-E609 PolarHBondContact O-N 3.45Å; E609-D611 PolarHBondContact O-N 3.07Å; E609-L612 PolarHBondContact O-N 3.01Å; E609-E613 PolarHBondContact O-N 3.34Å
610	Y	53.4	Low	63.3	Low	120 Å²	120	116.1 Å²	116.1	47%	0.471	56%	0.564	S	S	.	*	H	α-helix	trans	-64.4	-36.4	174.7	-84.7	-66	0	0	0	113.8	R606 T607 L612 K614	R606-Y610 HydrophobicContact CG-CE2 3.79Å; R606-Y610 WeakPolarHBondContact O-CD2 3.19Å; R606-Y610 PolarHBondContact O-N 2.79Å; R606-Y610 HydrophobicContact CG-CD2 4.02Å; T607-Y610 PolarHBondContact O-N 3.41Å; Y610-L612 VanDerWaalsContact C-N 3.35Å; Y610-K614 WeakPolarHBondContact O-CB 3.33Å; Y610-K614 WeakPolarHBondContact O-CG 3.31Å; Y610-K614 PolarHBondContact O-N 3.02Å; Y610-K614 VanDerWaalsContact O-N 3.16Å
611	D	57.2	Low	62.1	Low	101 Å²	101	122.1 Å²	122.1	54%	0.54	59%	0.593	S	S	.	*	H	α-helix	trans	-71.7	-30.2	176.8	-79.4	-19.8	0	0	0	112.2	T607 Q608 E609 K615	T607-D611 PolarHBondContact O-N 2.78Å; Q608-D611 PolarHBondContact O-N 3.43Å; E609-D611 PolarHBondContact O-N 3.07Å; D611-K615 PolarHBondContact O-N 2.86Å
612	L	52.8	Low	61	Low	115 Å²	115	126.8 Å²	126.8	60%	0.602	60%	0.602	S	S	*	*	H	α-helix	trans	-72.6	-40.9	173.8	-74.9	163.8	0	0	0	111.7	Q608 E609 Y610 K614 K615	Q608-L612 HydrophobicContact CG-CD1 4.33Å; Q608-L612 WeakPolarHBondContact O-CD1 3.5Å; Q608-L612 VanDerWaalsContact O-CG 3.3Å; Q608-L612 WeakPolarHBondContact O-CG 3.48Å; Q608-L612 PolarHBondContact O-N 3.12Å; Q608-L612 VanDerWaalsContact O-N 3.07Å; E609-L612 PolarHBondContact O-N 3.01Å; Y610-L612 VanDerWaalsContact C-N 3.35Å; L612-K614 PolarHBondContact O-N 3.15Å; L612-K615 PolarHBondContact O-N 2.82Å
613	E	54.7	Low	59.7	Low	153 Å²	153	124.8 Å²	124.8	72%	0.715	60%	0.602	S	S	*	*	H	α-helix	trans	-66.2	-24.4	174	-74.9	177.8	170.7	0	0	113	E609	E609-E613 PolarHBondContact O-N 3.34Å
614	K	50.1	Low	58.1	Low	164 Å²	164	128.1 Å²	128.1	71%	0.713	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-3.3	177.2	-83.8	-173.3	178.5	-177.1	0	115.2	Y610 L612 P616	Y610-K614 WeakPolarHBondContact O-CB 3.33Å; Y610-K614 WeakPolarHBondContact O-CG 3.31Å; Y610-K614 PolarHBondContact O-N 3.02Å; Y610-K614 VanDerWaalsContact O-N 3.16Å; L612-K614 PolarHBondContact O-N 3.15Å; K614-P616 VanDerWaalsContact C-CD 3.44Å; K614-P616 WeakPolarHBondContact O-CD 3.3Å
615	K	40	Very low	56.6	Low	168 Å²	168	134.2 Å²	134.2	73%	0.73	64%	0.64	S	S	*	*			trans	-89	92	164.8	-80.7	-172.9	174.6	-173.5	0	108.2	D611 L612 E617	D611-K615 PolarHBondContact O-N 2.86Å; L612-K615 PolarHBondContact O-N 2.82Å; K615-E617 PolarHBondContact O-N 3.04Å
616	P	42.8	Very low	55	Low	102 Å²	102	134.5 Å²	134.5	66%	0.662	65%	0.645	S	S	*	*			trans	-60.7	133.5	162.9	27.6	-32.2	0	0	0	107.7	K614 I618	K614-P616 VanDerWaalsContact C-CD 3.44Å; K614-P616 WeakPolarHBondContact O-CD 3.3Å; P616-I618 PolarHBondContact O-N 2.8Å
617	E	46.6	Very low	53	Low	198 Å²	198	136.5 Å²	136.5	93%	0.925	66%	0.664	S	S	*	*			trans	-50.1	119.2	168.9	-63.6	177.3	163.3	0	0	108.6	K615	K615-E617 PolarHBondContact O-N 3.04Å
618	I	37.4	Very low	51.3	Low	230 Å²	230	143.2 Å²	143.2	100%	1.179	69%	0.69	S	S	*	*			trans	-117	0	161.6	-61	176.1	0	0	0	106.3	P616	P616-I618 PolarHBondContact O-N 2.8Å

Retrieved 618 of 618 residues in 1538.9 ms (Link to these results)

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