A0A077ZEP5_TRITR Loading...

Sodium and chloride dependent GABA transporter

AlphaFold DB , UniProt , Accession A0A077ZEP5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 606 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	34.2	Very low	34.1	Very low	237 Å²	237	118.5 Å²	118.5	100%	1.167	66%	0.655	S	S	*	*				0	106.7	0	-87.8	171.8	171.4	0	0	107.7	T3	M1-T3 PolarHBondContact O-N 3.28Å
2	A	33	Very low	34.7	Very low	103 Å²	103	115.3 Å²	115.3	85%	0.851	63%	0.631	S	S	*	*			trans	-64.1	107.7	172.7	0	0	0	0	0	107.7	R4	A2-R4 PolarHBondContact O-N 3.32Å
3	T	32	Very low	35.7	Very low	126 Å²	126	112.3 Å²	112.3	77%	0.773	61%	0.61	S	S	*	*			trans	-59.6	103.2	171.4	39.4	0	0	0	0	107.6	M1 T5	M1-T3 PolarHBondContact O-N 3.28Å; T3-T5 PolarHBondContact O-N 2.9Å
4	R	29.4	Very low	37.1	Very low	187 Å²	187	109.9 Å²	109.9	71%	0.706	59%	0.588	S	S	*	*			trans	-51.8	102.4	167.1	-92.2	176.3	165.1	177.3	-9.1	108	A2 T6	A2-R4 PolarHBondContact O-N 3.32Å; R4-T6 HydrophobicContact CB-CG2 4.42Å; R4-T6 PolarHBondContact O-N 3.29Å
5	T	30.4	Very low	39.6	Very low	139 Å²	139	104.5 Å²	104.5	85%	0.853	56%	0.556	S	S	*	*			trans	-78.3	77	166.6	48.5	0	0	0	0	107.9	T3	T3-T5 PolarHBondContact O-N 2.9Å
6	T	30.7	Very low	42.2	Very low	100 Å²	100	101.3 Å²	101.3	61%	0.613	54%	0.539	S	S	*	.			trans	-96.9	116.8	171.9	43.7	0	0	0	0	109.3	R4	R4-T6 HydrophobicContact CB-CG2 4.42Å; R4-T6 PolarHBondContact O-N 3.29Å
7	G	35.7	Very low	45	Very low	37 Å²	37	97.6 Å²	97.6	38%	0.381	52%	0.519	S	S	.	.			trans	96.8	103.2	161.2	0	0	0	0	0	115	F9	G7-F9 WeakPolarHBondContact O-CD2 3.47Å; G7-F9 PolarHBondContact O-N 2.89Å
8	N	33.3	Very low	47.6	Very low	131 Å²	131	92.7 Å²	92.7	70%	0.701	49%	0.492	S	S	*	.			trans	-65	86	154.4	-71.3	-6.6	0	0	0	107	I10	N8-I10 PolarHBondContact O-N 3.37Å
9	F	37.2	Very low	49.9	Very low	126 Å²	126	89.3 Å²	89.3	55%	0.553	48%	0.477	S	S	*	.			trans	-79.9	97.8	174.8	-69.4	-78.2	0	0	0	107.8	G7 I11 E560 P562	G7-F9 WeakPolarHBondContact O-CD2 3.47Å; G7-F9 PolarHBondContact O-N 2.89Å; F9-I11 PolarHBondContact O-N 3.3Å; F9-E560 VanDerWaalsContact O-OE2 3.14Å; F9-P562 HydrophobicContact CD2-CB 4.37Å
10	I	40.3	Very low	52	Low	46 Å²	46	91.7 Å²	91.7	24%	0.236	48%	0.483	C	S	.	.			trans	-60.8	119.9	160.2	-62.7	174.3	0	0	0	105.7	N8 E12 L78 L557 E560	N8-I10 PolarHBondContact O-N 3.37Å; I10-E12 PolarHBondContact O-N 2.92Å; I10-L78 HydrophobicContact CD1-CD1 3.86Å; I10-L557 HydrophobicContact CD1-CD2 4.28Å; I10-E560 WeakPolarHBondContact CA-OE2 3.4Å
11	I	38.4	Very low	54	Low	72 Å²	72	91.7 Å²	91.7	37%	0.369	48%	0.479	S	S	.	.			trans	-62.9	104.5	175.9	-61.4	170.4	0	0	0	107.3	F9 E13 E560 K563	F9-I11 PolarHBondContact O-N 3.3Å; I11-E13 VanDerWaalsContact C-N 3.31Å; I11-E13 PolarHBondContact O-N 3.46Å; I11-E560 PolarHBondContact N-OE2 3.08Å; I11-K563 HydrophobicContact CD1-CD 3.84Å; I11-K563 HydrophobicContact CD1-CG 4.37Å
12	E	41.9	Very low	56.9	Low	80 Å²	80	83.2 Å²	83.2	37%	0.374	44%	0.443	S	S	.	.			trans	-63.3	97.3	165.7	-70.1	-176.5	179.8	0	0	107.4	I10 Y570	I10-E12 PolarHBondContact O-N 2.92Å; E12-Y570 PolarHBondContact O-OH 2.8Å
13	E	48.1	Very low	60	Low	76 Å²	76	78.6 Å²	78.6	36%	0.355	40%	0.404	S	S	.	.			trans	-62.4	148.2	161.9	-78.5	-178.2	179.7	0	0	108.9	I11 R15 K85	I11-E13 VanDerWaalsContact C-N 3.31Å; I11-E13 PolarHBondContact O-N 3.46Å; E13-R15 VanDerWaalsContact C-N 3.33Å; E13-R15 PolarHBondContact O-N 3.25Å; E13-K85 IonicContact OE1-NZ 2.57Å; E13-K85 PolarHBondContact OE1-NZ 3.31Å; E13-K85 IonicContact OE2-NZ 3.78Å; E13-K85 PolarHBondContact OE2-NZ 3.14Å
14	W	54.6	Low	63	Low	79 Å²	79	72.6 Å²	72.6	30%	0.299	37%	0.367	S	S	.	.			trans	-59.9	93.4	178.9	-77.9	94.2	0	0	0	109.9	Y570 Y577 A586	W14-Y570 AromaticContact CD2-CE1 3.51Å; W14-Y570 HydrophobicContact CD2-CE1 3.51Å; W14-Y570 AromaticContact CD2-CZ 3.96Å; W14-Y570 AromaticContact CE2-CD1 3.81Å; W14-Y570 AromaticContact CE2-CE1 3.05Å; W14-Y570 AromaticContact CE2-CZ 3.51Å; W14-Y570 AromaticContact CE3-CE1 3.75Å; W14-Y570 HydrophobicContact CE3-CE1 3.75Å; W14-Y570 HydrophobicContact CG-CE1 4.37Å; W14-Y570 AromaticContact CH2-CD1 3.19Å; W14-Y570 HydrophobicContact CH2-CD1 3.19Å; W14-Y570 AromaticContact CH2-CE1 3.12Å; W14-Y570 HydrophobicContact CH2-CE1 3.12Å; W14-Y570 HydrophobicContact CH2-CG 4.46Å; W14-Y570 AromaticContact CZ2-CD1 3.13Å; W14-Y570 HydrophobicContact CZ2-CD1 3.13Å; W14-Y570 AromaticContact CZ2-CE1 2.9Å; W14-Y570 HydrophobicContact CZ2-CE1 2.9Å; W14-Y570 HydrophobicContact CZ2-CG 4.19Å; W14-Y570 AromaticContact CZ2-CZ 3.77Å; W14-Y570 AromaticContact CZ3-CD1 3.99Å; W14-Y570 HydrophobicContact CZ3-CD1 3.99Å; W14-Y570 AromaticContact CZ3-CE1 3.55Å; W14-Y570 HydrophobicContact CZ3-CE1 3.55Å; W14-Y570 AromaticContact NE1-CE1 3.66Å; W14-Y570 AromaticContact NE1-CZ 3.6Å; W14-Y570 PolarHBondContact NE1-OH 2.79Å; W14-Y577 HydrophobicContact CH2-CE1 4.31Å; W14-Y577 AromaticContact CH2-CE2 3.77Å; W14-Y577 HydrophobicContact CH2-CE2 3.77Å; W14-Y577 AromaticContact CH2-CZ 3.35Å; W14-Y577 WeakPolarHBondContact CH2-OH 3.34Å; W14-Y577 AromaticContact CZ2-CE2 3.55Å; W14-Y577 HydrophobicContact CZ2-CE2 3.55Å; W14-Y577 AromaticContact CZ2-CZ 3.58Å; W14-Y577 WeakPolarHBondContact CZ2-OH 3.2Å; W14-Y577 AromaticContact CZ3-CZ 3.9Å; W14-Y577 WeakPolarHBondContact CZ3-OH 3.34Å; W14-A586 HydrophobicContact CE3-CB 4.47Å; W14-A586 HydrophobicContact CZ3-CB 4.37Å
15	R	75.1	Confident	66.3	Low	29 Å²	29	64.6 Å²	64.6	11%	0.109	34%	0.338	C	S	.	.			trans	-113.7	133.8	172.4	-178.7	165.1	-64.5	-121	-9.3	109.6	E13 L17 A80 S81 S285 F286 D386	E13-R15 VanDerWaalsContact C-N 3.33Å; E13-R15 PolarHBondContact O-N 3.25Å; R15-L17 PolarHBondContact O-N 3.38Å; R15-A80 VanDerWaalsContact CZ-O 3.24Å; R15-A80 PolarHBondContact NE-O 3.39Å; R15-A80 PolarHBondContact NH2-O 3.41Å; R15-S81 VanDerWaalsContact NH2-CA 3.33Å; R15-S285 WeakPolarHBondContact CD-O 3.34Å; R15-S285 VanDerWaalsContact NH1-CB 3.31Å; R15-S285 PolarHBondContact NH1-OG 2.75Å; R15-F286 HydrophobicContact CG-CD1 3.51Å; R15-F286 HydrophobicContact CG-CE1 3.77Å; R15-D386 IonicContact CZ-OD1 3.11Å; R15-D386 IonicContact CZ-OD2 3.07Å; R15-D386 IonicContact NH2-OD1 2.74Å; R15-D386 PolarHBondContact NH2-OD1 2.93Å; R15-D386 IonicContact NH2-OD2 2.91Å; R15-D386 PolarHBondContact NH2-OD2 3.04Å
16	D	81.5	Confident	69.5	Low	53 Å²	53	58.7 Å²	58.7	28%	0.283	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-64	128.8	173.3	-73.2	-42.7	0	0	0	110.4	V210 F286 R398	D16-V210 HydrophobicContact CB-CG2 3.98Å; D16-F286 WeakPolarHBondContact O-CD1 2.9Å; D16-R398 IonicContact OD2-CZ 2.67Å; D16-R398 IonicContact OD2-NH1 3.2Å; D16-R398 PolarHBondContact OD2-NH1 2.84Å; D16-R398 IonicContact OD2-NH2 3.26Å; D16-R398 PolarHBondContact OD2-NH2 3.14Å
17	L	89.6	Confident	72.7	Confident	39 Å²	39	53.9 Å²	53.9	20%	0.204	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-92.2	152.7	174.1	-57.7	175.8	0	0	0	110.7	R15 S19 R211 F286 R288	R15-L17 PolarHBondContact O-N 3.38Å; L17-S19 PolarHBondContact O-N 2.8Å; L17-R211 WeakPolarHBondContact O-CG 3.04Å; L17-R211 PolarHBondContact O-NE 3.35Å; L17-R211 VanDerWaalsContact O-NE 3.14Å; L17-F286 WeakPolarHBondContact CA-O 3.29Å; L17-F286 WeakPolarHBondContact CD2-O 3.37Å; L17-R288 HydrophobicContact CD1-CG 4.13Å
18	W	91.9	Very high	75.7	Confident	9 Å²	9	52.1 Å²	52.1	3%	0.034	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-51.3	135.5	164.7	-60	111.1	0	0	0	109.9	F20 D23 F24 V27 V210 L283 F286 N287	W18-F20 VanDerWaalsContact C-N 3.32Å; W18-F20 PolarHBondContact O-N 2.95Å; W18-D23 HydrophobicContact CE3-CB 4.25Å; W18-F24 HydrophobicContact CB-CB 4.46Å; W18-F24 HydrophobicContact CD2-CB 4.11Å; W18-F24 HydrophobicContact CG-CB 3.82Å; W18-F24 HydrophobicContact CZ2-CD2 4.46Å; W18-F24 AromaticContact NE1-CD2 3.48Å; W18-F24 AromaticContact NE1-CG 3.97Å; W18-V27 HydrophobicContact CH2-CB 4.22Å; W18-V27 HydrophobicContact CH2-CG1 4.07Å; W18-V27 HydrophobicContact CH2-CG2 3.92Å; W18-V27 HydrophobicContact CZ3-CG2 3.83Å; W18-V210 HydrophobicContact CD2-CB 4.48Å; W18-V210 HydrophobicContact CE3-CB 3.9Å; W18-V210 HydrophobicContact CE3-CG2 4.43Å; W18-V210 HydrophobicContact CH2-CB 3.99Å; W18-V210 HydrophobicContact CH2-CG1 4.18Å; W18-V210 HydrophobicContact CZ3-CB 3.63Å; W18-V210 HydrophobicContact CZ3-CG1 4.33Å; W18-V210 VanDerWaalsContact CZ3-O 3.28Å; W18-V210 WeakPolarHBondContact CZ3-O 2.73Å; W18-L283 HydrophobicContact CH2-CD2 4.17Å; W18-L283 HydrophobicContact CZ2-CD2 3.86Å; W18-L283 PolarHBondContact NE1-O 3.47Å; W18-L283 VanDerWaalsContact NE1-O 3.14Å; W18-F286 VanDerWaalsContact CD1-C 3.4Å; W18-F286 HydrophobicContact CD2-CB 4.31Å; W18-F286 HydrophobicContact CG-CB 4.31Å; W18-F286 HydrophobicContact CZ2-CB 4.23Å; W18-F286 HydrophobicContact CZ2-CD2 4.16Å; W18-F286 PolarHBondContact N-O 2.9Å; W18-F286 VanDerWaalsContact N-O 3.13Å; W18-N287 PolarHBondContact NE1-OD1 3.39Å
19	S	90.2	Very high	78.8	Confident	28 Å²	28	47.2 Å²	47.2	20%	0.196	23%	0.226	C	C	.	.	S	Bend	trans	-61.3	-46.9	-178.7	-29.9	0	0	0	0	110.2	L17 D23 R211	L17-S19 PolarHBondContact O-N 2.8Å; S19-D23 VanDerWaalsContact CB-OD2 3.29Å; S19-D23 WeakPolarHBondContact CB-OD2 3.22Å; S19-D23 PolarHBondContact OG-OD2 2.96Å; S19-R211 WeakPolarHBondContact OG-CB 2.84Å; S19-R211 WeakPolarHBondContact OG-CG 3.29Å
20	F	93.1	Very high	81.7	Confident	137 Å²	137	41.2 Å²	41.2	60%	0.601	20%	0.2	S	C	*	.	S	Bend	trans	-129.3	154.7	176.3	-56.1	-75	0	0	0	111	W18 S22 D23	W18-F20 VanDerWaalsContact C-N 3.32Å; W18-F20 PolarHBondContact O-N 2.95Å; F20-S22 PolarHBondContact O-N 3.43Å; F20-D23 PolarHBondContact N-OD2 3.13Å; F20-D23 VanDerWaalsContact O-CB 3.31Å; F20-D23 WeakPolarHBondContact O-CB 3.44Å; F20-D23 PolarHBondContact O-N 2.96Å
21	K	93.2	Very high	84.5	Confident	91 Å²	91	39.2 Å²	39.2	40%	0.396	19%	0.189	S	C	.	.	H	α-helix	trans	-56.7	-36.2	172.1	178.1	171.6	178.7	152.7	0	112.2	D23 F24 I25 N291 D296	K21-D23 PolarHBondContact O-N 3.17Å; K21-F24 WeakPolarHBondContact O-CB 3.29Å; K21-F24 PolarHBondContact O-N 2.96Å; K21-I25 HydrophobicContact CG-CG1 4.36Å; K21-I25 WeakPolarHBondContact O-CG1 3.36Å; K21-I25 PolarHBondContact O-N 2.92Å; K21-I25 VanDerWaalsContact O-N 3.13Å; K21-N291 WeakPolarHBondContact CD-OD1 3.43Å; K21-N291 VanDerWaalsContact CE-OD1 3.32Å; K21-N291 WeakPolarHBondContact CE-OD1 3.38Å; K21-N291 PolarHBondContact NZ-OD1 3.46Å; K21-D296 WeakPolarHBondContact CE-OD1 3.44Å; K21-D296 WeakPolarHBondContact CE-OD2 3.34Å; K21-D296 VanDerWaalsContact NZ-CG 3.33Å; K21-D296 IonicContact NZ-OD1 2.68Å; K21-D296 PolarHBondContact NZ-OD1 2.8Å; K21-D296 IonicContact NZ-OD2 3.16Å; K21-D296 PolarHBondContact NZ-OD2 3.06Å; K21-D296 VanDerWaalsContact NZ-OD2 3.16Å
22	S	95.9	Very high	87.3	Confident	60 Å²	60	35.8 Å²	35.8	42%	0.42	17%	0.172	S	C	.	.	H	α-helix	trans	-62.9	-29.4	177.8	52.7	0	0	0	0	112.8	F20 I25 I26 Y218	F20-S22 PolarHBondContact O-N 3.43Å; S22-I25 PolarHBondContact O-N 3.21Å; S22-I26 WeakPolarHBondContact O-CB 3.47Å; S22-I26 WeakPolarHBondContact O-CG2 3.39Å; S22-I26 PolarHBondContact O-N 2.94Å; S22-Y218 WeakPolarHBondContact CB-OH 3.49Å; S22-Y218 PolarHBondContact OG-OH 3.16Å
23	D	96.4	Very high	89.9	Confident	6 Å²	6	32.1 Å²	32.1	3%	0.032	16%	0.155	C	C	.	.	H	α-helix	trans	-66.7	-40	176.5	-58.9	-11.4	0	0	0	111.2	W18 S19 F20 K21 I26 V27 Y218	W18-D23 HydrophobicContact CE3-CB 4.25Å; S19-D23 VanDerWaalsContact CB-OD2 3.29Å; S19-D23 WeakPolarHBondContact CB-OD2 3.22Å; S19-D23 PolarHBondContact OG-OD2 2.96Å; F20-D23 PolarHBondContact N-OD2 3.13Å; F20-D23 VanDerWaalsContact O-CB 3.31Å; F20-D23 WeakPolarHBondContact O-CB 3.44Å; F20-D23 PolarHBondContact O-N 2.96Å; K21-D23 PolarHBondContact O-N 3.17Å; D23-I26 VanDerWaalsContact O-CG2 3.29Å; D23-I26 WeakPolarHBondContact O-CG2 3.24Å; D23-V27 WeakPolarHBondContact O-CG2 3.39Å; D23-V27 PolarHBondContact O-N 3.35Å; D23-Y218 PolarHBondContact N-OH 2.77Å; D23-Y218 VanDerWaalsContact OD1-CE2 3.3Å; D23-Y218 WeakPolarHBondContact OD1-CE2 3.32Å; D23-Y218 PolarHBondContact OD1-OH 3.17Å
24	F	96.9	Very high	91.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.9	-50.4	171.9	165.7	-111.7	0	0	0	111.3	W18 K21 I26 V27 C28 L73 L283 N287 D296 I300	W18-F24 HydrophobicContact CB-CB 4.46Å; W18-F24 HydrophobicContact CD2-CB 4.11Å; W18-F24 HydrophobicContact CG-CB 3.82Å; W18-F24 HydrophobicContact CZ2-CD2 4.46Å; W18-F24 AromaticContact NE1-CD2 3.48Å; W18-F24 AromaticContact NE1-CG 3.97Å; K21-F24 WeakPolarHBondContact O-CB 3.29Å; K21-F24 PolarHBondContact O-N 2.96Å; F24-I26 PolarHBondContact O-N 3.37Å; F24-V27 PolarHBondContact O-N 3Å; F24-C28 WeakPolarHBondContact CE2-SG 3.47Å; F24-C28 PolarHBondContact O-N 3.43Å; F24-C28 PolarHBondContact O-SG 3.43Å; F24-L73 HydrophobicContact CE2-CD2 3.9Å; F24-L73 HydrophobicContact CZ-CD1 4.2Å; F24-L73 HydrophobicContact CZ-CD2 3.63Å; F24-L283 HydrophobicContact CD2-CB 4.47Å; F24-L283 HydrophobicContact CE2-CB 3.99Å; F24-N287 VanDerWaalsContact CD2-OD1 3.23Å; F24-N287 WeakPolarHBondContact CD2-OD1 3.43Å; F24-N287 WeakPolarHBondContact CE2-ND2 3.29Å; F24-N287 WeakPolarHBondContact CG-OD1 3.34Å; F24-N287 WeakPolarHBondContact CZ-ND2 3.37Å; F24-D296 HydrophobicContact CE1-CB 3.95Å; F24-I300 HydrophobicContact CZ-CD1 4.48Å
25	I	98	Very high	93.7	Very high	19 Å²	19	26 Å²	26	10%	0.097	13%	0.133	C	C	.	.	H	α-helix	trans	-60.9	-43.9	-176.5	-64.6	-63	0	0	0	111.4	K21 S22 V27 C28 F29 D296 L299	K21-I25 HydrophobicContact CG-CG1 4.36Å; K21-I25 WeakPolarHBondContact O-CG1 3.36Å; K21-I25 PolarHBondContact O-N 2.92Å; K21-I25 VanDerWaalsContact O-N 3.13Å; S22-I25 PolarHBondContact O-N 3.21Å; I25-V27 VanDerWaalsContact C-N 3.34Å; I25-V27 PolarHBondContact O-N 2.9Å; I25-C28 WeakPolarHBondContact O-CB 2.98Å; I25-C28 PolarHBondContact O-N 2.79Å; I25-F29 HydrophobicContact CG2-CD1 4.2Å; I25-F29 HydrophobicContact CG2-CD2 4.35Å; I25-F29 HydrophobicContact CG2-CE1 3.59Å; I25-F29 HydrophobicContact CG2-CE2 3.77Å; I25-F29 HydrophobicContact CG2-CZ 3.33Å; I25-F29 WeakPolarHBondContact O-CD1 2.99Å; I25-F29 WeakPolarHBondContact O-CG 3.27Å; I25-F29 PolarHBondContact O-N 3.38Å; I25-D296 HydrophobicContact CD1-CB 3.75Å; I25-L299 HydrophobicContact CG2-CD2 4.03Å
26	I	98	Very high	94.2	Very high	14 Å²	14	25.6 Å²	25.6	7%	0.072	13%	0.133	C	C	.	.	H	α-helix	trans	-66.8	-36.5	-179.8	-163.2	63.6	0	0	0	111.8	S22 D23 F24 C28 F29 V30 C217 Y218 F221	S22-I26 WeakPolarHBondContact O-CB 3.47Å; S22-I26 WeakPolarHBondContact O-CG2 3.39Å; S22-I26 PolarHBondContact O-N 2.94Å; D23-I26 VanDerWaalsContact O-CG2 3.29Å; D23-I26 WeakPolarHBondContact O-CG2 3.24Å; F24-I26 PolarHBondContact O-N 3.37Å; I26-C28 VanDerWaalsContact C-N 3.33Å; I26-F29 HydrophobicContact CD1-CD2 4.24Å; I26-F29 PolarHBondContact O-N 3.13Å; I26-V30 WeakPolarHBondContact O-CB 3.38Å; I26-V30 WeakPolarHBondContact O-CG2 3.36Å; I26-V30 PolarHBondContact O-N 2.8Å; I26-C217 HydrophobicContact CG2-CB 4.17Å; I26-Y218 HydrophobicContact CB-CD1 4.48Å; I26-Y218 HydrophobicContact CB-CE1 4.34Å; I26-Y218 HydrophobicContact CG1-CD1 4.04Å; I26-Y218 HydrophobicContact CG1-CE1 4.37Å; I26-Y218 HydrophobicContact CG1-CG 4.23Å; I26-Y218 HydrophobicContact CG2-CD1 4.48Å; I26-Y218 HydrophobicContact CG2-CD2 4.08Å; I26-Y218 HydrophobicContact CG2-CE1 4.3Å; I26-Y218 HydrophobicContact CG2-CE2 3.88Å; I26-Y218 HydrophobicContact CG2-CG 4.38Å; I26-F221 HydrophobicContact CD1-CB 3.72Å; I26-F221 HydrophobicContact CD1-CD1 3.38Å; I26-F221 HydrophobicContact CD1-CD2 4.41Å; I26-F221 HydrophobicContact CD1-CE1 4.06Å; I26-F221 HydrophobicContact CD1-CG 3.57Å; I26-F221 HydrophobicContact CG1-CB 4.14Å; I26-F221 HydrophobicContact CG1-CG 4.47Å
27	V	98.3	Very high	94.8	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.4	-40.2	174.1	173.1	0	0	0	0	110.5	W18 D23 F24 I25 F29 V30 Y31 C217 L283 V375	W18-V27 HydrophobicContact CH2-CB 4.22Å; W18-V27 HydrophobicContact CH2-CG1 4.07Å; W18-V27 HydrophobicContact CH2-CG2 3.92Å; W18-V27 HydrophobicContact CZ3-CG2 3.83Å; D23-V27 WeakPolarHBondContact O-CG2 3.39Å; D23-V27 PolarHBondContact O-N 3.35Å; F24-V27 PolarHBondContact O-N 3Å; I25-V27 VanDerWaalsContact C-N 3.34Å; I25-V27 PolarHBondContact O-N 2.9Å; V27-F29 VanDerWaalsContact C-N 3.34Å; V27-F29 PolarHBondContact O-N 2.82Å; V27-V30 WeakPolarHBondContact O-CB 3.37Å; V27-V30 PolarHBondContact O-N 3.37Å; V27-Y31 WeakPolarHBondContact O-CB 3.5Å; V27-Y31 PolarHBondContact O-N 3.36Å; V27-C217 HydrophobicContact CG2-CB 3.86Å; V27-L283 HydrophobicContact CG1-CD1 4.44Å; V27-L283 HydrophobicContact CG1-CD2 3.59Å; V27-V375 HydrophobicContact CG1-CG2 3.97Å
28	C	98.3	Very high	95	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.8	-38.1	172.4	-66.8	0	0	0	0	112.3	F24 I25 I26 Y31 V32 I300	F24-C28 WeakPolarHBondContact CE2-SG 3.47Å; F24-C28 PolarHBondContact O-N 3.43Å; F24-C28 PolarHBondContact O-SG 3.43Å; I25-C28 WeakPolarHBondContact O-CB 2.98Å; I25-C28 PolarHBondContact O-N 2.79Å; I26-C28 VanDerWaalsContact C-N 3.33Å; C28-Y31 WeakPolarHBondContact O-CB 3.28Å; C28-Y31 PolarHBondContact O-N 2.73Å; C28-V32 WeakPolarHBondContact O-CG2 3.35Å; C28-V32 PolarHBondContact O-N 3.46Å; C28-I300 HydrophobicContact CB-CD1 3.6Å; C28-I300 HydrophobicContact CB-CG1 3.66Å; C28-I300 HydrophobicContact CB-CG2 4.49Å
29	F	98.3	Very high	95.2	Very high	27 Å²	27	21.5 Å²	21.5	12%	0.118	11%	0.112	C	C	.	.	H	α-helix	trans	-65.2	-44.9	176.8	-68.7	-2.5	0	0	0	112.4	I25 I26 V27 Y31 V32 F33 F221 L299 I303	I25-F29 HydrophobicContact CG2-CD1 4.2Å; I25-F29 HydrophobicContact CG2-CD2 4.35Å; I25-F29 HydrophobicContact CG2-CE1 3.59Å; I25-F29 HydrophobicContact CG2-CE2 3.77Å; I25-F29 HydrophobicContact CG2-CZ 3.33Å; I25-F29 WeakPolarHBondContact O-CD1 2.99Å; I25-F29 WeakPolarHBondContact O-CG 3.27Å; I25-F29 PolarHBondContact O-N 3.38Å; I26-F29 HydrophobicContact CD1-CD2 4.24Å; I26-F29 PolarHBondContact O-N 3.13Å; V27-F29 VanDerWaalsContact C-N 3.34Å; V27-F29 PolarHBondContact O-N 2.82Å; F29-Y31 VanDerWaalsContact C-N 3.25Å; F29-Y31 PolarHBondContact O-N 2.9Å; F29-V32 PolarHBondContact O-N 3.23Å; F29-F33 WeakPolarHBondContact O-CB 3.33Å; F29-F33 PolarHBondContact O-N 3.36Å; F29-F221 HydrophobicContact CB-CD2 3.88Å; F29-F221 HydrophobicContact CB-CE2 3.63Å; F29-F221 HydrophobicContact CB-CZ 4.12Å; F29-F221 HydrophobicContact CD2-CE1 4.34Å; F29-F221 HydrophobicContact CD2-CE2 4.4Å; F29-F221 HydrophobicContact CD2-CZ 4.03Å; F29-F221 HydrophobicContact CG-CE2 4.45Å; F29-F221 HydrophobicContact CG-CZ 4.5Å; F29-L299 HydrophobicContact CE1-CD2 4.32Å; F29-L299 HydrophobicContact CE1-CG 3.95Å; F29-L299 HydrophobicContact CZ-CD1 4.22Å; F29-L299 HydrophobicContact CZ-CD2 3.87Å; F29-L299 HydrophobicContact CZ-CG 3.77Å; F29-I303 HydrophobicContact CB-CG2 4.44Å; F29-I303 HydrophobicContact CD1-CB 4.11Å; F29-I303 HydrophobicContact CD1-CG1 4.28Å; F29-I303 HydrophobicContact CD1-CG2 3.82Å; F29-I303 HydrophobicContact CD2-CG2 4.33Å; F29-I303 HydrophobicContact CE1-CB 3.95Å; F29-I303 HydrophobicContact CE1-CG1 3.68Å; F29-I303 HydrophobicContact CE1-CG2 4.11Å; F29-I303 HydrophobicContact CE2-CG1 4.18Å; F29-I303 HydrophobicContact CG-CG2 3.96Å; F29-I303 HydrophobicContact CZ-CB 4.36Å; F29-I303 HydrophobicContact CZ-CD1 4.36Å; F29-I303 HydrophobicContact CZ-CG1 3.63Å; F29-I303 HydrophobicContact CZ-CG2 4.49Å
30	V	97.9	Very high	95.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-52.6	-45.6	169.7	152.2	0	0	0	0	110.7	I26 V27 C217 F221 N371	I26-V30 WeakPolarHBondContact O-CB 3.38Å; I26-V30 WeakPolarHBondContact O-CG2 3.36Å; I26-V30 PolarHBondContact O-N 2.8Å; V27-V30 WeakPolarHBondContact O-CB 3.37Å; V27-V30 PolarHBondContact O-N 3.37Å; V30-C217 HydrophobicContact CG2-CB 3.86Å; V30-C217 WeakPolarHBondContact CG2-O 3.47Å; V30-F221 HydrophobicContact CG2-CB 3.71Å; V30-F221 HydrophobicContact CG2-CD2 4.41Å; V30-N371 HydrophobicContact CB-CB 4.26Å; V30-N371 HydrophobicContact CG1-CB 3.36Å; V30-N371 VanDerWaalsContact CG1-CG 3.48Å
31	Y	97.9	Very high	95.5	Very high	4 Å²	4	14 Å²	14	2%	0.016	8%	0.077	C	C	.	.	H	α-helix	trans	-66	-44.3	-178.8	-170.7	-128.3	0	0	0	113.4	V27 C28 F29 F33 G274 F277 A279 Y280 F372 V375	V27-Y31 WeakPolarHBondContact O-CB 3.5Å; V27-Y31 PolarHBondContact O-N 3.36Å; C28-Y31 WeakPolarHBondContact O-CB 3.28Å; C28-Y31 PolarHBondContact O-N 2.73Å; F29-Y31 VanDerWaalsContact C-N 3.25Å; F29-Y31 PolarHBondContact O-N 2.9Å; Y31-F33 VanDerWaalsContact C-N 3.33Å; Y31-G274 PolarHBondContact OH-O 2.96Å; Y31-F277 WeakPolarHBondContact OH-CD2 3.37Å; Y31-A279 HydrophobicContact CE1-CB 3.9Å; Y31-A279 HydrophobicContact CE2-CB 4.29Å; Y31-A279 VanDerWaalsContact OH-CB 3.31Å; Y31-A279 WeakPolarHBondContact OH-CB 3.49Å; Y31-Y280 HydrophobicContact CD1-CE1 4.14Å; Y31-Y280 HydrophobicContact CD1-CE2 4.3Å; Y31-Y280 AromaticContact CD1-CZ 3.84Å; Y31-Y280 HydrophobicContact CE1-CD2 4.46Å; Y31-Y280 HydrophobicContact CE1-CE1 4.48Å; Y31-Y280 AromaticContact CE1-CE2 3.92Å; Y31-Y280 HydrophobicContact CE1-CE2 3.92Å; Y31-Y280 AromaticContact CE1-CZ 3.95Å; Y31-F372 AromaticContact CD2-CD2 3.93Å; Y31-F372 HydrophobicContact CD2-CD2 3.93Å; Y31-F372 HydrophobicContact CD2-CE2 4.35Å; Y31-F372 AromaticContact CE2-CD2 3.57Å; Y31-F372 HydrophobicContact CE2-CD2 3.57Å; Y31-F372 AromaticContact CE2-CE2 3.54Å; Y31-F372 HydrophobicContact CE2-CE2 3.54Å; Y31-V375 HydrophobicContact CD2-CB 3.57Å; Y31-V375 HydrophobicContact CD2-CG1 3.59Å; Y31-V375 HydrophobicContact CD2-CG2 3.84Å; Y31-V375 HydrophobicContact CE2-CB 3.97Å; Y31-V375 HydrophobicContact CE2-CG1 3.73Å; Y31-V375 HydrophobicContact CG-CB 4.27Å; Y31-V375 HydrophobicContact CG-CG1 4.03Å; Y31-V375 HydrophobicContact CG-CG2 4.16Å
32	V	97.7	Very high	95.5	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-82.8	-7.9	-178.4	-58.7	0	0	0	0	114	C28 F29 S34 Y280 I300 H304	C28-V32 WeakPolarHBondContact O-CG2 3.35Å; C28-V32 PolarHBondContact O-N 3.46Å; F29-V32 PolarHBondContact O-N 3.23Å; V32-S34 PolarHBondContact O-N 3.17Å; V32-Y280 WeakPolarHBondContact CG1-OH 3.45Å; V32-I300 HydrophobicContact CG1-CG2 3.62Å; V32-H304 HydrophobicContact CB-CB 3.86Å; V32-H304 HydrophobicContact CG1-CB 4.45Å; V32-H304 HydrophobicContact CG2-CB 3.97Å; V32-H304 PolarHBondContact O-ND1 3.3Å
33	F	97.2	Very high	95.4	Very high	3 Å²	3	8.4 Å²	8.4	1%	0.013	5%	0.045	C	C	.	.	S	Bend	trans	-75.2	70.1	171.2	-158.5	171.6	0	0	0	109.8	F29 Y31 I38 F221 P224 L225 V228 L307 F364 L368	F29-F33 WeakPolarHBondContact O-CB 3.33Å; F29-F33 PolarHBondContact O-N 3.36Å; Y31-F33 VanDerWaalsContact C-N 3.33Å; F33-I38 HydrophobicContact CD2-CD1 4.17Å; F33-I38 HydrophobicContact CE2-CD1 3.77Å; F33-F221 HydrophobicContact CD1-CD2 4.38Å; F33-F221 HydrophobicContact CD1-CE2 4.29Å; F33-P224 HydrophobicContact CD1-CG 4.42Å; F33-P224 HydrophobicContact CE1-CB 4.04Å; F33-P224 HydrophobicContact CE1-CG 4.26Å; F33-L225 HydrophobicContact CE1-CB 4.39Å; F33-V228 HydrophobicContact CZ-CB 4.42Å; F33-V228 HydrophobicContact CZ-CG1 3.84Å; F33-L307 HydrophobicContact CB-CD1 3.87Å; F33-L307 HydrophobicContact CD1-CD1 4.14Å; F33-L307 HydrophobicContact CD1-CD2 4.31Å; F33-L307 HydrophobicContact CD2-CB 4.04Å; F33-L307 HydrophobicContact CD2-CD1 4.09Å; F33-L307 HydrophobicContact CD2-CD2 4.33Å; F33-L307 HydrophobicContact CD2-CG 4.39Å; F33-L307 HydrophobicContact CE1-CD2 4.1Å; F33-L307 HydrophobicContact CE2-CB 4.21Å; F33-L307 HydrophobicContact CE2-CD2 4.1Å; F33-L307 HydrophobicContact CG-CD1 3.79Å; F33-L307 HydrophobicContact CG-CD2 4.44Å; F33-L307 HydrophobicContact CZ-CD2 4Å; F33-F364 HydrophobicContact CE1-CE2 4.46Å; F33-F364 HydrophobicContact CE2-CE2 4.17Å; F33-F364 HydrophobicContact CE2-CZ 4.18Å; F33-F364 AromaticContact CZ-CE2 3.77Å; F33-F364 HydrophobicContact CZ-CE2 3.77Å; F33-F364 HydrophobicContact CZ-CZ 4.2Å; F33-L368 HydrophobicContact CB-CD2 4.16Å; F33-L368 HydrophobicContact CD1-CD2 3.74Å; F33-L368 HydrophobicContact CD2-CD1 4.39Å; F33-L368 HydrophobicContact CD2-CD2 3.81Å; F33-L368 HydrophobicContact CE1-CD2 4.06Å; F33-L368 HydrophobicContact CE2-CD1 4.49Å; F33-L368 HydrophobicContact CE2-CD2 4.15Å; F33-L368 HydrophobicContact CG-CD2 3.6Å; F33-L368 HydrophobicContact CZ-CD2 4.25Å
34	S	89.6	Confident	95.3	Very high	17 Å²	17	9.2 Å²	9.2	12%	0.119	5%	0.048	C	C	.	.			trans	-84	121.7	-163.5	165.2	0	0	0	0	112.3	V32 T36 S37 I38 G272	V32-S34 PolarHBondContact O-N 3.17Å; S34-T36 VanDerWaalsContact C-N 3.27Å; S34-T36 PolarHBondContact O-N 3.48Å; S34-T36 PolarHBondContact OG-N 3.25Å; S34-T36 PolarHBondContact OG-OG1 2.75Å; S34-S37 PolarHBondContact O-N 3.19Å; S34-S37 PolarHBondContact OG-N 2.96Å; S34-S37 PolarHBondContact OG-OG 3.22Å; S34-I38 WeakPolarHBondContact O-CG1 3.32Å; S34-I38 PolarHBondContact O-N 2.78Å; S34-G272 VanDerWaalsContact CB-O 3.26Å; S34-G272 WeakPolarHBondContact CB-O 3.5Å
35	S	91.9	Very high	95.2	Very high	11 Å²	11	9.8 Å²	9.8	8%	0.077	5%	0.051	C	C	.	.	H	α-helix	trans	-63.1	-33.4	172.7	56.5	0	0	0	0	112.5	S37 I38 L39	S35-S37 VanDerWaalsContact C-N 3.33Å; S35-S37 PolarHBondContact O-N 2.9Å; S35-I38 PolarHBondContact O-N 3.43Å; S35-L39 WeakPolarHBondContact O-CB 3.49Å; S35-L39 WeakPolarHBondContact O-CG 3.41Å; S35-L39 PolarHBondContact O-N 2.87Å
36	T	87.4	Confident	95	Very high	20 Å²	20	10.8 Å²	10.8	12%	0.123	6%	0.056	C	C	.	.	H	α-helix	trans	-67.3	-35.8	179.4	61.4	0	0	0	0	111.7	S34 A40 Y112 Q268 Y271	S34-T36 VanDerWaalsContact C-N 3.27Å; S34-T36 PolarHBondContact O-N 3.48Å; S34-T36 PolarHBondContact OG-N 3.25Å; S34-T36 PolarHBondContact OG-OG1 2.75Å; T36-A40 WeakPolarHBondContact O-CB 3.35Å; T36-A40 PolarHBondContact O-N 3.36Å; T36-Y112 WeakPolarHBondContact CG2-OH 3.46Å; T36-Q268 PolarHBondContact O-NE2 3.13Å; T36-Y271 HydrophobicContact CG2-CE1 4.05Å
37	S	92.3	Very high	94.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-63.6	-46.8	172.9	-59.1	0	0	0	0	111.4	S34 S35 L39 L41 Q268 G272	S34-S37 PolarHBondContact O-N 3.19Å; S34-S37 PolarHBondContact OG-N 2.96Å; S34-S37 PolarHBondContact OG-OG 3.22Å; S35-S37 VanDerWaalsContact C-N 3.33Å; S35-S37 PolarHBondContact O-N 2.9Å; S37-L39 VanDerWaalsContact C-N 3.33Å; S37-L39 PolarHBondContact O-N 3.14Å; S37-L41 VanDerWaalsContact O-CB 3.28Å; S37-L41 WeakPolarHBondContact O-CB 3.17Å; S37-L41 VanDerWaalsContact O-CD1 3.28Å; S37-L41 WeakPolarHBondContact O-CD1 3.41Å; S37-L41 WeakPolarHBondContact O-CG 3.3Å; S37-L41 PolarHBondContact O-N 2.71Å; S37-L41 VanDerWaalsContact O-N 3.15Å; S37-Q268 VanDerWaalsContact CA-NE2 3.34Å; S37-G272 WeakPolarHBondContact OG-CA 3.49Å
38	I	95.3	Very high	94.6	Very high	2 Å²	2	15.5 Å²	15.5	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-64	-40	-178.1	-61.2	-179.6	0	0	0	111.8	F33 S34 S35 V315 F364 F365 L368	F33-I38 HydrophobicContact CD2-CD1 4.17Å; F33-I38 HydrophobicContact CE2-CD1 3.77Å; S34-I38 WeakPolarHBondContact O-CG1 3.32Å; S34-I38 PolarHBondContact O-N 2.78Å; S35-I38 PolarHBondContact O-N 3.43Å; I38-V315 HydrophobicContact CG2-CG2 3.48Å; I38-V315 VanDerWaalsContact CG2-CG2 3.48Å; I38-F364 HydrophobicContact CD1-CE1 4.06Å; I38-F364 HydrophobicContact CD1-CZ 3.58Å; I38-F365 HydrophobicContact CG2-CE1 4.27Å; I38-F365 HydrophobicContact CG2-CZ 4.2Å; I38-L368 HydrophobicContact CD1-CD1 3.7Å
39	L	95.4	Very high	94.4	Very high	13 Å²	13	16.1 Å²	16.1	7%	0.068	8%	0.084	C	C	.	.	H	α-helix	trans	-81.4	-32.6	-176.6	-66.4	170	0	0	0	113.6	S35 S37 Q340 L341 L344 F365	S35-L39 WeakPolarHBondContact O-CB 3.49Å; S35-L39 WeakPolarHBondContact O-CG 3.41Å; S35-L39 PolarHBondContact O-N 2.87Å; S37-L39 VanDerWaalsContact C-N 3.33Å; S37-L39 PolarHBondContact O-N 3.14Å; L39-Q340 HydrophobicContact CB-CB 4.39Å; L39-Q340 HydrophobicContact CD2-CB 4.07Å; L39-Q340 HydrophobicContact CD2-CG 4.17Å; L39-Q340 WeakPolarHBondContact O-CG 3.36Å; L39-L341 HydrophobicContact CD1-CB 4.43Å; L39-L341 HydrophobicContact CD2-CB 4.02Å; L39-L344 HydrophobicContact CD2-CD1 3.87Å; L39-F365 HydrophobicContact CD1-CD1 4.32Å; L39-F365 HydrophobicContact CD1-CE1 3.9Å; L39-F365 HydrophobicContact CD2-CE1 3.64Å; L39-F365 HydrophobicContact CD2-CE2 4.34Å; L39-F365 HydrophobicContact CD2-CZ 3.47Å; L39-F365 VanDerWaalsContact CD2-CZ 3.47Å; L39-F365 HydrophobicContact CG-CE1 3.67Å; L39-F365 HydrophobicContact CG-CZ 4.04Å
40	A	93.8	Very high	94.3	Very high	4 Å²	4	14.9 Å²	14.9	3%	0.033	8%	0.08	C	C	.	.	H	α-helix	trans	-90.4	-34.5	-175	0	0	0	0	0	114	T36 K43 M44 Y336	T36-A40 WeakPolarHBondContact O-CB 3.35Å; T36-A40 PolarHBondContact O-N 3.36Å; A40-K43 PolarHBondContact O-N 2.85Å; A40-M44 HydrophobicContact CB-CE 4.37Å; A40-M44 HydrophobicContact CB-SD 4.34Å; A40-M44 WeakPolarHBondContact O-CG 2.99Å; A40-M44 PolarHBondContact O-N 3.4Å; A40-Y336 HydrophobicContact CB-CD1 4.46Å
41	L	95.1	Very high	94.1	Very high	3 Å²	3	15.5 Å²	15.5	2%	0.016	9%	0.086	C	C	.	.	H	α-helix	trans	-57.9	-45.1	-169.9	-73.7	171	0	0	0	114.7	S37 K43 M44 F45 F53 Y57 Q268 L312	S37-L41 VanDerWaalsContact O-CB 3.28Å; S37-L41 WeakPolarHBondContact O-CB 3.17Å; S37-L41 VanDerWaalsContact O-CD1 3.28Å; S37-L41 WeakPolarHBondContact O-CD1 3.41Å; S37-L41 WeakPolarHBondContact O-CG 3.3Å; S37-L41 PolarHBondContact O-N 2.71Å; S37-L41 VanDerWaalsContact O-N 3.15Å; L41-K43 VanDerWaalsContact C-N 3.29Å; L41-K43 PolarHBondContact O-N 3.2Å; L41-M44 PolarHBondContact O-N 3.48Å; L41-M44 VanDerWaalsContact O-N 3.14Å; L41-F45 HydrophobicContact CB-CD2 4.35Å; L41-F45 HydrophobicContact CB-CE2 4.44Å; L41-F45 HydrophobicContact CD2-CD2 4.48Å; L41-F45 HydrophobicContact CD2-CE2 4.12Å; L41-F45 VanDerWaalsContact O-CD2 3.28Å; L41-F45 WeakPolarHBondContact O-CD2 3.38Å; L41-F45 PolarHBondContact O-N 3.39Å; L41-F53 HydrophobicContact CD2-CE1 4.14Å; L41-Y57 HydrophobicContact CD2-CD2 4.25Å; L41-Y57 HydrophobicContact CD2-CE2 4Å; L41-Q268 HydrophobicContact CD2-CG 3.7Å; L41-Q268 HydrophobicContact CG-CG 4.39Å; L41-L312 HydrophobicContact CB-CD1 4.01Å
42	P	93.8	Very high	94.1	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-55.5	-44.4	-176.3	-22.5	29	0	0	0	113.2	I46 I248 L312 V315 L319 L334	P42-I46 PolarHBondContact O-N 3.1Å; P42-I248 HydrophobicContact CB-CD1 3.94Å; P42-L312 HydrophobicContact CB-CD1 4.17Å; P42-L312 HydrophobicContact CG-CD1 3.94Å; P42-V315 HydrophobicContact CB-CG1 4.36Å; P42-V315 HydrophobicContact CG-CB 3.89Å; P42-V315 HydrophobicContact CG-CG1 3.44Å; P42-V315 VanDerWaalsContact CG-CG1 3.44Å; P42-L319 HydrophobicContact CB-CD1 4.47Å; P42-L334 HydrophobicContact CB-CD2 4.21Å
43	K	93.3	Very high	94.1	Very high	34 Å²	34	15.3 Å²	15.3	15%	0.148	9%	0.085	C	C	.	.	H	α-helix	trans	-70	-43.3	178.2	-174.2	166.8	176.3	172.3	0	111.8	A40 L41 F45 I46 E47 L334 T335 Y336	A40-K43 PolarHBondContact O-N 2.85Å; L41-K43 VanDerWaalsContact C-N 3.29Å; L41-K43 PolarHBondContact O-N 3.2Å; K43-F45 VanDerWaalsContact C-N 3.31Å; K43-F45 PolarHBondContact O-N 3.17Å; K43-I46 PolarHBondContact O-N 3.24Å; K43-E47 VanDerWaalsContact CE-CD 3.45Å; K43-E47 WeakPolarHBondContact CE-OE1 3.43Å; K43-E47 HydrophobicContact CG-CG 4.24Å; K43-E47 IonicContact NZ-OE1 2.69Å; K43-E47 WeakPolarHBondContact O-CG 3.44Å; K43-E47 PolarHBondContact O-N 3Å; K43-L334 HydrophobicContact CB-CB 4.28Å; K43-L334 HydrophobicContact CB-CD2 4.17Å; K43-L334 HydrophobicContact CD-CB 4.08Å; K43-L334 HydrophobicContact CG-CB 4.09Å; K43-L334 PolarHBondContact NZ-O 3.18Å; K43-T335 WeakPolarHBondContact CD-O 3.27Å; K43-Y336 HydrophobicContact CB-CD1 4.45Å; K43-Y336 HydrophobicContact CB-CE1 3.87Å; K43-Y336 HydrophobicContact CD-CD1 4.12Å; K43-Y336 HydrophobicContact CD-CD2 3.72Å; K43-Y336 HydrophobicContact CD-CE1 3.74Å; K43-Y336 HydrophobicContact CD-CE2 3.3Å; K43-Y336 HydrophobicContact CD-CG 4.11Å; K43-Y336 HydrophobicContact CG-CE1 3.89Å; K43-Y336 HydrophobicContact CG-CE2 4.08Å; K43-Y336 WeakPolarHBondContact CG-OH 3.45Å
44	M	94.9	Very high	94.1	Very high	22 Å²	22	15.7 Å²	15.7	11%	0.108	9%	0.089	C	C	.	.	H	α-helix	trans	-59.3	-41	176.2	-71.5	-177.2	164.4	0	0	112.6	A40 L41 N48 F53 Q268 Y336	A40-M44 HydrophobicContact CB-CE 4.37Å; A40-M44 HydrophobicContact CB-SD 4.34Å; A40-M44 WeakPolarHBondContact O-CG 2.99Å; A40-M44 PolarHBondContact O-N 3.4Å; L41-M44 PolarHBondContact O-N 3.48Å; L41-M44 VanDerWaalsContact O-N 3.14Å; M44-N48 WeakPolarHBondContact O-CB 3.19Å; M44-N48 PolarHBondContact O-N 3.42Å; M44-N48 PolarHBondContact O-ND2 3.25Å; M44-F53 HydrophobicContact CB-CE1 3.89Å; M44-F53 HydrophobicContact CB-CE2 4.28Å; M44-F53 HydrophobicContact CB-CZ 3.71Å; M44-F53 HydrophobicContact CG-CZ 4.46Å; M44-F53 HydrophobicContact SD-CZ 4.09Å; M44-Q268 HydrophobicContact CE-CB 4.16Å; M44-Q268 HydrophobicContact CE-CG 4.37Å; M44-Q268 HydrophobicContact SD-CB 3.68Å; M44-Q268 HydrophobicContact SD-CG 3.6Å; M44-Q268 VanDerWaalsContact SD-CG 3.6Å; M44-Y336 HydrophobicContact CG-CE1 4.27Å
45	F	95.4	Very high	94.4	Very high	12 Å²	12	17.6 Å²	17.6	5%	0.053	10%	0.101	C	C	.	.	H	α-helix	trans	-58.5	-55.2	174.2	-91.9	-107.9	0	0	0	110.2	L41 K43 E47 N48 G49 G50 F53 I248 F249 L312	L41-F45 HydrophobicContact CB-CD2 4.35Å; L41-F45 HydrophobicContact CB-CE2 4.44Å; L41-F45 HydrophobicContact CD2-CD2 4.48Å; L41-F45 HydrophobicContact CD2-CE2 4.12Å; L41-F45 VanDerWaalsContact O-CD2 3.28Å; L41-F45 WeakPolarHBondContact O-CD2 3.38Å; L41-F45 PolarHBondContact O-N 3.39Å; K43-F45 VanDerWaalsContact C-N 3.31Å; K43-F45 PolarHBondContact O-N 3.17Å; F45-E47 PolarHBondContact O-N 3.2Å; F45-N48 PolarHBondContact O-N 3.41Å; F45-G49 PolarHBondContact O-N 3.09Å; F45-G50 VanDerWaalsContact CD1-O 3.23Å; F45-G50 WeakPolarHBondContact CD1-O 3.31Å; F45-G50 WeakPolarHBondContact O-CA 3.37Å; F45-G50 PolarHBondContact O-N 3.27Å; F45-F53 HydrophobicContact CD1-CD1 4.44Å; F45-F53 AromaticContact CD2-CD1 3.48Å; F45-F53 HydrophobicContact CD2-CD1 3.48Å; F45-F53 VanDerWaalsContact CD2-CD1 3.48Å; F45-F53 AromaticContact CD2-CE1 3.76Å; F45-F53 HydrophobicContact CD2-CE1 3.76Å; F45-F53 AromaticContact CE2-CD1 3.66Å; F45-F53 HydrophobicContact CE2-CD1 3.66Å; F45-F53 AromaticContact CE2-CE1 3.84Å; F45-F53 HydrophobicContact CE2-CE1 3.84Å; F45-F53 AromaticContact CG-CD1 3.92Å; F45-F53 HydrophobicContact CG-CD1 3.92Å; F45-F53 HydrophobicContact CZ-CD1 4.22Å; F45-I248 HydrophobicContact CB-CG2 3.95Å; F45-I248 HydrophobicContact CD1-CG2 3.86Å; F45-I248 HydrophobicContact CG-CG2 4.04Å; F45-F249 HydrophobicContact CE1-CE1 4.37Å; F45-L312 HydrophobicContact CD1-CD2 4.34Å; F45-L312 HydrophobicContact CD2-CD1 4.22Å; F45-L312 HydrophobicContact CD2-CD2 3.98Å; F45-L312 HydrophobicContact CE1-CD2 3.96Å; F45-L312 HydrophobicContact CE2-CD2 3.55Å; F45-L312 HydrophobicContact CG-CD2 4.36Å; F45-L312 HydrophobicContact CZ-CD2 3.54Å
46	I	93.1	Very high	94.7	Very high	40 Å²	40	17.1 Å²	17.1	21%	0.205	10%	0.097	C	C	.	.	H	α-helix	trans	-61.8	-42.5	-176.8	-72.9	174	0	0	0	112.3	P42 K43 N48 M244 I248 L334	P42-I46 PolarHBondContact O-N 3.1Å; K43-I46 PolarHBondContact O-N 3.24Å; I46-N48 VanDerWaalsContact C-N 3.31Å; I46-N48 PolarHBondContact O-N 3.05Å; I46-M244 HydrophobicContact CD1-CE 3.38Å; I46-M244 HydrophobicContact CD1-SD 3.93Å; I46-I248 HydrophobicContact CD1-CD1 4.36Å; I46-I248 HydrophobicContact CD1-CG1 3.7Å; I46-I248 HydrophobicContact CG1-CG1 3.71Å; I46-L334 HydrophobicContact CB-CD1 4.03Å; I46-L334 HydrophobicContact CD1-CD1 3.38Å; I46-L334 HydrophobicContact CD1-CD2 4.17Å; I46-L334 HydrophobicContact CD1-CG 4.32Å; I46-L334 HydrophobicContact CG1-CD1 4.27Å; I46-L334 HydrophobicContact CG2-CD1 3.9Å
47	E	92.9	Very high	95.2	Very high	107 Å²	107	16.7 Å²	16.7	50%	0.5	9%	0.093	S	C	.	.	H	α-helix	trans	-73.6	-21.3	-178.1	-69	-178.5	162.7	0	0	113.2	K43 F45 Y336	K43-E47 VanDerWaalsContact CE-CD 3.45Å; K43-E47 WeakPolarHBondContact CE-OE1 3.43Å; K43-E47 HydrophobicContact CG-CG 4.24Å; K43-E47 IonicContact NZ-OE1 2.69Å; K43-E47 WeakPolarHBondContact O-CG 3.44Å; K43-E47 PolarHBondContact O-N 3Å; F45-E47 PolarHBondContact O-N 3.2Å; E47-Y336 PolarHBondContact OE2-OH 2.85Å
48	N	95.4	Very high	95.4	Very high	7 Å²	7	21.2 Å²	21.2	4%	0.037	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	27.4	-173.2	-63.8	-87.5	0	0	0	114.3	M44 F45 I46 F53 A255 T261	M44-N48 WeakPolarHBondContact O-CB 3.19Å; M44-N48 PolarHBondContact O-N 3.42Å; M44-N48 PolarHBondContact O-ND2 3.25Å; F45-N48 PolarHBondContact O-N 3.41Å; I46-N48 VanDerWaalsContact C-N 3.31Å; I46-N48 PolarHBondContact O-N 3.05Å; N48-F53 HydrophobicContact CB-CB 3.92Å; N48-F53 HydrophobicContact CB-CD2 3.52Å; N48-F53 HydrophobicContact CB-CE2 4.34Å; N48-F53 HydrophobicContact CB-CG 3.98Å; N48-F53 WeakPolarHBondContact O-CB 3.06Å; N48-A255 WeakPolarHBondContact O-CB 3.3Å; N48-T261 HydrophobicContact CB-CG2 4.05Å; N48-T261 WeakPolarHBondContact OD1-CA 3.38Å; N48-T261 PolarHBondContact OD1-OG1 3.4Å
49	G	94.7	Very high	95.6	Very high	12 Å²	12	24.5 Å²	24.5	12%	0.124	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	23.6	171.3	0	0	0	0	0	115.5	F45 G51 A52 D252	F45-G49 PolarHBondContact O-N 3.09Å; G49-G51 PolarHBondContact O-N 3.13Å; G49-A52 WeakPolarHBondContact O-CB 3.36Å; G49-A52 PolarHBondContact O-N 2.84Å; G49-A52 VanDerWaalsContact O-N 3.12Å; G49-D252 PolarHBondContact O-N 3.38Å
50	G	94.9	Very high	95.7	Very high	2 Å²	2	24 Å²	24	2%	0.021	13%	0.131	C	C	.	.	B	Isolated β-bridge	trans	57.1	-112.3	170.9	0	0	0	0	0	113	F45 A52 F53 G54 I248 E250	F45-G50 VanDerWaalsContact CD1-O 3.23Å; F45-G50 WeakPolarHBondContact CD1-O 3.31Å; F45-G50 WeakPolarHBondContact O-CA 3.37Å; F45-G50 PolarHBondContact O-N 3.27Å; G50-A52 PolarHBondContact O-N 3.2Å; G50-A52 VanDerWaalsContact O-N 3.14Å; G50-F53 WeakPolarHBondContact O-CB 3.46Å; G50-F53 PolarHBondContact O-N 2.95Å; G50-G54 PolarHBondContact O-N 3.43Å; G50-G54 VanDerWaalsContact O-N 3.14Å; G50-I248 CarbonylContact C-O 3.59Å; G50-I248 WeakPolarHBondContact CA-O 3.29Å; G50-E250 VanDerWaalsContact CA-O 3.31Å; G50-E250 WeakPolarHBondContact CA-O 3.41Å
51	G	94.7	Very high	95.9	Very high	13 Å²	13	24 Å²	24	13%	0.134	13%	0.131	C	C	.	.	H	α-helix	trans	-56.3	-30.6	180	0	0	0	0	0	113.9	G49 G54 V55 E250 T251	G49-G51 PolarHBondContact O-N 3.13Å; G51-G54 PolarHBondContact O-N 3.44Å; G51-V55 PolarHBondContact O-N 2.88Å; G51-E250 PolarHBondContact N-O 3.39Å; G51-T251 WeakPolarHBondContact CA-OG1 3.08Å
52	A	97.1	Very high	96	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-43.3	176.5	0	0	0	0	0	111.6	G49 G50 G54 V55 A56 T251 D252 W253 L256	G49-A52 WeakPolarHBondContact O-CB 3.36Å; G49-A52 PolarHBondContact O-N 2.84Å; G49-A52 VanDerWaalsContact O-N 3.12Å; G50-A52 PolarHBondContact O-N 3.2Å; G50-A52 VanDerWaalsContact O-N 3.14Å; A52-G54 VanDerWaalsContact C-N 3.3Å; A52-G54 PolarHBondContact O-N 3.02Å; A52-V55 PolarHBondContact O-N 2.93Å; A52-A56 PolarHBondContact O-N 2.92Å; A52-A56 VanDerWaalsContact O-N 3.11Å; A52-T251 HydrophobicContact CB-CG2 4.04Å; A52-D252 WeakPolarHBondContact CB-O 3.25Å; A52-W253 HydrophobicContact CB-CE3 4.23Å; A52-L256 HydrophobicContact CB-CD2 4.33Å; A52-L256 HydrophobicContact CB-CG 4.12Å; A52-L256 WeakPolarHBondContact O-CD2 3.11Å
53	F	97.5	Very high	96.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.8	-41.1	171.8	177.1	-95.2	0	0	0	111.5	L41 M44 F45 N48 G50 V55 A56 Y57 T261 C264 A265	L41-F53 HydrophobicContact CD2-CE1 4.14Å; M44-F53 HydrophobicContact CB-CE1 3.89Å; M44-F53 HydrophobicContact CB-CE2 4.28Å; M44-F53 HydrophobicContact CB-CZ 3.71Å; M44-F53 HydrophobicContact CG-CZ 4.46Å; M44-F53 HydrophobicContact SD-CZ 4.09Å; F45-F53 HydrophobicContact CD1-CD1 4.44Å; F45-F53 AromaticContact CD2-CD1 3.48Å; F45-F53 HydrophobicContact CD2-CD1 3.48Å; F45-F53 VanDerWaalsContact CD2-CD1 3.48Å; F45-F53 AromaticContact CD2-CE1 3.76Å; F45-F53 HydrophobicContact CD2-CE1 3.76Å; F45-F53 AromaticContact CE2-CD1 3.66Å; F45-F53 HydrophobicContact CE2-CD1 3.66Å; F45-F53 AromaticContact CE2-CE1 3.84Å; F45-F53 HydrophobicContact CE2-CE1 3.84Å; F45-F53 AromaticContact CG-CD1 3.92Å; F45-F53 HydrophobicContact CG-CD1 3.92Å; F45-F53 HydrophobicContact CZ-CD1 4.22Å; N48-F53 HydrophobicContact CB-CB 3.92Å; N48-F53 HydrophobicContact CB-CD2 3.52Å; N48-F53 HydrophobicContact CB-CE2 4.34Å; N48-F53 HydrophobicContact CB-CG 3.98Å; N48-F53 WeakPolarHBondContact O-CB 3.06Å; G50-F53 WeakPolarHBondContact O-CB 3.46Å; G50-F53 PolarHBondContact O-N 2.95Å; F53-V55 VanDerWaalsContact C-N 3.28Å; F53-V55 PolarHBondContact O-N 2.89Å; F53-A56 PolarHBondContact O-N 3.32Å; F53-A56 VanDerWaalsContact O-N 3.13Å; F53-Y57 WeakPolarHBondContact O-CB 3.3Å; F53-Y57 PolarHBondContact O-N 2.87Å; F53-T261 HydrophobicContact CD2-CG2 4.26Å; F53-C264 HydrophobicContact CE2-CB 3.77Å; F53-A265 HydrophobicContact CD2-CB 4.23Å; F53-A265 HydrophobicContact CE2-CB 3.8Å; F53-A265 HydrophobicContact CZ-CB 4.3Å
54	G	96.7	Very high	96.3	Very high	10 Å²	10	30.5 Å²	30.5	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-56	-41.4	174.9	0	0	0	0	0	113	G50 G51 A52 Y57 L58	G50-G54 PolarHBondContact O-N 3.43Å; G50-G54 VanDerWaalsContact O-N 3.14Å; G51-G54 PolarHBondContact O-N 3.44Å; A52-G54 VanDerWaalsContact C-N 3.3Å; A52-G54 PolarHBondContact O-N 3.02Å; G54-Y57 PolarHBondContact O-N 3.28Å; G54-L58 WeakPolarHBondContact O-CG 3.31Å; G54-L58 PolarHBondContact O-N 3.37Å
55	V	96.7	Very high	96.5	Very high	58 Å²	58	29.4 Å²	29.4	35%	0.352	16%	0.164	S	C	.	.	H	α-helix	trans	-64.2	-47.4	174.2	174.5	0	0	0	0	111.3	G51 A52 F53 Y57 L58 I59 W253	G51-V55 PolarHBondContact O-N 2.88Å; A52-V55 PolarHBondContact O-N 2.93Å; F53-V55 VanDerWaalsContact C-N 3.28Å; F53-V55 PolarHBondContact O-N 2.89Å; V55-Y57 VanDerWaalsContact C-N 3.3Å; V55-Y57 PolarHBondContact O-N 3.02Å; V55-L58 PolarHBondContact O-N 3.16Å; V55-I59 HydrophobicContact CG1-CD1 3.8Å; V55-I59 HydrophobicContact CG1-CG1 4.45Å; V55-I59 VanDerWaalsContact O-CG1 3.32Å; V55-I59 WeakPolarHBondContact O-CG1 3.39Å; V55-I59 PolarHBondContact O-N 2.87Å; V55-W253 HydrophobicContact CG2-CH2 4.43Å; V55-W253 HydrophobicContact CG2-CZ3 4.32Å
56	A	98	Very high	96.6	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.9	-40.4	177.4	0	0	0	0	0	112.1	A52 F53 I59 S60 L256 W262 A265	A52-A56 PolarHBondContact O-N 2.92Å; A52-A56 VanDerWaalsContact O-N 3.11Å; F53-A56 PolarHBondContact O-N 3.32Å; F53-A56 VanDerWaalsContact O-N 3.13Å; A56-I59 PolarHBondContact O-N 3.11Å; A56-S60 PolarHBondContact O-N 2.91Å; A56-L256 HydrophobicContact CB-CD2 4.06Å; A56-W262 HydrophobicContact CB-CD2 4.3Å; A56-W262 HydrophobicContact CB-CE3 3.99Å; A56-W262 HydrophobicContact CB-CH2 4.08Å; A56-W262 HydrophobicContact CB-CZ2 4.37Å; A56-W262 HydrophobicContact CB-CZ3 3.88Å; A56-A265 HydrophobicContact CB-CB 3.81Å
57	Y	97.8	Very high	96.8	Very high	12 Å²	12	27.1 Å²	27.1	5%	0.047	15%	0.152	C	C	.	.	H	α-helix	trans	-63.5	-46.1	176.7	-179	-94.3	0	0	0	112	L41 F53 G54 V55 S60 L61 Q268 H304	L41-Y57 HydrophobicContact CD2-CD2 4.25Å; L41-Y57 HydrophobicContact CD2-CE2 4Å; F53-Y57 WeakPolarHBondContact O-CB 3.3Å; F53-Y57 PolarHBondContact O-N 2.87Å; G54-Y57 PolarHBondContact O-N 3.28Å; V55-Y57 VanDerWaalsContact C-N 3.3Å; V55-Y57 PolarHBondContact O-N 3.02Å; Y57-S60 WeakPolarHBondContact O-CB 3.17Å; Y57-S60 PolarHBondContact O-N 2.82Å; Y57-L61 HydrophobicContact CD1-CD1 4.08Å; Y57-L61 HydrophobicContact CD1-CG 4.47Å; Y57-L61 HydrophobicContact CE1-CD1 3.62Å; Y57-L61 HydrophobicContact CE1-CG 4.16Å; Y57-L61 PolarHBondContact O-N 2.78Å; Y57-Q268 HydrophobicContact CD2-CB 4.5Å; Y57-Q268 HydrophobicContact CE2-CB 4.27Å; Y57-Q268 HydrophobicContact CE2-CG 4.02Å; Y57-H304 PolarHBondContact OH-NE2 2.84Å
58	L	97.6	Very high	97.1	Very high	95 Å²	95	22.2 Å²	22.2	50%	0.497	13%	0.129	S	C	.	.	H	α-helix	trans	-63.7	-41.1	176.1	-71.8	174.5	0	0	0	112.4	G54 V55 S60 L61 L62	G54-L58 WeakPolarHBondContact O-CG 3.31Å; G54-L58 PolarHBondContact O-N 3.37Å; V55-L58 PolarHBondContact O-N 3.16Å; L58-S60 VanDerWaalsContact C-N 3.3Å; L58-S60 PolarHBondContact O-N 2.68Å; L58-L61 HydrophobicContact CD2-CD1 4.39Å; L58-L61 PolarHBondContact O-N 3.39Å; L58-L62 WeakPolarHBondContact O-CG 3.47Å; L58-L62 PolarHBondContact O-N 2.75Å; L58-L62 VanDerWaalsContact O-N 3.13Å
59	I	98	Very high	97.3	Very high	70 Å²	70	21.9 Å²	21.9	36%	0.359	13%	0.128	S	C	.	.	H	α-helix	trans	-60.7	-42.9	174.5	-69.7	168.8	0	0	0	110.1	V55 A56 L61 L62 V63 W262	V55-I59 HydrophobicContact CG1-CD1 3.8Å; V55-I59 HydrophobicContact CG1-CG1 4.45Å; V55-I59 VanDerWaalsContact O-CG1 3.32Å; V55-I59 WeakPolarHBondContact O-CG1 3.39Å; V55-I59 PolarHBondContact O-N 2.87Å; A56-I59 PolarHBondContact O-N 3.11Å; I59-L61 PolarHBondContact O-N 3.39Å; I59-L62 PolarHBondContact O-N 2.71Å; I59-V63 HydrophobicContact CG2-CG2 4.04Å; I59-V63 WeakPolarHBondContact O-CB 3.36Å; I59-V63 WeakPolarHBondContact O-CG2 3.43Å; I59-V63 PolarHBondContact O-N 3.19Å; I59-W262 HydrophobicContact CB-CZ3 4.45Å; I59-W262 HydrophobicContact CD1-CH2 4.08Å; I59-W262 HydrophobicContact CG2-CH2 4.39Å; I59-W262 HydrophobicContact CG2-CZ3 4.21Å
60	S	97.9	Very high	97.4	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.014	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-40.5	176.9	-175.5	0	0	0	0	112.9	A56 Y57 L58 L62 C64 C65 L266 S269	A56-S60 PolarHBondContact O-N 2.91Å; Y57-S60 WeakPolarHBondContact O-CB 3.17Å; Y57-S60 PolarHBondContact O-N 2.82Å; L58-S60 VanDerWaalsContact C-N 3.3Å; L58-S60 PolarHBondContact O-N 2.68Å; S60-L62 VanDerWaalsContact C-N 3.33Å; S60-L62 PolarHBondContact O-N 2.86Å; S60-C64 WeakPolarHBondContact O-CA 3.42Å; S60-C64 VanDerWaalsContact O-CB 3.27Å; S60-C64 WeakPolarHBondContact O-CB 3.32Å; S60-C64 PolarHBondContact O-N 3.26Å; S60-C65 PolarHBondContact O-N 3.03Å; S60-C65 VanDerWaalsContact O-N 3.11Å; S60-L266 VanDerWaalsContact OG-CD2 3.29Å; S60-L266 WeakPolarHBondContact OG-CD2 3.42Å; S60-S269 VanDerWaalsContact CB-OG 3.22Å; S60-S269 WeakPolarHBondContact CB-OG 3.3Å; S60-S269 PolarHBondContact OG-OG 3.13Å
61	L	98.1	Very high	97.6	Very high	5 Å²	5	21.2 Å²	21.2	3%	0.026	12%	0.121	C	C	.	.	I	π-helix	trans	-59.3	-45	174.5	-70.4	176.9	0	0	0	111.7	Y57 L58 I59 C65 I66 T273 V301 A305	Y57-L61 HydrophobicContact CD1-CD1 4.08Å; Y57-L61 HydrophobicContact CD1-CG 4.47Å; Y57-L61 HydrophobicContact CE1-CD1 3.62Å; Y57-L61 HydrophobicContact CE1-CG 4.16Å; Y57-L61 PolarHBondContact O-N 2.78Å; L58-L61 HydrophobicContact CD2-CD1 4.39Å; L58-L61 PolarHBondContact O-N 3.39Å; I59-L61 PolarHBondContact O-N 3.39Å; L61-C65 HydrophobicContact CD2-CB 4.16Å; L61-C65 WeakPolarHBondContact O-CB 3.3Å; L61-C65 PolarHBondContact O-N 2.57Å; L61-I66 PolarHBondContact O-N 3.32Å; L61-T273 HydrophobicContact CD2-CG2 3.58Å; L61-V301 HydrophobicContact CB-CG1 4.02Å; L61-V301 HydrophobicContact CD2-CG1 4.31Å; L61-A305 HydrophobicContact CD1-CB 3.92Å
62	L	96.7	Very high	97.8	Very high	104 Å²	104	20.6 Å²	20.6	55%	0.545	12%	0.115	S	C	.	.	I	π-helix	trans	-71.9	-45.7	-177.5	-66.5	175.6	0	0	0	113.2	L58 I59 S60 I66	L58-L62 WeakPolarHBondContact O-CG 3.47Å; L58-L62 PolarHBondContact O-N 2.75Å; L58-L62 VanDerWaalsContact O-N 3.13Å; I59-L62 PolarHBondContact O-N 2.71Å; S60-L62 VanDerWaalsContact C-N 3.33Å; S60-L62 PolarHBondContact O-N 2.86Å; L62-I66 HydrophobicContact CD2-CD1 3.84Å
63	V	96.9	Very high	97.8	Very high	64 Å²	64	20.6 Å²	20.6	39%	0.388	12%	0.115	S	C	.	.	I	π-helix	trans	-88.7	-29.4	-170.5	178.2	0	0	0	0	112.1	I59 P67 L480	I59-V63 HydrophobicContact CG2-CG2 4.04Å; I59-V63 WeakPolarHBondContact O-CB 3.36Å; I59-V63 WeakPolarHBondContact O-CG2 3.43Å; I59-V63 PolarHBondContact O-N 3.19Å; V63-P67 VanDerWaalsContact O-CG 3.29Å; V63-P67 WeakPolarHBondContact O-CG 3.4Å; V63-L480 HydrophobicContact CG1-CD2 4.13Å; V63-L480 VanDerWaalsContact O-CD2 3.28Å; V63-L480 WeakPolarHBondContact O-CD2 3.21Å
64	C	97.7	Very high	97.8	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.034	12%	0.115	C	C	.	.	I	π-helix	trans	-111.2	-53.4	-177.4	-55.9	0	0	0	0	111.7	S60 P67 L68 L270	S60-C64 WeakPolarHBondContact O-CA 3.42Å; S60-C64 VanDerWaalsContact O-CB 3.27Å; S60-C64 WeakPolarHBondContact O-CB 3.32Å; S60-C64 PolarHBondContact O-N 3.26Å; C64-P67 WeakPolarHBondContact O-CD 3.12Å; C64-L68 WeakPolarHBondContact O-CB 3.11Å; C64-L68 WeakPolarHBondContact O-CD1 3.49Å; C64-L68 WeakPolarHBondContact O-CG 3.17Å; C64-L68 PolarHBondContact O-N 3.1Å; C64-L270 HydrophobicContact CB-CD2 4.31Å
65	C	98.3	Very high	97.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.11	C	C	.	.	I	π-helix	trans	-70.1	-42.8	-169.7	-57.4	0	0	0	0	112.8	S60 L61 L68 V69 T273 L275	S60-C65 PolarHBondContact O-N 3.03Å; S60-C65 VanDerWaalsContact O-N 3.11Å; L61-C65 HydrophobicContact CD2-CB 4.16Å; L61-C65 WeakPolarHBondContact O-CB 3.3Å; L61-C65 PolarHBondContact O-N 2.57Å; C65-L68 PolarHBondContact O-N 3.24Å; C65-V69 WeakPolarHBondContact O-CB 3.37Å; C65-V69 VanDerWaalsContact O-CG2 3.3Å; C65-V69 WeakPolarHBondContact O-CG2 3.38Å; C65-V69 PolarHBondContact O-N 2.74Å; C65-T273 HydrophobicContact CB-CG2 4.13Å; C65-L275 HydrophobicContact CB-CD1 3.98Å
66	I	98.2	Very high	97.7	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.021	9%	0.093	C	C	.	.	H	α-helix	trans	-58	-54.5	177.7	-67.1	174.9	0	0	0	112	L61 L62 L68 M70 T297 F298 V301 F477	L61-I66 PolarHBondContact O-N 3.32Å; L62-I66 HydrophobicContact CD2-CD1 3.84Å; I66-L68 VanDerWaalsContact C-N 3.29Å; I66-L68 PolarHBondContact O-N 3.07Å; I66-M70 HydrophobicContact CG2-CE 4.15Å; I66-M70 VanDerWaalsContact O-CB 3.24Å; I66-M70 WeakPolarHBondContact O-CB 3.5Å; I66-M70 PolarHBondContact O-N 3.45Å; I66-T297 HydrophobicContact CG2-CG2 4.1Å; I66-T297 WeakPolarHBondContact O-CG2 3.18Å; I66-F298 HydrophobicContact CD1-CD1 3.85Å; I66-F298 HydrophobicContact CD1-CE1 3.75Å; I66-F298 HydrophobicContact CG2-CE1 4.19Å; I66-F298 HydrophobicContact CG2-CE2 4.46Å; I66-F298 HydrophobicContact CG2-CZ 4.12Å; I66-V301 HydrophobicContact CD1-CG1 4.41Å; I66-V301 HydrophobicContact CG1-CB 3.98Å; I66-V301 HydrophobicContact CG1-CG1 3.89Å; I66-V301 HydrophobicContact CG1-CG2 3.86Å; I66-F477 HydrophobicContact CB-CD1 4.22Å; I66-F477 HydrophobicContact CB-CE1 3.94Å; I66-F477 HydrophobicContact CG2-CD1 3.52Å; I66-F477 HydrophobicContact CG2-CE1 3.39Å; I66-F477 HydrophobicContact CG2-CG 4.31Å; I66-F477 HydrophobicContact CG2-CZ 4.08Å
67	P	98.2	Very high	97.5	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-57	-40.4	177.2	-18.1	21	0	0	0	113.8	V63 C64 M70 M71 F477 L480 T481 L484	V63-P67 VanDerWaalsContact O-CG 3.29Å; V63-P67 WeakPolarHBondContact O-CG 3.4Å; C64-P67 WeakPolarHBondContact O-CD 3.12Å; P67-M70 PolarHBondContact O-N 3.42Å; P67-M71 VanDerWaalsContact O-CB 3.32Å; P67-M71 WeakPolarHBondContact O-CB 3.1Å; P67-M71 PolarHBondContact O-N 3.5Å; P67-F477 HydrophobicContact CB-CD1 4.42Å; P67-F477 HydrophobicContact CG-CD1 3.77Å; P67-F477 HydrophobicContact CG-CE1 4.49Å; P67-L480 HydrophobicContact CG-CD2 3.84Å; P67-L480 HydrophobicContact CG-CG 4.38Å; P67-T481 HydrophobicContact CB-CG2 3.9Å; P67-L484 HydrophobicContact CB-CD1 3.7Å; P67-L484 HydrophobicContact CG-CD1 3.95Å
68	L	98.5	Very high	97.2	Very high	3 Å²	3	17.5 Å²	17.5	2%	0.016	9%	0.094	C	C	.	.	H	α-helix	trans	-75	-42.7	-174.2	-65.6	176.8	0	0	0	112.7	C64 C65 I66 M70 M71 E72 L270 L275 L441 I445 L484	C64-L68 WeakPolarHBondContact O-CB 3.11Å; C64-L68 WeakPolarHBondContact O-CD1 3.49Å; C64-L68 WeakPolarHBondContact O-CG 3.17Å; C64-L68 PolarHBondContact O-N 3.1Å; C65-L68 PolarHBondContact O-N 3.24Å; I66-L68 VanDerWaalsContact C-N 3.29Å; I66-L68 PolarHBondContact O-N 3.07Å; L68-M70 VanDerWaalsContact C-N 3.27Å; L68-M70 PolarHBondContact O-N 3.18Å; L68-M71 HydrophobicContact CD2-CE 4.17Å; L68-M71 WeakPolarHBondContact O-CB 3.27Å; L68-M71 PolarHBondContact O-N 3.03Å; L68-E72 PolarHBondContact O-N 3.19Å; L68-L270 HydrophobicContact CD1-CD2 3.68Å; L68-L275 HydrophobicContact CB-CD1 3.89Å; L68-L275 HydrophobicContact CB-CD2 3.82Å; L68-L275 HydrophobicContact CD1-CD1 4.34Å; L68-L441 HydrophobicContact CD1-CD2 4.31Å; L68-I445 HydrophobicContact CD1-CD1 4.07Å; L68-I445 HydrophobicContact CD2-CD1 3.43Å; L68-I445 VanDerWaalsContact CD2-CD1 3.43Å; L68-I445 HydrophobicContact CD2-CG1 3.49Å; L68-I445 VanDerWaalsContact CD2-CG1 3.49Å; L68-I445 HydrophobicContact CD2-CG2 4.41Å; L68-I445 HydrophobicContact CG-CD1 4.41Å; L68-L484 HydrophobicContact CD1-CD1 4.37Å; L68-L484 HydrophobicContact CD2-CB 4.35Å; L68-L484 HydrophobicContact CD2-CD1 3.8Å; L68-L484 HydrophobicContact CG-CD1 3.8Å
69	V	98.6	Very high	96.9	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.7	-40.1	172.7	173.8	0	0	0	0	110	C65 M71 L73 L275 Y280 T297	C65-V69 WeakPolarHBondContact O-CB 3.37Å; C65-V69 VanDerWaalsContact O-CG2 3.3Å; C65-V69 WeakPolarHBondContact O-CG2 3.38Å; C65-V69 PolarHBondContact O-N 2.74Å; V69-M71 VanDerWaalsContact C-N 3.33Å; V69-M71 PolarHBondContact O-N 2.91Å; V69-L73 HydrophobicContact CG1-CD1 3.9Å; V69-L73 HydrophobicContact CG1-CG 4.31Å; V69-L73 WeakPolarHBondContact O-CB 3.07Å; V69-L73 VanDerWaalsContact O-CG 3.3Å; V69-L73 WeakPolarHBondContact O-CG 3.41Å; V69-L73 PolarHBondContact O-N 3.32Å; V69-L275 HydrophobicContact CG2-CD1 4.07Å; V69-L275 HydrophobicContact CG2-CD2 3.76Å; V69-L275 HydrophobicContact CG2-CG 3.98Å; V69-Y280 HydrophobicContact CG1-CD1 4.07Å; V69-Y280 HydrophobicContact CG1-CD2 4.41Å; V69-Y280 HydrophobicContact CG1-CE1 3.99Å; V69-Y280 HydrophobicContact CG1-CE2 4.34Å; V69-Y280 HydrophobicContact CG1-CG 4.27Å; V69-Y280 HydrophobicContact CG2-CD2 4.22Å; V69-Y280 HydrophobicContact CG2-CE2 3.79Å; V69-T297 HydrophobicContact CB-CG2 3.8Å; V69-T297 HydrophobicContact CG1-CG2 3.78Å
70	M	98.1	Very high	96.5	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-62.4	-42	175.6	-167.3	-179.5	-57	0	0	111.5	I66 P67 L68 A74 L293 V294 T297 F298 A474 F477 F478	I66-M70 HydrophobicContact CG2-CE 4.15Å; I66-M70 VanDerWaalsContact O-CB 3.24Å; I66-M70 WeakPolarHBondContact O-CB 3.5Å; I66-M70 PolarHBondContact O-N 3.45Å; P67-M70 PolarHBondContact O-N 3.42Å; L68-M70 VanDerWaalsContact C-N 3.27Å; L68-M70 PolarHBondContact O-N 3.18Å; M70-A74 WeakPolarHBondContact O-CB 3.31Å; M70-A74 PolarHBondContact O-N 3.06Å; M70-L293 HydrophobicContact CG-CD1 3.63Å; M70-V294 HydrophobicContact CE-CB 4.43Å; M70-V294 HydrophobicContact CE-CG1 3.79Å; M70-V294 HydrophobicContact SD-CG1 4.32Å; M70-V294 HydrophobicContact SD-CG2 4.16Å; M70-T297 WeakPolarHBondContact CA-OG1 3.05Å; M70-T297 HydrophobicContact CB-CG2 4.09Å; M70-F298 HydrophobicContact CE-CE2 4.3Å; M70-A474 HydrophobicContact SD-CB 4.27Å; M70-F477 HydrophobicContact CE-CB 4.03Å; M70-F477 HydrophobicContact CE-CD2 4.47Å; M70-F477 HydrophobicContact CE-CG 4.16Å; M70-F477 HydrophobicContact SD-CB 4.09Å; M70-F478 HydrophobicContact CG-CE1 4.49Å; M70-F478 HydrophobicContact CG-CE2 4.21Å; M70-F478 HydrophobicContact CG-CZ 3.86Å; M70-F478 HydrophobicContact SD-CD2 4.37Å; M70-F478 HydrophobicContact SD-CE2 3.88Å; M70-F478 HydrophobicContact SD-CZ 4.13Å
71	M	98.2	Very high	96.2	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.3	-52.3	176.8	-175.7	-168	71.9	0	0	111.9	P67 L68 V69 L73 A74 V75 E444 I445 I448 L457 T481	P67-M71 VanDerWaalsContact O-CB 3.32Å; P67-M71 WeakPolarHBondContact O-CB 3.1Å; P67-M71 PolarHBondContact O-N 3.5Å; L68-M71 HydrophobicContact CD2-CE 4.17Å; L68-M71 WeakPolarHBondContact O-CB 3.27Å; L68-M71 PolarHBondContact O-N 3.03Å; V69-M71 VanDerWaalsContact C-N 3.33Å; V69-M71 PolarHBondContact O-N 2.91Å; M71-L73 PolarHBondContact O-N 2.98Å; M71-A74 PolarHBondContact O-N 3.47Å; M71-V75 WeakPolarHBondContact O-CG2 3.29Å; M71-V75 PolarHBondContact O-N 3.37Å; M71-E444 WeakPolarHBondContact CE-OE1 3.38Å; M71-I445 HydrophobicContact CE-CG1 4.03Å; M71-I448 HydrophobicContact CE-CD1 3.65Å; M71-I448 HydrophobicContact CG-CB 4.36Å; M71-I448 HydrophobicContact CG-CD1 4.06Å; M71-I448 HydrophobicContact CG-CG2 3.69Å; M71-I448 HydrophobicContact SD-CB 3.81Å; M71-I448 HydrophobicContact SD-CD1 3.8Å; M71-I448 HydrophobicContact SD-CG1 4.44Å; M71-I448 HydrophobicContact SD-CG2 3.72Å; M71-L457 HydrophobicContact CG-CD2 4.05Å; M71-T481 HydrophobicContact CB-CG2 4.48Å; M71-T481 HydrophobicContact SD-CG2 4.46Å
72	E	98.3	Very high	96	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61.4	-46.4	179.7	-79.2	-165.1	-145.3	0	0	111.7	L68 A74 V75 G76 G278 Y280 I281 E444	L68-E72 PolarHBondContact O-N 3.19Å; E72-A74 VanDerWaalsContact C-N 3.31Å; E72-A74 PolarHBondContact O-N 3.43Å; E72-V75 PolarHBondContact O-N 3.06Å; E72-G76 PolarHBondContact O-N 2.9Å; E72-G278 WeakPolarHBondContact OE2-CA 3.17Å; E72-Y280 WeakPolarHBondContact OE2-CB 3.36Å; E72-Y280 PolarHBondContact OE2-N 3.46Å; E72-I281 HydrophobicContact CB-CG1 3.84Å; E72-I281 HydrophobicContact CG-CD1 4.41Å; E72-I281 HydrophobicContact CG-CG1 3.93Å; E72-I281 WeakPolarHBondContact O-CA 3.02Å; E72-E444 VanDerWaalsContact CG-OE1 3.31Å; E72-E444 WeakPolarHBondContact CG-OE1 3.45Å
73	L	98.1	Very high	96	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-61.3	-39.8	176.5	-73.9	177.2	0	0	0	111.9	F24 V69 M71 G76 Q77 Y280 L293 I300	F24-L73 HydrophobicContact CE2-CD2 3.9Å; F24-L73 HydrophobicContact CZ-CD1 4.2Å; F24-L73 HydrophobicContact CZ-CD2 3.63Å; V69-L73 HydrophobicContact CG1-CD1 3.9Å; V69-L73 HydrophobicContact CG1-CG 4.31Å; V69-L73 WeakPolarHBondContact O-CB 3.07Å; V69-L73 VanDerWaalsContact O-CG 3.3Å; V69-L73 WeakPolarHBondContact O-CG 3.41Å; V69-L73 PolarHBondContact O-N 3.32Å; M71-L73 PolarHBondContact O-N 2.98Å; L73-G76 PolarHBondContact O-N 3.48Å; L73-Q77 VanDerWaalsContact O-CB 3.29Å; L73-Q77 WeakPolarHBondContact O-CB 3.47Å; L73-Q77 PolarHBondContact O-N 3.36Å; L73-Y280 HydrophobicContact CD2-CD1 4.04Å; L73-Y280 WeakPolarHBondContact CD2-O 3.26Å; L73-Y280 HydrophobicContact CG-CD1 4.25Å; L73-L293 HydrophobicContact CB-CB 4.42Å; L73-I300 HydrophobicContact CD1-CD1 4.15Å
74	A	96.9	Very high	96	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-64.3	-45.1	176.8	0	0	0	0	0	112.2	M70 M71 E72 G76 Q77 L78 L293 L457 V461 F478	M70-A74 WeakPolarHBondContact O-CB 3.31Å; M70-A74 PolarHBondContact O-N 3.06Å; M71-A74 PolarHBondContact O-N 3.47Å; E72-A74 VanDerWaalsContact C-N 3.31Å; E72-A74 PolarHBondContact O-N 3.43Å; A74-G76 VanDerWaalsContact C-N 3.34Å; A74-Q77 PolarHBondContact O-N 3.31Å; A74-L78 WeakPolarHBondContact O-CB 3.32Å; A74-L78 PolarHBondContact O-N 2.93Å; A74-L293 HydrophobicContact CB-CD1 4.28Å; A74-L293 HydrophobicContact CB-CD2 4.04Å; A74-L457 HydrophobicContact CB-CD1 4.2Å; A74-L457 HydrophobicContact CB-CD2 4.43Å; A74-L457 HydrophobicContact CB-CG 4.43Å; A74-V461 HydrophobicContact CB-CG2 3.5Å; A74-F478 HydrophobicContact CB-CE1 4.06Å; A74-F478 HydrophobicContact CB-CZ 3.76Å
75	V	96.1	Very high	95.7	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-61.5	-45.4	176	169.4	0	0	0	0	110.8	M71 E72 L78 C79 M90 I281 I448 L457	M71-V75 WeakPolarHBondContact O-CG2 3.29Å; M71-V75 PolarHBondContact O-N 3.37Å; E72-V75 PolarHBondContact O-N 3.06Å; V75-L78 PolarHBondContact O-N 3.3Å; V75-C79 VanDerWaalsContact O-CB 3.32Å; V75-C79 WeakPolarHBondContact O-CB 3.45Å; V75-C79 PolarHBondContact O-N 3.43Å; V75-C79 PolarHBondContact O-SG 3.14Å; V75-C79 VanDerWaalsContact O-SG 3.4Å; V75-M90 HydrophobicContact CG1-CG 3.83Å; V75-M90 HydrophobicContact CG2-CE 3.88Å; V75-M90 HydrophobicContact CG2-CG 4.17Å; V75-M90 HydrophobicContact CG2-SD 4.27Å; V75-I281 HydrophobicContact CG1-CD1 4.43Å; V75-I281 HydrophobicContact CG1-CG1 4.47Å; V75-I281 HydrophobicContact CG1-CG2 4.17Å; V75-I448 HydrophobicContact CG2-CD1 3.79Å; V75-I448 HydrophobicContact CG2-CG1 4.19Å; V75-I448 HydrophobicContact CG2-CG2 4.19Å; V75-L457 HydrophobicContact CG2-CD2 4.18Å
76	G	95.2	Very high	95.5	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-56.5	-56.1	174.9	0	0	0	0	0	112.3	E72 L73 A74 L78 C79 A80 I281 S285	E72-G76 PolarHBondContact O-N 2.9Å; L73-G76 PolarHBondContact O-N 3.48Å; A74-G76 VanDerWaalsContact C-N 3.34Å; G76-L78 VanDerWaalsContact C-N 3.31Å; G76-L78 PolarHBondContact O-N 3Å; G76-C79 PolarHBondContact O-N 3.47Å; G76-A80 WeakPolarHBondContact O-CA 3.44Å; G76-A80 PolarHBondContact O-N 3.38Å; G76-I281 WeakPolarHBondContact CA-O 3.28Å; G76-S285 VanDerWaalsContact O-CA 3.28Å; G76-S285 WeakPolarHBondContact O-CA 3.48Å
77	Q	93.8	Very high	95.4	Very high	5 Å²	5	6.7 Å²	6.7	2%	0.023	4%	0.039	C	C	.	.	H	α-helix	trans	-68.4	-28.5	-176.3	-167.6	176.6	-52.6	0	0	112.9	L73 A74 G284 N287 R288 R289 N291 L293 M464	L73-Q77 VanDerWaalsContact O-CB 3.29Å; L73-Q77 WeakPolarHBondContact O-CB 3.47Å; L73-Q77 PolarHBondContact O-N 3.36Å; A74-Q77 PolarHBondContact O-N 3.31Å; Q77-G284 VanDerWaalsContact CA-O 3.27Å; Q77-G284 WeakPolarHBondContact CA-O 3.39Å; Q77-G284 PolarHBondContact N-O 2.91Å; Q77-N287 HydrophobicContact CG-CB 3.95Å; Q77-R288 PolarHBondContact NE2-O 2.86Å; Q77-R289 PolarHBondContact NE2-O 2.89Å; Q77-N291 PolarHBondContact NE2-O 3.06Å; Q77-L293 HydrophobicContact CB-CD2 4.45Å; Q77-M464 VanDerWaalsContact C-CE 3.48Å; Q77-M464 HydrophobicContact CB-CE 3.73Å; Q77-M464 HydrophobicContact CG-CE 3.49Å; Q77-M464 VanDerWaalsContact CG-CE 3.49Å; Q77-M464 WeakPolarHBondContact O-CE 3.42Å
78	L	91.5	Very high	95.2	Very high	10 Å²	10	10.9 Å²	10.9	5%	0.052	6%	0.057	C	C	.	.	H	α-helix	trans	-75	-45.9	176.8	176.9	63	0	0	0	111.6	I10 A74 V75 G76 M90 L457 D460 M464 L557	I10-L78 HydrophobicContact CD1-CD1 3.86Å; A74-L78 WeakPolarHBondContact O-CB 3.32Å; A74-L78 PolarHBondContact O-N 2.93Å; V75-L78 PolarHBondContact O-N 3.3Å; G76-L78 VanDerWaalsContact C-N 3.31Å; G76-L78 PolarHBondContact O-N 3Å; L78-M90 HydrophobicContact CD2-SD 4.3Å; L78-L457 HydrophobicContact CD2-CD1 4.01Å; L78-D460 HydrophobicContact CD1-CB 4.32Å; L78-D460 HydrophobicContact CD2-CB 4.27Å; L78-M464 HydrophobicContact CB-CE 4.23Å; L78-M464 HydrophobicContact CB-SD 3.95Å; L78-M464 HydrophobicContact CD1-SD 3.7Å; L78-M464 HydrophobicContact CG-SD 4.41Å; L78-L557 HydrophobicContact CD2-CD1 4.35Å
79	C	90.8	Very high	94.8	Very high	7 Å²	7	11.9 Å²	11.9	5%	0.047	6%	0.063	C	C	.	.	H	α-helix	trans	-86.2	-17.1	-175	-63.4	0	0	0	0	113.3	V75 G76 S81 S86	V75-C79 VanDerWaalsContact O-CB 3.32Å; V75-C79 WeakPolarHBondContact O-CB 3.45Å; V75-C79 PolarHBondContact O-N 3.43Å; V75-C79 PolarHBondContact O-SG 3.14Å; V75-C79 VanDerWaalsContact O-SG 3.4Å; G76-C79 PolarHBondContact O-N 3.47Å; C79-S81 WeakPolarHBondContact O-CB 3.39Å; C79-S81 PolarHBondContact O-N 3.17Å; C79-S81 VanDerWaalsContact O-N 3.11Å; C79-S81 PolarHBondContact O-OG 2.94Å; C79-S86 VanDerWaalsContact CB-OG 3.26Å; C79-S86 WeakPolarHBondContact CB-OG 3.42Å
80	A	91.1	Very high	94.4	Very high	28 Å²	28	11.9 Å²	11.9	23%	0.231	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.5	42.6	-172.9	0	0	0	0	0	111.7	R15 G76	R15-A80 VanDerWaalsContact CZ-O 3.24Å; R15-A80 PolarHBondContact NE-O 3.39Å; R15-A80 PolarHBondContact NH2-O 3.41Å; G76-A80 WeakPolarHBondContact O-CA 3.44Å; G76-A80 PolarHBondContact O-N 3.38Å
81	S	90.8	Very high	94.1	Very high	4 Å²	4	11.9 Å²	11.9	3%	0.028	6%	0.063	C	C	.	.	S	Bend	trans	-142.8	156.1	-169.3	-71.2	0	0	0	0	111.6	R15 C79 S86 S285	R15-S81 VanDerWaalsContact NH2-CA 3.33Å; C79-S81 WeakPolarHBondContact O-CB 3.39Å; C79-S81 PolarHBondContact O-N 3.17Å; C79-S81 VanDerWaalsContact O-N 3.11Å; C79-S81 PolarHBondContact O-OG 2.94Å; S81-S86 VanDerWaalsContact C-OG 3.22Å; S81-S86 VanDerWaalsContact CB-OG 3.31Å; S81-S86 WeakPolarHBondContact CB-OG 3.05Å; S81-S86 PolarHBondContact O-OG 2.86Å; S81-S285 WeakPolarHBondContact O-CB 3.4Å
82	S	93.8	Very high	93.7	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.007	7%	0.067	C	C	.	.			trans	-66.9	167.2	171.5	63.9	0	0	0	0	112.6	K85 S86 P383 D386	S82-K85 PolarHBondContact O-N 3.09Å; S82-S86 VanDerWaalsContact O-CB 3.31Å; S82-S86 WeakPolarHBondContact O-CB 3.36Å; S82-S86 PolarHBondContact O-N 3.19Å; S82-S86 PolarHBondContact O-OG 2.92Å; S82-P383 WeakPolarHBondContact OG-CA 3.18Å; S82-D386 WeakPolarHBondContact CB-OD2 3.41Å; S82-D386 PolarHBondContact N-OD2 3.25Å; S82-D386 PolarHBondContact OG-OD2 2.96Å
83	P	97	Very high	93.4	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-52.2	-46.6	-174.5	-26.8	32.8	0	0	0	115	K85 M87 Y101 G278 I281 T282 N379	P83-K85 PolarHBondContact O-N 3.29Å; P83-M87 VanDerWaalsContact O-CB 3.25Å; P83-M87 WeakPolarHBondContact O-CB 3.36Å; P83-M87 WeakPolarHBondContact O-CG 3.46Å; P83-M87 PolarHBondContact O-N 3.31Å; P83-Y101 HydrophobicContact CB-CD2 4.49Å; P83-G278 WeakPolarHBondContact CG-O 3.23Å; P83-I281 HydrophobicContact CB-CD1 4.43Å; P83-I281 HydrophobicContact CG-CB 4.23Å; P83-I281 HydrophobicContact CG-CG2 4.4Å; P83-T282 WeakPolarHBondContact CD-OG1 3.39Å; P83-N379 WeakPolarHBondContact CG-OD1 3.47Å
84	P	95.8	Very high	93.2	Very high	27 Å²	27	13.7 Å²	13.7	18%	0.175	7%	0.073	C	C	.	.	H	α-helix	trans	-59.9	-45.4	-179.8	-21.3	30.7	0	0	0	112.9	F88 P383	P84-F88 WeakPolarHBondContact O-CB 3.15Å; P84-F88 PolarHBondContact O-N 3.41Å; P84-P383 HydrophobicContact CG-CB 4.05Å; P84-P383 HydrophobicContact CG-CG 4.27Å
85	K	92.8	Very high	93.1	Very high	55 Å²	55	14 Å²	14	24%	0.239	8%	0.075	C	C	.	.	H	α-helix	trans	-76.1	-38.8	-176.9	-176.6	171.9	-173.6	168.6	0	112	E13 S82 P83 F88 N89 D386	E13-K85 IonicContact OE1-NZ 2.57Å; E13-K85 PolarHBondContact OE1-NZ 3.31Å; E13-K85 IonicContact OE2-NZ 3.78Å; E13-K85 PolarHBondContact OE2-NZ 3.14Å; S82-K85 PolarHBondContact O-N 3.09Å; P83-K85 PolarHBondContact O-N 3.29Å; K85-F88 WeakPolarHBondContact O-CB 3.42Å; K85-F88 PolarHBondContact O-N 3.36Å; K85-N89 WeakPolarHBondContact O-CB 3.29Å; K85-N89 VanDerWaalsContact O-CG 3.27Å; K85-N89 PolarHBondContact O-N 3.27Å; K85-N89 PolarHBondContact O-ND2 3.24Å; K85-D386 HydrophobicContact CD-CB 4.38Å
86	S	94.5	Very high	93.1	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-61.9	-45.7	172.1	-69.1	0	0	0	0	111.6	C79 S81 S82 F88 N89 M90	C79-S86 VanDerWaalsContact CB-OG 3.26Å; C79-S86 WeakPolarHBondContact CB-OG 3.42Å; S81-S86 VanDerWaalsContact C-OG 3.22Å; S81-S86 VanDerWaalsContact CB-OG 3.31Å; S81-S86 WeakPolarHBondContact CB-OG 3.05Å; S81-S86 PolarHBondContact O-OG 2.86Å; S82-S86 VanDerWaalsContact O-CB 3.31Å; S82-S86 WeakPolarHBondContact O-CB 3.36Å; S82-S86 PolarHBondContact O-N 3.19Å; S82-S86 PolarHBondContact O-OG 2.92Å; S86-F88 VanDerWaalsContact C-N 3.33Å; S86-F88 PolarHBondContact O-N 2.99Å; S86-N89 WeakPolarHBondContact O-CB 3.15Å; S86-N89 PolarHBondContact O-N 2.85Å; S86-N89 VanDerWaalsContact O-N 3.1Å; S86-M90 VanDerWaalsContact O-CG 3.29Å; S86-M90 WeakPolarHBondContact O-CG 3.28Å; S86-M90 PolarHBondContact O-N 2.92Å
87	M	95.3	Very high	93.2	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-64.5	-37.5	175.8	-70.5	-56.7	-67.9	0	0	112	P83 N89 M90 S91 F94 V97 E444 A447 I448	P83-M87 VanDerWaalsContact O-CB 3.25Å; P83-M87 WeakPolarHBondContact O-CB 3.36Å; P83-M87 WeakPolarHBondContact O-CG 3.46Å; P83-M87 PolarHBondContact O-N 3.31Å; M87-N89 VanDerWaalsContact C-N 3.3Å; M87-N89 PolarHBondContact O-N 3.45Å; M87-M90 PolarHBondContact O-N 3.4Å; M87-S91 CarbonylContact O-C 3.54Å; M87-S91 PolarHBondContact O-N 3.39Å; M87-F94 HydrophobicContact CE-CB 4.35Å; M87-V97 HydrophobicContact CE-CB 4.3Å; M87-V97 HydrophobicContact CE-CG1 4.5Å; M87-E444 HydrophobicContact CE-CG 3.98Å; M87-E444 HydrophobicContact SD-CG 3.97Å; M87-A447 HydrophobicContact CE-CB 3.74Å; M87-I448 HydrophobicContact SD-CD1 4.2Å; M87-I448 HydrophobicContact SD-CG1 4.36Å
88	F	93.3	Very high	93.4	Very high	87 Å²	87	13.8 Å²	13.8	38%	0.382	7%	0.074	S	C	.	.	H	α-helix	trans	-59.7	-41.4	171.2	179.5	-95.9	0	0	0	112.3	P84 K85 S86 P92 A95 P556	P84-F88 WeakPolarHBondContact O-CB 3.15Å; P84-F88 PolarHBondContact O-N 3.41Å; K85-F88 WeakPolarHBondContact O-CB 3.42Å; K85-F88 PolarHBondContact O-N 3.36Å; S86-F88 VanDerWaalsContact C-N 3.33Å; S86-F88 PolarHBondContact O-N 2.99Å; F88-P92 HydrophobicContact CD2-CB 4.02Å; F88-P92 HydrophobicContact CE2-CB 3.91Å; F88-P92 HydrophobicContact CE2-CG 4.44Å; F88-P92 VanDerWaalsContact O-CD 3.28Å; F88-P92 WeakPolarHBondContact O-CD 3.41Å; F88-P92 WeakPolarHBondContact O-CG 3.05Å; F88-A95 HydrophobicContact CB-CB 3.72Å; F88-A95 HydrophobicContact CD2-CB 4.15Å; F88-A95 HydrophobicContact CG-CB 4.46Å; F88-P556 HydrophobicContact CD1-CG 4.39Å; F88-P556 HydrophobicContact CE1-CG 4.17Å
89	N	90.1	Very high	93.7	Very high	24 Å²	24	16.1 Å²	16.1	13%	0.128	9%	0.089	C	C	.	.	H	α-helix	trans	-69.2	-36	179.3	-73.8	-15.8	0	0	0	112.7	K85 S86 M87 S555 P556 L557	K85-N89 WeakPolarHBondContact O-CB 3.29Å; K85-N89 VanDerWaalsContact O-CG 3.27Å; K85-N89 PolarHBondContact O-N 3.27Å; K85-N89 PolarHBondContact O-ND2 3.24Å; S86-N89 WeakPolarHBondContact O-CB 3.15Å; S86-N89 PolarHBondContact O-N 2.85Å; S86-N89 VanDerWaalsContact O-N 3.1Å; M87-N89 VanDerWaalsContact C-N 3.3Å; M87-N89 PolarHBondContact O-N 3.45Å; N89-S555 PolarHBondContact O-OG 2.9Å; N89-P556 WeakPolarHBondContact O-CD 3.12Å; N89-L557 HydrophobicContact CB-CD1 4.07Å; N89-L557 HydrophobicContact CB-CD2 4.14Å; N89-L557 HydrophobicContact CB-CG 3.91Å
90	M	90.6	Very high	94	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-76.6	-51.1	176.4	-62.7	-58.8	-71.6	0	0	111.7	V75 L78 S86 M87 I448 Y452 L457 S555 L557	V75-M90 HydrophobicContact CG1-CG 3.83Å; V75-M90 HydrophobicContact CG2-CE 3.88Å; V75-M90 HydrophobicContact CG2-CG 4.17Å; V75-M90 HydrophobicContact CG2-SD 4.27Å; L78-M90 HydrophobicContact CD2-SD 4.3Å; S86-M90 VanDerWaalsContact O-CG 3.29Å; S86-M90 WeakPolarHBondContact O-CG 3.28Å; S86-M90 PolarHBondContact O-N 2.92Å; M87-M90 PolarHBondContact O-N 3.4Å; M90-I448 HydrophobicContact CE-CG2 4.07Å; M90-Y452 HydrophobicContact CB-CD2 4.48Å; M90-Y452 HydrophobicContact CE-CD1 3.22Å; M90-Y452 HydrophobicContact CE-CD2 3.79Å; M90-Y452 HydrophobicContact CE-CE1 3.44Å; M90-Y452 VanDerWaalsContact CE-CE1 3.44Å; M90-Y452 HydrophobicContact CE-CE2 3.97Å; M90-Y452 HydrophobicContact CE-CG 3.38Å; M90-Y452 WeakPolarHBondContact O-CD2 3.25Å; M90-Y452 HydrophobicContact SD-CD1 4.44Å; M90-Y452 HydrophobicContact SD-CD2 4.13Å; M90-Y452 HydrophobicContact SD-CE1 4.29Å; M90-Y452 HydrophobicContact SD-CE2 3.97Å; M90-Y452 HydrophobicContact SD-CG 4.33Å; M90-L457 HydrophobicContact CE-CD1 4.1Å; M90-S555 WeakPolarHBondContact O-CB 3.48Å; M90-L557 HydrophobicContact SD-CD1 3.79Å
91	S	91.8	Very high	94.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.076	C	C	.	.			trans	-150.5	101.3	179.1	-171.6	0	0	0	0	110.8	M87 L93 F94 A95 V451	M87-S91 CarbonylContact O-C 3.54Å; M87-S91 PolarHBondContact O-N 3.39Å; S91-L93 PolarHBondContact O-N 3.48Å; S91-F94 PolarHBondContact O-N 2.9Å; S91-A95 PolarHBondContact O-N 3.36Å; S91-V451 WeakPolarHBondContact OG-CG1 3.49Å
92	P	89.9	Confident	94.6	Very high	14 Å²	14	15.3 Å²	15.3	9%	0.091	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-51.9	-36.8	-176.7	-30.4	35.3	0	0	0	114.6	F88 F94 A95 N528 C532	F88-P92 HydrophobicContact CD2-CB 4.02Å; F88-P92 HydrophobicContact CE2-CB 3.91Å; F88-P92 HydrophobicContact CE2-CG 4.44Å; F88-P92 VanDerWaalsContact O-CD 3.28Å; F88-P92 WeakPolarHBondContact O-CD 3.41Å; F88-P92 WeakPolarHBondContact O-CG 3.05Å; P92-F94 VanDerWaalsContact C-N 3.3Å; P92-F94 PolarHBondContact O-N 3.07Å; P92-A95 WeakPolarHBondContact O-CB 3.48Å; P92-A95 PolarHBondContact O-N 2.62Å; P92-N528 PolarHBondContact O-ND2 2.81Å; P92-C532 PolarHBondContact O-SG 3.35Å; P92-C532 VanDerWaalsContact O-SG 3.34Å
93	L	91.4	Very high	94.8	Very high	5 Å²	5	18.6 Å²	18.6	3%	0.026	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-58.9	-40.3	177.9	-75.9	162.8	0	0	0	112.7	S91 N528 I529 C532 I533 A552 F553	S91-L93 PolarHBondContact O-N 3.48Å; L93-N528 PolarHBondContact O-ND2 3.24Å; L93-I529 HydrophobicContact CD2-CG2 4.38Å; L93-I529 VanDerWaalsContact O-CG1 3.29Å; L93-I529 WeakPolarHBondContact O-CG1 3.36Å; L93-C532 HydrophobicContact CD2-CB 4.02Å; L93-I533 HydrophobicContact CD2-CD1 4.21Å; L93-I533 HydrophobicContact CD2-CG1 3.69Å; L93-A552 HydrophobicContact CD1-CB 4.4Å; L93-A552 HydrophobicContact CD2-CB 4.33Å; L93-A552 HydrophobicContact CG-CB 4.45Å; L93-A552 WeakPolarHBondContact CG-O 3.24Å; L93-F553 HydrophobicContact CD1-CB 4.31Å; L93-F553 HydrophobicContact CD1-CD1 3.32Å; L93-F553 HydrophobicContact CD1-CD2 3.72Å; L93-F553 HydrophobicContact CD1-CE1 3.33Å; L93-F553 HydrophobicContact CD1-CE2 3.7Å; L93-F553 HydrophobicContact CD1-CG 3.52Å; L93-F553 HydrophobicContact CD1-CZ 3.52Å
94	F	94.8	Very high	94.8	Very high	20 Å²	20	18.9 Å²	18.9	9%	0.088	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-96.9	12.3	-176.1	-65.7	-79.5	0	0	0	113.4	M87 S91 P92 G96 V97 L443 F446 A447 V451 I529	M87-F94 HydrophobicContact CE-CB 4.35Å; S91-F94 PolarHBondContact O-N 2.9Å; P92-F94 VanDerWaalsContact C-N 3.3Å; P92-F94 PolarHBondContact O-N 3.07Å; F94-G96 PolarHBondContact O-N 3.46Å; F94-G96 VanDerWaalsContact O-N 3.1Å; F94-V97 HydrophobicContact CB-CG2 4.3Å; F94-V97 VanDerWaalsContact O-CB 3.32Å; F94-V97 WeakPolarHBondContact O-CB 3.3Å; F94-V97 WeakPolarHBondContact O-CG2 3.5Å; F94-V97 PolarHBondContact O-N 3.18Å; F94-L443 HydrophobicContact CD1-CD2 4.48Å; F94-L443 HydrophobicContact CE1-CD2 4.01Å; F94-F446 HydrophobicContact CE1-CD1 4.43Å; F94-F446 HydrophobicContact CE2-CD1 4.09Å; F94-F446 HydrophobicContact CE2-CE1 4.03Å; F94-F446 AromaticContact CZ-CD1 3.79Å; F94-F446 HydrophobicContact CZ-CD1 3.79Å; F94-F446 AromaticContact CZ-CE1 3.78Å; F94-F446 HydrophobicContact CZ-CE1 3.78Å; F94-A447 HydrophobicContact CB-CB 3.57Å; F94-A447 HydrophobicContact CD2-CB 3.69Å; F94-A447 HydrophobicContact CG-CB 3.67Å; F94-V451 HydrophobicContact CD2-CG2 4.45Å; F94-V451 HydrophobicContact CE2-CG2 3.98Å; F94-I529 HydrophobicContact CE1-CD1 4.29Å
95	A	94.3	Very high	94.8	Very high	6 Å²	6	17.6 Å²	17.6	5%	0.05	9%	0.091	C	C	.	.	H	α-helix	trans	-55.1	-30.4	175.8	0	0	0	0	0	113.2	F88 S91 P92 V97 G98 N528	F88-A95 HydrophobicContact CB-CB 3.72Å; F88-A95 HydrophobicContact CD2-CB 4.15Å; F88-A95 HydrophobicContact CG-CB 4.46Å; S91-A95 PolarHBondContact O-N 3.36Å; P92-A95 WeakPolarHBondContact O-CB 3.48Å; P92-A95 PolarHBondContact O-N 2.62Å; A95-V97 PolarHBondContact O-N 3.44Å; A95-V97 VanDerWaalsContact O-N 3.16Å; A95-G98 PolarHBondContact O-N 2.98Å; A95-G98 VanDerWaalsContact O-N 3.1Å; A95-N528 WeakPolarHBondContact CB-ND2 3.38Å; A95-N528 PolarHBondContact N-ND2 2.88Å
96	G	96.7	Very high	95	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-57.5	-24.8	175	0	0	0	0	0	114.4	F94 G98 T99 S100 N528	F94-G96 PolarHBondContact O-N 3.46Å; F94-G96 VanDerWaalsContact O-N 3.1Å; G96-G98 VanDerWaalsContact C-N 3.33Å; G96-G98 PolarHBondContact O-N 2.93Å; G96-T99 PolarHBondContact O-N 3.31Å; G96-S100 PolarHBondContact O-N 2.91Å; G96-S100 PolarHBondContact O-OG 3.47Å; G96-N528 PolarHBondContact N-ND2 2.75Å
97	V	97.6	Very high	95.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.7	-43.6	175.1	174.9	0	0	0	0	110.7	M87 F94 A95 T99 S100 Y101 L440 L443 E444 V525	M87-V97 HydrophobicContact CE-CB 4.3Å; M87-V97 HydrophobicContact CE-CG1 4.5Å; F94-V97 HydrophobicContact CB-CG2 4.3Å; F94-V97 VanDerWaalsContact O-CB 3.32Å; F94-V97 WeakPolarHBondContact O-CB 3.3Å; F94-V97 WeakPolarHBondContact O-CG2 3.5Å; F94-V97 PolarHBondContact O-N 3.18Å; A95-V97 PolarHBondContact O-N 3.44Å; A95-V97 VanDerWaalsContact O-N 3.16Å; V97-T99 VanDerWaalsContact C-N 3.34Å; V97-T99 PolarHBondContact O-N 2.94Å; V97-S100 WeakPolarHBondContact O-CB 3.33Å; V97-S100 PolarHBondContact O-N 3.4Å; V97-Y101 HydrophobicContact CG1-CD2 4.09Å; V97-Y101 HydrophobicContact CG1-CE2 3.68Å; V97-Y101 PolarHBondContact O-N 3.24Å; V97-L440 HydrophobicContact CG1-CD2 4.41Å; V97-L443 HydrophobicContact CG2-CB 3.89Å; V97-E444 HydrophobicContact CG1-CB 4.02Å; V97-E444 HydrophobicContact CG1-CG 4.41Å; V97-V525 HydrophobicContact CG2-CG2 4Å
98	G	97.5	Very high	95.1	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66	-36.6	177.9	0	0	0	0	0	112.9	A95 G96 Y101 T102	A95-G98 PolarHBondContact O-N 2.98Å; A95-G98 VanDerWaalsContact O-N 3.1Å; G96-G98 VanDerWaalsContact C-N 3.33Å; G96-G98 PolarHBondContact O-N 2.93Å; G98-Y101 PolarHBondContact O-N 3.4Å; G98-T102 PolarHBondContact O-N 3.14Å; G98-T102 VanDerWaalsContact O-N 3.12Å; G98-T102 PolarHBondContact O-OG1 3.48Å
99	T	97.2	Very high	95.3	Very high	59 Å²	59	13.6 Å²	13.6	36%	0.362	8%	0.076	S	C	.	.	H	α-helix	trans	-66.1	-41.9	173.5	-53.8	0	0	0	0	111.1	G96 V97 Y101 T102 L103 P524	G96-T99 PolarHBondContact O-N 3.31Å; V97-T99 VanDerWaalsContact C-N 3.34Å; V97-T99 PolarHBondContact O-N 2.94Å; T99-Y101 VanDerWaalsContact C-N 3.34Å; T99-Y101 PolarHBondContact O-N 3.23Å; T99-T102 VanDerWaalsContact O-CB 3.3Å; T99-T102 WeakPolarHBondContact O-CB 3.33Å; T99-T102 PolarHBondContact O-N 3.46Å; T99-T102 VanDerWaalsContact O-N 3.16Å; T99-L103 PolarHBondContact O-N 3.1Å; T99-P524 HydrophobicContact CG2-CB 3.96Å; T99-P524 HydrophobicContact CG2-CG 4.06Å
100	S	97.8	Very high	95.7	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61.8	-39.1	174.4	-71	0	0	0	0	112.6	G96 V97 T102 L103 L104 L440 I521	G96-S100 PolarHBondContact O-N 2.91Å; G96-S100 PolarHBondContact O-OG 3.47Å; V97-S100 WeakPolarHBondContact O-CB 3.33Å; V97-S100 PolarHBondContact O-N 3.4Å; S100-T102 VanDerWaalsContact C-N 3.31Å; S100-T102 PolarHBondContact O-N 3.48Å; S100-L103 PolarHBondContact O-N 3.36Å; S100-L104 WeakPolarHBondContact O-CB 3.41Å; S100-L104 PolarHBondContact O-N 3.13Å; S100-L440 VanDerWaalsContact CB-CD2 3.4Å; S100-I521 WeakPolarHBondContact CB-O 3.32Å; S100-I521 PolarHBondContact OG-O 3Å
101	Y	97.8	Very high	96	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.4	-37.9	172.3	-79	-34.7	0	0	0	113.5	P83 V97 G98 T99 L104 S105 C276 F277 L440 E444	P83-Y101 HydrophobicContact CB-CD2 4.49Å; V97-Y101 HydrophobicContact CG1-CD2 4.09Å; V97-Y101 HydrophobicContact CG1-CE2 3.68Å; V97-Y101 PolarHBondContact O-N 3.24Å; G98-Y101 PolarHBondContact O-N 3.4Å; T99-Y101 VanDerWaalsContact C-N 3.34Å; T99-Y101 PolarHBondContact O-N 3.23Å; Y101-L104 PolarHBondContact O-N 3.33Å; Y101-S105 WeakPolarHBondContact O-CB 3.47Å; Y101-S105 PolarHBondContact O-N 3.43Å; Y101-S105 PolarHBondContact O-OG 3.37Å; Y101-C276 WeakPolarHBondContact CD1-O 3.31Å; Y101-C276 VanDerWaalsContact CE1-C 3.47Å; Y101-C276 WeakPolarHBondContact CE1-O 3.38Å; Y101-F277 WeakPolarHBondContact CB-O 3.47Å; Y101-L440 HydrophobicContact CD1-CB 4.28Å; Y101-L440 HydrophobicContact CD1-CD1 3.86Å; Y101-L440 HydrophobicContact CE1-CB 3.56Å; Y101-L440 HydrophobicContact CE1-CD1 3.98Å; Y101-L440 HydrophobicContact CE1-CG 4.37Å; Y101-E444 HydrophobicContact CE2-CB 4.48Å; Y101-E444 HydrophobicContact CE2-CG 4.26Å; Y101-E444 WeakPolarHBondContact CE2-OE2 3.39Å; Y101-E444 PolarHBondContact OH-OE2 3.31Å
102	T	97.6	Very high	96.3	Very high	21 Å²	21	13.5 Å²	13.5	13%	0.129	7%	0.074	C	C	.	.	H	α-helix	trans	-62.4	-46.5	175.1	-53.5	0	0	0	0	110.6	G98 T99 S100 S105 L106 I380 P383	G98-T102 PolarHBondContact O-N 3.14Å; G98-T102 VanDerWaalsContact O-N 3.12Å; G98-T102 PolarHBondContact O-OG1 3.48Å; T99-T102 VanDerWaalsContact O-CB 3.3Å; T99-T102 WeakPolarHBondContact O-CB 3.33Å; T99-T102 PolarHBondContact O-N 3.46Å; T99-T102 VanDerWaalsContact O-N 3.16Å; S100-T102 VanDerWaalsContact C-N 3.31Å; S100-T102 PolarHBondContact O-N 3.48Å; T102-S105 PolarHBondContact O-N 3.41Å; T102-L106 PolarHBondContact O-N 2.87Å; T102-I380 HydrophobicContact CG2-CG2 4.35Å; T102-P383 HydrophobicContact CG2-CB 4.2Å; T102-P383 HydrophobicContact CG2-CG 4.05Å; T102-P383 WeakPolarHBondContact OG1-CG 3.4Å
103	L	96.7	Very high	96.7	Very high	71 Å²	71	12.9 Å²	12.9	37%	0.372	7%	0.07	S	C	.	.	H	α-helix	trans	-65.9	-41	176.9	-66.5	178.4	0	0	0	112.4	T99 S100 S105 L106 L107 I521 P524	T99-L103 PolarHBondContact O-N 3.1Å; S100-L103 PolarHBondContact O-N 3.36Å; L103-S105 VanDerWaalsContact C-N 3.34Å; L103-L106 PolarHBondContact O-N 2.59Å; L103-L107 PolarHBondContact O-N 2.59Å; L103-I521 HydrophobicContact CB-CG2 4.29Å; L103-P524 HydrophobicContact CD1-CG 3.8Å
104	L	96.5	Very high	97	Very high	6 Å²	6	12.6 Å²	12.6	3%	0.031	7%	0.069	C	C	.	.	H	α-helix	trans	-61.2	-45.2	175.6	-178.2	60.1	0	0	0	110.5	S100 Y101 L106 L107 T108 C276 F277 L432 C436 L440 I521	S100-L104 WeakPolarHBondContact O-CB 3.41Å; S100-L104 PolarHBondContact O-N 3.13Å; Y101-L104 PolarHBondContact O-N 3.33Å; L104-L106 VanDerWaalsContact C-N 3.32Å; L104-L106 PolarHBondContact O-N 3.49Å; L104-L107 PolarHBondContact O-N 2.71Å; L104-T108 WeakPolarHBondContact O-CB 3.24Å; L104-T108 PolarHBondContact O-N 3.19Å; L104-T108 PolarHBondContact O-OG1 2.97Å; L104-C276 WeakPolarHBondContact CD2-O 3.36Å; L104-F277 HydrophobicContact CD2-CD1 4.2Å; L104-F277 HydrophobicContact CD2-CE1 4.28Å; L104-F277 HydrophobicContact CG-CD1 4.23Å; L104-F277 HydrophobicContact CG-CE1 4.19Å; L104-L432 HydrophobicContact CD1-CD2 4.11Å; L104-C436 HydrophobicContact CD1-CB 4.26Å; L104-L440 HydrophobicContact CD2-CD1 4.18Å; L104-I521 HydrophobicContact CB-CG2 4.07Å; L104-I521 HydrophobicContact CD1-CD1 4.41Å
105	S	97.5	Very high	97.1	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.4	-39.2	176.4	-64.5	0	0	0	0	111.9	Y101 T102 L103 S109 N379	Y101-S105 WeakPolarHBondContact O-CB 3.47Å; Y101-S105 PolarHBondContact O-N 3.43Å; Y101-S105 PolarHBondContact O-OG 3.37Å; T102-S105 PolarHBondContact O-N 3.41Å; L103-S105 VanDerWaalsContact C-N 3.34Å; S105-S109 WeakPolarHBondContact O-CB 3.31Å; S105-S109 PolarHBondContact O-N 2.81Å; S105-S109 PolarHBondContact O-OG 2.61Å; S105-S109 VanDerWaalsContact O-OG 3.09Å; S105-N379 PolarHBondContact OG-ND2 3.05Å
106	L	97	Very high	97.3	Very high	26 Å²	26	12.6 Å²	12.6	14%	0.136	7%	0.067	C	C	.	.	H	α-helix	trans	-61.6	-50.6	175.4	-179.2	63.2	0	0	0	111.6	T102 L103 L104 S109 S110 I380 L408 I412	T102-L106 PolarHBondContact O-N 2.87Å; L103-L106 PolarHBondContact O-N 2.59Å; L104-L106 VanDerWaalsContact C-N 3.32Å; L104-L106 PolarHBondContact O-N 3.49Å; L106-S109 PolarHBondContact O-N 3.3Å; L106-S109 PolarHBondContact O-OG 3.45Å; L106-S110 PolarHBondContact O-N 3.25Å; L106-S110 VanDerWaalsContact O-N 3.15Å; L106-S110 PolarHBondContact O-OG 3.36Å; L106-I380 VanDerWaalsContact CA-CD1 3.42Å; L106-I380 HydrophobicContact CB-CD1 3.95Å; L106-I380 HydrophobicContact CB-CG1 4.37Å; L106-I380 HydrophobicContact CD1-CD1 4.09Å; L106-L408 HydrophobicContact CD2-CD2 4.12Å; L106-I412 HydrophobicContact CD1-CD1 4.07Å; L106-I412 HydrophobicContact CD2-CD1 3.83Å; L106-I412 HydrophobicContact CG-CD1 3.88Å
107	L	95.3	Very high	97.4	Very high	24 Å²	24	12.5 Å²	12.5	13%	0.126	7%	0.066	C	C	.	.	H	α-helix	trans	-65.3	-48.1	179.2	-177	64.2	0	0	0	111.8	L103 L104 S109 S110 I111 Y416 I428 L432 M518 I521	L103-L107 PolarHBondContact O-N 2.59Å; L104-L107 PolarHBondContact O-N 2.71Å; L107-S109 VanDerWaalsContact C-N 3.32Å; L107-S109 PolarHBondContact O-N 2.98Å; L107-S110 PolarHBondContact O-N 3.49Å; L107-S110 PolarHBondContact O-OG 3.4Å; L107-I111 HydrophobicContact CD1-CD1 4.49Å; L107-I111 HydrophobicContact CG-CD1 4.15Å; L107-I111 PolarHBondContact O-N 3.1Å; L107-I111 VanDerWaalsContact O-N 3.11Å; L107-Y416 WeakPolarHBondContact CD1-OH 3.11Å; L107-I428 HydrophobicContact CD2-CG2 4.29Å; L107-L432 HydrophobicContact CD2-CD1 3.69Å; L107-L432 HydrophobicContact CD2-CD2 3.83Å; L107-L432 HydrophobicContact CD2-CG 4.22Å; L107-L432 HydrophobicContact CG-CD1 4.25Å; L107-M518 HydrophobicContact CD2-CE 4.41Å; L107-M518 HydrophobicContact CD2-SD 3.46Å; L107-M518 WeakPolarHBondContact CD2-SD 3.4Å; L107-I521 HydrophobicContact CD2-CD1 3.6Å
108	T	96	Very high	97.3	Very high	7 Å²	7	12.5 Å²	12.5	4%	0.043	7%	0.066	C	C	.	.	H	α-helix	trans	-60.2	-41.7	178.3	-58.5	0	0	0	0	111.3	L104 S110 I111 Y112 F277 F372 L376	L104-T108 WeakPolarHBondContact O-CB 3.24Å; L104-T108 PolarHBondContact O-N 3.19Å; L104-T108 PolarHBondContact O-OG1 2.97Å; T108-S110 PolarHBondContact O-N 3.34Å; T108-I111 PolarHBondContact O-N 3.1Å; T108-Y112 HydrophobicContact CG2-CD2 3.67Å; T108-Y112 HydrophobicContact CG2-CE2 3.61Å; T108-Y112 VanDerWaalsContact O-CD2 3.29Å; T108-Y112 WeakPolarHBondContact O-CD2 3.26Å; T108-Y112 PolarHBondContact O-N 2.89Å; T108-F277 HydrophobicContact CG2-CE1 3.96Å; T108-F277 HydrophobicContact CG2-CZ 4.25Å; T108-F372 HydrophobicContact CG2-CE1 3.87Å; T108-F372 HydrophobicContact CG2-CZ 4.31Å; T108-L376 HydrophobicContact CG2-CD1 3.71Å
109	S	97.9	Very high	97.3	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-60.3	-43.9	176.5	69.6	0	0	0	0	112	S105 L106 L107 I111 Y112 V113 L373	S105-S109 WeakPolarHBondContact O-CB 3.31Å; S105-S109 PolarHBondContact O-N 2.81Å; S105-S109 PolarHBondContact O-OG 2.61Å; S105-S109 VanDerWaalsContact O-OG 3.09Å; L106-S109 PolarHBondContact O-N 3.3Å; L106-S109 PolarHBondContact O-OG 3.45Å; L107-S109 VanDerWaalsContact C-N 3.32Å; L107-S109 PolarHBondContact O-N 2.98Å; S109-I111 VanDerWaalsContact C-N 3.33Å; S109-I111 PolarHBondContact O-N 2.99Å; S109-Y112 PolarHBondContact O-N 3.39Å; S109-V113 VanDerWaalsContact O-CG2 3.31Å; S109-V113 WeakPolarHBondContact O-CG2 3.46Å; S109-V113 PolarHBondContact O-N 3.3Å; S109-L373 WeakPolarHBondContact O-CD2 3.1Å
110	S	97.4	Very high	97.3	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-63.3	-35.6	177.7	64.6	0	0	0	0	113.5	L106 L107 T108 A114 I412 Y416	L106-S110 PolarHBondContact O-N 3.25Å; L106-S110 VanDerWaalsContact O-N 3.15Å; L106-S110 PolarHBondContact O-OG 3.36Å; L107-S110 PolarHBondContact O-N 3.49Å; L107-S110 PolarHBondContact O-OG 3.4Å; T108-S110 PolarHBondContact O-N 3.34Å; S110-A114 PolarHBondContact O-N 3Å; S110-I412 WeakPolarHBondContact OG-CG2 3.26Å; S110-Y416 WeakPolarHBondContact OG-CE2 3.43Å
111	I	97	Very high	97.2	Very high	4 Å²	4	10.9 Å²	10.9	2%	0.021	6%	0.055	C	C	.	.	H	α-helix	trans	-66.6	-45.8	173.6	-69.7	162.4	0	0	0	111	L107 T108 S109 V113 A114 Y115 Y416 I425 I428 V429 L432	L107-I111 HydrophobicContact CD1-CD1 4.49Å; L107-I111 HydrophobicContact CG-CD1 4.15Å; L107-I111 PolarHBondContact O-N 3.1Å; L107-I111 VanDerWaalsContact O-N 3.11Å; T108-I111 PolarHBondContact O-N 3.1Å; S109-I111 VanDerWaalsContact C-N 3.33Å; S109-I111 PolarHBondContact O-N 2.99Å; I111-V113 VanDerWaalsContact C-N 3.33Å; I111-V113 PolarHBondContact O-N 3.21Å; I111-A114 WeakPolarHBondContact O-CB 3.33Å; I111-A114 PolarHBondContact O-N 2.98Å; I111-A114 VanDerWaalsContact O-N 3.13Å; I111-Y115 HydrophobicContact CG2-CD2 3.96Å; I111-Y115 HydrophobicContact CG2-CE2 3.54Å; I111-Y115 PolarHBondContact O-N 3.29Å; I111-Y416 HydrophobicContact CG1-CE2 4.08Å; I111-I425 HydrophobicContact CG2-CG2 3.64Å; I111-I428 HydrophobicContact CD1-CG2 3.73Å; I111-V429 HydrophobicContact CD1-CG2 4.24Å; I111-V429 HydrophobicContact CG2-CG2 4.09Å; I111-L432 HydrophobicContact CD1-CD1 4.01Å
112	Y	97.9	Very high	97.1	Very high	20 Å²	20	10.9 Å²	10.9	8%	0.078	6%	0.055	C	C	.	.	H	α-helix	trans	-67.8	-32.3	179.8	-88.2	-105.9	0	0	0	112.5	T36 T108 S109 A114 Y115 A116 I369 F372	T36-Y112 WeakPolarHBondContact CG2-OH 3.46Å; T108-Y112 HydrophobicContact CG2-CD2 3.67Å; T108-Y112 HydrophobicContact CG2-CE2 3.61Å; T108-Y112 VanDerWaalsContact O-CD2 3.29Å; T108-Y112 WeakPolarHBondContact O-CD2 3.26Å; T108-Y112 PolarHBondContact O-N 2.89Å; S109-Y112 PolarHBondContact O-N 3.39Å; Y112-A114 VanDerWaalsContact C-N 3.33Å; Y112-Y115 PolarHBondContact O-N 2.93Å; Y112-A116 PolarHBondContact O-N 3.41Å; Y112-I369 HydrophobicContact CD1-CG1 4.2Å; Y112-I369 HydrophobicContact CD1-CG2 4.14Å; Y112-I369 WeakPolarHBondContact O-CG2 3.35Å; Y112-F372 AromaticContact CD1-CD1 3.66Å; Y112-F372 HydrophobicContact CD1-CD1 3.66Å; Y112-F372 HydrophobicContact CD1-CE1 4.16Å; Y112-F372 HydrophobicContact CD2-CD1 4.25Å; Y112-F372 AromaticContact CD2-CE1 3.97Å; Y112-F372 HydrophobicContact CD2-CE1 3.97Å; Y112-F372 AromaticContact CE1-CD1 3.59Å; Y112-F372 HydrophobicContact CE1-CD1 3.59Å; Y112-F372 AromaticContact CE1-CE1 3.87Å; Y112-F372 HydrophobicContact CE1-CE1 3.87Å; Y112-F372 HydrophobicContact CE1-CG 4.48Å; Y112-F372 HydrophobicContact CE2-CD1 4.18Å; Y112-F372 AromaticContact CE2-CE1 3.66Å; Y112-F372 HydrophobicContact CE2-CE1 3.66Å; Y112-F372 AromaticContact CG-CD1 3.98Å; Y112-F372 HydrophobicContact CG-CD1 3.98Å; Y112-F372 HydrophobicContact CG-CE1 4.18Å; Y112-F372 AromaticContact CZ-CD1 3.84Å; Y112-F372 AromaticContact CZ-CE1 3.59Å
113	V	98.6	Very high	97	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-64.5	-38.7	170.6	177	0	0	0	0	111.2	S109 I111 A116 S117 V198 W199 I202 L373 T413	S109-V113 VanDerWaalsContact O-CG2 3.31Å; S109-V113 WeakPolarHBondContact O-CG2 3.46Å; S109-V113 PolarHBondContact O-N 3.3Å; I111-V113 VanDerWaalsContact C-N 3.33Å; I111-V113 PolarHBondContact O-N 3.21Å; V113-A116 PolarHBondContact O-N 2.89Å; V113-S117 PolarHBondContact O-N 3.02Å; V113-V198 HydrophobicContact CB-CG1 4.26Å; V113-V198 HydrophobicContact CG1-CB 3.93Å; V113-V198 HydrophobicContact CG1-CG1 3.85Å; V113-V198 HydrophobicContact CG2-CG1 3.79Å; V113-W199 HydrophobicContact CG2-CD2 4.34Å; V113-W199 HydrophobicContact CG2-CH2 4.48Å; V113-W199 HydrophobicContact CG2-CZ2 3.79Å; V113-I202 HydrophobicContact CG2-CD1 4.23Å; V113-L373 HydrophobicContact CG2-CD1 3.8Å; V113-L373 HydrophobicContact CG2-CD2 4Å; V113-T413 HydrophobicContact CB-CG2 4.09Å; V113-T413 HydrophobicContact CG1-CG2 3.83Å
114	A	97.7	Very high	96.9	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.7	-41.4	173.5	0	0	0	0	0	112	S110 I111 Y112 A116 S117 Y118 T413 Y416 I425	S110-A114 PolarHBondContact O-N 3Å; I111-A114 WeakPolarHBondContact O-CB 3.33Å; I111-A114 PolarHBondContact O-N 2.98Å; I111-A114 VanDerWaalsContact O-N 3.13Å; Y112-A114 VanDerWaalsContact C-N 3.33Å; A114-A116 VanDerWaalsContact C-N 3.35Å; A114-A116 PolarHBondContact O-N 2.76Å; A114-S117 PolarHBondContact O-N 2.78Å; A114-S117 PolarHBondContact O-OG 3.09Å; A114-Y118 HydrophobicContact CB-CE2 4.46Å; A114-Y118 VanDerWaalsContact O-CD2 3.26Å; A114-Y118 WeakPolarHBondContact O-CD2 3.25Å; A114-Y118 VanDerWaalsContact O-CG 3.26Å; A114-Y118 PolarHBondContact O-N 3.1Å; A114-T413 HydrophobicContact CB-CG2 4.41Å; A114-Y416 HydrophobicContact CB-CD2 4.34Å; A114-Y416 HydrophobicContact CB-CG 4.46Å; A114-I425 HydrophobicContact CB-CD1 3.63Å
115	Y	97.4	Very high	96.6	Very high	25 Å²	25	11.6 Å²	11.6	10%	0.098	6%	0.059	C	C	.	.	H	α-helix	trans	-61.6	-41.3	172	-70.8	-48.2	0	0	0	112.7	I111 Y112 S117 Y118 I119 F338 F422 I425	I111-Y115 HydrophobicContact CG2-CD2 3.96Å; I111-Y115 HydrophobicContact CG2-CE2 3.54Å; I111-Y115 PolarHBondContact O-N 3.29Å; Y112-Y115 PolarHBondContact O-N 2.93Å; Y115-S117 VanDerWaalsContact C-N 3.32Å; Y115-S117 PolarHBondContact O-N 2.87Å; Y115-Y118 AromaticContact CD1-CD2 3.87Å; Y115-Y118 HydrophobicContact CD1-CD2 3.87Å; Y115-Y118 HydrophobicContact CD1-CE2 4.04Å; Y115-Y118 HydrophobicContact CE1-CE2 4.46Å; Y115-Y118 WeakPolarHBondContact O-CB 3.43Å; Y115-Y118 PolarHBondContact O-N 2.89Å; Y115-I119 WeakPolarHBondContact O-CG1 3.47Å; Y115-I119 PolarHBondContact O-N 3.05Å; Y115-F338 HydrophobicContact CD1-CB 4.2Å; Y115-F338 AromaticContact CD1-CD2 3.47Å; Y115-F338 HydrophobicContact CD1-CD2 3.47Å; Y115-F338 VanDerWaalsContact CD1-CD2 3.47Å; Y115-F338 HydrophobicContact CD1-CE2 4.1Å; Y115-F338 HydrophobicContact CD1-CG 4.01Å; Y115-F338 HydrophobicContact CE1-CB 3.95Å; Y115-F338 HydrophobicContact CE1-CD2 4.1Å; Y115-F338 HydrophobicContact CE1-CG 4.21Å; Y115-F338 HydrophobicContact CG-CD2 4.14Å; Y115-F422 HydrophobicContact CE1-CD2 4.37Å; Y115-F422 HydrophobicContact CE1-CE2 4.03Å; Y115-I425 HydrophobicContact CE1-CG2 4.17Å; Y115-I425 HydrophobicContact CE2-CG2 4.19Å; Y115-I425 VanDerWaalsContact OH-CG2 3.24Å; Y115-I425 WeakPolarHBondContact OH-CG2 3.34Å
116	A	98.3	Very high	96.3	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-62.4	-38.7	174.2	0	0	0	0	0	112	Y112 V113 A114 Y118 I119 I120 V198 L366 I369	Y112-A116 PolarHBondContact O-N 3.41Å; V113-A116 PolarHBondContact O-N 2.89Å; A114-A116 VanDerWaalsContact C-N 3.35Å; A114-A116 PolarHBondContact O-N 2.76Å; A116-Y118 VanDerWaalsContact C-N 3.34Å; A116-Y118 PolarHBondContact O-N 3Å; A116-I119 PolarHBondContact O-N 3.38Å; A116-I120 VanDerWaalsContact O-CG1 3.32Å; A116-I120 WeakPolarHBondContact O-CG1 3.24Å; A116-I120 PolarHBondContact O-N 2.97Å; A116-V198 HydrophobicContact CB-CG1 4.27Å; A116-V198 HydrophobicContact CB-CG2 3.66Å; A116-L366 HydrophobicContact CB-CD1 3.84Å; A116-I369 HydrophobicContact CB-CG2 3.87Å
117	S	98	Very high	96	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.1	-32.8	177	79.1	0	0	0	0	112.5	V113 A114 Y115 I120 S121 L191 S195	V113-S117 PolarHBondContact O-N 3.02Å; A114-S117 PolarHBondContact O-N 2.78Å; A114-S117 PolarHBondContact O-OG 3.09Å; Y115-S117 VanDerWaalsContact C-N 3.32Å; Y115-S117 PolarHBondContact O-N 2.87Å; S117-I120 PolarHBondContact O-N 3.42Å; S117-S121 WeakPolarHBondContact O-CB 3.26Å; S117-S121 PolarHBondContact O-N 3.16Å; S117-L191 WeakPolarHBondContact CB-O 3.45Å; S117-S195 WeakPolarHBondContact CB-OG 3.46Å
118	Y	96.7	Very high	95.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.8	-42.6	169.2	-56.2	-35.4	0	0	0	112.1	A114 Y115 A116 S121 L122 F170 L175 L191 F338 Y416 F422 I425	A114-Y118 HydrophobicContact CB-CE2 4.46Å; A114-Y118 VanDerWaalsContact O-CD2 3.26Å; A114-Y118 WeakPolarHBondContact O-CD2 3.25Å; A114-Y118 VanDerWaalsContact O-CG 3.26Å; A114-Y118 PolarHBondContact O-N 3.1Å; Y115-Y118 AromaticContact CD1-CD2 3.87Å; Y115-Y118 HydrophobicContact CD1-CD2 3.87Å; Y115-Y118 HydrophobicContact CD1-CE2 4.04Å; Y115-Y118 HydrophobicContact CE1-CE2 4.46Å; Y115-Y118 WeakPolarHBondContact O-CB 3.43Å; Y115-Y118 PolarHBondContact O-N 2.89Å; A116-Y118 VanDerWaalsContact C-N 3.34Å; A116-Y118 PolarHBondContact O-N 3Å; Y118-S121 WeakPolarHBondContact O-CB 3.24Å; Y118-S121 PolarHBondContact O-N 3.28Å; Y118-L122 WeakPolarHBondContact O-CG 3.47Å; Y118-L122 PolarHBondContact O-N 2.59Å; Y118-F170 HydrophobicContact CD1-CZ 4.4Å; Y118-F170 HydrophobicContact CD2-CZ 4.16Å; Y118-F170 HydrophobicContact CG-CE2 4.41Å; Y118-F170 AromaticContact CG-CZ 3.95Å; Y118-F170 HydrophobicContact CG-CZ 3.95Å; Y118-L175 HydrophobicContact CD1-CD2 3.68Å; Y118-L175 HydrophobicContact CE1-CD2 3.48Å; Y118-L175 VanDerWaalsContact CE1-CD2 3.48Å; Y118-L191 HydrophobicContact CD1-CD1 4.03Å; Y118-L191 HydrophobicContact CD1-CD2 3.66Å; Y118-L191 HydrophobicContact CD1-CG 4.49Å; Y118-L191 HydrophobicContact CE1-CD1 3.61Å; Y118-L191 HydrophobicContact CE1-CD2 4.13Å; Y118-L191 HydrophobicContact CE1-CG 4.49Å; Y118-F338 HydrophobicContact CD2-CE2 4.32Å; Y118-F338 HydrophobicContact CD2-CZ 4.31Å; Y118-F338 HydrophobicContact CG-CZ 4.39Å; Y118-Y416 PolarHBondContact OH-O 3.27Å; Y118-F422 HydrophobicContact CD2-CD2 4.09Å; Y118-F422 HydrophobicContact CE2-CB 4.43Å; Y118-F422 AromaticContact CE2-CD2 3.62Å; Y118-F422 HydrophobicContact CE2-CD2 3.62Å; Y118-F422 HydrophobicContact CE2-CE2 4.41Å; Y118-F422 PolarHBondContact OH-N 3.13Å; Y118-I425 HydrophobicContact CE2-CD1 4.1Å; Y118-I425 WeakPolarHBondContact OH-CD1 3.13Å
119	I	97.5	Very high	95.2	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.3	-42.2	176	-66.1	175.3	0	0	0	111.2	Y115 A116 S121 L122 L123 F338 L341 L362 F365 L366 I369	Y115-I119 WeakPolarHBondContact O-CG1 3.47Å; Y115-I119 PolarHBondContact O-N 3.05Å; A116-I119 PolarHBondContact O-N 3.38Å; I119-S121 VanDerWaalsContact C-N 3.31Å; I119-S121 PolarHBondContact O-N 2.84Å; I119-L122 WeakPolarHBondContact O-CB 3.21Å; I119-L122 PolarHBondContact O-N 3.04Å; I119-L123 HydrophobicContact CG2-CD1 4.42Å; I119-L123 PolarHBondContact O-N 3.44Å; I119-F338 HydrophobicContact CD1-CE2 4.5Å; I119-F338 HydrophobicContact CG1-CE2 3.93Å; I119-F338 HydrophobicContact CG1-CZ 4.29Å; I119-L341 HydrophobicContact CD1-CD1 3.78Å; I119-L341 HydrophobicContact CG1-CD1 4.19Å; I119-L362 HydrophobicContact CG2-CB 4.02Å; I119-L362 HydrophobicContact CG2-CD2 4.03Å; I119-L362 WeakPolarHBondContact CG2-O 3.29Å; I119-F365 HydrophobicContact CD1-CB 3.89Å; I119-L366 HydrophobicContact CG2-CB 3.94Å; I119-L366 HydrophobicContact CG2-CD1 4.38Å; I119-I369 HydrophobicContact CD1-CD1 3.67Å
120	I	97.9	Very high	94.6	Very high	24 Å²	24	27.1 Å²	27.1	12%	0.123	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-41	175.3	-69	164	0	0	0	110.6	A116 S117 L122 L123 V124 F197 V198 L366	A116-I120 VanDerWaalsContact O-CG1 3.32Å; A116-I120 WeakPolarHBondContact O-CG1 3.24Å; A116-I120 PolarHBondContact O-N 2.97Å; S117-I120 PolarHBondContact O-N 3.42Å; I120-L122 VanDerWaalsContact C-N 3.34Å; I120-L122 PolarHBondContact O-N 2.85Å; I120-L123 WeakPolarHBondContact O-CB 3.41Å; I120-L123 PolarHBondContact O-N 2.97Å; I120-V124 WeakPolarHBondContact O-CG2 3.48Å; I120-V124 PolarHBondContact O-N 2.84Å; I120-F197 HydrophobicContact CD1-CD1 3.75Å; I120-F197 HydrophobicContact CD1-CE1 4.39Å; I120-V198 HydrophobicContact CD1-CG2 3.53Å; I120-L366 HydrophobicContact CD1-CD1 4.31Å; I120-L366 HydrophobicContact CG1-CD1 4.08Å; I120-L366 HydrophobicContact CG1-CD2 4.16Å
121	S	95.5	Very high	93.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	17%	0.173	C	C	.	.	H	α-helix	trans	-61.1	-43	174.3	-170.5	0	0	0	0	111.5	S117 Y118 I119 L123 V124 H125 V174 L190	S117-S121 WeakPolarHBondContact O-CB 3.26Å; S117-S121 PolarHBondContact O-N 3.16Å; Y118-S121 WeakPolarHBondContact O-CB 3.24Å; Y118-S121 PolarHBondContact O-N 3.28Å; I119-S121 VanDerWaalsContact C-N 3.31Å; I119-S121 PolarHBondContact O-N 2.84Å; S121-L123 PolarHBondContact O-N 3.27Å; S121-V124 PolarHBondContact O-N 2.98Å; S121-H125 PolarHBondContact O-N 2.92Å; S121-H125 PolarHBondContact O-ND1 3.46Å; S121-V174 WeakPolarHBondContact OG-CG1 3.38Å; S121-L190 VanDerWaalsContact OG-CD2 3.24Å; S121-L190 WeakPolarHBondContact OG-CD2 3.39Å
122	L	94.8	Very high	93.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-41.6	174.2	-73.5	165.9	0	0	0	112.2	Y118 I119 I120 V124 H125 L126 W137 F169 F170 V174 F338 L342 L345 L362	Y118-L122 WeakPolarHBondContact O-CG 3.47Å; Y118-L122 PolarHBondContact O-N 2.59Å; I119-L122 WeakPolarHBondContact O-CB 3.21Å; I119-L122 PolarHBondContact O-N 3.04Å; I120-L122 VanDerWaalsContact C-N 3.34Å; I120-L122 PolarHBondContact O-N 2.85Å; L122-V124 VanDerWaalsContact C-N 3.34Å; L122-V124 PolarHBondContact O-N 3.3Å; L122-H125 PolarHBondContact O-N 3.17Å; L122-L126 WeakPolarHBondContact O-CB 3.22Å; L122-L126 PolarHBondContact O-N 3.15Å; L122-W137 HydrophobicContact CD2-CZ3 4.25Å; L122-F169 HydrophobicContact CD2-CE1 4.08Å; L122-F170 HydrophobicContact CD2-CD2 4.39Å; L122-V174 HydrophobicContact CD2-CG2 3.86Å; L122-F338 HydrophobicContact CD1-CZ 4.19Å; L122-L342 HydrophobicContact CD1-CD2 4.05Å; L122-L345 HydrophobicContact CD1-CD2 4.17Å; L122-L345 HydrophobicContact CD2-CD2 4.1Å; L122-L362 HydrophobicContact CB-CD1 3.98Å; L122-L362 HydrophobicContact CB-CD2 4.06Å; L122-L362 HydrophobicContact CD1-CD2 4.04Å
123	L	95.4	Very high	92.3	Very high	26 Å²	26	46.5 Å²	46.5	14%	0.136	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-42.4	173.3	-77.3	166.9	0	0	0	111.6	I119 I120 S121 L126 F127 L362 L366	I119-L123 HydrophobicContact CG2-CD1 4.42Å; I119-L123 PolarHBondContact O-N 3.44Å; I120-L123 WeakPolarHBondContact O-CB 3.41Å; I120-L123 PolarHBondContact O-N 2.97Å; S121-L123 PolarHBondContact O-N 3.27Å; L123-L126 VanDerWaalsContact O-CB 3.25Å; L123-L126 WeakPolarHBondContact O-CB 3.46Å; L123-L126 PolarHBondContact O-N 3.21Å; L123-F127 WeakPolarHBondContact O-CD2 3.42Å; L123-F127 PolarHBondContact O-N 2.94Å; L123-L362 HydrophobicContact CD1-CB 4.43Å; L123-L362 HydrophobicContact CD2-CB 3.72Å; L123-L362 HydrophobicContact CD2-CD1 3.87Å; L123-L362 HydrophobicContact CD2-CG 4.46Å; L123-L362 HydrophobicContact CG-CB 3.89Å; L123-L362 HydrophobicContact CG-CD1 3.98Å; L123-L366 HydrophobicContact CD1-CD2 4.11Å
124	V	94.3	Very high	91.4	Very high	47 Å²	47	49.8 Å²	49.8	29%	0.285	25%	0.252	S	S	.	.	H	α-helix	trans	-64.2	-41.8	178	165.8	0	0	0	0	111.4	I120 S121 L122 L126 F127 M128 L190	I120-V124 WeakPolarHBondContact O-CG2 3.48Å; I120-V124 PolarHBondContact O-N 2.84Å; S121-V124 PolarHBondContact O-N 2.98Å; L122-V124 VanDerWaalsContact C-N 3.34Å; L122-V124 PolarHBondContact O-N 3.3Å; V124-L126 VanDerWaalsContact C-N 3.33Å; V124-L126 PolarHBondContact O-N 2.92Å; V124-F127 PolarHBondContact O-N 3.35Å; V124-M128 HydrophobicContact CG1-CE 3.27Å; V124-M128 WeakPolarHBondContact O-CG 3.32Å; V124-M128 PolarHBondContact O-N 3.28Å; V124-L190 HydrophobicContact CB-CD1 4.34Å; V124-L190 HydrophobicContact CG1-CD1 4.01Å; V124-L190 HydrophobicContact CG1-CD2 4.11Å; V124-L190 HydrophobicContact CG2-CD1 4.23Å
125	H	90.7	Very high	90.5	Very high	40 Å²	40	49.8 Å²	49.8	19%	0.185	25%	0.252	C	S	.	.	H	α-helix	trans	-66.4	-33.5	173.5	-71.7	85	0	0	0	112.6	S121 L122 M128 S129	S121-H125 PolarHBondContact O-N 2.92Å; S121-H125 PolarHBondContact O-ND1 3.46Å; L122-H125 PolarHBondContact O-N 3.17Å; H125-M128 PolarHBondContact O-N 3.23Å; H125-S129 PolarHBondContact O-N 3.26Å; H125-S129 VanDerWaalsContact O-N 3.09Å; H125-S129 PolarHBondContact O-OG 3.32Å
126	L	91.6	Very high	89.5	Confident	6 Å²	6	51 Å²	51	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-46.9	172.5	-169.3	55.5	0	0	0	111.5	L122 L123 V124 S129 I130 P135 W137 H355 A359 L362	L122-L126 WeakPolarHBondContact O-CB 3.22Å; L122-L126 PolarHBondContact O-N 3.15Å; L123-L126 VanDerWaalsContact O-CB 3.25Å; L123-L126 WeakPolarHBondContact O-CB 3.46Å; L123-L126 PolarHBondContact O-N 3.21Å; V124-L126 VanDerWaalsContact C-N 3.33Å; V124-L126 PolarHBondContact O-N 2.92Å; L126-S129 CarbonylContact O-C 3.2Å; L126-S129 PolarHBondContact O-N 3.18Å; L126-S129 PolarHBondContact O-OG 3.15Å; L126-I130 PolarHBondContact O-N 3.17Å; L126-P135 HydrophobicContact CD1-CB 3.82Å; L126-W137 HydrophobicContact CB-CH2 3.85Å; L126-W137 HydrophobicContact CB-CZ2 4.46Å; L126-W137 HydrophobicContact CD1-CH2 3.75Å; L126-W137 HydrophobicContact CD1-CZ2 3.59Å; L126-W137 HydrophobicContact CG-CH2 4.29Å; L126-W137 HydrophobicContact CG-CZ2 4.42Å; L126-H355 HydrophobicContact CD1-CB 4.25Å; L126-A359 HydrophobicContact CD2-CB 3.78Å; L126-L362 HydrophobicContact CD2-CD1 4.4Å
127	F	90.3	Very high	88.6	Confident	130 Å²	130	51.1 Å²	51.1	57%	0.57	27%	0.265	S	S	*	.	H	α-helix	trans	-68.7	-36.6	178.7	-75.9	-65.6	0	0	0	112.5	L123 V124 S129 I130	L123-F127 WeakPolarHBondContact O-CD2 3.42Å; L123-F127 PolarHBondContact O-N 2.94Å; V124-F127 PolarHBondContact O-N 3.35Å; F127-S129 PolarHBondContact O-N 3.1Å; F127-I130 HydrophobicContact CD1-CD1 4.49Å; F127-I130 WeakPolarHBondContact O-CB 3.15Å; F127-I130 VanDerWaalsContact O-CG2 3.28Å; F127-I130 WeakPolarHBondContact O-CG2 3.44Å; F127-I130 PolarHBondContact O-N 3.28Å
128	M	88.3	Confident	87.3	Confident	134 Å²	134	51.3 Å²	51.3	66%	0.66	27%	0.266	S	S	*	.	H	α-helix	trans	-66.8	-25.4	174.9	-74.7	-165.2	-110.9	0	0	113.1	V124 H125	V124-M128 HydrophobicContact CG1-CE 3.27Å; V124-M128 WeakPolarHBondContact O-CG 3.32Å; V124-M128 PolarHBondContact O-N 3.28Å; H125-M128 PolarHBondContact O-N 3.23Å
129	S	85.4	Confident	85.9	Confident	5 Å²	5	53 Å²	53	4%	0.035	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	18.8	178	56.4	0	0	0	0	113.1	H125 L126 F127 E131 N132 H355	H125-S129 PolarHBondContact O-N 3.26Å; H125-S129 VanDerWaalsContact O-N 3.09Å; H125-S129 PolarHBondContact O-OG 3.32Å; L126-S129 CarbonylContact O-C 3.2Å; L126-S129 PolarHBondContact O-N 3.18Å; L126-S129 PolarHBondContact O-OG 3.15Å; F127-S129 PolarHBondContact O-N 3.1Å; S129-E131 VanDerWaalsContact C-N 3.26Å; S129-E131 PolarHBondContact O-N 2.97Å; S129-N132 WeakPolarHBondContact O-CB 3.46Å; S129-N132 PolarHBondContact O-N 3.15Å; S129-N132 VanDerWaalsContact O-N 3.09Å; S129-H355 PolarHBondContact O-NE2 3.08Å
130	I	86.1	Confident	84.3	Confident	107 Å²	107	53.5 Å²	53.5	55%	0.549	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-26.2	-176.9	-158.6	165.2	0	0	0	113.5	L126 F127 N132	L126-I130 PolarHBondContact O-N 3.17Å; F127-I130 HydrophobicContact CD1-CD1 4.49Å; F127-I130 WeakPolarHBondContact O-CB 3.15Å; F127-I130 VanDerWaalsContact O-CG2 3.28Å; F127-I130 WeakPolarHBondContact O-CG2 3.44Å; F127-I130 PolarHBondContact O-N 3.28Å; I130-N132 VanDerWaalsContact C-N 3.31Å
131	E	83.6	Confident	82.4	Confident	185 Å²	185	53.3 Å²	53.3	86%	0.864	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-15.6	175.7	-64.7	-176.8	175.8	0	0	112.7	S129	S129-E131 VanDerWaalsContact C-N 3.26Å; S129-E131 PolarHBondContact O-N 2.97Å
132	N	81.5	Confident	80.4	Confident	91 Å²	91	55 Å²	55	49%	0.487	30%	0.298	S	S	.	.	S	Bend	trans	-82.5	144.4	175.8	-59.8	-20.1	0	0	0	109.6	S129 I130 T134 H355	S129-N132 WeakPolarHBondContact O-CB 3.46Å; S129-N132 PolarHBondContact O-N 3.15Å; S129-N132 VanDerWaalsContact O-N 3.09Å; I130-N132 VanDerWaalsContact C-N 3.31Å; N132-T134 PolarHBondContact O-N 3.02Å; N132-T134 VanDerWaalsContact O-N 3.16Å; N132-H355 PolarHBondContact O-CE1 2.82Å; N132-H355 PolarHBondContact O-NE2 2.83Å
133	D	78	Confident	78.3	Confident	155 Å²	155	59.5 Å²	59.5	83%	0.829	32%	0.317	S	S	*	.	S	Bend	trans	-58.6	-31.4	179.5	-69.1	-37.8	0	0	0	113.2
134	T	79.8	Confident	76.1	Confident	70 Å²	70	61.9 Å²	61.9	43%	0.429	33%	0.333	S	S	.	.	S	Bend	trans	-136.2	146.3	179.1	61.5	0	0	0	0	111.5	N132 P354	N132-T134 PolarHBondContact O-N 3.02Å; N132-T134 VanDerWaalsContact O-N 3.16Å; T134-P354 HydrophobicContact CG2-CG 4.46Å
135	P	80	Confident	73.6	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.338	C	S	.	.			trans	-63.9	153.2	172.4	28.4	-33.7	0	0	0	110.6	L126 W137 A138 P354	L126-P135 HydrophobicContact CD1-CB 3.82Å; P135-W137 HydrophobicContact CB-CD2 4.02Å; P135-W137 HydrophobicContact CB-CE3 4.48Å; P135-W137 HydrophobicContact CB-CH2 4.31Å; P135-W137 HydrophobicContact CB-CZ2 3.77Å; P135-W137 HydrophobicContact CG-CZ2 4.33Å; P135-W137 PolarHBondContact O-N 3.41Å; P135-A138 HydrophobicContact CG-CB 4.04Å; P135-A138 WeakPolarHBondContact O-CB 3.3Å; P135-A138 PolarHBondContact O-N 3.33Å; P135-P354 HydrophobicContact CG-CB 4.09Å
136	S	75.5	Confident	71.1	Confident	51 Å²	51	64.9 Å²	64.9	36%	0.357	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-15.3	-171.5	-54.7	0	0	0	0	115.5	F169	S136-F169 VanDerWaalsContact CB-CE2 3.42Å
137	W	78.9	Confident	68.7	Low	2 Å²	2	69.9 Å²	69.9	1%	0.008	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-5.1	177.6	55.9	75	0	0	0	114.6	L122 L126 P135 I166 F169 L345 S358	L122-W137 HydrophobicContact CD2-CZ3 4.25Å; L126-W137 HydrophobicContact CB-CH2 3.85Å; L126-W137 HydrophobicContact CB-CZ2 4.46Å; L126-W137 HydrophobicContact CD1-CH2 3.75Å; L126-W137 HydrophobicContact CD1-CZ2 3.59Å; L126-W137 HydrophobicContact CG-CH2 4.29Å; L126-W137 HydrophobicContact CG-CZ2 4.42Å; P135-W137 HydrophobicContact CB-CD2 4.02Å; P135-W137 HydrophobicContact CB-CE3 4.48Å; P135-W137 HydrophobicContact CB-CH2 4.31Å; P135-W137 HydrophobicContact CB-CZ2 3.77Å; P135-W137 HydrophobicContact CG-CZ2 4.33Å; P135-W137 PolarHBondContact O-N 3.41Å; W137-I166 HydrophobicContact CB-CD1 3.76Å; W137-I166 HydrophobicContact CB-CG1 3.87Å; W137-I166 HydrophobicContact CG-CD1 4.15Å; W137-F169 HydrophobicContact CB-CD1 4.34Å; W137-F169 HydrophobicContact CE3-CD1 4.32Å; W137-F169 AromaticContact CE3-CE1 3.58Å; W137-F169 HydrophobicContact CE3-CE1 3.58Å; W137-F169 AromaticContact CE3-CZ 3.81Å; W137-F169 HydrophobicContact CE3-CZ 3.81Å; W137-F169 HydrophobicContact CZ3-CE1 4.13Å; W137-F169 HydrophobicContact CZ3-CZ 4.2Å; W137-L345 HydrophobicContact CD2-CD2 3.92Å; W137-L345 HydrophobicContact CD2-CG 4.14Å; W137-L345 HydrophobicContact CE3-CD2 4.33Å; W137-L345 HydrophobicContact CG-CD2 4.33Å; W137-L345 HydrophobicContact CG-CG 4.27Å; W137-L345 HydrophobicContact CH2-CD2 4.28Å; W137-L345 HydrophobicContact CZ2-CD1 3.81Å; W137-L345 HydrophobicContact CZ2-CD2 3.92Å; W137-L345 HydrophobicContact CZ2-CG 3.99Å; W137-L345 HydrophobicContact CZ3-CD2 4.5Å; W137-L345 PolarHBondContact NE1-O 3.24Å; W137-S358 PolarHBondContact NE1-OG 3.46Å
138	A	72.1	Confident	66.4	Low	4 Å²	4	67.3 Å²	67.3	3%	0.033	38%	0.376	C	S	.	.			trans	-68.8	-27.9	177.9	0	0	0	0	0	115.8	P135 C140 G349 H350	P135-A138 HydrophobicContact CG-CB 4.04Å; P135-A138 WeakPolarHBondContact O-CB 3.3Å; P135-A138 PolarHBondContact O-N 3.33Å; A138-C140 PolarHBondContact O-N 3.35Å; A138-G349 WeakPolarHBondContact CB-O 3.35Å; A138-H350 PolarHBondContact O-CE1 3.4Å; A138-H350 PolarHBondContact O-NE2 3.1Å
139	P	65.9	Low	64	Low	36 Å²	36	66.4 Å²	66.4	23%	0.234	37%	0.373	C	S	.	.	S	Bend	trans	-70.2	127.7	-175.7	-15.3	27.3	0	0	0	112.3	V144	P139-V144 HydrophobicContact CB-CG2 3.41Å; P139-V144 VanDerWaalsContact CB-CG2 3.41Å; P139-V144 HydrophobicContact CG-CG2 4.42Å
140	C	64	Low	62.2	Low	10 Å²	10	72.7 Å²	72.7	7%	0.068	41%	0.406	C	S	.	.			trans	-62.1	144.3	177	-72.3	0	0	0	0	111.4	A138 G142 K143 C326 H350	A138-C140 PolarHBondContact O-N 3.35Å; C140-G142 PolarHBondContact O-N 2.96Å; C140-K143 HydrophobicContact CB-CB 4.37Å; C140-K143 HydrophobicContact CB-CD 4.29Å; C140-K143 HydrophobicContact CB-CG 4.37Å; C140-K143 PolarHBondContact O-N 3.13Å; C140-C326 HydrophobicContact CB-CB 3.87Å; C140-C326 WeakPolarHBondContact CB-SG 3.46Å; C140-C326 WeakPolarHBondContact SG-CA 3.26Å; C140-C326 WeakPolarHBondContact SG-CB 3.44Å; C140-C326 CovalentContact SG-SG 2.06Å; C140-C326 PolarHBondContact SG-SG 2.96Å; C140-H350 PolarHBondContact SG-CE1 3.33Å; C140-H350 PolarHBondContact SG-NE2 3.47Å; C140-H350 VanDerWaalsContact SG-NE2 3.38Å
141	P	59	Low	60.3	Low	20 Å²	20	76.2 Å²	76.2	13%	0.13	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	108.8	169.6	-28.9	36.7	0	0	0	111.8	Q163 E346	P141-Q163 HydrophobicContact CB-CG 3.62Å; P141-E346 WeakPolarHBondContact CD-OE1 3.5Å
142	G	53.7	Low	58.3	Low	35 Å²	35	69.7 Å²	69.7	36%	0.361	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.5	-18.8	171.2	0	0	0	0	0	117.3	C140	C140-G142 PolarHBondContact O-N 2.96Å
143	K	49.7	Very low	56.5	Low	95 Å²	95	72.8 Å²	72.8	41%	0.413	42%	0.415	S	S	.	.	H	α-helix	trans	-73.6	-34.6	179.3	-75.6	-172.7	177.2	177.5	0	113.4	C140 A145 I146 D147 K325	C140-K143 HydrophobicContact CB-CB 4.37Å; C140-K143 HydrophobicContact CB-CD 4.29Å; C140-K143 HydrophobicContact CB-CG 4.37Å; C140-K143 PolarHBondContact O-N 3.13Å; K143-A145 PolarHBondContact O-N 2.93Å; K143-I146 PolarHBondContact O-N 3.49Å; K143-D147 PolarHBondContact O-N 3.39Å; K143-K325 PolarHBondContact NZ-O 3.11Å
144	V	50.6	Low	54.7	Low	77 Å²	77	74.7 Å²	74.7	47%	0.467	41%	0.411	S	S	.	.	H	α-helix	trans	-60.3	-35.8	177.1	-177	0	0	0	0	112	P139 I146 T148	P139-V144 HydrophobicContact CB-CG2 3.41Å; P139-V144 VanDerWaalsContact CB-CG2 3.41Å; P139-V144 HydrophobicContact CG-CG2 4.42Å; V144-I146 VanDerWaalsContact C-N 3.3Å; V144-I146 PolarHBondContact O-N 3.2Å; V144-T148 PolarHBondContact O-N 3.44Å; V144-T148 VanDerWaalsContact O-N 3.15Å; V144-T148 PolarHBondContact O-OG1 3.3Å
145	A	41.5	Very low	52.8	Low	48 Å²	48	78.4 Å²	78.4	40%	0.397	43%	0.427	S	S	.	.	H	α-helix	trans	-65.8	-34.4	176.9	0	0	0	0	0	111.4	K143 T148 L149	K143-A145 PolarHBondContact O-N 2.93Å; A145-T148 PolarHBondContact O-OG1 2.84Å; A145-L149 HydrophobicContact CB-CD1 4.48Å; A145-L149 WeakPolarHBondContact O-CB 3.34Å; A145-L149 VanDerWaalsContact O-CD1 3.25Å; A145-L149 WeakPolarHBondContact O-CD1 3.45Å; A145-L149 WeakPolarHBondContact O-CG 3.41Å; A145-L149 PolarHBondContact O-N 3.43Å
146	I	38	Very low	50.8	Low	101 Å²	101	85.5 Å²	85.5	52%	0.518	47%	0.465	S	S	.	.	H	α-helix	trans	-73.6	-43.4	-178.3	-60.6	172.8	0	0	0	110.8	K143 V144 T148 L149 L150	K143-I146 PolarHBondContact O-N 3.49Å; V144-I146 VanDerWaalsContact C-N 3.3Å; V144-I146 PolarHBondContact O-N 3.2Å; I146-T148 PolarHBondContact O-N 3Å; I146-L149 PolarHBondContact O-N 3Å; I146-L150 HydrophobicContact CG2-CD1 3.74Å; I146-L150 HydrophobicContact CG2-CG 4.26Å; I146-L150 WeakPolarHBondContact O-CB 3.45Å; I146-L150 VanDerWaalsContact O-CG 3.22Å; I146-L150 WeakPolarHBondContact O-CG 3.29Å; I146-L150 PolarHBondContact O-N 3.49Å
147	D	41.8	Very low	49.1	Very low	111 Å²	111	88.5 Å²	88.5	59%	0.594	48%	0.481	S	S	*	.	H	α-helix	trans	-66.2	-40.3	178.7	-72.9	-20	0	0	0	111.6	K143 L150 E151	K143-D147 PolarHBondContact O-N 3.39Å; D147-L150 PolarHBondContact O-N 3.49Å; D147-E151 PolarHBondContact O-N 2.97Å; D147-E151 VanDerWaalsContact O-N 3.17Å
148	T	40.3	Very low	47	Very low	77 Å²	77	94.2 Å²	94.2	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-72.1	-31.4	176.2	47.8	0	0	0	0	113.5	V144 A145 I146 A152	V144-T148 PolarHBondContact O-N 3.44Å; V144-T148 VanDerWaalsContact O-N 3.15Å; V144-T148 PolarHBondContact O-OG1 3.3Å; A145-T148 PolarHBondContact O-OG1 2.84Å; I146-T148 PolarHBondContact O-N 3Å; T148-A152 VanDerWaalsContact O-CB 3.28Å; T148-A152 WeakPolarHBondContact O-CB 3.28Å; T148-A152 PolarHBondContact O-N 2.92Å
149	L	38.7	Very low	45.2	Very low	114 Å²	114	97.1 Å²	97.1	60%	0.597	55%	0.546	S	S	*	.	H	α-helix	trans	-76.7	-24.8	174	-72.2	168.3	0	0	0	112.9	A145 I146 A152	A145-L149 HydrophobicContact CB-CD1 4.48Å; A145-L149 WeakPolarHBondContact O-CB 3.34Å; A145-L149 VanDerWaalsContact O-CD1 3.25Å; A145-L149 WeakPolarHBondContact O-CD1 3.45Å; A145-L149 WeakPolarHBondContact O-CG 3.41Å; A145-L149 PolarHBondContact O-N 3.43Å; I146-L149 PolarHBondContact O-N 3Å; L149-A152 VanDerWaalsContact O-O 3.08Å
150	L	47.2	Very low	43.7	Very low	138 Å²	138	100.9 Å²	100.9	72%	0.723	57%	0.57	S	S	*	*	H	α-helix	trans	-78	-28.5	173.7	-74.1	170	0	0	0	112.2	I146 D147	I146-L150 HydrophobicContact CG2-CD1 3.74Å; I146-L150 HydrophobicContact CG2-CG 4.26Å; I146-L150 WeakPolarHBondContact O-CB 3.45Å; I146-L150 VanDerWaalsContact O-CG 3.22Å; I146-L150 WeakPolarHBondContact O-CG 3.29Å; I146-L150 PolarHBondContact O-N 3.49Å; D147-L150 PolarHBondContact O-N 3.49Å
151	E	46.3	Very low	42.3	Very low	180 Å²	180	107.8 Å²	107.8	84%	0.841	60%	0.601	S	S	*	*	H	α-helix	trans	-82	-29.2	171.2	-80.5	-173.1	154.1	0	0	113.4	D147	D147-E151 PolarHBondContact O-N 2.97Å; D147-E151 VanDerWaalsContact O-N 3.17Å
152	A	42.7	Very low	41.2	Very low	49 Å²	49	111.6 Å²	111.6	41%	0.405	63%	0.628	S	S	.	*			trans	-99.9	96.5	178.2	0	0	0	0	0	110.7	T148 L149 Y154	T148-A152 VanDerWaalsContact O-CB 3.28Å; T148-A152 WeakPolarHBondContact O-CB 3.28Å; T148-A152 PolarHBondContact O-N 2.92Å; L149-A152 VanDerWaalsContact O-O 3.08Å; A152-Y154 PolarHBondContact O-N 3.2Å
153	D	43	Very low	40.8	Very low	156 Å²	156	113.7 Å²	113.7	83%	0.834	63%	0.629	S	S	*	*			trans	-67	34.8	176.1	-151.9	13.7	0	0	0	113.8
154	Y	40.4	Very low	40.9	Very low	194 Å²	194	111.8 Å²	111.8	76%	0.761	63%	0.625	S	S	*	*			trans	-110.9	93.8	-178.6	-81.7	-81.8	0	0	0	111	A152	A152-Y154 PolarHBondContact O-N 3.2Å
155	I	40.5	Very low	41.9	Very low	149 Å²	149	110.9 Å²	110.9	76%	0.764	62%	0.617	S	S	*	*			trans	-53.7	134.8	161.8	-62.4	168.5	0	0	0	109.2
156	N	37.6	Very low	43.8	Very low	149 Å²	149	108.6 Å²	108.6	80%	0.797	60%	0.599	S	S	*	*			trans	84.6	71	174.6	-58	-25.4	0	0	0	117.2
157	V	38.6	Very low	46	Very low	113 Å²	113	105.5 Å²	105.5	69%	0.685	58%	0.583	S	S	*	*			trans	-132.1	113.8	146.2	-170.8	0	0	0	0	107.9	A159	V157-A159 HydrophobicContact CG1-CB 3.96Å; V157-A159 PolarHBondContact O-N 2.95Å
158	S	34.8	Very low	47.8	Very low	123 Å²	123	105.2 Å²	105.2	86%	0.86	58%	0.576	S	S	*	*			trans	-65.2	70.5	155.9	49.4	0	0	0	0	107.5
159	A	34.7	Very low	50	Low	65 Å²	65	102 Å²	102	54%	0.537	56%	0.556	S	S	.	*			trans	-71.4	119.5	176.9	0	0	0	0	0	105.6	V157 E161	V157-A159 HydrophobicContact CG1-CB 3.96Å; V157-A159 PolarHBondContact O-N 2.95Å; A159-E161 PolarHBondContact O-N 3.34Å; A159-E161 VanDerWaalsContact O-N 3.08Å
160	P	35.3	Very low	52.4	Low	115 Å²	115	96.6 Å²	96.6	75%	0.747	53%	0.528	S	S	*	.			trans	-61.9	121.6	-178.7	26.1	-30.4	0	0	0	106.2	S162	P160-S162 VanDerWaalsContact C-N 3.27Å; P160-S162 PolarHBondContact O-N 3.07Å
161	E	34.9	Very low	54.3	Low	155 Å²	155	94.1 Å²	94.1	72%	0.724	51%	0.512	S	S	*	.			trans	-33.8	89.4	178.2	-72	171	143.8	0	0	111.1	A159 Q163	A159-E161 PolarHBondContact O-N 3.34Å; A159-E161 VanDerWaalsContact O-N 3.08Å; E161-Q163 HydrophobicContact CB-CB 4.36Å; E161-Q163 PolarHBondContact O-N 2.78Å
162	S	34.4	Very low	56.1	Low	100 Å²	100	89.7 Å²	89.7	70%	0.699	50%	0.498	S	S	*	.			trans	-80.9	51.5	167.5	52.9	0	0	0	0	106.7	P160 V164	P160-S162 VanDerWaalsContact C-N 3.27Å; P160-S162 PolarHBondContact O-N 3.07Å; S162-V164 PolarHBondContact O-N 3.44Å
163	Q	45.6	Very low	58.1	Low	79 Å²	79	91.8 Å²	91.8	37%	0.369	50%	0.501	S	S	.	.			trans	-63.3	101	172	-163.6	167.7	27.7	0	0	105.3	P141 E161 D165	P141-Q163 HydrophobicContact CB-CG 3.62Å; E161-Q163 HydrophobicContact CB-CB 4.36Å; E161-Q163 PolarHBondContact O-N 2.78Å; Q163-D165 PolarHBondContact O-N 2.89Å
164	V	51.8	Low	60.2	Low	55 Å²	55	84.7 Å²	84.7	33%	0.333	46%	0.463	S	S	.	.			trans	-72.9	77	175.8	-175.1	0	0	0	0	106.8	S162	S162-V164 PolarHBondContact O-N 3.44Å
165	D	71.6	Confident	62.5	Low	57 Å²	57	75.5 Å²	75.5	31%	0.305	43%	0.428	S	S	.	.			trans	-73.2	129.8	163.5	-179.6	-29.1	0	0	0	107	Q163 N167 K168 F169	Q163-D165 PolarHBondContact O-N 2.89Å; D165-N167 PolarHBondContact O-N 2.95Å; D165-N167 VanDerWaalsContact O-N 3.14Å; D165-N167 WeakPolarHBondContact OD1-CB 3.48Å; D165-N167 PolarHBondContact OD1-N 2.94Å; D165-N167 PolarHBondContact OD1-ND2 3.37Å; D165-K168 HydrophobicContact CB-CB 4.07Å; D165-K168 CarbonylContact O-C 3.56Å; D165-K168 WeakPolarHBondContact O-CA 3.34Å; D165-K168 VanDerWaalsContact O-CB 3.29Å; D165-K168 WeakPolarHBondContact O-CB 3.49Å; D165-K168 PolarHBondContact O-N 3.35Å; D165-F169 PolarHBondContact O-N 3.47Å
166	I	82	Confident	64.8	Low	1 Å²	1	72.9 Å²	72.9	1%	0.005	42%	0.415	C	S	.	.	H	α-helix	trans	-55.9	-31.6	179.6	-169.3	165.3	0	0	0	112.9	W137 K168 F169 F170 L342 L345 E346	W137-I166 HydrophobicContact CB-CD1 3.76Å; W137-I166 HydrophobicContact CB-CG1 3.87Å; W137-I166 HydrophobicContact CG-CD1 4.15Å; I166-K168 VanDerWaalsContact C-N 3.33Å; I166-F169 PolarHBondContact O-N 3.33Å; I166-F170 WeakPolarHBondContact O-CB 3.49Å; I166-F170 PolarHBondContact O-N 2.91Å; I166-L342 HydrophobicContact CD1-CB 4.04Å; I166-L342 HydrophobicContact CD1-CD2 4.47Å; I166-L342 WeakPolarHBondContact CD1-O 3.31Å; I166-L342 HydrophobicContact CG1-CB 4.1Å; I166-L342 HydrophobicContact CG1-CD2 4.4Å; I166-L342 HydrophobicContact CG2-CB 4.06Å; I166-L345 HydrophobicContact CD1-CB 4.03Å; I166-L345 HydrophobicContact CD1-CD2 4.36Å; I166-L345 HydrophobicContact CD1-CG 4.38Å; I166-E346 HydrophobicContact CB-CB 4.44Å; I166-E346 HydrophobicContact CD1-CB 3.83Å; I166-E346 HydrophobicContact CG2-CB 4.43Å; I166-E346 VanDerWaalsContact CG2-OE2 3.27Å; I166-E346 WeakPolarHBondContact CG2-OE2 3.38Å
167	N	82.9	Confident	67.1	Low	36 Å²	36	67.6 Å²	67.6	19%	0.193	39%	0.392	C	S	.	.	H	α-helix	trans	-67.5	-36.7	174.6	-64.6	-73.9	0	0	0	111.2	D165 F170 Q171 S339	D165-N167 PolarHBondContact O-N 2.95Å; D165-N167 VanDerWaalsContact O-N 3.14Å; D165-N167 WeakPolarHBondContact OD1-CB 3.48Å; D165-N167 PolarHBondContact OD1-N 2.94Å; D165-N167 PolarHBondContact OD1-ND2 3.37Å; N167-F170 PolarHBondContact O-N 2.95Å; N167-Q171 WeakPolarHBondContact O-CB 3.48Å; N167-Q171 VanDerWaalsContact O-CG 3.27Å; N167-Q171 WeakPolarHBondContact O-CG 3.35Å; N167-Q171 PolarHBondContact O-N 3.21Å; N167-S339 PolarHBondContact OD1-OG 3Å
168	K	81.4	Confident	69.4	Low	104 Å²	104	63.9 Å²	63.9	45%	0.452	37%	0.37	S	S	.	.	H	α-helix	trans	-69.7	-43.5	174.9	-168.2	-179.7	-176.9	177.5	0	110.8	D165 I166 F170 Q171 T172	D165-K168 HydrophobicContact CB-CB 4.07Å; D165-K168 CarbonylContact O-C 3.56Å; D165-K168 WeakPolarHBondContact O-CA 3.34Å; D165-K168 VanDerWaalsContact O-CB 3.29Å; D165-K168 WeakPolarHBondContact O-CB 3.49Å; D165-K168 PolarHBondContact O-N 3.35Å; I166-K168 VanDerWaalsContact C-N 3.33Å; K168-F170 VanDerWaalsContact C-N 3.31Å; K168-F170 PolarHBondContact O-N 2.87Å; K168-Q171 PolarHBondContact O-N 2.93Å; K168-T172 WeakPolarHBondContact O-CB 3.38Å; K168-T172 PolarHBondContact O-N 3.5Å; K168-T172 PolarHBondContact O-OG1 3.49Å; K168-T172 VanDerWaalsContact O-OG1 3.14Å
169	F	84.7	Confident	71.6	Confident	9 Å²	9	63.2 Å²	63.2	4%	0.039	37%	0.365	C	S	.	.	H	α-helix	trans	-53.6	-50.1	170.7	167.9	-92.8	0	0	0	110.9	L122 S136 W137 D165 I166 Q171 T172 I173 V174	L122-F169 HydrophobicContact CD2-CE1 4.08Å; S136-F169 VanDerWaalsContact CB-CE2 3.42Å; W137-F169 HydrophobicContact CB-CD1 4.34Å; W137-F169 HydrophobicContact CE3-CD1 4.32Å; W137-F169 AromaticContact CE3-CE1 3.58Å; W137-F169 HydrophobicContact CE3-CE1 3.58Å; W137-F169 AromaticContact CE3-CZ 3.81Å; W137-F169 HydrophobicContact CE3-CZ 3.81Å; W137-F169 HydrophobicContact CZ3-CE1 4.13Å; W137-F169 HydrophobicContact CZ3-CZ 4.2Å; D165-F169 PolarHBondContact O-N 3.47Å; I166-F169 PolarHBondContact O-N 3.33Å; F169-Q171 PolarHBondContact O-N 3.22Å; F169-T172 PolarHBondContact O-N 3.41Å; F169-I173 HydrophobicContact CD2-CB 4.08Å; F169-I173 HydrophobicContact CD2-CD1 3.61Å; F169-I173 HydrophobicContact CD2-CG1 4.06Å; F169-I173 HydrophobicContact CE2-CB 3.91Å; F169-I173 HydrophobicContact CE2-CD1 3.71Å; F169-I173 HydrophobicContact CE2-CG1 4.22Å; F169-I173 HydrophobicContact CE2-CG2 3.92Å; F169-I173 HydrophobicContact CZ-CB 4.4Å; F169-I173 HydrophobicContact CZ-CG2 4.28Å; F169-I173 WeakPolarHBondContact O-CA 3.29Å; F169-I173 WeakPolarHBondContact O-CB 3.42Å; F169-I173 PolarHBondContact O-N 2.81Å; F169-V174 HydrophobicContact CD1-CG2 4.27Å; F169-V174 HydrophobicContact CE1-CG2 3.6Å; F169-V174 HydrophobicContact CZ-CG2 4.06Å; F169-V174 PolarHBondContact O-N 2.86Å
170	F	89.8	Confident	73.7	Confident	1 Å²	1	61.5 Å²	61.5	0%	0.004	35%	0.354	C	S	.	.	I	π-helix	trans	-62.2	-45.9	179.9	-178.8	-112.1	0	0	0	112	Y118 L122 I166 N167 K168 V174 L175 F338 L342 F422	Y118-F170 HydrophobicContact CD1-CZ 4.4Å; Y118-F170 HydrophobicContact CD2-CZ 4.16Å; Y118-F170 HydrophobicContact CG-CE2 4.41Å; Y118-F170 AromaticContact CG-CZ 3.95Å; Y118-F170 HydrophobicContact CG-CZ 3.95Å; L122-F170 HydrophobicContact CD2-CD2 4.39Å; I166-F170 WeakPolarHBondContact O-CB 3.49Å; I166-F170 PolarHBondContact O-N 2.91Å; N167-F170 PolarHBondContact O-N 2.95Å; K168-F170 VanDerWaalsContact C-N 3.31Å; K168-F170 PolarHBondContact O-N 2.87Å; F170-V174 HydrophobicContact CD2-CB 3.75Å; F170-V174 HydrophobicContact CD2-CG1 3.87Å; F170-V174 HydrophobicContact CD2-CG2 4.06Å; F170-V174 HydrophobicContact CE2-CB 4.14Å; F170-V174 HydrophobicContact CE2-CG1 3.75Å; F170-V174 WeakPolarHBondContact O-CB 3.31Å; F170-V174 PolarHBondContact O-N 3.43Å; F170-L175 HydrophobicContact CD1-CD1 3.72Å; F170-L175 HydrophobicContact CD1-CG 4.18Å; F170-L175 HydrophobicContact CE1-CD1 3.29Å; F170-L175 HydrophobicContact CE1-CD2 4.31Å; F170-L175 HydrophobicContact CE1-CG 3.8Å; F170-L175 HydrophobicContact CE2-CD2 4.37Å; F170-L175 HydrophobicContact CE2-CG 4.2Å; F170-L175 HydrophobicContact CZ-CD1 3.77Å; F170-L175 HydrophobicContact CZ-CD2 3.9Å; F170-L175 HydrophobicContact CZ-CG 3.79Å; F170-L175 WeakPolarHBondContact O-CB 3.46Å; F170-L175 WeakPolarHBondContact O-CG 3.2Å; F170-L175 PolarHBondContact O-N 2.84Å; F170-F338 HydrophobicContact CD2-CE1 4.27Å; F170-F338 HydrophobicContact CE1-CD1 4.11Å; F170-F338 AromaticContact CE1-CE1 3.85Å; F170-F338 HydrophobicContact CE1-CE1 3.85Å; F170-F338 AromaticContact CE2-CE1 3.6Å; F170-F338 HydrophobicContact CE2-CE1 3.6Å; F170-F338 HydrophobicContact CE2-CZ 4.12Å; F170-F338 HydrophobicContact CZ-CD1 4.02Å; F170-F338 AromaticContact CZ-CE1 3.36Å; F170-F338 HydrophobicContact CZ-CE1 3.36Å; F170-F338 HydrophobicContact CZ-CZ 4.04Å; F170-L342 HydrophobicContact CB-CD1 3.74Å; F170-L342 HydrophobicContact CB-CD2 4.28Å; F170-L342 HydrophobicContact CD1-CD1 3.76Å; F170-L342 HydrophobicContact CD2-CD1 4.44Å; F170-L342 HydrophobicContact CD2-CD2 4.13Å; F170-L342 HydrophobicContact CE1-CD1 4.48Å; F170-L342 HydrophobicContact CG-CD1 3.73Å; F170-L342 HydrophobicContact CG-CD2 4.18Å; F170-F422 HydrophobicContact CD1-CE1 4.34Å; F170-F422 HydrophobicContact CD1-CZ 4.45Å; F170-F422 HydrophobicContact CE1-CD1 4.03Å; F170-F422 AromaticContact CE1-CD2 3.94Å; F170-F422 HydrophobicContact CE1-CD2 3.94Å; F170-F422 AromaticContact CE1-CE1 3.83Å; F170-F422 HydrophobicContact CE1-CE1 3.83Å; F170-F422 AromaticContact CE1-CE2 3.79Å; F170-F422 HydrophobicContact CE1-CE2 3.79Å; F170-F422 HydrophobicContact CE1-CG 4.06Å; F170-F422 AromaticContact CE1-CZ 3.72Å; F170-F422 HydrophobicContact CE1-CZ 3.72Å; F170-F422 HydrophobicContact CZ-CD2 4.33Å; F170-F422 HydrophobicContact CZ-CE2 4.29Å
171	Q	87.1	Confident	75.8	Confident	86 Å²	86	57.8 Å²	57.8	40%	0.402	33%	0.329	S	S	.	.	I	π-helix	trans	-67.4	-42.1	179.5	-73.8	177.9	22.9	0	0	113	N167 K168 F169 L175 N176 A177	N167-Q171 WeakPolarHBondContact O-CB 3.48Å; N167-Q171 VanDerWaalsContact O-CG 3.27Å; N167-Q171 WeakPolarHBondContact O-CG 3.35Å; N167-Q171 PolarHBondContact O-N 3.21Å; K168-Q171 PolarHBondContact O-N 2.93Å; F169-Q171 PolarHBondContact O-N 3.22Å; Q171-L175 CarbonylContact O-C 3.57Å; Q171-N176 WeakPolarHBondContact O-CA 3.43Å; Q171-N176 PolarHBondContact O-N 3.4Å; Q171-A177 HydrophobicContact CB-CB 4.32Å; Q171-A177 WeakPolarHBondContact O-CB 3.33Å; Q171-A177 PolarHBondContact O-N 3.42Å
172	T	85.4	Confident	77.9	Confident	87 Å²	87	54.5 Å²	54.5	53%	0.534	31%	0.314	S	S	.	.	I	π-helix	trans	-85.7	-45.6	-173.6	-55.5	0	0	0	0	112.5	K168 F169 N176	K168-T172 WeakPolarHBondContact O-CB 3.38Å; K168-T172 PolarHBondContact O-N 3.5Å; K168-T172 PolarHBondContact O-OG1 3.49Å; K168-T172 VanDerWaalsContact O-OG1 3.14Å; F169-T172 PolarHBondContact O-N 3.41Å; T172-N176 WeakPolarHBondContact O-CA 3.25Å; T172-N176 PolarHBondContact O-N 3.32Å
173	I	84.5	Confident	80.4	Confident	93 Å²	93	54.9 Å²	54.9	48%	0.477	30%	0.304	S	S	.	.	I	π-helix	trans	-91.4	-48.9	-172.3	-56.5	-165	0	0	0	111	F169	F169-I173 HydrophobicContact CD2-CB 4.08Å; F169-I173 HydrophobicContact CD2-CD1 3.61Å; F169-I173 HydrophobicContact CD2-CG1 4.06Å; F169-I173 HydrophobicContact CE2-CB 3.91Å; F169-I173 HydrophobicContact CE2-CD1 3.71Å; F169-I173 HydrophobicContact CE2-CG1 4.22Å; F169-I173 HydrophobicContact CE2-CG2 3.92Å; F169-I173 HydrophobicContact CZ-CB 4.4Å; F169-I173 HydrophobicContact CZ-CG2 4.28Å; F169-I173 WeakPolarHBondContact O-CA 3.29Å; F169-I173 WeakPolarHBondContact O-CB 3.42Å; F169-I173 PolarHBondContact O-N 2.81Å
174	V	86.8	Confident	82.3	Confident	7 Å²	7	55.4 Å²	55.4	4%	0.042	31%	0.313	C	S	.	.	I	π-helix	trans	-79.2	-47.3	-175.2	-177.7	0	0	0	0	111.5	S121 L122 F169 F170	S121-V174 WeakPolarHBondContact OG-CG1 3.38Å; L122-V174 HydrophobicContact CD2-CG2 3.86Å; F169-V174 HydrophobicContact CD1-CG2 4.27Å; F169-V174 HydrophobicContact CE1-CG2 3.6Å; F169-V174 HydrophobicContact CZ-CG2 4.06Å; F169-V174 PolarHBondContact O-N 2.86Å; F170-V174 HydrophobicContact CD2-CB 3.75Å; F170-V174 HydrophobicContact CD2-CG1 3.87Å; F170-V174 HydrophobicContact CD2-CG2 4.06Å; F170-V174 HydrophobicContact CE2-CB 4.14Å; F170-V174 HydrophobicContact CE2-CG1 3.75Å; F170-V174 WeakPolarHBondContact O-CB 3.31Å; F170-V174 PolarHBondContact O-N 3.43Å
175	L	88.7	Confident	84	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.01	32%	0.315	C	S	.	.	S	Bend	trans	-96	-15.3	-175.7	-65.1	-179.2	0	0	0	114.3	Y118 F170 Q171 A177 Q188 L191 F422	Y118-L175 HydrophobicContact CD1-CD2 3.68Å; Y118-L175 HydrophobicContact CE1-CD2 3.48Å; Y118-L175 VanDerWaalsContact CE1-CD2 3.48Å; F170-L175 HydrophobicContact CD1-CD1 3.72Å; F170-L175 HydrophobicContact CD1-CG 4.18Å; F170-L175 HydrophobicContact CE1-CD1 3.29Å; F170-L175 HydrophobicContact CE1-CD2 4.31Å; F170-L175 HydrophobicContact CE1-CG 3.8Å; F170-L175 HydrophobicContact CE2-CD2 4.37Å; F170-L175 HydrophobicContact CE2-CG 4.2Å; F170-L175 HydrophobicContact CZ-CD1 3.77Å; F170-L175 HydrophobicContact CZ-CD2 3.9Å; F170-L175 HydrophobicContact CZ-CG 3.79Å; F170-L175 WeakPolarHBondContact O-CB 3.46Å; F170-L175 WeakPolarHBondContact O-CG 3.2Å; F170-L175 PolarHBondContact O-N 2.84Å; Q171-L175 CarbonylContact O-C 3.57Å; L175-A177 HydrophobicContact CB-CB 4.37Å; L175-A177 PolarHBondContact O-N 2.88Å; L175-A177 VanDerWaalsContact O-N 3.11Å; L175-Q188 PolarHBondContact O-NE2 2.98Å; L175-Q188 PolarHBondContact O-OE1 3.3Å; L175-L191 HydrophobicContact CD2-CD1 4.34Å; L175-F422 HydrophobicContact CD1-CB 3.48Å; L175-F422 VanDerWaalsContact CD1-CB 3.48Å; L175-F422 HydrophobicContact CD1-CD1 3.89Å; L175-F422 HydrophobicContact CD1-CG 3.77Å; L175-F422 HydrophobicContact CD2-CB 4.43Å
176	N	87.6	Confident	85.1	Confident	93 Å²	93	59.7 Å²	59.7	50%	0.497	34%	0.335	S	S	.	.			trans	37.7	52.8	-170.9	-169.9	9.8	0	0	0	111.8	Q171 T172 Q419	Q171-N176 WeakPolarHBondContact O-CA 3.43Å; Q171-N176 PolarHBondContact O-N 3.4Å; T172-N176 WeakPolarHBondContact O-CA 3.25Å; T172-N176 PolarHBondContact O-N 3.32Å; N176-Q419 PolarHBondContact ND2-NE2 3.34Å; N176-Q419 WeakPolarHBondContact O-CB 3.4Å; N176-Q419 VanDerWaalsContact O-CD 3.3Å; N176-Q419 WeakPolarHBondContact O-CG 3.43Å; N176-Q419 PolarHBondContact O-NE2 2.82Å
177	A	85.9	Confident	85.6	Confident	39 Å²	39	63.7 Å²	63.7	32%	0.322	36%	0.356	S	S	.	.			trans	-64.8	145.7	-163.5	0	0	0	0	0	112.4	Q171 L175 Q419	Q171-A177 HydrophobicContact CB-CB 4.32Å; Q171-A177 WeakPolarHBondContact O-CB 3.33Å; Q171-A177 PolarHBondContact O-N 3.42Å; L175-A177 HydrophobicContact CB-CB 4.37Å; L175-A177 PolarHBondContact O-N 2.88Å; L175-A177 VanDerWaalsContact O-N 3.11Å; A177-Q419 WeakPolarHBondContact CA-O 3.22Å
178	T	87.6	Confident	86.2	Confident	34 Å²	34	63.3 Å²	63.3	21%	0.209	35%	0.353	C	S	.	.			trans	-74.8	166.7	172.7	49.8	0	0	0	0	111.7	G180 E183 Q419	T178-G180 VanDerWaalsContact C-N 3.27Å; T178-G180 PolarHBondContact O-N 2.93Å; T178-G180 PolarHBondContact OG1-O 3.18Å; T178-E183 WeakPolarHBondContact CB-O 3.49Å; T178-E183 HydrophobicContact CG2-CB 4.2Å; T178-E183 WeakPolarHBondContact CG2-O 3.39Å; T178-E183 PolarHBondContact OG1-O 3.49Å; T178-Q419 HydrophobicContact CG2-CB 3.82Å
179	S	82	Confident	86.8	Confident	109 Å²	109	68.3 Å²	68.3	76%	0.762	37%	0.369	S	S	*	.	S	Bend	trans	-67.6	-28.2	-176.9	72.9	0	0	0	0	113.1	E183	S179-E183 VanDerWaalsContact OG-CD 3.28Å; S179-E183 PolarHBondContact OG-OE2 3.48Å
180	G	77.3	Confident	87.3	Confident	30 Å²	30	70.8 Å²	70.8	31%	0.309	38%	0.382	S	S	.	.	S	Bend	trans	-154.1	165.7	-179.7	0	0	0	0	0	112.7	T178 E182 E183	T178-G180 VanDerWaalsContact C-N 3.27Å; T178-G180 PolarHBondContact O-N 2.93Å; T178-G180 PolarHBondContact OG1-O 3.18Å; G180-E182 PolarHBondContact O-N 3.47Å; G180-E183 PolarHBondContact O-N 3.22Å
181	V	79.1	Confident	87.7	Confident	37 Å²	37	70.7 Å²	70.7	22%	0.224	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-28.3	-175.7	-172.1	0	0	0	0	112.5	E183 P423 V424 I427	V181-E183 VanDerWaalsContact C-N 3.27Å; V181-E183 PolarHBondContact O-N 2.95Å; V181-P423 HydrophobicContact CG2-CB 3.96Å; V181-P423 HydrophobicContact CG2-CG 4.36Å; V181-V424 HydrophobicContact CG1-CG2 3.54Å; V181-I427 HydrophobicContact CB-CD1 4.45Å; V181-I427 HydrophobicContact CG1-CD1 3.88Å; V181-I427 HydrophobicContact CG2-CD1 3.96Å
182	E	80.4	Confident	88.2	Confident	85 Å²	85	67.7 Å²	67.7	40%	0.397	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-32.2	178.3	-36.6	-62.3	-172.6	0	0	112.2	G180 T184 N508 W510	G180-E182 PolarHBondContact O-N 3.47Å; E182-T184 PolarHBondContact O-N 2.86Å; E182-T184 VanDerWaalsContact O-N 3.16Å; E182-N508 VanDerWaalsContact OE1-CG 3.29Å; E182-N508 PolarHBondContact OE1-ND2 3.16Å; E182-N508 PolarHBondContact OE1-OD1 3.03Å; E182-N508 VanDerWaalsContact OE1-OD1 3.11Å; E182-W510 VanDerWaalsContact CD-CD1 3.42Å; E182-W510 WeakPolarHBondContact OE2-CB 3.5Å
183	E	85.7	Confident	88.8	Confident	108 Å²	108	66.6 Å²	66.6	51%	0.505	36%	0.364	S	S	.	.			trans	-86.1	88.1	179.4	-66.1	-178.7	170.4	0	0	107.9	T178 S179 G180 V181 G185	T178-E183 WeakPolarHBondContact CB-O 3.49Å; T178-E183 HydrophobicContact CG2-CB 4.2Å; T178-E183 WeakPolarHBondContact CG2-O 3.39Å; T178-E183 PolarHBondContact OG1-O 3.49Å; S179-E183 VanDerWaalsContact OG-CD 3.28Å; S179-E183 PolarHBondContact OG-OE2 3.48Å; G180-E183 PolarHBondContact O-N 3.22Å; V181-E183 VanDerWaalsContact C-N 3.27Å; V181-E183 PolarHBondContact O-N 2.95Å; E183-G185 PolarHBondContact O-N 3.19Å; E183-G185 VanDerWaalsContact O-N 3.08Å
184	T	85.3	Confident	89.4	Confident	91 Å²	91	62.2 Å²	62.2	56%	0.558	34%	0.342	S	S	*	.			trans	-57	-33	-174.3	50.3	0	0	0	0	112.9	E182 T418 S420	E182-T184 PolarHBondContact O-N 2.86Å; E182-T184 VanDerWaalsContact O-N 3.16Å; T184-T418 VanDerWaalsContact O-CB 3.32Å; T184-T418 WeakPolarHBondContact O-CB 3.31Å; T184-S420 WeakPolarHBondContact CA-OG 3.13Å; T184-S420 PolarHBondContact O-N 3.35Å; T184-S420 PolarHBondContact O-OG 3.48Å
185	G	89.1	Confident	90	Very high	36 Å²	36	61.9 Å²	61.9	37%	0.371	34%	0.34	S	S	.	.			trans	74.3	-163.1	-178.2	0	0	0	0	0	112.3	E183	E183-G185 PolarHBondContact O-N 3.19Å; E183-G185 VanDerWaalsContact O-N 3.08Å
186	K	93.1	Very high	90.4	Very high	165 Å²	165	63.7 Å²	63.7	72%	0.717	36%	0.356	S	S	*	.			trans	-91.6	153.7	178.2	-64.3	-179.2	-177.3	176.6	0	111.2	T418 Q419	K186-T418 WeakPolarHBondContact O-CA 3.01Å; K186-Q419 PolarHBondContact O-N 2.91Å
187	L	93.7	Very high	90.9	Very high	85 Å²	85	64.2 Å²	64.2	45%	0.445	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-65.6	138.5	166.3	-77.8	172.5	0	0	0	110.6	I192 L414 N417 T418	L187-I192 HydrophobicContact CB-CD1 3.79Å; L187-I192 HydrophobicContact CD1-CD1 4.22Å; L187-I192 HydrophobicContact CD2-CD1 4.23Å; L187-I192 HydrophobicContact CG-CD1 4.3Å; L187-L414 VanDerWaalsContact CD2-O 3.27Å; L187-L414 WeakPolarHBondContact CD2-O 3.4Å; L187-N417 HydrophobicContact CD2-CB 4.43Å; L187-T418 HydrophobicContact CD2-CG2 3.71Å; L187-T418 HydrophobicContact CG-CG2 4.37Å
188	Q	94.3	Very high	91.6	Very high	28 Å²	28	62.4 Å²	62.4	13%	0.131	34%	0.338	C	S	.	.			trans	-101.8	114.5	-178	-56.7	-159.6	-40.9	0	0	111	L175 L190 L191 I192 N417 Q419	L175-Q188 PolarHBondContact O-NE2 2.98Å; L175-Q188 PolarHBondContact O-OE1 3.3Å; Q188-L190 VanDerWaalsContact C-N 3.3Å; Q188-L190 PolarHBondContact O-N 2.63Å; Q188-L191 HydrophobicContact CB-CB 4.11Å; Q188-L191 HydrophobicContact CB-CD1 3.94Å; Q188-L191 HydrophobicContact CB-CG 3.86Å; Q188-L191 HydrophobicContact CG-CD1 4.28Å; Q188-L191 PolarHBondContact O-N 3.2Å; Q188-L191 VanDerWaalsContact O-N 3.08Å; Q188-I192 WeakPolarHBondContact O-CG1 3.44Å; Q188-I192 PolarHBondContact O-N 2.95Å; Q188-N417 PolarHBondContact N-O 3.49Å; Q188-Q419 HydrophobicContact CG-CG 4.24Å
189	W	95.1	Very high	92.1	Very high	210 Å²	210	61.2 Å²	61.2	80%	0.795	33%	0.33	S	S	*	.	H	α-helix	trans	-60.3	-36.4	-174.8	-66.3	110.6	0	0	0	113.8	L191 I192 S193	W189-L191 VanDerWaalsContact C-N 3.35Å; W189-I192 HydrophobicContact CE3-CD1 4.26Å; W189-I192 HydrophobicContact CZ3-CD1 4.49Å; W189-I192 PolarHBondContact O-N 3.37Å; W189-S193 WeakPolarHBondContact O-CB 3.47Å; W189-S193 PolarHBondContact O-N 3.15Å; W189-S193 PolarHBondContact O-OG 2.9Å
190	L	95.3	Very high	92.9	Very high	60 Å²	60	60.5 Å²	60.5	31%	0.314	32%	0.317	S	S	.	.	H	α-helix	trans	-67.2	-35.5	176.8	-177	58.3	0	0	0	112.4	S121 V124 Q188 S193 G194	S121-L190 VanDerWaalsContact OG-CD2 3.24Å; S121-L190 WeakPolarHBondContact OG-CD2 3.39Å; V124-L190 HydrophobicContact CB-CD1 4.34Å; V124-L190 HydrophobicContact CG1-CD1 4.01Å; V124-L190 HydrophobicContact CG1-CD2 4.11Å; V124-L190 HydrophobicContact CG2-CD1 4.23Å; Q188-L190 VanDerWaalsContact C-N 3.3Å; Q188-L190 PolarHBondContact O-N 2.63Å; L190-S193 PolarHBondContact O-OG 3.42Å; L190-G194 PolarHBondContact O-N 3.28Å; L190-G194 VanDerWaalsContact O-N 3.07Å
191	L	96.7	Very high	93.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-73.7	-40.1	175.1	-60.5	-173.4	0	0	0	111.5	S117 Y118 L175 Q188 W189 S193 G194 S195 N417	S117-L191 WeakPolarHBondContact CB-O 3.45Å; Y118-L191 HydrophobicContact CD1-CD1 4.03Å; Y118-L191 HydrophobicContact CD1-CD2 3.66Å; Y118-L191 HydrophobicContact CD1-CG 4.49Å; Y118-L191 HydrophobicContact CE1-CD1 3.61Å; Y118-L191 HydrophobicContact CE1-CD2 4.13Å; Y118-L191 HydrophobicContact CE1-CG 4.49Å; L175-L191 HydrophobicContact CD2-CD1 4.34Å; Q188-L191 HydrophobicContact CB-CB 4.11Å; Q188-L191 HydrophobicContact CB-CD1 3.94Å; Q188-L191 HydrophobicContact CB-CG 3.86Å; Q188-L191 HydrophobicContact CG-CD1 4.28Å; Q188-L191 PolarHBondContact O-N 3.2Å; Q188-L191 VanDerWaalsContact O-N 3.08Å; W189-L191 VanDerWaalsContact C-N 3.35Å; L191-S193 VanDerWaalsContact C-N 3.34Å; L191-G194 PolarHBondContact O-N 3.38Å; L191-S195 WeakPolarHBondContact O-CB 3.36Å; L191-S195 PolarHBondContact O-N 3.37Å; L191-S195 PolarHBondContact O-OG 3.12Å; L191-N417 HydrophobicContact CB-CB 3.99Å
192	I	98.1	Very high	94.8	Very high	23 Å²	23	59 Å²	59	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-45.3	175.6	-68.9	171.2	0	0	0	110.4	L187 Q188 W189 S195 A196 F410 L414 N417	L187-I192 HydrophobicContact CB-CD1 3.79Å; L187-I192 HydrophobicContact CD1-CD1 4.22Å; L187-I192 HydrophobicContact CD2-CD1 4.23Å; L187-I192 HydrophobicContact CG-CD1 4.3Å; Q188-I192 WeakPolarHBondContact O-CG1 3.44Å; Q188-I192 PolarHBondContact O-N 2.95Å; W189-I192 HydrophobicContact CE3-CD1 4.26Å; W189-I192 HydrophobicContact CZ3-CD1 4.49Å; W189-I192 PolarHBondContact O-N 3.37Å; I192-S195 PolarHBondContact O-N 2.67Å; I192-A196 WeakPolarHBondContact O-CB 3.45Å; I192-A196 PolarHBondContact O-N 3.07Å; I192-F410 HydrophobicContact CG2-CE2 4.43Å; I192-F410 HydrophobicContact CG2-CZ 4.08Å; I192-L414 HydrophobicContact CD1-CD2 4.26Å; I192-L414 HydrophobicContact CG1-CD2 3.89Å; I192-L414 HydrophobicContact CG2-CD2 4.03Å; I192-N417 HydrophobicContact CG1-CB 3.89Å
193	S	97.6	Very high	95.6	Very high	63 Å²	63	57.2 Å²	57.2	44%	0.441	29%	0.293	S	S	.	.	H	α-helix	trans	-65.7	-39.9	178.6	64.2	0	0	0	0	111.7	W189 L190 L191 A196 F197	W189-S193 WeakPolarHBondContact O-CB 3.47Å; W189-S193 PolarHBondContact O-N 3.15Å; W189-S193 PolarHBondContact O-OG 2.9Å; L190-S193 PolarHBondContact O-OG 3.42Å; L191-S193 VanDerWaalsContact C-N 3.34Å; S193-A196 PolarHBondContact O-N 3.15Å; S193-F197 WeakPolarHBondContact O-CB 3.19Å; S193-F197 PolarHBondContact O-N 2.69Å
194	G	98.1	Very high	96.2	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-59.3	-47.9	171.3	0	0	0	0	0	112.6	L190 L191 A196 F197 V198	L190-G194 PolarHBondContact O-N 3.28Å; L190-G194 VanDerWaalsContact O-N 3.07Å; L191-G194 PolarHBondContact O-N 3.38Å; G194-A196 PolarHBondContact O-N 3.29Å; G194-F197 WeakPolarHBondContact O-CB 3.47Å; G194-F197 PolarHBondContact O-N 3.13Å; G194-V198 VanDerWaalsContact O-CG2 3.29Å; G194-V198 WeakPolarHBondContact O-CG2 3.34Å; G194-V198 PolarHBondContact O-N 3.25Å
195	S	98.4	Very high	96.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-43.7	176.2	-60.6	0	0	0	0	111.9	S117 L191 I192 F197 V198 W199 T413 N417	S117-S195 WeakPolarHBondContact CB-OG 3.46Å; L191-S195 WeakPolarHBondContact O-CB 3.36Å; L191-S195 PolarHBondContact O-N 3.37Å; L191-S195 PolarHBondContact O-OG 3.12Å; I192-S195 PolarHBondContact O-N 2.67Å; S195-F197 VanDerWaalsContact C-N 3.34Å; S195-F197 PolarHBondContact O-N 3.08Å; S195-V198 PolarHBondContact O-N 3.39Å; S195-W199 VanDerWaalsContact O-CD1 3.26Å; S195-W199 PolarHBondContact O-N 2.71Å; S195-T413 WeakPolarHBondContact OG-CG2 3.44Å; S195-N417 WeakPolarHBondContact CB-OD1 3.28Å; S195-N417 PolarHBondContact OG-ND2 2.95Å; S195-N417 VanDerWaalsContact OG-ND2 3.13Å; S195-N417 PolarHBondContact OG-OD1 3.17Å
196	A	98.4	Very high	97	Very high	41 Å²	41	50.1 Å²	50.1	34%	0.339	25%	0.246	S	C	.	.	H	α-helix	trans	-62.7	-41.5	178	0	0	0	0	0	111.6	I192 S193 G194 W199 L200 F410	I192-A196 WeakPolarHBondContact O-CB 3.45Å; I192-A196 PolarHBondContact O-N 3.07Å; S193-A196 PolarHBondContact O-N 3.15Å; G194-A196 PolarHBondContact O-N 3.29Å; A196-W199 PolarHBondContact O-N 3.14Å; A196-L200 WeakPolarHBondContact O-CB 3.35Å; A196-L200 PolarHBondContact O-N 3.22Å; A196-F410 HydrophobicContact CB-CD2 4.44Å; A196-F410 HydrophobicContact CB-CE2 3.71Å; A196-F410 HydrophobicContact CB-CZ 4.15Å
197	F	98.6	Very high	97	Very high	104 Å²	104	45.1 Å²	45.1	46%	0.456	23%	0.225	S	C	.	.	H	α-helix	trans	-60.7	-46	174.3	173.4	-99.6	0	0	0	111.8	I120 S193 G194 S195 L200 V201 F370	I120-F197 HydrophobicContact CD1-CD1 3.75Å; I120-F197 HydrophobicContact CD1-CE1 4.39Å; S193-F197 WeakPolarHBondContact O-CB 3.19Å; S193-F197 PolarHBondContact O-N 2.69Å; G194-F197 WeakPolarHBondContact O-CB 3.47Å; G194-F197 PolarHBondContact O-N 3.13Å; S195-F197 VanDerWaalsContact C-N 3.34Å; S195-F197 PolarHBondContact O-N 3.08Å; F197-L200 WeakPolarHBondContact O-CB 3.25Å; F197-L200 PolarHBondContact O-N 3.05Å; F197-V201 HydrophobicContact CD1-CG2 4.46Å; F197-V201 HydrophobicContact CD2-CG2 4.49Å; F197-V201 HydrophobicContact CE1-CG2 4.03Å; F197-V201 HydrophobicContact CE2-CG2 4.05Å; F197-V201 HydrophobicContact CZ-CG2 3.81Å; F197-V201 WeakPolarHBondContact O-CG2 3.17Å; F197-V201 PolarHBondContact O-N 2.96Å; F197-F370 HydrophobicContact CE1-CZ 4.21Å
198	V	98.7	Very high	96.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-47	179.5	173.7	0	0	0	0	111.1	V113 A116 I120 G194 S195 L200 V201 I202 F370 L373	V113-V198 HydrophobicContact CB-CG1 4.26Å; V113-V198 HydrophobicContact CG1-CB 3.93Å; V113-V198 HydrophobicContact CG1-CG1 3.85Å; V113-V198 HydrophobicContact CG2-CG1 3.79Å; A116-V198 HydrophobicContact CB-CG1 4.27Å; A116-V198 HydrophobicContact CB-CG2 3.66Å; I120-V198 HydrophobicContact CD1-CG2 3.53Å; G194-V198 VanDerWaalsContact O-CG2 3.29Å; G194-V198 WeakPolarHBondContact O-CG2 3.34Å; G194-V198 PolarHBondContact O-N 3.25Å; S195-V198 PolarHBondContact O-N 3.39Å; V198-L200 VanDerWaalsContact C-N 3.31Å; V198-L200 PolarHBondContact O-N 3.06Å; V198-V201 PolarHBondContact O-N 2.88Å; V198-I202 HydrophobicContact CG1-CD1 3.95Å; V198-I202 WeakPolarHBondContact O-CG1 3.47Å; V198-I202 PolarHBondContact O-N 3.4Å; V198-F370 HydrophobicContact CB-CE1 4.08Å; V198-F370 HydrophobicContact CB-CZ 4.34Å; V198-F370 HydrophobicContact CG1-CD1 4.32Å; V198-F370 HydrophobicContact CG1-CE1 3.66Å; V198-F370 HydrophobicContact CG1-CZ 4.29Å; V198-F370 HydrophobicContact CG2-CE1 4.16Å; V198-F370 HydrophobicContact CG2-CZ 3.95Å; V198-L373 HydrophobicContact CG1-CD1 3.89Å
199	W	98.5	Very high	96.6	Very high	9 Å²	9	44.6 Å²	44.6	3%	0.034	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-36.1	176.4	-80.7	111.8	0	0	0	112.9	V113 S195 A196 I202 F203 V377 C406 F410 T413	V113-W199 HydrophobicContact CG2-CD2 4.34Å; V113-W199 HydrophobicContact CG2-CH2 4.48Å; V113-W199 HydrophobicContact CG2-CZ2 3.79Å; S195-W199 VanDerWaalsContact O-CD1 3.26Å; S195-W199 PolarHBondContact O-N 2.71Å; A196-W199 PolarHBondContact O-N 3.14Å; W199-I202 HydrophobicContact CD2-CD1 4.49Å; W199-I202 HydrophobicContact CE3-CB 4.48Å; W199-I202 HydrophobicContact CE3-CD1 3.99Å; W199-I202 HydrophobicContact CE3-CG2 4.4Å; W199-I202 HydrophobicContact CZ3-CD1 4.19Å; W199-I202 HydrophobicContact CZ3-CG2 4.42Å; W199-I202 PolarHBondContact O-N 2.94Å; W199-F203 WeakPolarHBondContact O-CB 3.46Å; W199-F203 PolarHBondContact O-N 3.47Å; W199-V377 HydrophobicContact CH2-CG2 4.1Å; W199-V377 HydrophobicContact CZ3-CG1 4.48Å; W199-V377 HydrophobicContact CZ3-CG2 3.8Å; W199-C406 HydrophobicContact CE3-CB 3.83Å; W199-C406 HydrophobicContact CZ3-CB 4.4Å; W199-F410 AromaticContact CD1-CD2 3.78Å; W199-F410 HydrophobicContact CG-CB 4.02Å; W199-T413 PolarHBondContact NE1-OG1 3.08Å; W199-T413 VanDerWaalsContact NE1-OG1 3.09Å
200	L	98.4	Very high	96.4	Very high	95 Å²	95	34.6 Å²	34.6	50%	0.497	19%	0.185	S	C	.	.	H	α-helix	trans	-63.1	-44.6	173.8	179.9	64.2	0	0	0	111.6	A196 F197 V198 F203 I204	A196-L200 WeakPolarHBondContact O-CB 3.35Å; A196-L200 PolarHBondContact O-N 3.22Å; F197-L200 WeakPolarHBondContact O-CB 3.25Å; F197-L200 PolarHBondContact O-N 3.05Å; V198-L200 VanDerWaalsContact C-N 3.31Å; V198-L200 PolarHBondContact O-N 3.06Å; L200-F203 PolarHBondContact O-N 3.17Å; L200-I204 HydrophobicContact CD1-CD1 4.15Å; L200-I204 HydrophobicContact CD1-CG1 4.48Å; L200-I204 HydrophobicContact CG-CD1 3.99Å; L200-I204 VanDerWaalsContact O-CG1 3.29Å; L200-I204 WeakPolarHBondContact O-CG1 3.36Å; L200-I204 PolarHBondContact O-N 2.9Å
201	V	98.4	Very high	96.2	Very high	34 Å²	34	34 Å²	34	21%	0.206	18%	0.179	C	C	.	.	H	α-helix	trans	-63.7	-41.4	176.9	171.5	0	0	0	0	111.2	F197 V198 I204 S205 F370	F197-V201 HydrophobicContact CD1-CG2 4.46Å; F197-V201 HydrophobicContact CD2-CG2 4.49Å; F197-V201 HydrophobicContact CE1-CG2 4.03Å; F197-V201 HydrophobicContact CE2-CG2 4.05Å; F197-V201 HydrophobicContact CZ-CG2 3.81Å; F197-V201 WeakPolarHBondContact O-CG2 3.17Å; F197-V201 PolarHBondContact O-N 2.96Å; V198-V201 PolarHBondContact O-N 2.88Å; V201-I204 PolarHBondContact O-N 3.45Å; V201-S205 WeakPolarHBondContact O-CB 3.21Å; V201-S205 PolarHBondContact O-N 3.15Å; V201-S205 PolarHBondContact O-OG 2.92Å; V201-F370 HydrophobicContact CB-CE1 3.74Å; V201-F370 HydrophobicContact CB-CZ 4.15Å; V201-F370 HydrophobicContact CG1-CD1 3.99Å; V201-F370 HydrophobicContact CG1-CE1 3.63Å; V201-F370 HydrophobicContact CG1-CZ 4.08Å; V201-F370 HydrophobicContact CG2-CE1 4.41Å; V201-F370 HydrophobicContact CG2-CZ 4.33Å
202	I	98.4	Very high	96.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-47.9	175.3	-68.7	166.3	0	0	0	110.6	V113 V198 W199 I204 S205 L206 L373 Y374 V377	V113-I202 HydrophobicContact CG2-CD1 4.23Å; V198-I202 HydrophobicContact CG1-CD1 3.95Å; V198-I202 WeakPolarHBondContact O-CG1 3.47Å; V198-I202 PolarHBondContact O-N 3.4Å; W199-I202 HydrophobicContact CD2-CD1 4.49Å; W199-I202 HydrophobicContact CE3-CB 4.48Å; W199-I202 HydrophobicContact CE3-CD1 3.99Å; W199-I202 HydrophobicContact CE3-CG2 4.4Å; W199-I202 HydrophobicContact CZ3-CD1 4.19Å; W199-I202 HydrophobicContact CZ3-CG2 4.42Å; W199-I202 PolarHBondContact O-N 2.94Å; I202-I204 PolarHBondContact O-N 3.43Å; I202-S205 WeakPolarHBondContact O-CB 3.45Å; I202-S205 PolarHBondContact O-N 3.41Å; I202-L206 HydrophobicContact CG2-CD1 3.88Å; I202-L206 PolarHBondContact O-N 3.39Å; I202-L206 VanDerWaalsContact O-N 3.08Å; I202-L373 HydrophobicContact CD1-CB 3.85Å; I202-L373 HydrophobicContact CD1-CD1 3.97Å; I202-L373 HydrophobicContact CD1-CG 4.34Å; I202-L373 HydrophobicContact CG1-CB 4.33Å; I202-Y374 HydrophobicContact CG1-CD1 4.5Å; I202-Y374 HydrophobicContact CG1-CE1 4.5Å; I202-V377 HydrophobicContact CG2-CB 3.95Å; I202-V377 HydrophobicContact CG2-CG1 3.82Å; I202-V377 HydrophobicContact CG2-CG2 3.94Å
203	F	98.3	Very high	96	Very high	48 Å²	48	37.3 Å²	37.3	21%	0.211	19%	0.19	C	C	.	.	H	α-helix	trans	-56.5	-49.9	176.7	172.1	-103.1	0	0	0	111.2	W199 L200 S205 L206 F207 C402 L403 C406	W199-F203 WeakPolarHBondContact O-CB 3.46Å; W199-F203 PolarHBondContact O-N 3.47Å; L200-F203 PolarHBondContact O-N 3.17Å; F203-S205 PolarHBondContact O-N 2.95Å; F203-L206 PolarHBondContact O-N 2.97Å; F203-L206 VanDerWaalsContact O-N 3.14Å; F203-F207 HydrophobicContact CD2-CB 4.34Å; F203-F207 HydrophobicContact CE1-CB 4.44Å; F203-F207 HydrophobicContact CE2-CB 3.93Å; F203-F207 HydrophobicContact CZ-CB 3.99Å; F203-F207 WeakPolarHBondContact O-CB 3.45Å; F203-F207 WeakPolarHBondContact O-CD1 3.37Å; F203-F207 PolarHBondContact O-N 3.18Å; F203-C402 HydrophobicContact CD2-CB 4.28Å; F203-C402 HydrophobicContact CE2-CB 4.33Å; F203-L403 HydrophobicContact CD2-CB 4.32Å; F203-L403 HydrophobicContact CD2-CD1 4.38Å; F203-L403 HydrophobicContact CE2-CB 3.79Å; F203-L403 HydrophobicContact CE2-CD1 4.17Å; F203-L403 HydrophobicContact CZ-CD1 4.49Å; F203-C406 HydrophobicContact CB-CB 4.47Å
204	I	97.6	Very high	95.8	Very high	80 Å²	80	34.3 Å²	34.3	41%	0.41	17%	0.169	S	C	.	.	H	α-helix	trans	-60.7	-29.8	177.3	-68	167.5	0	0	0	111.6	L200 V201 I202 F207 W212	L200-I204 HydrophobicContact CD1-CD1 4.15Å; L200-I204 HydrophobicContact CD1-CG1 4.48Å; L200-I204 HydrophobicContact CG-CD1 3.99Å; L200-I204 VanDerWaalsContact O-CG1 3.29Å; L200-I204 WeakPolarHBondContact O-CG1 3.36Å; L200-I204 PolarHBondContact O-N 2.9Å; V201-I204 PolarHBondContact O-N 3.45Å; I202-I204 PolarHBondContact O-N 3.43Å; I204-F207 WeakPolarHBondContact O-CD1 3.33Å; I204-F207 VanDerWaalsContact O-CE1 3.23Å; I204-F207 WeakPolarHBondContact O-CE1 3.12Å; I204-W212 PolarHBondContact O-NE1 2.94Å
205	S	96.9	Very high	95.7	Very high	7 Å²	7	39.5 Å²	39.5	5%	0.049	19%	0.191	C	C	.	.	H	α-helix	trans	-80	-22.1	-179.8	-55.7	0	0	0	0	113.3	V201 I202 F203 Y374	V201-S205 WeakPolarHBondContact O-CB 3.21Å; V201-S205 PolarHBondContact O-N 3.15Å; V201-S205 PolarHBondContact O-OG 2.92Å; I202-S205 WeakPolarHBondContact O-CB 3.45Å; I202-S205 PolarHBondContact O-N 3.41Å; F203-S205 PolarHBondContact O-N 2.95Å; S205-Y374 VanDerWaalsContact CB-CE1 3.49Å; S205-Y374 VanDerWaalsContact OG-CE1 3.23Å; S205-Y374 WeakPolarHBondContact OG-CE1 3.34Å
206	L	95.5	Very high	95.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-116.5	-19.7	-172	-70	174.5	0	0	0	115	I202 F203 L208 G209 L213 V377 L378	I202-L206 HydrophobicContact CG2-CD1 3.88Å; I202-L206 PolarHBondContact O-N 3.39Å; I202-L206 VanDerWaalsContact O-N 3.08Å; F203-L206 PolarHBondContact O-N 2.97Å; F203-L206 VanDerWaalsContact O-N 3.14Å; L206-L208 PolarHBondContact O-N 3.49Å; L206-L208 VanDerWaalsContact O-N 3.1Å; L206-G209 PolarHBondContact O-N 2.99Å; L206-L213 HydrophobicContact CD2-CB 4.35Å; L206-L213 HydrophobicContact CD2-CD1 3.93Å; L206-L213 HydrophobicContact CD2-CD2 3.69Å; L206-L213 HydrophobicContact CD2-CG 4.19Å; L206-V377 HydrophobicContact CD1-CB 3.71Å; L206-V377 HydrophobicContact CD1-CG1 3.52Å; L206-L378 HydrophobicContact CD2-CB 4.24Å; L206-L378 HydrophobicContact CD2-CD1 4.44Å
207	F	92.6	Very high	95.6	Very high	60 Å²	60	38.5 Å²	38.5	26%	0.263	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.9	-171.3	80.4	-72.6	0	0	0	114.1	F203 I204 T399	F203-F207 HydrophobicContact CD2-CB 4.34Å; F203-F207 HydrophobicContact CE1-CB 4.44Å; F203-F207 HydrophobicContact CE2-CB 3.93Å; F203-F207 HydrophobicContact CZ-CB 3.99Å; F203-F207 WeakPolarHBondContact O-CB 3.45Å; F203-F207 WeakPolarHBondContact O-CD1 3.37Å; F203-F207 PolarHBondContact O-N 3.18Å; I204-F207 WeakPolarHBondContact O-CD1 3.33Å; I204-F207 VanDerWaalsContact O-CE1 3.23Å; I204-F207 WeakPolarHBondContact O-CE1 3.12Å; F207-T399 HydrophobicContact CB-CG2 4.28Å; F207-T399 HydrophobicContact CD2-CG2 4Å; F207-T399 WeakPolarHBondContact O-CG2 3.5Å
208	L	89.3	Confident	95.5	Very high	99 Å²	99	37.4 Å²	37.4	52%	0.518	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	2.3	176.3	-64.7	176	0	0	0	114	L206 W212	L206-L208 PolarHBondContact O-N 3.49Å; L206-L208 VanDerWaalsContact O-N 3.1Å; L208-W212 HydrophobicContact CB-CB 3.54Å; L208-W212 HydrophobicContact CB-CG 3.85Å; L208-W212 HydrophobicContact CD1-CB 4.37Å; L208-W212 HydrophobicContact CD1-CD2 4.19Å; L208-W212 HydrophobicContact CD1-CG 4.06Å; L208-W212 HydrophobicContact CG-CG 4.47Å
209	G	90	Very high	95.4	Very high	2 Å²	2	44.4 Å²	44.4	2%	0.021	21%	0.205	C	C	.	.			trans	84.4	-171.3	176.8	0	0	0	0	0	116.1	L206 R211 W212 L213	L206-G209 PolarHBondContact O-N 2.99Å; G209-R211 VanDerWaalsContact C-N 3.29Å; G209-R211 PolarHBondContact O-N 3.1Å; G209-W212 PolarHBondContact O-N 3.31Å; G209-W212 VanDerWaalsContact O-N 3.1Å; G209-L213 PolarHBondContact O-N 3.32Å
210	V	91.4	Very high	95.3	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-29.4	-167	-64.5	0	0	0	0	114	D16 W18 W212 L213 G214 F286 L378	D16-V210 HydrophobicContact CB-CG2 3.98Å; W18-V210 HydrophobicContact CD2-CB 4.48Å; W18-V210 HydrophobicContact CE3-CB 3.9Å; W18-V210 HydrophobicContact CE3-CG2 4.43Å; W18-V210 HydrophobicContact CH2-CB 3.99Å; W18-V210 HydrophobicContact CH2-CG1 4.18Å; W18-V210 HydrophobicContact CZ3-CB 3.63Å; W18-V210 HydrophobicContact CZ3-CG1 4.33Å; W18-V210 VanDerWaalsContact CZ3-O 3.28Å; W18-V210 WeakPolarHBondContact CZ3-O 2.73Å; V210-W212 VanDerWaalsContact C-N 3.34Å; V210-W212 PolarHBondContact O-N 3.33Å; V210-L213 PolarHBondContact O-N 3.22Å; V210-G214 PolarHBondContact O-N 3.02Å; V210-F286 HydrophobicContact CG1-CD1 4.1Å; V210-F286 HydrophobicContact CG1-CD2 3.74Å; V210-F286 HydrophobicContact CG1-CE1 3.98Å; V210-F286 HydrophobicContact CG1-CE2 3.64Å; V210-F286 HydrophobicContact CG1-CG 3.96Å; V210-F286 HydrophobicContact CG1-CZ 3.74Å; V210-F286 HydrophobicContact CG2-CD1 4.27Å; V210-F286 HydrophobicContact CG2-CG 4.37Å; V210-L378 HydrophobicContact CG1-CD1 3.94Å; V210-L378 HydrophobicContact CG1-CD2 4.11Å
211	R	90.7	Very high	95.2	Very high	46 Å²	46	41.1 Å²	41.1	17%	0.174	19%	0.188	C	C	.	.	H	α-helix	trans	-68.6	-33.4	176.8	-63.2	-176.3	175.1	-173.8	-7.4	112.8	L17 S19 G209 P584 L585	L17-R211 WeakPolarHBondContact O-CG 3.04Å; L17-R211 PolarHBondContact O-NE 3.35Å; L17-R211 VanDerWaalsContact O-NE 3.14Å; S19-R211 WeakPolarHBondContact OG-CB 2.84Å; S19-R211 WeakPolarHBondContact OG-CG 3.29Å; G209-R211 VanDerWaalsContact C-N 3.29Å; G209-R211 PolarHBondContact O-N 3.1Å; R211-P584 VanDerWaalsContact NH1-C 3.31Å; R211-P584 PolarHBondContact NH1-O 2.82Å; R211-L585 VanDerWaalsContact CZ-O 3.29Å; R211-L585 PolarHBondContact NH1-O 3.31Å; R211-L585 PolarHBondContact NH2-O 3.12Å
212	W	93.9	Very high	95.2	Very high	93 Å²	93	42.8 Å²	42.8	35%	0.352	20%	0.198	S	C	.	.	H	α-helix	trans	-77.3	-44.8	172.4	171	-114.4	0	0	0	110.6	I204 L208 G209 V210 G214 K215 V216	I204-W212 PolarHBondContact O-NE1 2.94Å; L208-W212 HydrophobicContact CB-CB 3.54Å; L208-W212 HydrophobicContact CB-CG 3.85Å; L208-W212 HydrophobicContact CD1-CB 4.37Å; L208-W212 HydrophobicContact CD1-CD2 4.19Å; L208-W212 HydrophobicContact CD1-CG 4.06Å; L208-W212 HydrophobicContact CG-CG 4.47Å; G209-W212 PolarHBondContact O-N 3.31Å; G209-W212 VanDerWaalsContact O-N 3.1Å; V210-W212 VanDerWaalsContact C-N 3.34Å; V210-W212 PolarHBondContact O-N 3.33Å; W212-G214 VanDerWaalsContact C-N 3.28Å; W212-G214 PolarHBondContact O-N 3.04Å; W212-K215 HydrophobicContact CE3-CD 4.27Å; W212-K215 WeakPolarHBondContact O-CA 3.47Å; W212-K215 WeakPolarHBondContact O-CB 3.48Å; W212-K215 PolarHBondContact O-N 3.48Å; W212-V216 HydrophobicContact CD2-CG2 4.18Å; W212-V216 HydrophobicContact CZ2-CG2 3.86Å; W212-V216 PolarHBondContact O-N 3.41Å; W212-V216 VanDerWaalsContact O-N 3.1Å
213	L	95.4	Very high	95.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-54.4	-45.2	177.1	178.4	63.4	0	0	0	112	L206 G209 V210 K215 V216 C217 Y374 L378	L206-L213 HydrophobicContact CD2-CB 4.35Å; L206-L213 HydrophobicContact CD2-CD1 3.93Å; L206-L213 HydrophobicContact CD2-CD2 3.69Å; L206-L213 HydrophobicContact CD2-CG 4.19Å; G209-L213 PolarHBondContact O-N 3.32Å; V210-L213 PolarHBondContact O-N 3.22Å; L213-K215 PolarHBondContact O-N 2.74Å; L213-V216 WeakPolarHBondContact O-CB 3.32Å; L213-V216 PolarHBondContact O-N 3.19Å; L213-V216 VanDerWaalsContact O-N 3.1Å; L213-C217 PolarHBondContact O-N 3.3Å; L213-C217 PolarHBondContact O-SG 2.94Å; L213-C217 VanDerWaalsContact O-SG 3.37Å; L213-Y374 HydrophobicContact CD1-CD2 4.36Å; L213-Y374 HydrophobicContact CD1-CG 4.04Å; L213-L378 HydrophobicContact CD2-CD2 3.88Å
214	G	95	Very high	95.2	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-53.7	-39.4	176.4	0	0	0	0	0	112.9	V210 W212 C217 Y218	V210-G214 PolarHBondContact O-N 3.02Å; W212-G214 VanDerWaalsContact C-N 3.28Å; W212-G214 PolarHBondContact O-N 3.04Å; G214-C217 PolarHBondContact O-N 2.87Å; G214-Y218 WeakPolarHBondContact O-CD2 3.23Å; G214-Y218 WeakPolarHBondContact O-CE2 3.49Å
215	K	95.8	Very high	95.2	Very high	111 Å²	111	42.4 Å²	42.4	48%	0.483	20%	0.198	S	C	.	.	H	α-helix	trans	-69.3	-44.3	176.9	-62.5	173.2	-174.7	177.1	0	112.1	W212 L213 C217 Y218 F219	W212-K215 HydrophobicContact CE3-CD 4.27Å; W212-K215 WeakPolarHBondContact O-CA 3.47Å; W212-K215 WeakPolarHBondContact O-CB 3.48Å; W212-K215 PolarHBondContact O-N 3.48Å; L213-K215 PolarHBondContact O-N 2.74Å; K215-C217 VanDerWaalsContact C-N 3.26Å; K215-C217 PolarHBondContact O-N 3.41Å; K215-Y218 PolarHBondContact O-N 3.49Å; K215-F219 WeakPolarHBondContact O-CD2 3.37Å
216	V	96.9	Very high	95.3	Very high	20 Å²	20	46.8 Å²	46.8	12%	0.121	22%	0.221	C	C	.	.	H	α-helix	trans	-56.9	-44.3	175.9	175.7	0	0	0	0	110.1	W212 L213 Y218 F219 T220 Y374	W212-V216 HydrophobicContact CD2-CG2 4.18Å; W212-V216 HydrophobicContact CZ2-CG2 3.86Å; W212-V216 PolarHBondContact O-N 3.41Å; W212-V216 VanDerWaalsContact O-N 3.1Å; L213-V216 WeakPolarHBondContact O-CB 3.32Å; L213-V216 PolarHBondContact O-N 3.19Å; L213-V216 VanDerWaalsContact O-N 3.1Å; V216-Y218 VanDerWaalsContact C-N 3.3Å; V216-Y218 PolarHBondContact O-N 2.86Å; V216-F219 PolarHBondContact O-N 3.2Å; V216-F219 VanDerWaalsContact O-N 3.08Å; V216-T220 HydrophobicContact CG1-CG2 4.05Å; V216-T220 PolarHBondContact O-N 3.41Å; V216-T220 VanDerWaalsContact O-N 3.13Å; V216-Y374 HydrophobicContact CG1-CE2 4.21Å
217	C	97.6	Very high	95.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-23.2	-176.8	-71.6	0	0	0	0	115.1	I26 V27 V30 L213 G214 K215 T220 F221	I26-C217 HydrophobicContact CG2-CB 4.17Å; V27-C217 HydrophobicContact CG2-CB 3.86Å; V30-C217 HydrophobicContact CG2-CB 3.86Å; V30-C217 WeakPolarHBondContact CG2-O 3.47Å; L213-C217 PolarHBondContact O-N 3.3Å; L213-C217 PolarHBondContact O-SG 2.94Å; L213-C217 VanDerWaalsContact O-SG 3.37Å; G214-C217 PolarHBondContact O-N 2.87Å; K215-C217 VanDerWaalsContact C-N 3.26Å; K215-C217 PolarHBondContact O-N 3.41Å; C217-T220 WeakPolarHBondContact CA-OG1 3.17Å; C217-F221 WeakPolarHBondContact O-CB 3.47Å; C217-F221 PolarHBondContact O-N 3.44Å
218	Y	97.3	Very high	95.6	Very high	80 Å²	80	44.8 Å²	44.8	31%	0.314	21%	0.213	S	C	.	.	H	α-helix	trans	-62.4	-45	170.4	-73.1	-88.4	0	0	0	111.4	S22 D23 I26 G214 K215 V216 V222	S22-Y218 WeakPolarHBondContact CB-OH 3.49Å; S22-Y218 PolarHBondContact OG-OH 3.16Å; D23-Y218 PolarHBondContact N-OH 2.77Å; D23-Y218 VanDerWaalsContact OD1-CE2 3.3Å; D23-Y218 WeakPolarHBondContact OD1-CE2 3.32Å; D23-Y218 PolarHBondContact OD1-OH 3.17Å; I26-Y218 HydrophobicContact CB-CD1 4.48Å; I26-Y218 HydrophobicContact CB-CE1 4.34Å; I26-Y218 HydrophobicContact CG1-CD1 4.04Å; I26-Y218 HydrophobicContact CG1-CE1 4.37Å; I26-Y218 HydrophobicContact CG1-CG 4.23Å; I26-Y218 HydrophobicContact CG2-CD1 4.48Å; I26-Y218 HydrophobicContact CG2-CD2 4.08Å; I26-Y218 HydrophobicContact CG2-CE1 4.3Å; I26-Y218 HydrophobicContact CG2-CE2 3.88Å; I26-Y218 HydrophobicContact CG2-CG 4.38Å; G214-Y218 WeakPolarHBondContact O-CD2 3.23Å; G214-Y218 WeakPolarHBondContact O-CE2 3.49Å; K215-Y218 PolarHBondContact O-N 3.49Å; V216-Y218 VanDerWaalsContact C-N 3.3Å; V216-Y218 PolarHBondContact O-N 2.86Å; Y218-V222 WeakPolarHBondContact O-CB 3.39Å; Y218-V222 VanDerWaalsContact O-CG2 3.25Å; Y218-V222 WeakPolarHBondContact O-CG2 3.43Å; Y218-V222 PolarHBondContact O-N 3.38Å; Y218-V222 VanDerWaalsContact O-N 3.12Å
219	F	94.9	Very high	96.1	Very high	147 Å²	147	43.7 Å²	43.7	65%	0.645	21%	0.207	S	C	*	.	H	α-helix	trans	-69.3	-46.3	179.6	-63.8	-79.7	0	0	0	111.2	K215 V216 F221 V222 I223	K215-F219 WeakPolarHBondContact O-CD2 3.37Å; V216-F219 PolarHBondContact O-N 3.2Å; V216-F219 VanDerWaalsContact O-N 3.08Å; F219-F221 PolarHBondContact O-N 3.48Å; F219-V222 PolarHBondContact O-N 2.94Å; F219-I223 VanDerWaalsContact O-CG1 3.32Å; F219-I223 WeakPolarHBondContact O-CG1 3.39Å; F219-I223 PolarHBondContact O-N 2.99Å; F219-I223 VanDerWaalsContact O-N 3.15Å
220	T	96.1	Very high	96.5	Very high	13 Å²	13	46.8 Å²	46.8	8%	0.08	23%	0.226	C	C	.	.	H	α-helix	trans	-75.7	-8.7	-177.3	70.3	0	0	0	0	113.3	V216 C217 P224 N371 Y374	V216-T220 HydrophobicContact CG1-CG2 4.05Å; V216-T220 PolarHBondContact O-N 3.41Å; V216-T220 VanDerWaalsContact O-N 3.13Å; C217-T220 WeakPolarHBondContact CA-OG1 3.17Å; T220-P224 WeakPolarHBondContact O-CD 3.28Å; T220-P224 WeakPolarHBondContact O-CG 3.41Å; T220-N371 WeakPolarHBondContact CB-OD1 3.23Å; T220-N371 PolarHBondContact O-ND2 3.18Å; T220-N371 PolarHBondContact O-OD1 3Å; T220-N371 PolarHBondContact OG1-OD1 3.43Å; T220-Y374 HydrophobicContact CG2-CE2 3.98Å
221	F	97.8	Very high	96.8	Very high	23 Å²	23	46.9 Å²	46.9	10%	0.101	23%	0.226	C	C	.	.	H	α-helix	trans	-86.2	-50.1	165.2	-179.5	-109.5	0	0	0	112.9	I26 F29 V30 F33 C217 F219 I223 P224 L225 L307	I26-F221 HydrophobicContact CD1-CB 3.72Å; I26-F221 HydrophobicContact CD1-CD1 3.38Å; I26-F221 HydrophobicContact CD1-CD2 4.41Å; I26-F221 HydrophobicContact CD1-CE1 4.06Å; I26-F221 HydrophobicContact CD1-CG 3.57Å; I26-F221 HydrophobicContact CG1-CB 4.14Å; I26-F221 HydrophobicContact CG1-CG 4.47Å; F29-F221 HydrophobicContact CB-CD2 3.88Å; F29-F221 HydrophobicContact CB-CE2 3.63Å; F29-F221 HydrophobicContact CB-CZ 4.12Å; F29-F221 HydrophobicContact CD2-CE1 4.34Å; F29-F221 HydrophobicContact CD2-CE2 4.4Å; F29-F221 HydrophobicContact CD2-CZ 4.03Å; F29-F221 HydrophobicContact CG-CE2 4.45Å; F29-F221 HydrophobicContact CG-CZ 4.5Å; V30-F221 HydrophobicContact CG2-CB 3.71Å; V30-F221 HydrophobicContact CG2-CD2 4.41Å; F33-F221 HydrophobicContact CD1-CD2 4.38Å; F33-F221 HydrophobicContact CD1-CE2 4.29Å; C217-F221 WeakPolarHBondContact O-CB 3.47Å; C217-F221 PolarHBondContact O-N 3.44Å; F219-F221 PolarHBondContact O-N 3.48Å; F221-I223 PolarHBondContact O-N 2.87Å; F221-P224 VanDerWaalsContact O-CD 3.29Å; F221-P224 WeakPolarHBondContact O-CD 3.42Å; F221-P224 WeakPolarHBondContact O-CG 3.37Å; F221-L225 HydrophobicContact CE1-CD2 3.99Å; F221-L225 HydrophobicContact CZ-CD2 4.22Å; F221-L225 WeakPolarHBondContact O-CB 3.46Å; F221-L225 PolarHBondContact O-N 3Å; F221-L307 HydrophobicContact CE2-CD1 4.17Å
222	V	97.9	Very high	97.1	Very high	69 Å²	69	46.1 Å²	46.1	42%	0.418	23%	0.225	S	C	.	.	H	α-helix	trans	-65.7	-41.8	-172.2	171	0	0	0	0	111.3	Y218 F219 L225 L226	Y218-V222 WeakPolarHBondContact O-CB 3.39Å; Y218-V222 VanDerWaalsContact O-CG2 3.25Å; Y218-V222 WeakPolarHBondContact O-CG2 3.43Å; Y218-V222 PolarHBondContact O-N 3.38Å; Y218-V222 VanDerWaalsContact O-N 3.12Å; F219-V222 PolarHBondContact O-N 2.94Å; V222-L225 WeakPolarHBondContact O-CB 3.47Å; V222-L225 PolarHBondContact O-N 3.46Å; V222-L226 HydrophobicContact CG1-CD1 3.96Å; V222-L226 HydrophobicContact CG1-CG 4.29Å; V222-L226 WeakPolarHBondContact O-CG 3.43Å; V222-L226 PolarHBondContact O-N 3.5Å
223	I	98	Very high	97.2	Very high	73 Å²	73	46.3 Å²	46.3	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-61.3	-55.6	-178.6	-61.8	168.3	0	0	0	111.9	F219 F221 L225 L226 L227 L367	F219-I223 VanDerWaalsContact O-CG1 3.32Å; F219-I223 WeakPolarHBondContact O-CG1 3.39Å; F219-I223 PolarHBondContact O-N 2.99Å; F219-I223 VanDerWaalsContact O-N 3.15Å; F221-I223 PolarHBondContact O-N 2.87Å; I223-L225 PolarHBondContact O-N 3.4Å; I223-L226 PolarHBondContact O-N 3.24Å; I223-L226 VanDerWaalsContact O-N 3.13Å; I223-L227 HydrophobicContact CG2-CD1 3.94Å; I223-L227 HydrophobicContact CG2-CG 4.29Å; I223-L227 WeakPolarHBondContact O-CG 3.29Å; I223-L227 PolarHBondContact O-N 3.47Å; I223-L367 HydrophobicContact CB-CD1 4.02Å; I223-L367 HydrophobicContact CG2-CD1 3.41Å; I223-L367 VanDerWaalsContact CG2-CD1 3.41Å
224	P	97.8	Very high	97.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.4	-28.1	178.5	24.2	-32.4	0	0	0	113	F33 T220 F221 L227 V228 F364 L367 L368	F33-P224 HydrophobicContact CD1-CG 4.42Å; F33-P224 HydrophobicContact CE1-CB 4.04Å; F33-P224 HydrophobicContact CE1-CG 4.26Å; T220-P224 WeakPolarHBondContact O-CD 3.28Å; T220-P224 WeakPolarHBondContact O-CG 3.41Å; F221-P224 VanDerWaalsContact O-CD 3.29Å; F221-P224 WeakPolarHBondContact O-CD 3.42Å; F221-P224 WeakPolarHBondContact O-CG 3.37Å; P224-L227 PolarHBondContact O-N 2.89Å; P224-V228 WeakPolarHBondContact O-CG1 3.35Å; P224-V228 PolarHBondContact O-N 2.93Å; P224-F364 HydrophobicContact CB-CD2 3.76Å; P224-F364 HydrophobicContact CB-CE2 3.97Å; P224-F364 WeakPolarHBondContact O-CD2 3.18Å; P224-F364 WeakPolarHBondContact O-CE2 3.24Å; P224-L367 HydrophobicContact CB-CB 4.31Å; P224-L367 HydrophobicContact CG-CB 4.32Å; P224-L368 HydrophobicContact CB-CD2 3.85Å; P224-L368 HydrophobicContact CG-CD2 4.27Å
225	L	98.3	Very high	97.3	Very high	46 Å²	46	48.6 Å²	48.6	24%	0.241	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-45.7	172.2	-178.9	62.8	0	0	0	111.4	F33 F221 V222 I223 V228 L229 L307 L310	F33-L225 HydrophobicContact CE1-CB 4.39Å; F221-L225 HydrophobicContact CE1-CD2 3.99Å; F221-L225 HydrophobicContact CZ-CD2 4.22Å; F221-L225 WeakPolarHBondContact O-CB 3.46Å; F221-L225 PolarHBondContact O-N 3Å; V222-L225 WeakPolarHBondContact O-CB 3.47Å; V222-L225 PolarHBondContact O-N 3.46Å; I223-L225 PolarHBondContact O-N 3.4Å; L225-V228 HydrophobicContact CD1-CG1 4.47Å; L225-V228 VanDerWaalsContact O-CG1 3.26Å; L225-V228 WeakPolarHBondContact O-CG1 3.44Å; L225-L229 HydrophobicContact CD1-CD1 4.38Å; L225-L229 HydrophobicContact CG-CD1 4.22Å; L225-L229 WeakPolarHBondContact O-CB 3.35Å; L225-L229 WeakPolarHBondContact O-CD1 3.29Å; L225-L229 WeakPolarHBondContact O-CG 3.45Å; L225-L229 PolarHBondContact O-N 3.47Å; L225-L229 VanDerWaalsContact O-N 3.1Å; L225-L307 HydrophobicContact CD1-CD2 3.92Å; L225-L310 HydrophobicContact CD1-CD2 4.23Å
226	L	98.3	Very high	97.3	Very high	100 Å²	100	47.4 Å²	47.4	52%	0.524	25%	0.245	S	C	.	.	H	α-helix	trans	-66	-38.8	175.5	-67.1	175.8	0	0	0	112.1	V222 I223 L229 T230	V222-L226 HydrophobicContact CG1-CD1 3.96Å; V222-L226 HydrophobicContact CG1-CG 4.29Å; V222-L226 WeakPolarHBondContact O-CG 3.43Å; V222-L226 PolarHBondContact O-N 3.5Å; I223-L226 PolarHBondContact O-N 3.24Å; I223-L226 VanDerWaalsContact O-N 3.13Å; L226-L229 PolarHBondContact O-N 2.89Å; L226-T230 WeakPolarHBondContact O-CB 3.37Å; L226-T230 PolarHBondContact O-N 3.21Å; L226-T230 PolarHBondContact O-OG1 3.5Å
227	L	98.3	Very high	97.2	Very high	17 Å²	17	51 Å²	51	9%	0.089	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-47.9	177	-68.9	172.8	0	0	0	111.6	I223 P224 L229 T230 L231 L360 L363 F364 L367	I223-L227 HydrophobicContact CG2-CD1 3.94Å; I223-L227 HydrophobicContact CG2-CG 4.29Å; I223-L227 WeakPolarHBondContact O-CG 3.29Å; I223-L227 PolarHBondContact O-N 3.47Å; P224-L227 PolarHBondContact O-N 2.89Å; L227-L229 VanDerWaalsContact C-N 3.33Å; L227-L229 PolarHBondContact O-N 3.3Å; L227-T230 PolarHBondContact O-N 2.53Å; L227-L231 WeakPolarHBondContact O-CB 3.43Å; L227-L231 VanDerWaalsContact O-CG 3.29Å; L227-L231 WeakPolarHBondContact O-CG 2.83Å; L227-L231 PolarHBondContact O-N 3.16Å; L227-L360 HydrophobicContact CD2-CB 4.27Å; L227-L360 HydrophobicContact CD2-CD2 3.61Å; L227-L360 HydrophobicContact CD2-CG 4.47Å; L227-L363 HydrophobicContact CD1-CB 4.27Å; L227-L363 HydrophobicContact CD1-CD2 4.02Å; L227-L363 HydrophobicContact CD1-CG 3.89Å; L227-F364 HydrophobicContact CB-CB 4.04Å; L227-F364 HydrophobicContact CB-CD2 4.13Å; L227-F364 HydrophobicContact CB-CG 4.46Å; L227-F364 HydrophobicContact CD1-CB 4Å; L227-L367 HydrophobicContact CD1-CD1 4.06Å
228	V	98	Very high	97	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-65.7	-36.8	178.7	72.3	0	0	0	0	111.8	F33 P224 L225 T230 L231 L232 L310 T314 F364	F33-V228 HydrophobicContact CZ-CB 4.42Å; F33-V228 HydrophobicContact CZ-CG1 3.84Å; P224-V228 WeakPolarHBondContact O-CG1 3.35Å; P224-V228 PolarHBondContact O-N 2.93Å; L225-V228 HydrophobicContact CD1-CG1 4.47Å; L225-V228 VanDerWaalsContact O-CG1 3.26Å; L225-V228 WeakPolarHBondContact O-CG1 3.44Å; V228-T230 VanDerWaalsContact C-N 3.34Å; V228-T230 PolarHBondContact O-N 3.46Å; V228-L231 PolarHBondContact O-N 2.96Å; V228-L232 VanDerWaalsContact O-CB 3.27Å; V228-L232 WeakPolarHBondContact O-CB 3.32Å; V228-L232 PolarHBondContact O-N 3.35Å; V228-L310 HydrophobicContact CG1-CD2 3.52Å; V228-L310 HydrophobicContact CG1-CG 3.99Å; V228-L310 HydrophobicContact CG2-CG 4.05Å; V228-T314 HydrophobicContact CG2-CG2 4.37Å; V228-F364 HydrophobicContact CB-CD2 4.33Å; V228-F364 HydrophobicContact CB-CE2 3.7Å; V228-F364 HydrophobicContact CB-CZ 3.87Å; V228-F364 HydrophobicContact CG1-CE2 4.44Å; V228-F364 HydrophobicContact CG2-CE2 4.34Å; V228-F364 HydrophobicContact CG2-CZ 3.99Å
229	L	98.3	Very high	96.7	Very high	76 Å²	76	54.9 Å²	54.9	40%	0.398	29%	0.293	S	S	.	.	H	α-helix	trans	-64.6	-40.4	175.4	-72.3	169.8	0	0	0	111.4	L225 L226 L227 L232 V233 L310	L225-L229 HydrophobicContact CD1-CD1 4.38Å; L225-L229 HydrophobicContact CG-CD1 4.22Å; L225-L229 WeakPolarHBondContact O-CB 3.35Å; L225-L229 WeakPolarHBondContact O-CD1 3.29Å; L225-L229 WeakPolarHBondContact O-CG 3.45Å; L225-L229 PolarHBondContact O-N 3.47Å; L225-L229 VanDerWaalsContact O-N 3.1Å; L226-L229 PolarHBondContact O-N 2.89Å; L227-L229 VanDerWaalsContact C-N 3.33Å; L227-L229 PolarHBondContact O-N 3.3Å; L229-L232 PolarHBondContact O-N 3.4Å; L229-V233 WeakPolarHBondContact O-CG2 3.32Å; L229-V233 PolarHBondContact O-N 2.61Å; L229-V233 VanDerWaalsContact O-N 3.08Å; L229-L310 HydrophobicContact CD2-CD1 4.18Å; L229-L310 HydrophobicContact CD2-CD2 4.08Å; L229-L310 HydrophobicContact CG-CD2 4.46Å
230	T	98.1	Very high	96.4	Very high	67 Å²	67	48.1 Å²	48.1	41%	0.411	27%	0.265	S	S	.	.	H	α-helix	trans	-66.2	-45.4	176.7	-55.4	0	0	0	0	111.2	L226 L227 V228 L232 V233 K234 W357	L226-T230 WeakPolarHBondContact O-CB 3.37Å; L226-T230 PolarHBondContact O-N 3.21Å; L226-T230 PolarHBondContact O-OG1 3.5Å; L227-T230 PolarHBondContact O-N 2.53Å; V228-T230 VanDerWaalsContact C-N 3.34Å; V228-T230 PolarHBondContact O-N 3.46Å; T230-L232 VanDerWaalsContact C-N 3.34Å; T230-L232 PolarHBondContact O-N 3.1Å; T230-V233 PolarHBondContact O-N 2.87Å; T230-K234 PolarHBondContact O-N 3.4Å; T230-K234 VanDerWaalsContact O-N 3.1Å; T230-W357 HydrophobicContact CG2-CH2 4.26Å; T230-W357 HydrophobicContact CG2-CZ3 4.1Å
231	L	97.8	Very high	96.3	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-39.9	176.1	-72.7	167.1	0	0	0	111.6	L227 V228 K234 S235 T314 W357 L361 F364	L227-L231 WeakPolarHBondContact O-CB 3.43Å; L227-L231 VanDerWaalsContact O-CG 3.29Å; L227-L231 WeakPolarHBondContact O-CG 2.83Å; L227-L231 PolarHBondContact O-N 3.16Å; V228-L231 PolarHBondContact O-N 2.96Å; L231-K234 PolarHBondContact O-N 2.97Å; L231-S235 VanDerWaalsContact O-CB 3.25Å; L231-S235 WeakPolarHBondContact O-CB 3.35Å; L231-S235 PolarHBondContact O-N 3.1Å; L231-S235 PolarHBondContact O-OG 3.37Å; L231-S235 VanDerWaalsContact O-OG 3.08Å; L231-T314 HydrophobicContact CB-CG2 3.9Å; L231-W357 HydrophobicContact CD2-CE3 4.07Å; L231-W357 HydrophobicContact CD2-CZ3 4.44Å; L231-L361 HydrophobicContact CD1-CD1 4Å; L231-F364 HydrophobicContact CD1-CB 4.32Å; L231-F364 HydrophobicContact CD1-CD1 4.39Å; L231-F364 HydrophobicContact CD1-CG 4.41Å
232	L	97.4	Very high	95.9	Very high	30 Å²	30	49.9 Å²	49.9	16%	0.157	28%	0.281	C	S	.	.	H	α-helix	trans	-60.3	-51.4	176	177.5	70.5	0	0	0	111.4	V228 L229 T230 K234 S235 L236 L310 V313 T314	V228-L232 VanDerWaalsContact O-CB 3.27Å; V228-L232 WeakPolarHBondContact O-CB 3.32Å; V228-L232 PolarHBondContact O-N 3.35Å; L229-L232 PolarHBondContact O-N 3.4Å; T230-L232 VanDerWaalsContact C-N 3.34Å; T230-L232 PolarHBondContact O-N 3.1Å; L232-K234 VanDerWaalsContact C-N 3.29Å; L232-K234 PolarHBondContact O-N 3.23Å; L232-S235 PolarHBondContact O-N 2.86Å; L232-S235 PolarHBondContact O-OG 3.47Å; L232-S235 VanDerWaalsContact O-OG 3.11Å; L232-L236 HydrophobicContact CD1-CD1 3.71Å; L232-L236 HydrophobicContact CD1-CG 3.94Å; L232-L236 HydrophobicContact CD2-CD1 4.46Å; L232-L236 HydrophobicContact CG-CD1 3.88Å; L232-L236 HydrophobicContact CG-CG 4.37Å; L232-L236 WeakPolarHBondContact O-CB 3.1Å; L232-L236 WeakPolarHBondContact O-CG 3.43Å; L232-L236 PolarHBondContact O-N 3.43Å; L232-L310 HydrophobicContact CB-CD1 4.37Å; L232-L310 HydrophobicContact CD2-CD1 3.5Å; L232-L310 VanDerWaalsContact CD2-CD1 3.5Å; L232-L310 HydrophobicContact CG-CD1 4.35Å; L232-V313 HydrophobicContact CD1-CB 4.19Å; L232-V313 HydrophobicContact CD1-CG1 3.75Å; L232-T314 HydrophobicContact CB-CG2 4.46Å; L232-T314 WeakPolarHBondContact CB-OG1 3.39Å; L232-T314 WeakPolarHBondContact CD1-OG1 3.36Å
233	V	97.1	Very high	95.6	Very high	97 Å²	97	50 Å²	50	59%	0.588	28%	0.279	S	S	*	.	H	α-helix	trans	-60.7	-43.4	-178.2	171.5	0	0	0	0	110.3	L229 T230 S237	L229-V233 WeakPolarHBondContact O-CG2 3.32Å; L229-V233 PolarHBondContact O-N 2.61Å; L229-V233 VanDerWaalsContact O-N 3.08Å; T230-V233 PolarHBondContact O-N 2.87Å; V233-S237 PolarHBondContact O-N 3Å; V233-S237 PolarHBondContact O-OG 3.38Å
234	K	96.5	Very high	95.3	Very high	49 Å²	49	46.6 Å²	46.6	21%	0.213	26%	0.261	C	S	.	.	H	α-helix	trans	-65.9	-46.3	177.2	-179	62.7	174.3	-179.5	0	112.1	T230 L231 L232 S237 T238 F351 W357	T230-K234 PolarHBondContact O-N 3.4Å; T230-K234 VanDerWaalsContact O-N 3.1Å; L231-K234 PolarHBondContact O-N 2.97Å; L232-K234 VanDerWaalsContact C-N 3.29Å; L232-K234 PolarHBondContact O-N 3.23Å; K234-S237 WeakPolarHBondContact O-CB 3.31Å; K234-S237 PolarHBondContact O-N 3.44Å; K234-T238 VanDerWaalsContact O-CG2 3.27Å; K234-T238 WeakPolarHBondContact O-CG2 3.41Å; K234-F351 HydrophobicContact CB-CE2 4.46Å; K234-F351 HydrophobicContact CG-CD2 3.76Å; K234-F351 HydrophobicContact CG-CE2 3.49Å; K234-F351 VanDerWaalsContact CG-CE2 3.49Å; K234-F351 HydrophobicContact CG-CZ 4.04Å; K234-W357 HydrophobicContact CB-CE3 4.26Å; K234-W357 HydrophobicContact CB-CH2 3.39Å; K234-W357 HydrophobicContact CB-CZ2 4.07Å; K234-W357 HydrophobicContact CB-CZ3 3.48Å; K234-W357 VanDerWaalsContact CB-CZ3 3.48Å; K234-W357 HydrophobicContact CD-CH2 3.84Å; K234-W357 HydrophobicContact CD-CZ2 3.58Å; K234-W357 HydrophobicContact CG-CD2 4.16Å; K234-W357 HydrophobicContact CG-CE3 4.01Å; K234-W357 HydrophobicContact CG-CH2 3.45Å; K234-W357 VanDerWaalsContact CG-CH2 3.45Å; K234-W357 HydrophobicContact CG-CZ2 3.59Å; K234-W357 HydrophobicContact CG-CZ3 3.65Å
235	S	95.4	Very high	95.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-41.7	-176.2	67.9	0	0	0	0	111.8	L231 L232 S237 T238 A241 A317	L231-S235 VanDerWaalsContact O-CB 3.25Å; L231-S235 WeakPolarHBondContact O-CB 3.35Å; L231-S235 PolarHBondContact O-N 3.1Å; L231-S235 PolarHBondContact O-OG 3.37Å; L231-S235 VanDerWaalsContact O-OG 3.08Å; L232-S235 PolarHBondContact O-N 2.86Å; L232-S235 PolarHBondContact O-OG 3.47Å; L232-S235 VanDerWaalsContact O-OG 3.11Å; S235-S237 PolarHBondContact O-N 2.75Å; S235-T238 PolarHBondContact O-N 2.9Å; S235-T238 VanDerWaalsContact O-N 3.13Å; S235-T238 PolarHBondContact O-OG1 2.91Å; S235-A241 WeakPolarHBondContact O-CB 3.3Å; S235-A317 WeakPolarHBondContact OG-CB 3.45Å
236	L	95.7	Very high	94.9	Very high	85 Å²	85	52.1 Å²	52.1	45%	0.445	29%	0.288	S	S	.	.	H	α-helix	trans	-64.7	-23.3	175.7	-71.1	177.8	0	0	0	113.7	L232 T238 V313 A317	L232-L236 HydrophobicContact CD1-CD1 3.71Å; L232-L236 HydrophobicContact CD1-CG 3.94Å; L232-L236 HydrophobicContact CD2-CD1 4.46Å; L232-L236 HydrophobicContact CG-CD1 3.88Å; L232-L236 HydrophobicContact CG-CG 4.37Å; L232-L236 WeakPolarHBondContact O-CB 3.1Å; L232-L236 WeakPolarHBondContact O-CG 3.43Å; L232-L236 PolarHBondContact O-N 3.43Å; L236-T238 PolarHBondContact O-N 3.18Å; L236-V313 HydrophobicContact CD2-CG1 4.16Å; L236-A317 HydrophobicContact CD2-CB 4.04Å
237	S	94.6	Very high	94.5	Very high	97 Å²	97	50.4 Å²	50.4	68%	0.678	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-1.4	178	-56.4	0	0	0	0	113.3	V233 K234 S235	V233-S237 PolarHBondContact O-N 3Å; V233-S237 PolarHBondContact O-OG 3.38Å; K234-S237 WeakPolarHBondContact O-CB 3.31Å; K234-S237 PolarHBondContact O-N 3.44Å; S235-S237 PolarHBondContact O-N 2.75Å
238	T	93.1	Very high	94.1	Very high	23 Å²	23	49.6 Å²	49.6	14%	0.141	27%	0.271	C	S	.	.	S	Bend	trans	-98.9	152.5	-174.4	66.7	0	0	0	0	112.6	K234 S235 L236 A241 F351	K234-T238 VanDerWaalsContact O-CG2 3.27Å; K234-T238 WeakPolarHBondContact O-CG2 3.41Å; S235-T238 PolarHBondContact O-N 2.9Å; S235-T238 VanDerWaalsContact O-N 3.13Å; S235-T238 PolarHBondContact O-OG1 2.91Å; L236-T238 PolarHBondContact O-N 3.18Å; T238-A241 WeakPolarHBondContact O-CB 3.5Å; T238-A241 PolarHBondContact O-N 3.44Å; T238-F351 HydrophobicContact CG2-CD1 4.09Å; T238-F351 HydrophobicContact CG2-CE1 3.3Å; T238-F351 HydrophobicContact CG2-CZ 3.76Å
239	E	92.3	Very high	93.8	Very high	137 Å²	137	53.9 Å²	53.9	64%	0.64	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	137.9	173.7	-170.4	178.3	-166.8	0	0	110.8	A241 H321 I324	E239-A241 VanDerWaalsContact C-N 3.31Å; E239-A241 PolarHBondContact O-N 3.16Å; E239-H321 WeakPolarHBondContact O-CA 3.27Å; E239-H321 PolarHBondContact O-ND1 3.28Å; E239-I324 HydrophobicContact CG-CG2 4.41Å
240	G	88.6	Confident	93.6	Very high	5 Å²	5	57 Å²	57	5%	0.052	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.3	-19.3	-177.2	0	0	0	0	0	115	S242 I243 G320	G240-S242 PolarHBondContact O-N 3.12Å; G240-I243 PolarHBondContact O-N 3.26Å; G240-G320 CarbonylContact O-C 3.57Å; G240-G320 WeakPolarHBondContact O-CA 3.5Å
241	A	92.2	Very high	93.5	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-58.7	-45.3	-177.7	0	0	0	0	0	113	S235 T238 E239 I243 V245 A317	S235-A241 WeakPolarHBondContact O-CB 3.3Å; T238-A241 WeakPolarHBondContact O-CB 3.5Å; T238-A241 PolarHBondContact O-N 3.44Å; E239-A241 VanDerWaalsContact C-N 3.31Å; E239-A241 PolarHBondContact O-N 3.16Å; A241-I243 VanDerWaalsContact C-N 3.31Å; A241-I243 PolarHBondContact O-N 3.39Å; A241-V245 VanDerWaalsContact O-CG2 3.27Å; A241-V245 WeakPolarHBondContact O-CG2 3.45Å; A241-V245 PolarHBondContact O-N 2.96Å; A241-V245 VanDerWaalsContact O-N 3.17Å; A241-A317 HydrophobicContact CB-CB 3.82Å
242	S	91.3	Very high	93.5	Very high	73 Å²	73	59.7 Å²	59.7	51%	0.51	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-34.5	-178.7	56.3	0	0	0	0	113.1	G240 Q246	G240-S242 PolarHBondContact O-N 3.12Å; S242-Q246 WeakPolarHBondContact O-CB 3.31Å; S242-Q246 WeakPolarHBondContact O-CG 3.41Å; S242-Q246 PolarHBondContact O-N 3.45Å
243	I	91.5	Very high	93.4	Very high	72 Å²	72	65.5 Å²	65.5	37%	0.369	34%	0.337	S	S	.	.	H	α-helix	trans	-65.6	-49.5	-176.8	-57.7	173.2	0	0	0	109.9	G240 A241 Q246 K247 I324 Y330	G240-I243 PolarHBondContact O-N 3.26Å; A241-I243 VanDerWaalsContact C-N 3.31Å; A241-I243 PolarHBondContact O-N 3.39Å; I243-Q246 PolarHBondContact O-N 3.13Å; I243-K247 WeakPolarHBondContact O-CB 3.25Å; I243-K247 PolarHBondContact O-N 2.97Å; I243-I324 HydrophobicContact CD1-CD1 4.36Å; I243-Y330 HydrophobicContact CG2-CE1 4.33Å; I243-Y330 HydrophobicContact CG2-CE2 4.37Å; I243-Y330 WeakPolarHBondContact CG2-OH 3.42Å
244	M	91	Very high	93.4	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-69.1	-38.3	-179.3	-170.9	64.9	168.3	0	0	112.2	I46 Q246 K247 I248 A316 L319 G320 Y330 L334	I46-M244 HydrophobicContact CD1-CE 3.38Å; I46-M244 HydrophobicContact CD1-SD 3.93Å; M244-Q246 VanDerWaalsContact C-N 3.34Å; M244-K247 PolarHBondContact O-N 3.2Å; M244-I248 HydrophobicContact CE-CD1 4.38Å; M244-I248 HydrophobicContact CG-CD1 4.31Å; M244-I248 PolarHBondContact O-N 3.32Å; M244-A316 WeakPolarHBondContact CB-O 3.38Å; M244-A316 WeakPolarHBondContact CG-O 3.34Å; M244-L319 HydrophobicContact CE-CB 4.29Å; M244-L319 HydrophobicContact CG-CB 4.49Å; M244-G320 VanDerWaalsContact CB-CA 3.4Å; M244-Y330 HydrophobicContact SD-CD1 3.87Å; M244-Y330 HydrophobicContact SD-CG 4.27Å; M244-L334 HydrophobicContact CE-CD1 3.96Å; M244-L334 HydrophobicContact CE-CD2 3.45Å; M244-L334 VanDerWaalsContact CE-CD2 3.45Å; M244-L334 HydrophobicContact CE-CG 3.74Å
245	V	93.7	Very high	93.4	Very high	27 Å²	27	64.5 Å²	64.5	16%	0.164	33%	0.326	C	S	.	.	H	α-helix	trans	-60.7	-45	173.7	171.9	0	0	0	0	110.5	A241 I248 F249 V313 A316 A317	A241-V245 VanDerWaalsContact O-CG2 3.27Å; A241-V245 WeakPolarHBondContact O-CG2 3.45Å; A241-V245 PolarHBondContact O-N 2.96Å; A241-V245 VanDerWaalsContact O-N 3.17Å; V245-I248 PolarHBondContact O-N 3.46Å; V245-F249 HydrophobicContact CG1-CD2 4.15Å; V245-F249 HydrophobicContact CG1-CE2 4.17Å; V245-F249 WeakPolarHBondContact O-CD2 3.27Å; V245-F249 PolarHBondContact O-N 3.48Å; V245-V313 HydrophobicContact CG2-CG1 4.41Å; V245-A316 HydrophobicContact CG2-CB 3.86Å; V245-A317 HydrophobicContact CG2-CB 4.25Å
246	Q	92.9	Very high	93.5	Very high	136 Å²	136	66.7 Å²	66.7	64%	0.636	34%	0.338	S	S	*	.	H	α-helix	trans	-62.1	-45.2	175.7	-75	172.4	8.4	0	0	111.8	S242 I243 M244 I248 F249 E250	S242-Q246 WeakPolarHBondContact O-CB 3.31Å; S242-Q246 WeakPolarHBondContact O-CG 3.41Å; S242-Q246 PolarHBondContact O-N 3.45Å; I243-Q246 PolarHBondContact O-N 3.13Å; M244-Q246 VanDerWaalsContact C-N 3.34Å; Q246-I248 VanDerWaalsContact C-N 3.32Å; Q246-I248 PolarHBondContact O-N 2.85Å; Q246-F249 CarbonylContact O-C 3.57Å; Q246-F249 PolarHBondContact O-N 3.27Å; Q246-F249 VanDerWaalsContact O-N 3.12Å; Q246-E250 PolarHBondContact O-N 3.09Å
247	K	90.2	Very high	93.6	Very high	63 Å²	63	71.7 Å²	71.7	27%	0.274	35%	0.352	S	S	.	.	H	α-helix	trans	-61.3	-37.4	179.5	-169.3	170.9	-179.3	174.9	0	112.8	I243 M244 F249 E250 E331	I243-K247 WeakPolarHBondContact O-CB 3.25Å; I243-K247 PolarHBondContact O-N 2.97Å; M244-K247 PolarHBondContact O-N 3.2Å; K247-F249 VanDerWaalsContact C-N 3.31Å; K247-F249 PolarHBondContact O-N 3.35Å; K247-E250 WeakPolarHBondContact O-CB 3.34Å; K247-E250 PolarHBondContact O-N 3.13Å; K247-E331 IonicContact NZ-OE1 3.09Å; K247-E331 PolarHBondContact NZ-OE1 3.29Å
248	I	91.5	Very high	93.6	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-65.8	-32.6	176.2	-82.9	166	0	0	0	112.5	P42 F45 I46 G50 M244 V245 Q246 L312 A316	P42-I248 HydrophobicContact CB-CD1 3.94Å; F45-I248 HydrophobicContact CB-CG2 3.95Å; F45-I248 HydrophobicContact CD1-CG2 3.86Å; F45-I248 HydrophobicContact CG-CG2 4.04Å; I46-I248 HydrophobicContact CD1-CD1 4.36Å; I46-I248 HydrophobicContact CD1-CG1 3.7Å; I46-I248 HydrophobicContact CG1-CG1 3.71Å; G50-I248 CarbonylContact C-O 3.59Å; G50-I248 WeakPolarHBondContact CA-O 3.29Å; M244-I248 HydrophobicContact CE-CD1 4.38Å; M244-I248 HydrophobicContact CG-CD1 4.31Å; M244-I248 PolarHBondContact O-N 3.32Å; V245-I248 PolarHBondContact O-N 3.46Å; Q246-I248 VanDerWaalsContact C-N 3.32Å; Q246-I248 PolarHBondContact O-N 2.85Å; I248-L312 HydrophobicContact CD1-CD1 4.45Å; I248-L312 HydrophobicContact CG2-CD1 4.12Å; I248-L312 HydrophobicContact CG2-CD2 4.38Å; I248-L312 HydrophobicContact CG2-CG 4.42Å; I248-A316 HydrophobicContact CD1-CB 3.34Å
249	F	91.5	Very high	93.7	Very high	91 Å²	91	75.4 Å²	75.4	40%	0.399	36%	0.357	S	S	.	.	H	α-helix	trans	-95	-4.3	178.9	-69.2	-65.9	0	0	0	113.9	F45 V245 Q246 K247 T251 L312 V313	F45-F249 HydrophobicContact CE1-CE1 4.37Å; V245-F249 HydrophobicContact CG1-CD2 4.15Å; V245-F249 HydrophobicContact CG1-CE2 4.17Å; V245-F249 WeakPolarHBondContact O-CD2 3.27Å; V245-F249 PolarHBondContact O-N 3.48Å; Q246-F249 CarbonylContact O-C 3.57Å; Q246-F249 PolarHBondContact O-N 3.27Å; Q246-F249 VanDerWaalsContact O-N 3.12Å; K247-F249 VanDerWaalsContact C-N 3.31Å; K247-F249 PolarHBondContact O-N 3.35Å; F249-T251 PolarHBondContact O-N 3.47Å; F249-T251 PolarHBondContact O-OG1 3.41Å; F249-L312 HydrophobicContact CZ-CD2 4.36Å; F249-V313 HydrophobicContact CE2-CG2 4.37Å; F249-V313 HydrophobicContact CZ-CG2 4.44Å
250	E	94.1	Very high	93.8	Very high	141 Å²	141	73.4 Å²	73.4	66%	0.659	35%	0.347	S	S	*	.			trans	-59	128.3	169.2	-168.8	171.1	-174.4	0	0	109.2	G50 G51 Q246 K247	G50-E250 VanDerWaalsContact CA-O 3.31Å; G50-E250 WeakPolarHBondContact CA-O 3.41Å; G51-E250 PolarHBondContact N-O 3.39Å; Q246-E250 PolarHBondContact O-N 3.09Å; K247-E250 WeakPolarHBondContact O-CB 3.34Å; K247-E250 PolarHBondContact O-N 3.13Å
251	T	96.3	Very high	94.1	Very high	56 Å²	56	73.1 Å²	73.1	34%	0.344	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-110.9	115.7	-163.9	-59.5	0	0	0	0	111.4	G51 A52 F249 W253	G51-T251 WeakPolarHBondContact CA-OG1 3.08Å; A52-T251 HydrophobicContact CB-CG2 4.04Å; F249-T251 PolarHBondContact O-N 3.47Å; F249-T251 PolarHBondContact O-OG1 3.41Å; T251-W253 HydrophobicContact CG2-CD2 3.61Å; T251-W253 HydrophobicContact CG2-CE3 3.98Å; T251-W253 HydrophobicContact CG2-CG 4.16Å; T251-W253 HydrophobicContact CG2-CH2 3.92Å; T251-W253 HydrophobicContact CG2-CZ2 3.54Å; T251-W253 HydrophobicContact CG2-CZ3 4.12Å
252	D	96	Very high	94.4	Very high	71 Å²	71	76.7 Å²	76.7	38%	0.38	36%	0.358	S	S	.	.			trans	-102.5	100	166.6	175.9	19.7	0	0	0	110.2	G49 A52 Q254 A255	G49-D252 PolarHBondContact O-N 3.38Å; A52-D252 WeakPolarHBondContact CB-O 3.25Å; D252-Q254 PolarHBondContact O-N 3.12Å; D252-Q254 VanDerWaalsContact OD1-CB 3.29Å; D252-Q254 WeakPolarHBondContact OD1-CB 3.06Å; D252-Q254 PolarHBondContact OD1-N 3.24Å; D252-A255 VanDerWaalsContact O-CB 3.26Å; D252-A255 WeakPolarHBondContact O-CB 3.47Å; D252-A255 PolarHBondContact O-N 2.91Å; D252-A255 VanDerWaalsContact O-N 3.13Å
253	W	96.7	Very high	94.6	Very high	152 Å²	152	73.6 Å²	73.6	58%	0.576	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-64.9	-20.1	178.7	-61.7	110.2	0	0	0	113.6	A52 V55 T251 A255 L256	A52-W253 HydrophobicContact CB-CE3 4.23Å; V55-W253 HydrophobicContact CG2-CH2 4.43Å; V55-W253 HydrophobicContact CG2-CZ3 4.32Å; T251-W253 HydrophobicContact CG2-CD2 3.61Å; T251-W253 HydrophobicContact CG2-CE3 3.98Å; T251-W253 HydrophobicContact CG2-CG 4.16Å; T251-W253 HydrophobicContact CG2-CH2 3.92Å; T251-W253 HydrophobicContact CG2-CZ2 3.54Å; T251-W253 HydrophobicContact CG2-CZ3 4.12Å; W253-A255 PolarHBondContact O-N 3.42Å; W253-L256 HydrophobicContact CE3-CD1 3.91Å; W253-L256 HydrophobicContact CZ3-CD1 4.27Å; W253-L256 PolarHBondContact O-N 2.94Å
254	Q	97.3	Very high	94.8	Very high	124 Å²	124	70.9 Å²	70.9	58%	0.579	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-68	-21.7	176.3	-62.6	-62.4	-30.6	0	0	111.9	D252 L256 Y257	D252-Q254 PolarHBondContact O-N 3.12Å; D252-Q254 VanDerWaalsContact OD1-CB 3.29Å; D252-Q254 WeakPolarHBondContact OD1-CB 3.06Å; D252-Q254 PolarHBondContact OD1-N 3.24Å; Q254-L256 PolarHBondContact O-N 2.9Å; Q254-Y257 PolarHBondContact O-N 3.35Å; Q254-Y257 VanDerWaalsContact O-N 3.15Å
255	A	96	Very high	95.2	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-60.8	-29.5	174.9	0	0	0	0	0	112.8	N48 D252 W253 Y257 K258 T261	N48-A255 WeakPolarHBondContact O-CB 3.3Å; D252-A255 VanDerWaalsContact O-CB 3.26Å; D252-A255 WeakPolarHBondContact O-CB 3.47Å; D252-A255 PolarHBondContact O-N 2.91Å; D252-A255 VanDerWaalsContact O-N 3.13Å; W253-A255 PolarHBondContact O-N 3.42Å; A255-Y257 PolarHBondContact O-N 2.92Å; A255-K258 VanDerWaalsContact O-CB 3.32Å; A255-K258 WeakPolarHBondContact O-CB 3.37Å; A255-K258 PolarHBondContact O-N 2.94Å; A255-T261 HydrophobicContact CB-CG2 4.44Å; A255-T261 WeakPolarHBondContact O-CB 3.38Å; A255-T261 PolarHBondContact O-OG1 3.16Å
256	L	96.8	Very high	95.3	Very high	46 Å²	46	70.5 Å²	70.5	24%	0.241	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-66.6	-18.7	177.9	-66.5	-179.1	0	0	0	113.9	A52 A56 W253 Q254 K258 W262	A52-L256 HydrophobicContact CB-CD2 4.33Å; A52-L256 HydrophobicContact CB-CG 4.12Å; A52-L256 WeakPolarHBondContact O-CD2 3.11Å; A56-L256 HydrophobicContact CB-CD2 4.06Å; W253-L256 HydrophobicContact CE3-CD1 3.91Å; W253-L256 HydrophobicContact CZ3-CD1 4.27Å; W253-L256 PolarHBondContact O-N 2.94Å; Q254-L256 PolarHBondContact O-N 2.9Å; L256-K258 VanDerWaalsContact C-N 3.29Å; L256-W262 HydrophobicContact CD2-CZ2 4.2Å; L256-W262 PolarHBondContact O-NE1 3.26Å
257	Y	97.4	Very high	95.5	Very high	191 Å²	191	64.4 Å²	64.4	75%	0.749	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-80.3	-11.6	172.4	-65.6	-78.3	0	0	0	112.7	Q254 A255	Q254-Y257 PolarHBondContact O-N 3.35Å; Q254-Y257 VanDerWaalsContact O-N 3.15Å; A255-Y257 PolarHBondContact O-N 2.92Å
258	K	95.9	Very high	95.8	Very high	106 Å²	106	62 Å²	62	46%	0.461	28%	0.282	S	S	.	.			trans	-85.4	128.2	179.4	-58.9	176.7	-176.1	169.6	0	110.2	A255 L256 E260 T261	A255-K258 VanDerWaalsContact O-CB 3.32Å; A255-K258 WeakPolarHBondContact O-CB 3.37Å; A255-K258 PolarHBondContact O-N 2.94Å; L256-K258 VanDerWaalsContact C-N 3.29Å; K258-E260 VanDerWaalsContact C-N 3.26Å; K258-E260 PolarHBondContact O-N 2.97Å; K258-T261 PolarHBondContact O-N 3.41Å
259	M	95	Very high	96	Very high	91 Å²	91	62 Å²	62	45%	0.448	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-35.8	175.8	-178.2	166.9	156.1	0	0	112.5	T261 W262 M263 F490 V494	M259-T261 PolarHBondContact O-N 3.46Å; M259-W262 PolarHBondContact O-N 3.47Å; M259-M263 PolarHBondContact O-N 2.95Å; M259-F490 HydrophobicContact CE-CD2 4.1Å; M259-F490 HydrophobicContact CE-CE2 3.55Å; M259-F490 HydrophobicContact CE-CZ 4.35Å; M259-F490 HydrophobicContact CG-CE2 3.51Å; M259-F490 HydrophobicContact CG-CZ 3.57Å; M259-F490 HydrophobicContact SD-CE2 3.94Å; M259-V494 HydrophobicContact CE-CB 4.07Å; M259-V494 HydrophobicContact CE-CG1 4.23Å; M259-V494 HydrophobicContact CE-CG2 3.11Å; M259-V494 HydrophobicContact CG-CG2 4.24Å; M259-V494 HydrophobicContact SD-CG2 4.46Å
260	E	93.1	Very high	96.2	Very high	95 Å²	95	57.7 Å²	57.7	44%	0.444	26%	0.263	S	S	.	.	H	α-helix	trans	-61.1	-41.8	178.3	-175.4	174	-172.7	0	0	112.3	K258 W262 M263 C264 M498	K258-E260 VanDerWaalsContact C-N 3.26Å; K258-E260 PolarHBondContact O-N 2.97Å; E260-W262 VanDerWaalsContact C-N 3.32Å; E260-W262 PolarHBondContact O-N 2.9Å; E260-M263 HydrophobicContact CG-CE 4.26Å; E260-M263 PolarHBondContact O-N 2.67Å; E260-M263 VanDerWaalsContact O-N 3.16Å; E260-C264 WeakPolarHBondContact O-CB 3.32Å; E260-C264 PolarHBondContact O-N 3.42Å; E260-C264 PolarHBondContact O-SG 3.22Å; E260-C264 VanDerWaalsContact O-SG 3.37Å; E260-M498 HydrophobicContact CG-CE 4.27Å; E260-M498 WeakPolarHBondContact OE1-CE 3.29Å
261	T	96.4	Very high	96.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.7	-43.7	177.6	-63.4	0	0	0	0	111.8	N48 F53 A255 K258 M259 A265	N48-T261 HydrophobicContact CB-CG2 4.05Å; N48-T261 WeakPolarHBondContact OD1-CA 3.38Å; N48-T261 PolarHBondContact OD1-OG1 3.4Å; F53-T261 HydrophobicContact CD2-CG2 4.26Å; A255-T261 HydrophobicContact CB-CG2 4.44Å; A255-T261 WeakPolarHBondContact O-CB 3.38Å; A255-T261 PolarHBondContact O-OG1 3.16Å; K258-T261 PolarHBondContact O-N 3.41Å; M259-T261 PolarHBondContact O-N 3.46Å; T261-A265 WeakPolarHBondContact O-CB 3.14Å; T261-A265 PolarHBondContact O-N 2.91Å
262	W	97.5	Very high	96	Very high	76 Å²	76	51.1 Å²	51.1	29%	0.288	23%	0.227	S	C	.	.	H	α-helix	trans	-69.9	-39.9	175.5	-73.7	98.8	0	0	0	112.7	A56 I59 L256 M259 E260 A265 L266	A56-W262 HydrophobicContact CB-CD2 4.3Å; A56-W262 HydrophobicContact CB-CE3 3.99Å; A56-W262 HydrophobicContact CB-CH2 4.08Å; A56-W262 HydrophobicContact CB-CZ2 4.37Å; A56-W262 HydrophobicContact CB-CZ3 3.88Å; I59-W262 HydrophobicContact CB-CZ3 4.45Å; I59-W262 HydrophobicContact CD1-CH2 4.08Å; I59-W262 HydrophobicContact CG2-CH2 4.39Å; I59-W262 HydrophobicContact CG2-CZ3 4.21Å; L256-W262 HydrophobicContact CD2-CZ2 4.2Å; L256-W262 PolarHBondContact O-NE1 3.26Å; M259-W262 PolarHBondContact O-N 3.47Å; E260-W262 VanDerWaalsContact C-N 3.32Å; E260-W262 PolarHBondContact O-N 2.9Å; W262-A265 PolarHBondContact O-N 3.35Å; W262-L266 VanDerWaalsContact O-CB 3.28Å; W262-L266 WeakPolarHBondContact O-CB 3.26Å; W262-L266 WeakPolarHBondContact O-CD1 3.03Å; W262-L266 WeakPolarHBondContact O-CG 3.24Å; W262-L266 PolarHBondContact O-N 2.98Å
263	M	96.2	Very high	96	Very high	7 Å²	7	47.8 Å²	47.8	3%	0.034	21%	0.209	C	C	.	.	H	α-helix	trans	-60.4	-46.6	175.4	178.5	-79.9	-60.9	0	0	111.7	M259 E260 S267 F490 I491 V494 K495 M498	M259-M263 PolarHBondContact O-N 2.95Å; E260-M263 HydrophobicContact CG-CE 4.26Å; E260-M263 PolarHBondContact O-N 2.67Å; E260-M263 VanDerWaalsContact O-N 3.16Å; M263-S267 VanDerWaalsContact O-CB 3.26Å; M263-S267 WeakPolarHBondContact O-CB 3.39Å; M263-S267 PolarHBondContact O-N 3.34Å; M263-S267 PolarHBondContact O-OG 2.85Å; M263-F490 HydrophobicContact CB-CE1 3.91Å; M263-F490 HydrophobicContact CB-CZ 4.28Å; M263-I491 HydrophobicContact CG-CG2 4.31Å; M263-V494 HydrophobicContact CB-CB 4.29Å; M263-V494 HydrophobicContact CB-CG1 4.06Å; M263-V494 HydrophobicContact CB-CG2 4.22Å; M263-V494 HydrophobicContact CE-CG1 4.28Å; M263-V494 HydrophobicContact CG-CB 3.82Å; M263-V494 HydrophobicContact CG-CG1 3.88Å; M263-V494 HydrophobicContact CG-CG2 4.15Å; M263-K495 HydrophobicContact SD-CD 4.44Å; M263-K495 HydrophobicContact SD-CG 3.87Å; M263-M498 HydrophobicContact CE-CE 4.41Å; M263-M498 HydrophobicContact CE-SD 3.56Å; M263-M498 VanDerWaalsContact CE-SD 3.56Å
264	C	96.4	Very high	95.9	Very high	15 Å²	15	40.7 Å²	40.7	10%	0.101	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-45.4	175.8	-70.4	0	0	0	0	111.2	F53 E260 S267 Q268	F53-C264 HydrophobicContact CE2-CB 3.77Å; E260-C264 WeakPolarHBondContact O-CB 3.32Å; E260-C264 PolarHBondContact O-N 3.42Å; E260-C264 PolarHBondContact O-SG 3.22Å; E260-C264 VanDerWaalsContact O-SG 3.37Å; C264-S267 PolarHBondContact O-OG 2.85Å; C264-Q268 WeakPolarHBondContact O-CB 3.28Å; C264-Q268 PolarHBondContact O-N 2.87Å
265	A	97.7	Very high	95.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-45.5	179.5	0	0	0	0	0	112.2	F53 A56 T261 W262 S269	F53-A265 HydrophobicContact CD2-CB 4.23Å; F53-A265 HydrophobicContact CE2-CB 3.8Å; F53-A265 HydrophobicContact CZ-CB 4.3Å; A56-A265 HydrophobicContact CB-CB 3.81Å; T261-A265 WeakPolarHBondContact O-CB 3.14Å; T261-A265 PolarHBondContact O-N 2.91Å; W262-A265 PolarHBondContact O-N 3.35Å; A265-S269 VanDerWaalsContact O-CB 3.31Å; A265-S269 WeakPolarHBondContact O-CB 3.42Å; A265-S269 PolarHBondContact O-N 3.28Å; A265-S269 PolarHBondContact O-OG 3.26Å
266	L	97.4	Very high	95.5	Very high	19 Å²	19	34.8 Å²	34.8	10%	0.099	16%	0.155	C	C	.	.	H	α-helix	trans	-65.6	-49	178.6	-71.7	160	0	0	0	111.1	S60 W262 S269 L270 V487 F490 I491	S60-L266 VanDerWaalsContact OG-CD2 3.29Å; S60-L266 WeakPolarHBondContact OG-CD2 3.42Å; W262-L266 VanDerWaalsContact O-CB 3.28Å; W262-L266 WeakPolarHBondContact O-CB 3.26Å; W262-L266 WeakPolarHBondContact O-CD1 3.03Å; W262-L266 WeakPolarHBondContact O-CG 3.24Å; W262-L266 PolarHBondContact O-N 2.98Å; L266-S269 PolarHBondContact O-N 2.87Å; L266-S269 PolarHBondContact O-OG 3.46Å; L266-L270 WeakPolarHBondContact O-CB 3.43Å; L266-L270 WeakPolarHBondContact O-CG 3.31Å; L266-L270 PolarHBondContact O-N 3.02Å; L266-V487 HydrophobicContact CB-CG1 4.35Å; L266-V487 HydrophobicContact CD1-CG1 4.24Å; L266-V487 HydrophobicContact CD2-CG1 3.72Å; L266-V487 HydrophobicContact CG-CG1 4.33Å; L266-F490 HydrophobicContact CD1-CD1 3.99Å; L266-F490 HydrophobicContact CD1-CE1 3.89Å; L266-I491 HydrophobicContact CB-CD1 3.85Å; L266-I491 HydrophobicContact CB-CG1 4.17Å
267	S	95.8	Very high	95.4	Very high	8 Å²	8	32.8 Å²	32.8	6%	0.056	14%	0.144	C	C	.	.	H	α-helix	trans	-63.3	-44.9	179.5	58.7	0	0	0	0	112.1	M263 C264 S269 Y271	M263-S267 VanDerWaalsContact O-CB 3.26Å; M263-S267 WeakPolarHBondContact O-CB 3.39Å; M263-S267 PolarHBondContact O-N 3.34Å; M263-S267 PolarHBondContact O-OG 2.85Å; C264-S267 PolarHBondContact O-OG 2.85Å; S267-S269 PolarHBondContact O-N 3.43Å; S267-Y271 VanDerWaalsContact O-CB 3.24Å; S267-Y271 WeakPolarHBondContact O-CB 3.34Å; S267-Y271 PolarHBondContact O-N 3.11Å
268	Q	95.9	Very high	95.4	Very high	13 Å²	13	23.7 Å²	23.7	6%	0.061	11%	0.109	C	C	.	.	H	α-helix	trans	-67.7	-37.2	-179.1	-172.4	58.3	34.1	0	0	112.9	T36 S37 L41 M44 Y57 C264 G272	T36-Q268 PolarHBondContact O-NE2 3.13Å; S37-Q268 VanDerWaalsContact CA-NE2 3.34Å; L41-Q268 HydrophobicContact CD2-CG 3.7Å; L41-Q268 HydrophobicContact CG-CG 4.39Å; M44-Q268 HydrophobicContact CE-CB 4.16Å; M44-Q268 HydrophobicContact CE-CG 4.37Å; M44-Q268 HydrophobicContact SD-CB 3.68Å; M44-Q268 HydrophobicContact SD-CG 3.6Å; M44-Q268 VanDerWaalsContact SD-CG 3.6Å; Y57-Q268 HydrophobicContact CD2-CB 4.5Å; Y57-Q268 HydrophobicContact CE2-CB 4.27Å; Y57-Q268 HydrophobicContact CE2-CG 4.02Å; C264-Q268 WeakPolarHBondContact O-CB 3.28Å; C264-Q268 PolarHBondContact O-N 2.87Å; Q268-G272 VanDerWaalsContact O-CA 3.27Å; Q268-G272 WeakPolarHBondContact O-CA 3.42Å; Q268-G272 PolarHBondContact O-N 3.46Å
269	S	96.4	Very high	95.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-71.6	-42.5	177.6	52.1	0	0	0	0	112.2	S60 A265 L266 S267 T273	S60-S269 VanDerWaalsContact CB-OG 3.22Å; S60-S269 WeakPolarHBondContact CB-OG 3.3Å; S60-S269 PolarHBondContact OG-OG 3.13Å; A265-S269 VanDerWaalsContact O-CB 3.31Å; A265-S269 WeakPolarHBondContact O-CB 3.42Å; A265-S269 PolarHBondContact O-N 3.28Å; A265-S269 PolarHBondContact O-OG 3.26Å; L266-S269 PolarHBondContact O-N 2.87Å; L266-S269 PolarHBondContact O-OG 3.46Å; S267-S269 PolarHBondContact O-N 3.43Å; S269-T273 WeakPolarHBondContact O-CB 3.29Å; S269-T273 VanDerWaalsContact O-CG2 3.3Å; S269-T273 WeakPolarHBondContact O-CG2 3.37Å; S269-T273 PolarHBondContact O-N 3.03Å; S269-T273 PolarHBondContact O-OG1 3.23Å
270	L	96.5	Very high	95.6	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.4	-51.8	175.2	-68.3	171.8	0	0	0	111	C64 L68 L266 T273 G274 L275 W438 L441 V487 I491	C64-L270 HydrophobicContact CB-CD2 4.31Å; L68-L270 HydrophobicContact CD1-CD2 3.68Å; L266-L270 WeakPolarHBondContact O-CB 3.43Å; L266-L270 WeakPolarHBondContact O-CG 3.31Å; L266-L270 PolarHBondContact O-N 3.02Å; L270-T273 PolarHBondContact O-N 2.95Å; L270-T273 PolarHBondContact O-OG1 3.38Å; L270-G274 PolarHBondContact O-N 2.97Å; L270-L275 HydrophobicContact CB-CB 4.47Å; L270-L275 HydrophobicContact CD2-CB 4.4Å; L270-L275 HydrophobicContact CD2-CD1 3.54Å; L270-L275 WeakPolarHBondContact O-CB 3.43Å; L270-L275 PolarHBondContact O-N 3.47Å; L270-W438 HydrophobicContact CB-CZ3 4.07Å; L270-W438 HydrophobicContact CD1-CZ3 3.92Å; L270-L441 HydrophobicContact CD1-CD2 4.05Å; L270-L441 HydrophobicContact CD2-CD2 4.3Å; L270-V487 HydrophobicContact CD1-CG1 4.12Å; L270-I491 HydrophobicContact CD1-CD1 3.75Å
271	Y	92.2	Very high	95.9	Very high	59 Å²	59	9.8 Å²	9.8	23%	0.231	4%	0.044	C	C	.	.	H	α-helix	trans	-67.9	-39	-179.5	-162.5	-109.1	0	0	0	112.1	T36 S267 T273 G274 F277	T36-Y271 HydrophobicContact CG2-CE1 4.05Å; S267-Y271 VanDerWaalsContact O-CB 3.24Å; S267-Y271 WeakPolarHBondContact O-CB 3.34Å; S267-Y271 PolarHBondContact O-N 3.11Å; Y271-T273 PolarHBondContact O-N 3.48Å; Y271-G274 PolarHBondContact O-N 3.44Å; Y271-G274 VanDerWaalsContact O-N 3.07Å; Y271-F277 HydrophobicContact CD2-CE2 4.37Å; Y271-F277 AromaticContact CE2-CE2 3.91Å; Y271-F277 HydrophobicContact CE2-CE2 3.91Å; Y271-F277 AromaticContact CE2-CZ 3.67Å; Y271-F277 HydrophobicContact CE2-CZ 3.67Å
272	G	94.2	Very high	95.9	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-65	-37.3	178.9	0	0	0	0	0	113.6	S34 S37 Q268 G274 H304	S34-G272 VanDerWaalsContact CB-O 3.26Å; S34-G272 WeakPolarHBondContact CB-O 3.5Å; S37-G272 WeakPolarHBondContact OG-CA 3.49Å; Q268-G272 VanDerWaalsContact O-CA 3.27Å; Q268-G272 WeakPolarHBondContact O-CA 3.42Å; Q268-G272 PolarHBondContact O-N 3.46Å; G272-G274 PolarHBondContact O-N 2.89Å; G272-H304 PolarHBondContact O-CE1 3.42Å; G272-H304 PolarHBondContact O-ND1 3.37Å
273	T	96.2	Very high	95.9	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.006	3%	0.031	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-4.9	173.3	52.6	0	0	0	0	113.2	L61 C65 S269 L270 Y271 L275 Y280 H304	L61-T273 HydrophobicContact CD2-CG2 3.58Å; C65-T273 HydrophobicContact CB-CG2 4.13Å; S269-T273 WeakPolarHBondContact O-CB 3.29Å; S269-T273 VanDerWaalsContact O-CG2 3.3Å; S269-T273 WeakPolarHBondContact O-CG2 3.37Å; S269-T273 PolarHBondContact O-N 3.03Å; S269-T273 PolarHBondContact O-OG1 3.23Å; L270-T273 PolarHBondContact O-N 2.95Å; L270-T273 PolarHBondContact O-OG1 3.38Å; Y271-T273 PolarHBondContact O-N 3.48Å; T273-L275 VanDerWaalsContact C-N 3.35Å; T273-L275 WeakPolarHBondContact OG1-CD1 3.4Å; T273-Y280 WeakPolarHBondContact O-CE2 3.36Å; T273-Y280 PolarHBondContact O-OH 2.89Å; T273-H304 HydrophobicContact CG2-CB 4.41Å; T273-H304 WeakPolarHBondContact CG2-CD2 3.26Å
274	G	92.9	Very high	96	Very high	3 Å²	3	5.9 Å²	5.9	3%	0.031	3%	0.029	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	17.5	-177.5	0	0	0	0	0	114.2	Y31 L270 Y271 G272	Y31-G274 PolarHBondContact OH-O 2.96Å; L270-G274 PolarHBondContact O-N 2.97Å; Y271-G274 PolarHBondContact O-N 3.44Å; Y271-G274 VanDerWaalsContact O-N 3.07Å; G272-G274 PolarHBondContact O-N 2.89Å
275	L	93	Very high	95.9	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	156.3	165.5	-68.6	163.5	0	0	0	109	C65 L68 V69 L270 T273 Y280	C65-L275 HydrophobicContact CB-CD1 3.98Å; L68-L275 HydrophobicContact CB-CD1 3.89Å; L68-L275 HydrophobicContact CB-CD2 3.82Å; L68-L275 HydrophobicContact CD1-CD1 4.34Å; V69-L275 HydrophobicContact CG2-CD1 4.07Å; V69-L275 HydrophobicContact CG2-CD2 3.76Å; V69-L275 HydrophobicContact CG2-CG 3.98Å; L270-L275 HydrophobicContact CB-CB 4.47Å; L270-L275 HydrophobicContact CD2-CB 4.4Å; L270-L275 HydrophobicContact CD2-CD1 3.54Å; L270-L275 WeakPolarHBondContact O-CB 3.43Å; L270-L275 PolarHBondContact O-N 3.47Å; T273-L275 VanDerWaalsContact C-N 3.35Å; T273-L275 WeakPolarHBondContact OG1-CD1 3.4Å; L275-Y280 HydrophobicContact CD2-CD2 4.22Å; L275-Y280 HydrophobicContact CD2-CE2 4.35Å
276	C	92.7	Very high	95.7	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.5	10.5	-176.9	-44.9	0	0	0	0	117	Y101 L104 P437	Y101-C276 WeakPolarHBondContact CD1-O 3.31Å; Y101-C276 VanDerWaalsContact CE1-C 3.47Å; Y101-C276 WeakPolarHBondContact CE1-O 3.38Å; L104-C276 WeakPolarHBondContact CD2-O 3.36Å; C276-P437 HydrophobicContact CB-CB 3.51Å
277	F	95.2	Very high	95.5	Very high	3 Å²	3	4.9 Å²	4.9	1%	0.013	2%	0.023	C	C	.	.	S	Bend	trans	-116.9	-7.3	173.6	-62.7	-81.6	0	0	0	113.7	Y31 Y101 L104 T108 Y271 A279 F372 L376 N379	Y31-F277 WeakPolarHBondContact OH-CD2 3.37Å; Y101-F277 WeakPolarHBondContact CB-O 3.47Å; L104-F277 HydrophobicContact CD2-CD1 4.2Å; L104-F277 HydrophobicContact CD2-CE1 4.28Å; L104-F277 HydrophobicContact CG-CD1 4.23Å; L104-F277 HydrophobicContact CG-CE1 4.19Å; T108-F277 HydrophobicContact CG2-CE1 3.96Å; T108-F277 HydrophobicContact CG2-CZ 4.25Å; Y271-F277 HydrophobicContact CD2-CE2 4.37Å; Y271-F277 AromaticContact CE2-CE2 3.91Å; Y271-F277 HydrophobicContact CE2-CE2 3.91Å; Y271-F277 AromaticContact CE2-CZ 3.67Å; Y271-F277 HydrophobicContact CE2-CZ 3.67Å; F277-A279 HydrophobicContact CB-CB 4.15Å; F277-A279 PolarHBondContact O-N 3.41Å; F277-F372 HydrophobicContact CE1-CZ 4.45Å; F277-F372 HydrophobicContact CE2-CE2 4.32Å; F277-F372 AromaticContact CE2-CZ 3.94Å; F277-F372 HydrophobicContact CE2-CZ 3.94Å; F277-F372 AromaticContact CZ-CZ 3.88Å; F277-F372 HydrophobicContact CZ-CZ 3.88Å; F277-L376 HydrophobicContact CB-CD2 4.21Å; F277-L376 HydrophobicContact CD1-CD2 3.87Å; F277-L376 HydrophobicContact CE1-CD2 4.41Å; F277-L376 HydrophobicContact CG-CD2 3.98Å; F277-N379 PolarHBondContact O-ND2 3.18Å
278	G	96	Very high	95.2	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	4%	0.043	C	C	.	.	S	Bend	trans	63.3	13.8	-168.3	0	0	0	0	0	113.1	E72 P83 Y280 I281 T282 N379	E72-G278 WeakPolarHBondContact OE2-CA 3.17Å; P83-G278 WeakPolarHBondContact CG-O 3.23Å; G278-Y280 VanDerWaalsContact C-N 3.31Å; G278-Y280 PolarHBondContact O-N 2.87Å; G278-I281 WeakPolarHBondContact O-CB 3.34Å; G278-I281 PolarHBondContact O-N 3.34Å; G278-T282 PolarHBondContact O-N 2.96Å; G278-N379 PolarHBondContact O-OD1 3.33Å
279	A	97.9	Very high	94.8	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-66.7	-33.9	-175.7	0	0	0	0	0	111.5	Y31 F277 I281 T282 L283 V375	Y31-A279 HydrophobicContact CE1-CB 3.9Å; Y31-A279 HydrophobicContact CE2-CB 4.29Å; Y31-A279 VanDerWaalsContact OH-CB 3.31Å; Y31-A279 WeakPolarHBondContact OH-CB 3.49Å; F277-A279 HydrophobicContact CB-CB 4.15Å; F277-A279 PolarHBondContact O-N 3.41Å; A279-I281 VanDerWaalsContact C-N 3.32Å; A279-I281 PolarHBondContact O-N 3.39Å; A279-T282 WeakPolarHBondContact O-CB 2.93Å; A279-T282 PolarHBondContact O-N 2.85Å; A279-L283 WeakPolarHBondContact O-CG 3.33Å; A279-L283 PolarHBondContact O-N 2.98Å; A279-V375 HydrophobicContact CB-CG1 3.88Å
280	Y	98.5	Very high	94.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-70.3	-30.3	176.3	-69.3	-70.9	0	0	0	111.9	Y31 V32 V69 E72 L73 T273 L275 G278 T282 L283 G284 I300	Y31-Y280 HydrophobicContact CD1-CE1 4.14Å; Y31-Y280 HydrophobicContact CD1-CE2 4.3Å; Y31-Y280 AromaticContact CD1-CZ 3.84Å; Y31-Y280 HydrophobicContact CE1-CD2 4.46Å; Y31-Y280 HydrophobicContact CE1-CE1 4.48Å; Y31-Y280 AromaticContact CE1-CE2 3.92Å; Y31-Y280 HydrophobicContact CE1-CE2 3.92Å; Y31-Y280 AromaticContact CE1-CZ 3.95Å; V32-Y280 WeakPolarHBondContact CG1-OH 3.45Å; V69-Y280 HydrophobicContact CG1-CD1 4.07Å; V69-Y280 HydrophobicContact CG1-CD2 4.41Å; V69-Y280 HydrophobicContact CG1-CE1 3.99Å; V69-Y280 HydrophobicContact CG1-CE2 4.34Å; V69-Y280 HydrophobicContact CG1-CG 4.27Å; V69-Y280 HydrophobicContact CG2-CD2 4.22Å; V69-Y280 HydrophobicContact CG2-CE2 3.79Å; E72-Y280 WeakPolarHBondContact OE2-CB 3.36Å; E72-Y280 PolarHBondContact OE2-N 3.46Å; L73-Y280 HydrophobicContact CD2-CD1 4.04Å; L73-Y280 WeakPolarHBondContact CD2-O 3.26Å; L73-Y280 HydrophobicContact CG-CD1 4.25Å; T273-Y280 WeakPolarHBondContact O-CE2 3.36Å; T273-Y280 PolarHBondContact O-OH 2.89Å; L275-Y280 HydrophobicContact CD2-CD2 4.22Å; L275-Y280 HydrophobicContact CD2-CE2 4.35Å; G278-Y280 VanDerWaalsContact C-N 3.31Å; G278-Y280 PolarHBondContact O-N 2.87Å; Y280-T282 VanDerWaalsContact C-N 3.32Å; Y280-T282 PolarHBondContact O-N 3.26Å; Y280-L283 HydrophobicContact CD1-CD1 4.4Å; Y280-L283 PolarHBondContact O-N 3.1Å; Y280-G284 PolarHBondContact O-N 3.33Å; Y280-I300 HydrophobicContact CE1-CG2 4.25Å
281	I	98.2	Very high	94.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-59.2	-47.4	169.6	-55.9	173.9	0	0	0	109.5	E72 V75 G76 P83 G278 A279 S285	E72-I281 HydrophobicContact CB-CG1 3.84Å; E72-I281 HydrophobicContact CG-CD1 4.41Å; E72-I281 HydrophobicContact CG-CG1 3.93Å; E72-I281 WeakPolarHBondContact O-CA 3.02Å; V75-I281 HydrophobicContact CG1-CD1 4.43Å; V75-I281 HydrophobicContact CG1-CG1 4.47Å; V75-I281 HydrophobicContact CG1-CG2 4.17Å; G76-I281 WeakPolarHBondContact CA-O 3.28Å; P83-I281 HydrophobicContact CB-CD1 4.43Å; P83-I281 HydrophobicContact CG-CB 4.23Å; P83-I281 HydrophobicContact CG-CG2 4.4Å; G278-I281 WeakPolarHBondContact O-CB 3.34Å; G278-I281 PolarHBondContact O-N 3.34Å; A279-I281 VanDerWaalsContact C-N 3.32Å; A279-I281 PolarHBondContact O-N 3.39Å; I281-S285 WeakPolarHBondContact O-CB 3.46Å; I281-S285 PolarHBondContact O-N 3.5Å
282	T	97.7	Very high	94.4	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.006	7%	0.073	C	C	.	.	H	α-helix	trans	-62	-49.7	176	-68.2	0	0	0	0	112	P83 G278 A279 Y280 G284 S285 F286 L378 N379 T382	P83-T282 WeakPolarHBondContact CD-OG1 3.39Å; G278-T282 PolarHBondContact O-N 2.96Å; A279-T282 WeakPolarHBondContact O-CB 2.93Å; A279-T282 PolarHBondContact O-N 2.85Å; Y280-T282 VanDerWaalsContact C-N 3.32Å; Y280-T282 PolarHBondContact O-N 3.26Å; T282-G284 VanDerWaalsContact C-N 3.34Å; T282-G284 PolarHBondContact O-N 3.48Å; T282-S285 WeakPolarHBondContact O-CB 3.26Å; T282-S285 PolarHBondContact O-N 3.38Å; T282-S285 PolarHBondContact O-OG 3Å; T282-F286 HydrophobicContact CG2-CE2 3.79Å; T282-F286 WeakPolarHBondContact O-CD2 3.28Å; T282-L378 HydrophobicContact CG2-CD2 4.28Å; T282-L378 HydrophobicContact CG2-CG 3.99Å; T282-N379 WeakPolarHBondContact CB-OD1 3.02Å; T282-N379 PolarHBondContact OG1-OD1 3.1Å; T282-T382 HydrophobicContact CG2-CG2 4.42Å
283	L	97.9	Very high	94.5	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-63	-40.7	-179.3	-65.7	177.7	0	0	0	112.3	W18 F24 V27 A279 Y280 S285 F286 V375 L378	W18-L283 HydrophobicContact CH2-CD2 4.17Å; W18-L283 HydrophobicContact CZ2-CD2 3.86Å; W18-L283 PolarHBondContact NE1-O 3.47Å; W18-L283 VanDerWaalsContact NE1-O 3.14Å; F24-L283 HydrophobicContact CD2-CB 4.47Å; F24-L283 HydrophobicContact CE2-CB 3.99Å; V27-L283 HydrophobicContact CG1-CD1 4.44Å; V27-L283 HydrophobicContact CG1-CD2 3.59Å; A279-L283 WeakPolarHBondContact O-CG 3.33Å; A279-L283 PolarHBondContact O-N 2.98Å; Y280-L283 HydrophobicContact CD1-CD1 4.4Å; Y280-L283 PolarHBondContact O-N 3.1Å; L283-S285 VanDerWaalsContact C-N 3.31Å; L283-S285 PolarHBondContact O-N 3.01Å; L283-F286 PolarHBondContact O-N 3.25Å; L283-V375 HydrophobicContact CD1-CG1 4.07Å; L283-V375 HydrophobicContact CD2-CG1 4.25Å; L283-V375 HydrophobicContact CG-CG1 4.24Å; L283-L378 HydrophobicContact CD2-CD2 4.16Å
284	G	96.3	Very high	94.5	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-67.3	-29.2	176.9	0	0	0	0	0	113.2	Q77 Y280 T282 F286 N287	Q77-G284 VanDerWaalsContact CA-O 3.27Å; Q77-G284 WeakPolarHBondContact CA-O 3.39Å; Q77-G284 PolarHBondContact N-O 2.91Å; Y280-G284 PolarHBondContact O-N 3.33Å; T282-G284 VanDerWaalsContact C-N 3.34Å; T282-G284 PolarHBondContact O-N 3.48Å; G284-F286 PolarHBondContact O-N 3.01Å; G284-N287 VanDerWaalsContact O-CB 3.3Å; G284-N287 WeakPolarHBondContact O-CB 3.4Å; G284-N287 PolarHBondContact O-N 3.5Å
285	S	95	Very high	94.7	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.007	8%	0.077	C	C	.	.	H	α-helix	trans	-62.9	-25.9	178.6	76.9	0	0	0	0	114.3	R15 G76 S81 I281 T282 L283 N287	R15-S285 WeakPolarHBondContact CD-O 3.34Å; R15-S285 VanDerWaalsContact NH1-CB 3.31Å; R15-S285 PolarHBondContact NH1-OG 2.75Å; G76-S285 VanDerWaalsContact O-CA 3.28Å; G76-S285 WeakPolarHBondContact O-CA 3.48Å; S81-S285 WeakPolarHBondContact O-CB 3.4Å; I281-S285 WeakPolarHBondContact O-CB 3.46Å; I281-S285 PolarHBondContact O-N 3.5Å; T282-S285 WeakPolarHBondContact O-CB 3.26Å; T282-S285 PolarHBondContact O-N 3.38Å; T282-S285 PolarHBondContact O-OG 3Å; L283-S285 VanDerWaalsContact C-N 3.31Å; L283-S285 PolarHBondContact O-N 3.01Å; S285-N287 VanDerWaalsContact C-N 3.35Å
286	F	94	Very high	94.9	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.009	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	1.2	178.7	-59	-63.5	0	0	0	112.7	R15 D16 L17 W18 V210 T282 L283 G284 L378 T382	R15-F286 HydrophobicContact CG-CD1 3.51Å; R15-F286 HydrophobicContact CG-CE1 3.77Å; D16-F286 WeakPolarHBondContact O-CD1 2.9Å; L17-F286 WeakPolarHBondContact CA-O 3.29Å; L17-F286 WeakPolarHBondContact CD2-O 3.37Å; W18-F286 VanDerWaalsContact CD1-C 3.4Å; W18-F286 HydrophobicContact CD2-CB 4.31Å; W18-F286 HydrophobicContact CG-CB 4.31Å; W18-F286 HydrophobicContact CZ2-CB 4.23Å; W18-F286 HydrophobicContact CZ2-CD2 4.16Å; W18-F286 PolarHBondContact N-O 2.9Å; W18-F286 VanDerWaalsContact N-O 3.13Å; V210-F286 HydrophobicContact CG1-CD1 4.1Å; V210-F286 HydrophobicContact CG1-CD2 3.74Å; V210-F286 HydrophobicContact CG1-CE1 3.98Å; V210-F286 HydrophobicContact CG1-CE2 3.64Å; V210-F286 HydrophobicContact CG1-CG 3.96Å; V210-F286 HydrophobicContact CG1-CZ 3.74Å; V210-F286 HydrophobicContact CG2-CD1 4.27Å; V210-F286 HydrophobicContact CG2-CG 4.37Å; T282-F286 HydrophobicContact CG2-CE2 3.79Å; T282-F286 WeakPolarHBondContact O-CD2 3.28Å; L283-F286 PolarHBondContact O-N 3.25Å; G284-F286 PolarHBondContact O-N 3.01Å; F286-L378 HydrophobicContact CD2-CD2 4.49Å; F286-L378 HydrophobicContact CE2-CD1 4.07Å; F286-L378 HydrophobicContact CE2-CD2 3.93Å; F286-L378 HydrophobicContact CE2-CG 4.13Å; F286-L378 HydrophobicContact CZ-CD1 4.2Å; F286-T382 HydrophobicContact CE1-CG2 4.34Å; F286-T382 HydrophobicContact CE2-CG2 4.29Å; F286-T382 HydrophobicContact CZ-CG2 3.63Å
287	N	92.4	Very high	95.2	Very high	11 Å²	11	16.9 Å²	16.9	6%	0.059	8%	0.079	C	C	.	.	S	Bend	trans	-77.3	147.2	175.9	-74.9	-20.2	0	0	0	111.6	W18 F24 Q77 G284 S285 N291	W18-N287 PolarHBondContact NE1-OD1 3.39Å; F24-N287 VanDerWaalsContact CD2-OD1 3.23Å; F24-N287 WeakPolarHBondContact CD2-OD1 3.43Å; F24-N287 WeakPolarHBondContact CE2-ND2 3.29Å; F24-N287 WeakPolarHBondContact CG-OD1 3.34Å; F24-N287 WeakPolarHBondContact CZ-ND2 3.37Å; Q77-N287 HydrophobicContact CG-CB 3.95Å; G284-N287 VanDerWaalsContact O-CB 3.3Å; G284-N287 WeakPolarHBondContact O-CB 3.4Å; G284-N287 PolarHBondContact O-N 3.5Å; S285-N287 VanDerWaalsContact C-N 3.35Å; N287-N291 HydrophobicContact CB-CB 4.16Å; N287-N291 PolarHBondContact ND2-ND2 3.36Å
288	R	90.5	Very high	95.3	Very high	124 Å²	124	20 Å²	20	47%	0.468	9%	0.093	S	C	.	.			trans	-57.5	142.5	163.8	-65.6	-178.4	-168.7	-160.1	1.7	109.5	L17 Q77 N290 N291 E589	L17-R288 HydrophobicContact CD1-CG 4.13Å; Q77-R288 PolarHBondContact NE2-O 2.86Å; R288-N290 PolarHBondContact O-N 3.07Å; R288-N290 VanDerWaalsContact O-N 3.17Å; R288-N291 WeakPolarHBondContact O-CB 3.41Å; R288-N291 PolarHBondContact O-N 2.93Å; R288-E589 WeakPolarHBondContact CB-OE1 3.33Å; R288-E589 WeakPolarHBondContact CD-OE1 3.36Å; R288-E589 WeakPolarHBondContact CG-OE1 3.22Å
289	R	87.2	Confident	95.4	Very high	70 Å²	70	23.1 Å²	23.1	26%	0.264	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-28.2	-173.2	-178.2	153.2	142	78.5	-2.5	113.1	Q77 M464 Y591	Q77-R289 PolarHBondContact NE2-O 2.89Å; R289-M464 HydrophobicContact CG-CE 4.47Å; R289-M464 HydrophobicContact CG-CG 4.18Å; R289-M464 WeakPolarHBondContact O-CB 3.35Å; R289-Y591 WeakPolarHBondContact CB-OH 3.11Å
290	N	88.9	Confident	95.5	Very high	74 Å²	74	23.2 Å²	23.2	40%	0.396	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	3.3	174.7	67.4	8.7	0	0	0	115.1	R288 N292 M464	R288-N290 PolarHBondContact O-N 3.07Å; R288-N290 VanDerWaalsContact O-N 3.17Å; N290-N292 PolarHBondContact O-N 3.02Å; N290-M464 WeakPolarHBondContact CA-O 3.44Å
291	N	92.3	Very high	95.5	Very high	16 Å²	16	23.5 Å²	23.5	9%	0.086	11%	0.111	C	C	.	.			trans	-61.9	137.5	-178.5	179.8	50.8	0	0	0	111.1	K21 Q77 N287 R288 L293 D296 I465	K21-N291 WeakPolarHBondContact CD-OD1 3.43Å; K21-N291 VanDerWaalsContact CE-OD1 3.32Å; K21-N291 WeakPolarHBondContact CE-OD1 3.38Å; K21-N291 PolarHBondContact NZ-OD1 3.46Å; Q77-N291 PolarHBondContact NE2-O 3.06Å; N287-N291 HydrophobicContact CB-CB 4.16Å; N287-N291 PolarHBondContact ND2-ND2 3.36Å; R288-N291 WeakPolarHBondContact O-CB 3.41Å; R288-N291 PolarHBondContact O-N 2.93Å; N291-L293 VanDerWaalsContact C-N 3.26Å; N291-L293 PolarHBondContact O-N 3.17Å; N291-D296 PolarHBondContact ND2-OD2 3Å; N291-D296 PolarHBondContact OD1-OD2 3.2Å; N291-I465 WeakPolarHBondContact O-CG2 3.26Å
292	N	95.3	Very high	95.4	Very high	32 Å²	32	28.5 Å²	28.5	17%	0.171	14%	0.138	C	C	.	.			trans	-76.9	72.6	179.7	-179.9	36.3	0	0	0	112.2	N290 V294 G295 D296 F470	N290-N292 PolarHBondContact O-N 3.02Å; N292-V294 PolarHBondContact O-N 2.96Å; N292-G295 PolarHBondContact O-N 2.89Å; N292-D296 PolarHBondContact O-N 2.88Å; N292-F470 VanDerWaalsContact CG-CD2 3.46Å; N292-F470 WeakPolarHBondContact ND2-CD2 3.33Å; N292-F470 WeakPolarHBondContact ND2-CE2 3.18Å; N292-F470 WeakPolarHBondContact OD1-CB 3.32Å; N292-F470 VanDerWaalsContact OD1-CD2 3.27Å; N292-F470 WeakPolarHBondContact OD1-CD2 3.31Å; N292-F470 VanDerWaalsContact OD1-CG 3.28Å; N292-F470 WeakPolarHBondContact OD1-CG 3.27Å
293	L	96	Very high	95.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.7	-30.3	-178.5	69.3	89.6	0	0	0	113.5	M70 L73 A74 Q77 N291 D296 T297 V461	M70-L293 HydrophobicContact CG-CD1 3.63Å; L73-L293 HydrophobicContact CB-CB 4.42Å; A74-L293 HydrophobicContact CB-CD1 4.28Å; A74-L293 HydrophobicContact CB-CD2 4.04Å; Q77-L293 HydrophobicContact CB-CD2 4.45Å; N291-L293 VanDerWaalsContact C-N 3.26Å; N291-L293 PolarHBondContact O-N 3.17Å; L293-D296 PolarHBondContact O-N 3.43Å; L293-T297 PolarHBondContact O-N 3.43Å; L293-T297 PolarHBondContact O-OG1 3.37Å; L293-V461 HydrophobicContact CD1-CG1 4.46Å; L293-V461 HydrophobicContact CD2-CG1 4.22Å; L293-V461 HydrophobicContact CD2-CG2 4.47Å; L293-V461 HydrophobicContact CG-CG1 4.49Å
294	V	97.3	Very high	95.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-51.5	-177.9	-179.9	0	0	0	0	110.4	M70 N292 D296 T297 F298 I465 F470 I473 A474	M70-V294 HydrophobicContact CE-CB 4.43Å; M70-V294 HydrophobicContact CE-CG1 3.79Å; M70-V294 HydrophobicContact SD-CG1 4.32Å; M70-V294 HydrophobicContact SD-CG2 4.16Å; N292-V294 PolarHBondContact O-N 2.96Å; V294-D296 PolarHBondContact O-N 3.47Å; V294-T297 PolarHBondContact O-N 3.28Å; V294-F298 HydrophobicContact CG1-CD2 4.37Å; V294-F298 HydrophobicContact CG1-CE2 4.13Å; V294-F298 VanDerWaalsContact O-CD2 3.26Å; V294-F298 WeakPolarHBondContact O-CD2 3.46Å; V294-F298 PolarHBondContact O-N 2.97Å; V294-I465 HydrophobicContact CG2-CD1 3.88Å; V294-F470 HydrophobicContact CB-CB 3.98Å; V294-F470 HydrophobicContact CB-CD1 4.08Å; V294-F470 HydrophobicContact CB-CG 4.32Å; V294-F470 HydrophobicContact CG1-CB 4.16Å; V294-F470 HydrophobicContact CG1-CD1 3.79Å; V294-F470 HydrophobicContact CG1-CG 4.4Å; V294-F470 HydrophobicContact CG2-CB 4.38Å; V294-I473 HydrophobicContact CG1-CG2 4.2Å; V294-A474 HydrophobicContact CG2-CB 3.79Å
295	G	97	Very high	95.5	Very high	14 Å²	14	31.5 Å²	31.5	14%	0.144	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-35	176.9	0	0	0	0	0	112	N292 F298 L299	N292-G295 PolarHBondContact O-N 2.89Å; G295-F298 PolarHBondContact O-N 2.83Å; G295-L299 PolarHBondContact O-N 2.91Å; G295-L299 VanDerWaalsContact O-N 3.09Å
296	D	97.6	Very high	95.7	Very high	7 Å²	7	35.3 Å²	35.3	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-42.4	177.7	-58.9	-13.7	0	0	0	110.8	K21 F24 I25 N291 N292 L293 V294 F298 L299 I300	K21-D296 WeakPolarHBondContact CE-OD1 3.44Å; K21-D296 WeakPolarHBondContact CE-OD2 3.34Å; K21-D296 VanDerWaalsContact NZ-CG 3.33Å; K21-D296 IonicContact NZ-OD1 2.68Å; K21-D296 PolarHBondContact NZ-OD1 2.8Å; K21-D296 IonicContact NZ-OD2 3.16Å; K21-D296 PolarHBondContact NZ-OD2 3.06Å; K21-D296 VanDerWaalsContact NZ-OD2 3.16Å; F24-D296 HydrophobicContact CE1-CB 3.95Å; I25-D296 HydrophobicContact CD1-CB 3.75Å; N291-D296 PolarHBondContact ND2-OD2 3Å; N291-D296 PolarHBondContact OD1-OD2 3.2Å; N292-D296 PolarHBondContact O-N 2.88Å; L293-D296 PolarHBondContact O-N 3.43Å; V294-D296 PolarHBondContact O-N 3.47Å; D296-F298 PolarHBondContact O-N 3.28Å; D296-L299 PolarHBondContact O-N 3.24Å; D296-I300 WeakPolarHBondContact O-CB 3.41Å; D296-I300 WeakPolarHBondContact O-CD1 3.41Å; D296-I300 WeakPolarHBondContact O-CG1 3.47Å; D296-I300 PolarHBondContact O-N 2.91Å
297	T	98.3	Very high	95.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.5	-47.9	174.6	-58.8	0	0	0	0	112.5	I66 V69 M70 L293 V294 L299 I300 V301	I66-T297 HydrophobicContact CG2-CG2 4.1Å; I66-T297 WeakPolarHBondContact O-CG2 3.18Å; V69-T297 HydrophobicContact CB-CG2 3.8Å; V69-T297 HydrophobicContact CG1-CG2 3.78Å; M70-T297 WeakPolarHBondContact CA-OG1 3.05Å; M70-T297 HydrophobicContact CB-CG2 4.09Å; L293-T297 PolarHBondContact O-N 3.43Å; L293-T297 PolarHBondContact O-OG1 3.37Å; V294-T297 PolarHBondContact O-N 3.28Å; T297-L299 VanDerWaalsContact C-N 3.29Å; T297-L299 PolarHBondContact O-N 2.9Å; T297-I300 PolarHBondContact O-N 2.65Å; T297-V301 HydrophobicContact CG2-CG2 4.47Å; T297-V301 WeakPolarHBondContact O-CG2 3.14Å; T297-V301 PolarHBondContact O-N 3.24Å
298	F	98.1	Very high	96	Very high	68 Å²	68	35.3 Å²	35.3	30%	0.298	18%	0.18	S	C	.	.	H	α-helix	trans	-60.1	-41.9	177.5	-82.2	-79.1	0	0	0	111.7	I66 M70 V294 G295 D296 L302 I473 F477	I66-F298 HydrophobicContact CD1-CD1 3.85Å; I66-F298 HydrophobicContact CD1-CE1 3.75Å; I66-F298 HydrophobicContact CG2-CE1 4.19Å; I66-F298 HydrophobicContact CG2-CE2 4.46Å; I66-F298 HydrophobicContact CG2-CZ 4.12Å; M70-F298 HydrophobicContact CE-CE2 4.3Å; V294-F298 HydrophobicContact CG1-CD2 4.37Å; V294-F298 HydrophobicContact CG1-CE2 4.13Å; V294-F298 VanDerWaalsContact O-CD2 3.26Å; V294-F298 WeakPolarHBondContact O-CD2 3.46Å; V294-F298 PolarHBondContact O-N 2.97Å; G295-F298 PolarHBondContact O-N 2.83Å; D296-F298 PolarHBondContact O-N 3.28Å; F298-L302 WeakPolarHBondContact O-CB 3.48Å; F298-L302 PolarHBondContact O-N 2.84Å; F298-I473 HydrophobicContact CE2-CG2 3.67Å; F298-I473 HydrophobicContact CZ-CG2 3.94Å; F298-F477 HydrophobicContact CE1-CE2 4.48Å; F298-F477 HydrophobicContact CE1-CZ 4.12Å; F298-F477 HydrophobicContact CE2-CE2 4.41Å; F298-F477 HydrophobicContact CZ-CD2 4.36Å; F298-F477 HydrophobicContact CZ-CE1 4.44Å; F298-F477 AromaticContact CZ-CE2 3.6Å; F298-F477 HydrophobicContact CZ-CE2 3.6Å; F298-F477 AromaticContact CZ-CZ 3.65Å; F298-F477 HydrophobicContact CZ-CZ 3.65Å
299	L	98.1	Very high	96.3	Very high	66 Å²	66	32.5 Å²	32.5	35%	0.346	18%	0.178	S	C	.	.	H	α-helix	trans	-65.4	-44.2	178.3	-178.3	61.1	0	0	0	111.8	I25 F29 G295 D296 T297 L302 I303	I25-L299 HydrophobicContact CG2-CD2 4.03Å; F29-L299 HydrophobicContact CE1-CD2 4.32Å; F29-L299 HydrophobicContact CE1-CG 3.95Å; F29-L299 HydrophobicContact CZ-CD1 4.22Å; F29-L299 HydrophobicContact CZ-CD2 3.87Å; F29-L299 HydrophobicContact CZ-CG 3.77Å; G295-L299 PolarHBondContact O-N 2.91Å; G295-L299 VanDerWaalsContact O-N 3.09Å; D296-L299 PolarHBondContact O-N 3.24Å; T297-L299 VanDerWaalsContact C-N 3.29Å; T297-L299 PolarHBondContact O-N 2.9Å; L299-L302 PolarHBondContact O-N 2.95Å; L299-I303 HydrophobicContact CD1-CG1 4.11Å; L299-I303 WeakPolarHBondContact O-CB 3.18Å; L299-I303 VanDerWaalsContact O-CG1 3.29Å; L299-I303 WeakPolarHBondContact O-CG1 3.35Å; L299-I303 PolarHBondContact O-N 3.06Å
300	I	98.3	Very high	96.7	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-60.1	-49.6	178.6	-69.5	163.8	0	0	0	110.6	F24 C28 V32 L73 Y280 D296 T297 I303 H304	F24-I300 HydrophobicContact CZ-CD1 4.48Å; C28-I300 HydrophobicContact CB-CD1 3.6Å; C28-I300 HydrophobicContact CB-CG1 3.66Å; C28-I300 HydrophobicContact CB-CG2 4.49Å; V32-I300 HydrophobicContact CG1-CG2 3.62Å; L73-I300 HydrophobicContact CD1-CD1 4.15Å; Y280-I300 HydrophobicContact CE1-CG2 4.25Å; D296-I300 WeakPolarHBondContact O-CB 3.41Å; D296-I300 WeakPolarHBondContact O-CD1 3.41Å; D296-I300 WeakPolarHBondContact O-CG1 3.47Å; D296-I300 PolarHBondContact O-N 2.91Å; T297-I300 PolarHBondContact O-N 2.65Å; I300-I303 PolarHBondContact O-N 3.1Å; I300-H304 WeakPolarHBondContact O-CB 3.26Å; I300-H304 PolarHBondContact O-N 3.41Å
301	V	98.2	Very high	97.1	Very high	7 Å²	7	27 Å²	27	4%	0.042	15%	0.154	C	C	.	.	H	α-helix	trans	-68.1	-37.4	-179.4	176.4	0	0	0	0	111.7	L61 I66 T297 H304 A305	L61-V301 HydrophobicContact CB-CG1 4.02Å; L61-V301 HydrophobicContact CD2-CG1 4.31Å; I66-V301 HydrophobicContact CD1-CG1 4.41Å; I66-V301 HydrophobicContact CG1-CB 3.98Å; I66-V301 HydrophobicContact CG1-CG1 3.89Å; I66-V301 HydrophobicContact CG1-CG2 3.86Å; T297-V301 HydrophobicContact CG2-CG2 4.47Å; T297-V301 WeakPolarHBondContact O-CG2 3.14Å; T297-V301 PolarHBondContact O-N 3.24Å; V301-H304 WeakPolarHBondContact O-CB 3.47Å; V301-H304 PolarHBondContact O-N 3.08Å; V301-A305 PolarHBondContact O-N 3.45Å
302	L	98.1	Very high	97.3	Very high	105 Å²	105	26.6 Å²	26.6	55%	0.55	15%	0.152	S	C	.	.	H	α-helix	trans	-62.1	-47.9	174.7	176.7	64	0	0	0	111.6	F298 L299 H304 A305 V306	F298-L302 WeakPolarHBondContact O-CB 3.48Å; F298-L302 PolarHBondContact O-N 2.84Å; L299-L302 PolarHBondContact O-N 2.95Å; L302-H304 VanDerWaalsContact C-N 3.32Å; L302-H304 PolarHBondContact O-N 3.5Å; L302-A305 WeakPolarHBondContact O-CB 3.26Å; L302-A305 PolarHBondContact O-N 3.24Å; L302-V306 WeakPolarHBondContact O-CG2 3.23Å; L302-V306 PolarHBondContact O-N 3.44Å
303	I	98	Very high	97.4	Very high	40 Å²	40	26.5 Å²	26.5	21%	0.205	15%	0.152	C	C	.	.	H	α-helix	trans	-64.7	-39.2	179.3	-70.5	-68.9	0	0	0	110.9	F29 L299 I300 A305 V306 L307	F29-I303 HydrophobicContact CB-CG2 4.44Å; F29-I303 HydrophobicContact CD1-CB 4.11Å; F29-I303 HydrophobicContact CD1-CG1 4.28Å; F29-I303 HydrophobicContact CD1-CG2 3.82Å; F29-I303 HydrophobicContact CD2-CG2 4.33Å; F29-I303 HydrophobicContact CE1-CB 3.95Å; F29-I303 HydrophobicContact CE1-CG1 3.68Å; F29-I303 HydrophobicContact CE1-CG2 4.11Å; F29-I303 HydrophobicContact CE2-CG1 4.18Å; F29-I303 HydrophobicContact CG-CG2 3.96Å; F29-I303 HydrophobicContact CZ-CB 4.36Å; F29-I303 HydrophobicContact CZ-CD1 4.36Å; F29-I303 HydrophobicContact CZ-CG1 3.63Å; F29-I303 HydrophobicContact CZ-CG2 4.49Å; L299-I303 HydrophobicContact CD1-CG1 4.11Å; L299-I303 WeakPolarHBondContact O-CB 3.18Å; L299-I303 VanDerWaalsContact O-CG1 3.29Å; L299-I303 WeakPolarHBondContact O-CG1 3.35Å; L299-I303 PolarHBondContact O-N 3.06Å; I300-I303 PolarHBondContact O-N 3.1Å; I303-A305 PolarHBondContact O-N 3.44Å; I303-V306 PolarHBondContact O-N 2.91Å; I303-L307 HydrophobicContact CG2-CD1 3.59Å; I303-L307 HydrophobicContact CG2-CG 4.13Å; I303-L307 WeakPolarHBondContact O-CB 3.5Å; I303-L307 VanDerWaalsContact O-CG 3.25Å; I303-L307 WeakPolarHBondContact O-CG 3.37Å; I303-L307 PolarHBondContact O-N 2.75Å
304	H	97.7	Very high	97.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.2	-49.3	171.1	179.8	64.4	0	0	0	111.8	V32 Y57 G272 T273 I300 V301 L302 V306 L307 S308	V32-H304 HydrophobicContact CB-CB 3.86Å; V32-H304 HydrophobicContact CG1-CB 4.45Å; V32-H304 HydrophobicContact CG2-CB 3.97Å; V32-H304 PolarHBondContact O-ND1 3.3Å; Y57-H304 PolarHBondContact OH-NE2 2.84Å; G272-H304 PolarHBondContact O-CE1 3.42Å; G272-H304 PolarHBondContact O-ND1 3.37Å; T273-H304 HydrophobicContact CG2-CB 4.41Å; T273-H304 WeakPolarHBondContact CG2-CD2 3.26Å; I300-H304 WeakPolarHBondContact O-CB 3.26Å; I300-H304 PolarHBondContact O-N 3.41Å; V301-H304 WeakPolarHBondContact O-CB 3.47Å; V301-H304 PolarHBondContact O-N 3.08Å; L302-H304 VanDerWaalsContact C-N 3.32Å; L302-H304 PolarHBondContact O-N 3.5Å; H304-V306 VanDerWaalsContact C-N 3.33Å; H304-V306 PolarHBondContact O-N 3.01Å; H304-L307 PolarHBondContact O-N 3.31Å; H304-S308 PolarHBondContact CE1-OG 3.09Å; H304-S308 VanDerWaalsContact CE1-OG 3.25Å; H304-S308 PolarHBondContact NE2-OG 3.41Å; H304-S308 VanDerWaalsContact O-CB 3.26Å; H304-S308 WeakPolarHBondContact O-CB 3.28Å; H304-S308 PolarHBondContact O-N 3.03Å; H304-S308 PolarHBondContact O-OG 3.15Å; H304-S308 VanDerWaalsContact O-OG 3.1Å
305	A	97.7	Very high	97.3	Very high	23 Å²	23	26.9 Å²	26.9	19%	0.19	16%	0.155	C	C	.	.	H	α-helix	trans	-60.2	-41.8	179	0	0	0	0	0	112.4	L61 V301 L302 I303 C309	L61-A305 HydrophobicContact CD1-CB 3.92Å; V301-A305 PolarHBondContact O-N 3.45Å; L302-A305 WeakPolarHBondContact O-CB 3.26Å; L302-A305 PolarHBondContact O-N 3.24Å; I303-A305 PolarHBondContact O-N 3.44Å; A305-C309 VanDerWaalsContact O-CB 3.28Å; A305-C309 WeakPolarHBondContact O-CB 3.28Å; A305-C309 PolarHBondContact O-N 3.27Å
306	V	97.8	Very high	97.3	Very high	81 Å²	81	26.3 Å²	26.3	49%	0.491	15%	0.149	S	C	.	.	H	α-helix	trans	-64.8	-47.9	177.4	171.8	0	0	0	0	111.3	L302 I303 H304 C309 L310	L302-V306 WeakPolarHBondContact O-CG2 3.23Å; L302-V306 PolarHBondContact O-N 3.44Å; I303-V306 PolarHBondContact O-N 2.91Å; H304-V306 VanDerWaalsContact C-N 3.33Å; H304-V306 PolarHBondContact O-N 3.01Å; V306-C309 PolarHBondContact O-N 3.39Å; V306-L310 WeakPolarHBondContact O-CB 3.3Å; V306-L310 PolarHBondContact O-N 2.82Å
307	L	97.6	Very high	97.2	Very high	9 Å²	9	26 Å²	26	5%	0.047	15%	0.147	C	C	.	.	H	α-helix	trans	-67.1	-38.4	-179.9	-67.4	172.3	0	0	0	112.1	F33 F221 L225 I303 H304 L310 G311	F33-L307 HydrophobicContact CB-CD1 3.87Å; F33-L307 HydrophobicContact CD1-CD1 4.14Å; F33-L307 HydrophobicContact CD1-CD2 4.31Å; F33-L307 HydrophobicContact CD2-CB 4.04Å; F33-L307 HydrophobicContact CD2-CD1 4.09Å; F33-L307 HydrophobicContact CD2-CD2 4.33Å; F33-L307 HydrophobicContact CD2-CG 4.39Å; F33-L307 HydrophobicContact CE1-CD2 4.1Å; F33-L307 HydrophobicContact CE2-CB 4.21Å; F33-L307 HydrophobicContact CE2-CD2 4.1Å; F33-L307 HydrophobicContact CG-CD1 3.79Å; F33-L307 HydrophobicContact CG-CD2 4.44Å; F33-L307 HydrophobicContact CZ-CD2 4Å; F221-L307 HydrophobicContact CE2-CD1 4.17Å; L225-L307 HydrophobicContact CD1-CD2 3.92Å; I303-L307 HydrophobicContact CG2-CD1 3.59Å; I303-L307 HydrophobicContact CG2-CG 4.13Å; I303-L307 WeakPolarHBondContact O-CB 3.5Å; I303-L307 VanDerWaalsContact O-CG 3.25Å; I303-L307 WeakPolarHBondContact O-CG 3.37Å; I303-L307 PolarHBondContact O-N 2.75Å; H304-L307 PolarHBondContact O-N 3.31Å; L307-L310 PolarHBondContact O-N 3.45Å; L307-G311 PolarHBondContact O-N 2.98Å
308	S	96.9	Very high	97.1	Very high	5 Å²	5	26.1 Å²	26.1	4%	0.035	15%	0.147	C	C	.	.	H	α-helix	trans	-65.1	-40.9	174	-70.9	0	0	0	0	111.8	H304 G311 L312	H304-S308 PolarHBondContact CE1-OG 3.09Å; H304-S308 VanDerWaalsContact CE1-OG 3.25Å; H304-S308 PolarHBondContact NE2-OG 3.41Å; H304-S308 VanDerWaalsContact O-CB 3.26Å; H304-S308 WeakPolarHBondContact O-CB 3.28Å; H304-S308 PolarHBondContact O-N 3.03Å; H304-S308 PolarHBondContact O-OG 3.15Å; H304-S308 VanDerWaalsContact O-OG 3.1Å; S308-G311 PolarHBondContact O-N 3.09Å; S308-L312 VanDerWaalsContact O-CB 3.25Å; S308-L312 WeakPolarHBondContact O-CB 3.4Å; S308-L312 PolarHBondContact O-N 3.34Å
309	C	95.9	Very high	96.8	Very high	65 Å²	65	22.9 Å²	22.9	44%	0.439	13%	0.133	S	C	.	.	H	α-helix	trans	-64.3	-45.6	174.1	-175.8	0	0	0	0	111.6	A305 V306 G311 L312 V313	A305-C309 VanDerWaalsContact O-CB 3.28Å; A305-C309 WeakPolarHBondContact O-CB 3.28Å; A305-C309 PolarHBondContact O-N 3.27Å; V306-C309 PolarHBondContact O-N 3.39Å; C309-G311 VanDerWaalsContact C-N 3.34Å; C309-G311 PolarHBondContact O-N 3.31Å; C309-L312 PolarHBondContact O-N 3.47Å; C309-V313 WeakPolarHBondContact O-CG2 3.48Å; C309-V313 PolarHBondContact O-N 2.99Å
310	L	96.5	Very high	96.6	Very high	29 Å²	29	19.7 Å²	19.7	15%	0.152	12%	0.117	C	C	.	.	H	α-helix	trans	-57.6	-47.1	176	177.1	56.1	0	0	0	111.4	L225 V228 L229 L232 V306 L307 T314	L225-L310 HydrophobicContact CD1-CD2 4.23Å; V228-L310 HydrophobicContact CG1-CD2 3.52Å; V228-L310 HydrophobicContact CG1-CG 3.99Å; V228-L310 HydrophobicContact CG2-CG 4.05Å; L229-L310 HydrophobicContact CD2-CD1 4.18Å; L229-L310 HydrophobicContact CD2-CD2 4.08Å; L229-L310 HydrophobicContact CG-CD2 4.46Å; L232-L310 HydrophobicContact CB-CD1 4.37Å; L232-L310 HydrophobicContact CD2-CD1 3.5Å; L232-L310 VanDerWaalsContact CD2-CD1 3.5Å; L232-L310 HydrophobicContact CG-CD1 4.35Å; V306-L310 WeakPolarHBondContact O-CB 3.3Å; V306-L310 PolarHBondContact O-N 2.82Å; L307-L310 PolarHBondContact O-N 3.45Å; L310-T314 WeakPolarHBondContact O-CB 3.15Å; L310-T314 PolarHBondContact O-N 2.94Å; L310-T314 VanDerWaalsContact O-N 3.09Å; L310-T314 PolarHBondContact O-OG1 2.79Å
311	G	97	Very high	96.3	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.6	-45.1	175.4	0	0	0	0	0	113.1	L307 S308 C309 V313 T314 V315	L307-G311 PolarHBondContact O-N 2.98Å; S308-G311 PolarHBondContact O-N 3.09Å; C309-G311 VanDerWaalsContact C-N 3.34Å; C309-G311 PolarHBondContact O-N 3.31Å; G311-V313 PolarHBondContact O-N 2.99Å; G311-T314 PolarHBondContact O-N 3.47Å; G311-V315 WeakPolarHBondContact O-CB 3.26Å; G311-V315 WeakPolarHBondContact O-CG2 3.37Å; G311-V315 PolarHBondContact O-N 3.32Å
312	L	96.1	Very high	96	Very high	6 Å²	6	19.9 Å²	19.9	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-55.7	-51	177.9	172.8	61.8	0	0	0	111.6	L41 P42 F45 I248 F249 S308 C309 T314 V315 A316	L41-L312 HydrophobicContact CB-CD1 4.01Å; P42-L312 HydrophobicContact CB-CD1 4.17Å; P42-L312 HydrophobicContact CG-CD1 3.94Å; F45-L312 HydrophobicContact CD1-CD2 4.34Å; F45-L312 HydrophobicContact CD2-CD1 4.22Å; F45-L312 HydrophobicContact CD2-CD2 3.98Å; F45-L312 HydrophobicContact CE1-CD2 3.96Å; F45-L312 HydrophobicContact CE2-CD2 3.55Å; F45-L312 HydrophobicContact CG-CD2 4.36Å; F45-L312 HydrophobicContact CZ-CD2 3.54Å; I248-L312 HydrophobicContact CD1-CD1 4.45Å; I248-L312 HydrophobicContact CG2-CD1 4.12Å; I248-L312 HydrophobicContact CG2-CD2 4.38Å; I248-L312 HydrophobicContact CG2-CG 4.42Å; F249-L312 HydrophobicContact CZ-CD2 4.36Å; S308-L312 VanDerWaalsContact O-CB 3.25Å; S308-L312 WeakPolarHBondContact O-CB 3.4Å; S308-L312 PolarHBondContact O-N 3.34Å; C309-L312 PolarHBondContact O-N 3.47Å; L312-T314 VanDerWaalsContact C-N 3.35Å; L312-T314 PolarHBondContact O-N 3.29Å; L312-V315 PolarHBondContact O-N 3.22Å; L312-A316 WeakPolarHBondContact O-CB 3.42Å; L312-A316 PolarHBondContact O-N 3.38Å
313	V	96.6	Very high	95.6	Very high	30 Å²	30	15.1 Å²	15.1	18%	0.182	9%	0.093	C	C	.	.	H	α-helix	trans	-65.7	-39.9	-179.9	179.1	0	0	0	0	111	L232 L236 V245 F249 C309 G311 A317	L232-V313 HydrophobicContact CD1-CB 4.19Å; L232-V313 HydrophobicContact CD1-CG1 3.75Å; L236-V313 HydrophobicContact CD2-CG1 4.16Å; V245-V313 HydrophobicContact CG2-CG1 4.41Å; F249-V313 HydrophobicContact CE2-CG2 4.37Å; F249-V313 HydrophobicContact CZ-CG2 4.44Å; C309-V313 WeakPolarHBondContact O-CG2 3.48Å; C309-V313 PolarHBondContact O-N 2.99Å; G311-V313 PolarHBondContact O-N 2.99Å; V313-A317 WeakPolarHBondContact O-CB 3.18Å; V313-A317 PolarHBondContact O-N 3.15Å
314	T	97.1	Very high	95.2	Very high	6 Å²	6	16 Å²	16	4%	0.037	10%	0.098	C	C	.	.	H	α-helix	trans	-61.9	-48.6	178.5	-55.5	0	0	0	0	111.5	V228 L231 L232 L310 G311 L312 A317 L318	V228-T314 HydrophobicContact CG2-CG2 4.37Å; L231-T314 HydrophobicContact CB-CG2 3.9Å; L232-T314 HydrophobicContact CB-CG2 4.46Å; L232-T314 WeakPolarHBondContact CB-OG1 3.39Å; L232-T314 WeakPolarHBondContact CD1-OG1 3.36Å; L310-T314 WeakPolarHBondContact O-CB 3.15Å; L310-T314 PolarHBondContact O-N 2.94Å; L310-T314 VanDerWaalsContact O-N 3.09Å; L310-T314 PolarHBondContact O-OG1 2.79Å; G311-T314 PolarHBondContact O-N 3.47Å; L312-T314 VanDerWaalsContact C-N 3.35Å; L312-T314 PolarHBondContact O-N 3.29Å; T314-A317 PolarHBondContact O-N 3.09Å; T314-L318 HydrophobicContact CG2-CD1 4.33Å; T314-L318 WeakPolarHBondContact O-CG 3.32Å; T314-L318 PolarHBondContact O-N 3.01Å; T314-L318 VanDerWaalsContact O-N 3.11Å
315	V	95.5	Very high	94.8	Very high	3 Å²	3	20 Å²	20	2%	0.018	12%	0.115	C	C	.	.	H	α-helix	trans	-68.7	-43.3	-179.9	175	0	0	0	0	110.7	I38 P42 G311 L312 A317 L318 L319 L344	I38-V315 HydrophobicContact CG2-CG2 3.48Å; I38-V315 VanDerWaalsContact CG2-CG2 3.48Å; P42-V315 HydrophobicContact CB-CG1 4.36Å; P42-V315 HydrophobicContact CG-CB 3.89Å; P42-V315 HydrophobicContact CG-CG1 3.44Å; P42-V315 VanDerWaalsContact CG-CG1 3.44Å; G311-V315 WeakPolarHBondContact O-CB 3.26Å; G311-V315 WeakPolarHBondContact O-CG2 3.37Å; G311-V315 PolarHBondContact O-N 3.32Å; L312-V315 PolarHBondContact O-N 3.22Å; V315-A317 VanDerWaalsContact C-N 3.32Å; V315-A317 PolarHBondContact O-N 2.93Å; V315-L318 PolarHBondContact O-N 3.37Å; V315-L319 HydrophobicContact CG1-CD1 3.88Å; V315-L319 HydrophobicContact CG1-CG 4.17Å; V315-L319 VanDerWaalsContact O-CG 3.3Å; V315-L319 WeakPolarHBondContact O-CG 3.49Å; V315-L319 PolarHBondContact O-N 2.9Å; V315-L344 HydrophobicContact CB-CD2 4.3Å; V315-L344 HydrophobicContact CG1-CD1 3.97Å; V315-L344 HydrophobicContact CG1-CD2 3.75Å; V315-L344 HydrophobicContact CG1-CG 4.31Å; V315-L344 HydrophobicContact CG2-CD1 3.83Å; V315-L344 HydrophobicContact CG2-CD2 4.33Å
316	A	95.2	Very high	94.2	Very high	2 Å²	2	19.4 Å²	19.4	2%	0.017	11%	0.109	C	C	.	.	H	α-helix	trans	-52	-50.4	173.4	0	0	0	0	0	112.2	M244 V245 I248 L312 L318 L319 G320	M244-A316 WeakPolarHBondContact CB-O 3.38Å; M244-A316 WeakPolarHBondContact CG-O 3.34Å; V245-A316 HydrophobicContact CG2-CB 3.86Å; I248-A316 HydrophobicContact CD1-CB 3.34Å; L312-A316 WeakPolarHBondContact O-CB 3.42Å; L312-A316 PolarHBondContact O-N 3.38Å; A316-L318 PolarHBondContact O-N 3.46Å; A316-L319 PolarHBondContact O-N 3.48Å; A316-G320 PolarHBondContact O-N 3.45Å
317	A	96.2	Very high	93.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.3	-43.4	179.8	0	0	0	0	0	112.3	S235 L236 A241 V245 V313 T314 V315 G320 H321	S235-A317 WeakPolarHBondContact OG-CB 3.45Å; L236-A317 HydrophobicContact CD2-CB 4.04Å; A241-A317 HydrophobicContact CB-CB 3.82Å; V245-A317 HydrophobicContact CG2-CB 4.25Å; V313-A317 WeakPolarHBondContact O-CB 3.18Å; V313-A317 PolarHBondContact O-N 3.15Å; T314-A317 PolarHBondContact O-N 3.09Å; V315-A317 VanDerWaalsContact C-N 3.32Å; V315-A317 PolarHBondContact O-N 2.93Å; A317-G320 PolarHBondContact O-N 3.03Å; A317-H321 PolarHBondContact O-N 3.38Å
318	L	95.6	Very high	92.9	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-63.8	-40.9	176.4	-73.1	171.6	0	0	0	112.5	T314 V315 A316 H321 L322 L344 A347 V348 F351 L361	T314-L318 HydrophobicContact CG2-CD1 4.33Å; T314-L318 WeakPolarHBondContact O-CG 3.32Å; T314-L318 PolarHBondContact O-N 3.01Å; T314-L318 VanDerWaalsContact O-N 3.11Å; V315-L318 PolarHBondContact O-N 3.37Å; A316-L318 PolarHBondContact O-N 3.46Å; L318-H321 WeakPolarHBondContact O-CB 3.33Å; L318-H321 PolarHBondContact O-N 3.43Å; L318-L322 PolarHBondContact O-N 2.69Å; L318-L344 HydrophobicContact CB-CD2 3.56Å; L318-L344 HydrophobicContact CD1-CD2 3.79Å; L318-L344 HydrophobicContact CG-CD2 4.32Å; L318-A347 HydrophobicContact CB-CB 4.24Å; L318-A347 WeakPolarHBondContact O-CB 3.3Å; L318-V348 HydrophobicContact CD1-CG1 4.38Å; L318-V348 HydrophobicContact CD2-CG1 3.77Å; L318-F351 HydrophobicContact CD2-CE2 3.84Å; L318-F351 HydrophobicContact CD2-CZ 3.53Å; L318-L361 HydrophobicContact CD1-CD1 4.45Å
319	L	93.5	Very high	92.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-71	-34.1	178.2	-62.6	179.7	0	0	0	112.5	P42 M244 V315 A316 H321 L322 A323 A333 L334 L344	P42-L319 HydrophobicContact CB-CD1 4.47Å; M244-L319 HydrophobicContact CE-CB 4.29Å; M244-L319 HydrophobicContact CG-CB 4.49Å; V315-L319 HydrophobicContact CG1-CD1 3.88Å; V315-L319 HydrophobicContact CG1-CG 4.17Å; V315-L319 VanDerWaalsContact O-CG 3.3Å; V315-L319 WeakPolarHBondContact O-CG 3.49Å; V315-L319 PolarHBondContact O-N 2.9Å; A316-L319 PolarHBondContact O-N 3.48Å; L319-H321 VanDerWaalsContact C-N 3.32Å; L319-L322 PolarHBondContact O-N 3.02Å; L319-A323 WeakPolarHBondContact O-CB 3.4Å; L319-A323 PolarHBondContact O-N 3.31Å; L319-A333 HydrophobicContact CB-CB 4.45Å; L319-A333 HydrophobicContact CD2-CB 4.37Å; L319-L334 HydrophobicContact CD1-CD2 3.94Å; L319-L344 HydrophobicContact CD2-CD2 3.86Å; L319-L344 HydrophobicContact CD2-CG 4.39Å; L319-L344 HydrophobicContact CG-CD2 4.11Å
320	G	93.4	Very high	91.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.6	-41.9	170.9	0	0	0	0	0	112.3	G240 M244 A316 A317 I324	G240-G320 CarbonylContact O-C 3.57Å; G240-G320 WeakPolarHBondContact O-CA 3.5Å; M244-G320 VanDerWaalsContact CB-CA 3.4Å; A316-G320 PolarHBondContact O-N 3.45Å; A317-G320 PolarHBondContact O-N 3.03Å; G320-I324 PolarHBondContact O-N 3.25Å
321	H	92.3	Very high	90.9	Very high	7 Å²	7	29.4 Å²	29.4	3%	0.032	15%	0.152	C	C	.	.	H	α-helix	trans	-60.3	-48.3	173.6	179.2	64.3	0	0	0	112.6	E239 A317 L318 L319 A323 I324 K325 A347 F351	E239-H321 WeakPolarHBondContact O-CA 3.27Å; E239-H321 PolarHBondContact O-ND1 3.28Å; A317-H321 PolarHBondContact O-N 3.38Å; L318-H321 WeakPolarHBondContact O-CB 3.33Å; L318-H321 PolarHBondContact O-N 3.43Å; L319-H321 VanDerWaalsContact C-N 3.32Å; H321-A323 PolarHBondContact O-N 3.5Å; H321-I324 PolarHBondContact O-N 2.93Å; H321-K325 VanDerWaalsContact CE1-CG 3.46Å; H321-K325 WeakPolarHBondContact CE1-CG 3.22Å; H321-K325 WeakPolarHBondContact O-CG 3.37Å; H321-K325 PolarHBondContact O-N 3.01Å; H321-A347 PolarHBondContact CD2-O 3Å; H321-F351 AromaticContact CD2-CD1 3.97Å; H321-F351 AromaticContact CD2-CE1 3.43Å; H321-F351 VanDerWaalsContact CD2-CE1 3.43Å; H321-F351 WeakPolarHBondContact CD2-CE1 3.29Å; H321-F351 AromaticContact CG-CE1 3.97Å; H321-F351 AromaticContact NE2-CD1 3.57Å; H321-F351 AromaticContact NE2-CE1 3.47Å; H321-F351 WeakPolarHBondContact NE2-CE1 3.22Å
322	L	91.6	Very high	90.2	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-59.2	-47.1	179.3	179.2	64.1	0	0	0	112	L318 L319 I324 K325 C326 A333 S343 E346 A347	L318-L322 PolarHBondContact O-N 2.69Å; L319-L322 PolarHBondContact O-N 3.02Å; L322-I324 VanDerWaalsContact C-N 3.31Å; L322-I324 PolarHBondContact O-N 3.47Å; L322-K325 PolarHBondContact O-N 3.33Å; L322-C326 PolarHBondContact O-N 3.49Å; L322-A333 HydrophobicContact CD2-CB 4.26Å; L322-S343 WeakPolarHBondContact CD2-O 3.47Å; L322-E346 HydrophobicContact CD1-CB 4.14Å; L322-E346 HydrophobicContact CD1-CG 3.71Å; L322-A347 HydrophobicContact CB-CB 3.84Å
323	A	89.8	Confident	89.5	Confident	4 Å²	4	34.3 Å²	34.3	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-57.9	-43.4	-178.6	0	0	0	0	0	112	L319 H321 D327 Q328 Y330	L319-A323 WeakPolarHBondContact O-CB 3.4Å; L319-A323 PolarHBondContact O-N 3.31Å; H321-A323 PolarHBondContact O-N 3.5Å; A323-D327 WeakPolarHBondContact O-CA 3.48Å; A323-D327 PolarHBondContact O-N 3.43Å; A323-D327 VanDerWaalsContact O-N 3.1Å; A323-Q328 PolarHBondContact O-N 3.3Å; A323-Y330 HydrophobicContact CB-CD1 3.29Å; A323-Y330 HydrophobicContact CB-CE1 3.46Å; A323-Y330 VanDerWaalsContact CB-CE1 3.46Å; A323-Y330 HydrophobicContact CB-CG 4Å
324	I	89.7	Confident	89.1	Confident	60 Å²	60	33.4 Å²	33.4	31%	0.308	17%	0.168	S	C	.	.	H	α-helix	trans	-68.5	-46.4	176	-67.5	-61.2	0	0	0	111.8	E239 I243 G320 H321 L322 C326 D327 Y330	E239-I324 HydrophobicContact CG-CG2 4.41Å; I243-I324 HydrophobicContact CD1-CD1 4.36Å; G320-I324 PolarHBondContact O-N 3.25Å; H321-I324 PolarHBondContact O-N 2.93Å; L322-I324 VanDerWaalsContact C-N 3.31Å; L322-I324 PolarHBondContact O-N 3.47Å; I324-C326 PolarHBondContact O-N 2.85Å; I324-D327 PolarHBondContact O-N 3.38Å; I324-Y330 WeakPolarHBondContact CD1-OH 3.32Å
325	K	88	Confident	88.7	Confident	84 Å²	84	34.5 Å²	34.5	37%	0.365	17%	0.174	S	C	.	.	H	α-helix	trans	-65.8	-37.9	-176.4	-74.1	-59.3	-175	-169.7	0	113.1	K143 H321 L322 H350	K143-K325 PolarHBondContact NZ-O 3.11Å; H321-K325 VanDerWaalsContact CE1-CG 3.46Å; H321-K325 WeakPolarHBondContact CE1-CG 3.22Å; H321-K325 WeakPolarHBondContact O-CG 3.37Å; H321-K325 PolarHBondContact O-N 3.01Å; L322-K325 PolarHBondContact O-N 3.33Å; K325-H350 HydrophobicContact CG-CB 4.29Å
326	C	86.2	Confident	88.3	Confident	9 Å²	9	38 Å²	38	6%	0.061	19%	0.188	C	C	.	.	H	α-helix	trans	-94.9	4.7	179.2	-65.9	0	0	0	0	114.8	C140 L322 I324 Q328 H350	C140-C326 HydrophobicContact CB-CB 3.87Å; C140-C326 WeakPolarHBondContact CB-SG 3.46Å; C140-C326 WeakPolarHBondContact SG-CA 3.26Å; C140-C326 WeakPolarHBondContact SG-CB 3.44Å; C140-C326 CovalentContact SG-SG 2.06Å; C140-C326 PolarHBondContact SG-SG 2.96Å; L322-C326 PolarHBondContact O-N 3.49Å; I324-C326 PolarHBondContact O-N 2.85Å; C326-Q328 VanDerWaalsContact C-N 3.26Å; C326-Q328 HydrophobicContact CB-CG 4.02Å; C326-Q328 WeakPolarHBondContact O-CG 3.44Å; C326-Q328 PolarHBondContact O-N 3.01Å; C326-H350 PolarHBondContact SG-NE2 2.75Å; C326-H350 VanDerWaalsContact SG-NE2 3.39Å
327	D	86	Confident	87.9	Confident	142 Å²	142	41.6 Å²	41.6	76%	0.759	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	46.7	-179.4	-163.7	31.4	0	0	0	112	A323 I324	A323-D327 WeakPolarHBondContact O-CA 3.48Å; A323-D327 PolarHBondContact O-N 3.43Å; A323-D327 VanDerWaalsContact O-N 3.1Å; I324-D327 PolarHBondContact O-N 3.38Å
328	Q	82.7	Confident	87.8	Confident	31 Å²	31	42.2 Å²	42.2	15%	0.145	21%	0.21	C	C	.	.			trans	-115.1	146.7	-178	-62.8	-168	4	0	0	111	A323 C326 Y330 K332	A323-Q328 PolarHBondContact O-N 3.3Å; C326-Q328 VanDerWaalsContact C-N 3.26Å; C326-Q328 HydrophobicContact CB-CG 4.02Å; C326-Q328 WeakPolarHBondContact O-CG 3.44Å; C326-Q328 PolarHBondContact O-N 3.01Å; Q328-Y330 PolarHBondContact O-N 3.39Å; Q328-K332 VanDerWaalsContact OE1-CD 3.28Å
329	P	84.1	Confident	87.6	Confident	79 Å²	79	42.8 Å²	42.8	51%	0.513	21%	0.214	S	C	.	.			trans	-58.1	136.3	170.6	24.7	-32.7	0	0	0	110	E331 K332	P329-E331 WeakPolarHBondContact CB-OE2 3.29Å; P329-E331 PolarHBondContact O-N 2.96Å; P329-E331 VanDerWaalsContact O-N 3.09Å; P329-K332 HydrophobicContact CG-CB 4.16Å; P329-K332 WeakPolarHBondContact O-CB 3.18Å; P329-K332 PolarHBondContact O-N 2.6Å
330	Y	82	Confident	87.6	Confident	42 Å²	42	42.8 Å²	42.8	17%	0.165	21%	0.214	C	C	.	.	H	α-helix	trans	-55.3	-31.1	-177.4	-61.4	-85.5	0	0	0	112.6	I243 M244 A323 I324 Q328 K332 A333 L334	I243-Y330 HydrophobicContact CG2-CE1 4.33Å; I243-Y330 HydrophobicContact CG2-CE2 4.37Å; I243-Y330 WeakPolarHBondContact CG2-OH 3.42Å; M244-Y330 HydrophobicContact SD-CD1 3.87Å; M244-Y330 HydrophobicContact SD-CG 4.27Å; A323-Y330 HydrophobicContact CB-CD1 3.29Å; A323-Y330 HydrophobicContact CB-CE1 3.46Å; A323-Y330 VanDerWaalsContact CB-CE1 3.46Å; A323-Y330 HydrophobicContact CB-CG 4Å; I324-Y330 WeakPolarHBondContact CD1-OH 3.32Å; Q328-Y330 PolarHBondContact O-N 3.39Å; Y330-K332 PolarHBondContact O-N 3.45Å; Y330-A333 PolarHBondContact O-N 2.83Å; Y330-A333 VanDerWaalsContact O-N 3.16Å; Y330-L334 PolarHBondContact O-N 3.22Å
331	E	81	Confident	87.7	Confident	105 Å²	105	43 Å²	43	49%	0.491	22%	0.215	S	C	.	.	H	α-helix	trans	-60.5	-30.1	176.7	-62.7	74.6	-161.5	0	0	112.3	K247 P329 L334	K247-E331 IonicContact NZ-OE1 3.09Å; K247-E331 PolarHBondContact NZ-OE1 3.29Å; P329-E331 WeakPolarHBondContact CB-OE2 3.29Å; P329-E331 PolarHBondContact O-N 2.96Å; P329-E331 VanDerWaalsContact O-N 3.09Å; E331-L334 PolarHBondContact O-N 2.98Å
332	K	80.9	Confident	87.7	Confident	106 Å²	106	42.6 Å²	42.6	46%	0.461	21%	0.213	S	C	.	.	H	α-helix	trans	-75.6	-27.8	178.2	-172	175.1	172.2	-165.5	0	112.5	Q328 P329 Y330 L334	Q328-K332 VanDerWaalsContact OE1-CD 3.28Å; P329-K332 HydrophobicContact CG-CB 4.16Å; P329-K332 WeakPolarHBondContact O-CB 3.18Å; P329-K332 PolarHBondContact O-N 2.6Å; Y330-K332 PolarHBondContact O-N 3.45Å; K332-L334 VanDerWaalsContact C-N 3.27Å
333	A	83	Confident	87.7	Confident	3 Å²	3	42.7 Å²	42.7	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-76.1	-17	175.2	0	0	0	0	0	112.9	L319 L322 Y330 T335 Q340	L319-A333 HydrophobicContact CB-CB 4.45Å; L319-A333 HydrophobicContact CD2-CB 4.37Å; L322-A333 HydrophobicContact CD2-CB 4.26Å; Y330-A333 PolarHBondContact O-N 2.83Å; Y330-A333 VanDerWaalsContact O-N 3.16Å; A333-T335 PolarHBondContact O-N 3.36Å; A333-Q340 PolarHBondContact O-NE2 2.85Å
334	L	87.6	Confident	88	Confident	11 Å²	11	42.6 Å²	42.6	6%	0.058	21%	0.213	C	C	.	.			trans	-86.8	104.8	179.7	-68.8	169.9	0	0	0	111.3	P42 K43 I46 M244 L319 Y330 E331 K332	P42-L334 HydrophobicContact CB-CD2 4.21Å; K43-L334 HydrophobicContact CB-CB 4.28Å; K43-L334 HydrophobicContact CB-CD2 4.17Å; K43-L334 HydrophobicContact CD-CB 4.08Å; K43-L334 HydrophobicContact CG-CB 4.09Å; K43-L334 PolarHBondContact NZ-O 3.18Å; I46-L334 HydrophobicContact CB-CD1 4.03Å; I46-L334 HydrophobicContact CD1-CD1 3.38Å; I46-L334 HydrophobicContact CD1-CD2 4.17Å; I46-L334 HydrophobicContact CD1-CG 4.32Å; I46-L334 HydrophobicContact CG1-CD1 4.27Å; I46-L334 HydrophobicContact CG2-CD1 3.9Å; M244-L334 HydrophobicContact CE-CD1 3.96Å; M244-L334 HydrophobicContact CE-CD2 3.45Å; M244-L334 VanDerWaalsContact CE-CD2 3.45Å; M244-L334 HydrophobicContact CE-CG 3.74Å; L319-L334 HydrophobicContact CD1-CD2 3.94Å; Y330-L334 PolarHBondContact O-N 3.22Å; E331-L334 PolarHBondContact O-N 2.98Å; K332-L334 VanDerWaalsContact C-N 3.27Å
335	T	89.4	Confident	88.2	Confident	29 Å²	29	39.7 Å²	39.7	18%	0.178	20%	0.198	C	C	.	.			trans	-123.3	-161.8	174.6	65.4	0	0	0	0	110	K43 A333 S339 Q340	K43-T335 WeakPolarHBondContact CD-O 3.27Å; A333-T335 PolarHBondContact O-N 3.36Å; T335-S339 PolarHBondContact OG1-O 3.33Å; T335-Q340 PolarHBondContact O-OE1 3.47Å; T335-Q340 VanDerWaalsContact O-OE1 3.09Å; T335-Q340 WeakPolarHBondContact OG1-CA 3.45Å; T335-Q340 PolarHBondContact OG1-N 3.5Å
336	Y	85.4	Confident	88.3	Confident	78 Å²	78	36.2 Å²	36.2	31%	0.306	18%	0.183	S	C	.	.			trans	-132.4	157.7	179.9	-73	-67.3	0	0	0	109.9	A40 K43 M44 E47 S339 Q340	A40-Y336 HydrophobicContact CB-CD1 4.46Å; K43-Y336 HydrophobicContact CB-CD1 4.45Å; K43-Y336 HydrophobicContact CB-CE1 3.87Å; K43-Y336 HydrophobicContact CD-CD1 4.12Å; K43-Y336 HydrophobicContact CD-CD2 3.72Å; K43-Y336 HydrophobicContact CD-CE1 3.74Å; K43-Y336 HydrophobicContact CD-CE2 3.3Å; K43-Y336 HydrophobicContact CD-CG 4.11Å; K43-Y336 HydrophobicContact CG-CE1 3.89Å; K43-Y336 HydrophobicContact CG-CE2 4.08Å; K43-Y336 WeakPolarHBondContact CG-OH 3.45Å; M44-Y336 HydrophobicContact CG-CE1 4.27Å; E47-Y336 PolarHBondContact OE2-OH 2.85Å; Y336-S339 PolarHBondContact O-N 3.37Å; Y336-Q340 PolarHBondContact O-N 3.5Å
337	D	88.4	Confident	88.6	Confident	77 Å²	77	35.8 Å²	35.8	41%	0.412	18%	0.18	S	C	.	.	H	α-helix	trans	50.8	-135.1	169.9	-52.1	-38.5	0	0	0	113.4	S339 Q340 L341	D337-S339 PolarHBondContact O-N 2.68Å; D337-Q340 WeakPolarHBondContact O-CB 3.24Å; D337-Q340 PolarHBondContact O-N 3.04Å; D337-L341 PolarHBondContact O-N 3.49Å
338	F	92.6	Very high	89	Confident	12 Å²	12	29 Å²	29	5%	0.053	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-29.4	-178.1	-160.5	-88	0	0	0	113.2	Y115 Y118 I119 L122 F170 Q340 L341 L342 F422	Y115-F338 HydrophobicContact CD1-CB 4.2Å; Y115-F338 AromaticContact CD1-CD2 3.47Å; Y115-F338 HydrophobicContact CD1-CD2 3.47Å; Y115-F338 VanDerWaalsContact CD1-CD2 3.47Å; Y115-F338 HydrophobicContact CD1-CE2 4.1Å; Y115-F338 HydrophobicContact CD1-CG 4.01Å; Y115-F338 HydrophobicContact CE1-CB 3.95Å; Y115-F338 HydrophobicContact CE1-CD2 4.1Å; Y115-F338 HydrophobicContact CE1-CG 4.21Å; Y115-F338 HydrophobicContact CG-CD2 4.14Å; Y118-F338 HydrophobicContact CD2-CE2 4.32Å; Y118-F338 HydrophobicContact CD2-CZ 4.31Å; Y118-F338 HydrophobicContact CG-CZ 4.39Å; I119-F338 HydrophobicContact CD1-CE2 4.5Å; I119-F338 HydrophobicContact CG1-CE2 3.93Å; I119-F338 HydrophobicContact CG1-CZ 4.29Å; L122-F338 HydrophobicContact CD1-CZ 4.19Å; F170-F338 HydrophobicContact CD2-CE1 4.27Å; F170-F338 HydrophobicContact CE1-CD1 4.11Å; F170-F338 AromaticContact CE1-CE1 3.85Å; F170-F338 HydrophobicContact CE1-CE1 3.85Å; F170-F338 AromaticContact CE2-CE1 3.6Å; F170-F338 HydrophobicContact CE2-CE1 3.6Å; F170-F338 HydrophobicContact CE2-CZ 4.12Å; F170-F338 HydrophobicContact CZ-CD1 4.02Å; F170-F338 AromaticContact CZ-CE1 3.36Å; F170-F338 HydrophobicContact CZ-CE1 3.36Å; F170-F338 HydrophobicContact CZ-CZ 4.04Å; F338-Q340 VanDerWaalsContact C-N 3.27Å; F338-Q340 PolarHBondContact O-N 3.42Å; F338-L341 WeakPolarHBondContact O-CB 3.42Å; F338-L341 PolarHBondContact O-N 2.8Å; F338-L342 HydrophobicContact CD1-CD1 4.3Å; F338-L342 HydrophobicContact CD1-CG 4.15Å; F338-L342 HydrophobicContact CE1-CD1 4.4Å; F338-L342 HydrophobicContact CE1-CD2 4Å; F338-L342 HydrophobicContact CE1-CG 4.12Å; F338-L342 WeakPolarHBondContact O-CG 3.24Å; F338-L342 PolarHBondContact O-N 3.24Å; F338-L342 VanDerWaalsContact O-N 3.07Å; F338-F422 HydrophobicContact CB-CE2 4.01Å; F338-F422 HydrophobicContact CB-CZ 4.25Å; F338-F422 AromaticContact CD1-CE2 3.8Å; F338-F422 HydrophobicContact CD1-CE2 3.8Å; F338-F422 HydrophobicContact CD1-CZ 4.02Å; F338-F422 AromaticContact CG-CE2 4Å; F338-F422 HydrophobicContact CG-CE2 4Å; F338-F422 HydrophobicContact CG-CZ 4.44Å
339	S	91.6	Very high	89.4	Confident	15 Å²	15	27.7 Å²	27.7	11%	0.105	14%	0.139	C	C	.	.	H	α-helix	trans	-66.9	-31.8	174.4	-83.3	0	0	0	0	111.9	N167 T335 Y336 D337 L341 L342 S343 R426	N167-S339 PolarHBondContact OD1-OG 3Å; T335-S339 PolarHBondContact OG1-O 3.33Å; Y336-S339 PolarHBondContact O-N 3.37Å; D337-S339 PolarHBondContact O-N 2.68Å; S339-L341 VanDerWaalsContact C-N 3.34Å; S339-L342 WeakPolarHBondContact O-CB 3.37Å; S339-L342 PolarHBondContact O-N 2.9Å; S339-S343 PolarHBondContact O-N 3.1Å; S339-S343 PolarHBondContact O-OG 3.44Å; S339-R426 PolarHBondContact OG-NH2 3.04Å
340	Q	93.9	Very high	89.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-69.6	-36.1	175	-170.2	66.9	80.1	0	0	111.1	L39 A333 T335 Y336 D337 F338 L342 S343 L344	L39-Q340 HydrophobicContact CB-CB 4.39Å; L39-Q340 HydrophobicContact CD2-CB 4.07Å; L39-Q340 HydrophobicContact CD2-CG 4.17Å; L39-Q340 WeakPolarHBondContact O-CG 3.36Å; A333-Q340 PolarHBondContact O-NE2 2.85Å; T335-Q340 PolarHBondContact O-OE1 3.47Å; T335-Q340 VanDerWaalsContact O-OE1 3.09Å; T335-Q340 WeakPolarHBondContact OG1-CA 3.45Å; T335-Q340 PolarHBondContact OG1-N 3.5Å; Y336-Q340 PolarHBondContact O-N 3.5Å; D337-Q340 WeakPolarHBondContact O-CB 3.24Å; D337-Q340 PolarHBondContact O-N 3.04Å; F338-Q340 VanDerWaalsContact C-N 3.27Å; F338-Q340 PolarHBondContact O-N 3.42Å; Q340-L342 VanDerWaalsContact C-N 3.31Å; Q340-L342 PolarHBondContact O-N 3.01Å; Q340-S343 PolarHBondContact O-N 3.27Å; Q340-L344 VanDerWaalsContact O-CG 3.24Å; Q340-L344 WeakPolarHBondContact O-CG 3.45Å; Q340-L344 PolarHBondContact O-N 3.44Å
341	L	95.5	Very high	90.1	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.016	12%	0.12	C	C	.	.	H	α-helix	trans	-60	-43.2	171.5	-178.7	160.1	0	0	0	110.8	L39 I119 D337 F338 S339 L344 L345 L362 F365	L39-L341 HydrophobicContact CD1-CB 4.43Å; L39-L341 HydrophobicContact CD2-CB 4.02Å; I119-L341 HydrophobicContact CD1-CD1 3.78Å; I119-L341 HydrophobicContact CG1-CD1 4.19Å; D337-L341 PolarHBondContact O-N 3.49Å; F338-L341 WeakPolarHBondContact O-CB 3.42Å; F338-L341 PolarHBondContact O-N 2.8Å; S339-L341 VanDerWaalsContact C-N 3.34Å; L341-L344 WeakPolarHBondContact O-CB 3.29Å; L341-L344 PolarHBondContact O-N 3.39Å; L341-L345 WeakPolarHBondContact O-CB 3.24Å; L341-L345 PolarHBondContact O-N 3.09Å; L341-L362 HydrophobicContact CD2-CD2 4.2Å; L341-F365 HydrophobicContact CD1-CB 3.64Å; L341-F365 HydrophobicContact CD1-CD1 4.16Å; L341-F365 HydrophobicContact CD1-CD2 3.69Å; L341-F365 HydrophobicContact CD1-CE2 4.38Å; L341-F365 HydrophobicContact CD1-CG 3.56Å; L341-F365 HydrophobicContact CG-CD2 3.89Å; L341-F365 HydrophobicContact CG-CE2 4.22Å; L341-F365 HydrophobicContact CG-CG 4.27Å
342	L	93.3	Very high	90.4	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-53.5	174.5	-64.8	177.5	0	0	0	110.3	L122 I166 F170 F338 S339 Q340 L344 L345 E346	L122-L342 HydrophobicContact CD1-CD2 4.05Å; I166-L342 HydrophobicContact CD1-CB 4.04Å; I166-L342 HydrophobicContact CD1-CD2 4.47Å; I166-L342 WeakPolarHBondContact CD1-O 3.31Å; I166-L342 HydrophobicContact CG1-CB 4.1Å; I166-L342 HydrophobicContact CG1-CD2 4.4Å; I166-L342 HydrophobicContact CG2-CB 4.06Å; F170-L342 HydrophobicContact CB-CD1 3.74Å; F170-L342 HydrophobicContact CB-CD2 4.28Å; F170-L342 HydrophobicContact CD1-CD1 3.76Å; F170-L342 HydrophobicContact CD2-CD1 4.44Å; F170-L342 HydrophobicContact CD2-CD2 4.13Å; F170-L342 HydrophobicContact CE1-CD1 4.48Å; F170-L342 HydrophobicContact CG-CD1 3.73Å; F170-L342 HydrophobicContact CG-CD2 4.18Å; F338-L342 HydrophobicContact CD1-CD1 4.3Å; F338-L342 HydrophobicContact CD1-CG 4.15Å; F338-L342 HydrophobicContact CE1-CD1 4.4Å; F338-L342 HydrophobicContact CE1-CD2 4Å; F338-L342 HydrophobicContact CE1-CG 4.12Å; F338-L342 WeakPolarHBondContact O-CG 3.24Å; F338-L342 PolarHBondContact O-N 3.24Å; F338-L342 VanDerWaalsContact O-N 3.07Å; S339-L342 WeakPolarHBondContact O-CB 3.37Å; S339-L342 PolarHBondContact O-N 2.9Å; Q340-L342 VanDerWaalsContact C-N 3.31Å; Q340-L342 PolarHBondContact O-N 3.01Å; L342-L344 PolarHBondContact O-N 2.7Å; L342-L344 VanDerWaalsContact O-N 3.08Å; L342-L345 CarbonylContact O-C 3.56Å; L342-L345 WeakPolarHBondContact O-CA 3.39Å; L342-L345 VanDerWaalsContact O-CB 3.26Å; L342-L345 WeakPolarHBondContact O-CB 3.19Å; L342-L345 PolarHBondContact O-N 3.49Å; L342-E346 PolarHBondContact O-N 2.89Å
343	S	91.7	Very high	90.9	Very high	7 Å²	7	28.7 Å²	28.7	5%	0.049	14%	0.14	C	C	.	.	H	α-helix	trans	-54.2	-35.3	176.2	-58.3	0	0	0	0	113	L322 S339 Q340 E346 A347	L322-S343 WeakPolarHBondContact CD2-O 3.47Å; S339-S343 PolarHBondContact O-N 3.1Å; S339-S343 PolarHBondContact O-OG 3.44Å; Q340-S343 PolarHBondContact O-N 3.27Å; S343-E346 PolarHBondContact O-N 3.33Å; S343-A347 PolarHBondContact O-N 3.41Å
344	L	94.1	Very high	91.4	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-69.4	-35.5	173.8	-66.8	167.2	0	0	0	113.1	L39 V315 L318 L319 Q340 L341 L342 E346 A347 V348 L361 F365	L39-L344 HydrophobicContact CD2-CD1 3.87Å; V315-L344 HydrophobicContact CB-CD2 4.3Å; V315-L344 HydrophobicContact CG1-CD1 3.97Å; V315-L344 HydrophobicContact CG1-CD2 3.75Å; V315-L344 HydrophobicContact CG1-CG 4.31Å; V315-L344 HydrophobicContact CG2-CD1 3.83Å; V315-L344 HydrophobicContact CG2-CD2 4.33Å; L318-L344 HydrophobicContact CB-CD2 3.56Å; L318-L344 HydrophobicContact CD1-CD2 3.79Å; L318-L344 HydrophobicContact CG-CD2 4.32Å; L319-L344 HydrophobicContact CD2-CD2 3.86Å; L319-L344 HydrophobicContact CD2-CG 4.39Å; L319-L344 HydrophobicContact CG-CD2 4.11Å; Q340-L344 VanDerWaalsContact O-CG 3.24Å; Q340-L344 WeakPolarHBondContact O-CG 3.45Å; Q340-L344 PolarHBondContact O-N 3.44Å; L341-L344 WeakPolarHBondContact O-CB 3.29Å; L341-L344 PolarHBondContact O-N 3.39Å; L342-L344 PolarHBondContact O-N 2.7Å; L342-L344 VanDerWaalsContact O-N 3.08Å; L344-E346 VanDerWaalsContact C-N 3.35Å; L344-A347 WeakPolarHBondContact O-CB 3.35Å; L344-A347 PolarHBondContact O-N 3.21Å; L344-V348 PolarHBondContact O-N 3.39Å; L344-L361 VanDerWaalsContact C-CD2 3.43Å; L344-L361 HydrophobicContact CB-CD1 4.46Å; L344-L361 HydrophobicContact CB-CD2 3.81Å; L344-L361 WeakPolarHBondContact O-CD2 3.4Å; L344-F365 HydrophobicContact CD1-CE2 4.1Å; L344-F365 HydrophobicContact CD1-CZ 4Å
345	L	94.1	Very high	91.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.7	-38.4	174.7	-172.7	64.5	0	0	0	111.6	L122 W137 I166 L341 L342 V348 G349 L361 L362	L122-L345 HydrophobicContact CD1-CD2 4.17Å; L122-L345 HydrophobicContact CD2-CD2 4.1Å; W137-L345 HydrophobicContact CD2-CD2 3.92Å; W137-L345 HydrophobicContact CD2-CG 4.14Å; W137-L345 HydrophobicContact CE3-CD2 4.33Å; W137-L345 HydrophobicContact CG-CD2 4.33Å; W137-L345 HydrophobicContact CG-CG 4.27Å; W137-L345 HydrophobicContact CH2-CD2 4.28Å; W137-L345 HydrophobicContact CZ2-CD1 3.81Å; W137-L345 HydrophobicContact CZ2-CD2 3.92Å; W137-L345 HydrophobicContact CZ2-CG 3.99Å; W137-L345 HydrophobicContact CZ3-CD2 4.5Å; W137-L345 PolarHBondContact NE1-O 3.24Å; I166-L345 HydrophobicContact CD1-CB 4.03Å; I166-L345 HydrophobicContact CD1-CD2 4.36Å; I166-L345 HydrophobicContact CD1-CG 4.38Å; L341-L345 WeakPolarHBondContact O-CB 3.24Å; L341-L345 PolarHBondContact O-N 3.09Å; L342-L345 CarbonylContact O-C 3.56Å; L342-L345 WeakPolarHBondContact O-CA 3.39Å; L342-L345 VanDerWaalsContact O-CB 3.26Å; L342-L345 WeakPolarHBondContact O-CB 3.19Å; L342-L345 PolarHBondContact O-N 3.49Å; L345-V348 HydrophobicContact CD1-CG2 4.3Å; L345-V348 WeakPolarHBondContact O-CG2 3.32Å; L345-G349 PolarHBondContact O-N 3.29Å; L345-G349 VanDerWaalsContact O-N 3.12Å; L345-L361 HydrophobicContact CB-CD2 4.18Å; L345-L361 HydrophobicContact CD1-CD2 4.29Å; L345-L362 HydrophobicContact CD1-CD1 4.01Å; L345-L362 HydrophobicContact CD1-CD2 4.08Å; L345-L362 HydrophobicContact CD1-CG 3.87Å; L345-L362 HydrophobicContact CD2-CD2 4.17Å
346	E	91.5	Very high	91.9	Very high	10 Å²	10	33 Å²	33	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-46.4	169.8	-168.1	177.9	169.9	0	0	110.6	P141 I166 L322 L342 S343 L344 V348 G349 H350	P141-E346 WeakPolarHBondContact CD-OE1 3.5Å; I166-E346 HydrophobicContact CB-CB 4.44Å; I166-E346 HydrophobicContact CD1-CB 3.83Å; I166-E346 HydrophobicContact CG2-CB 4.43Å; I166-E346 VanDerWaalsContact CG2-OE2 3.27Å; I166-E346 WeakPolarHBondContact CG2-OE2 3.38Å; L322-E346 HydrophobicContact CD1-CB 4.14Å; L322-E346 HydrophobicContact CD1-CG 3.71Å; L342-E346 PolarHBondContact O-N 2.89Å; S343-E346 PolarHBondContact O-N 3.33Å; L344-E346 VanDerWaalsContact C-N 3.35Å; E346-V348 PolarHBondContact O-N 2.94Å; E346-G349 WeakPolarHBondContact O-CA 3.43Å; E346-G349 PolarHBondContact O-N 3.28Å; E346-H350 PolarHBondContact O-CD2 3.35Å
347	A	92.3	Very high	92.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.7	-48.5	179.3	0	0	0	0	0	112.8	L318 H321 L322 S343 L344 G349 H350	L318-A347 HydrophobicContact CB-CB 4.24Å; L318-A347 WeakPolarHBondContact O-CB 3.3Å; H321-A347 PolarHBondContact CD2-O 3Å; L322-A347 HydrophobicContact CB-CB 3.84Å; S343-A347 PolarHBondContact O-N 3.41Å; L344-A347 WeakPolarHBondContact O-CB 3.35Å; L344-A347 PolarHBondContact O-N 3.21Å; A347-G349 VanDerWaalsContact C-N 3.25Å; A347-G349 PolarHBondContact O-N 3.47Å; A347-H350 PolarHBondContact O-N 2.82Å
348	V	93.9	Very high	92.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-73.1	-18.9	178.5	-60.1	0	0	0	0	113	L318 L344 L345 E346 H350 F351 W357 L361	L318-V348 HydrophobicContact CD1-CG1 4.38Å; L318-V348 HydrophobicContact CD2-CG1 3.77Å; L344-V348 PolarHBondContact O-N 3.39Å; L345-V348 HydrophobicContact CD1-CG2 4.3Å; L345-V348 WeakPolarHBondContact O-CG2 3.32Å; E346-V348 PolarHBondContact O-N 2.94Å; V348-H350 PolarHBondContact O-N 3.07Å; V348-F351 HydrophobicContact CB-CD2 4.21Å; V348-F351 HydrophobicContact CB-CE2 4.4Å; V348-F351 HydrophobicContact CG1-CD2 4.29Å; V348-F351 HydrophobicContact CG1-CE2 4Å; V348-F351 WeakPolarHBondContact O-CB 3.43Å; V348-F351 PolarHBondContact O-N 3.35Å; V348-F351 VanDerWaalsContact O-N 3.16Å; V348-W357 HydrophobicContact CB-CB 3.92Å; V348-L361 HydrophobicContact CG1-CD2 4.24Å; V348-L361 HydrophobicContact CG2-CB 4.32Å; V348-L361 HydrophobicContact CG2-CD2 3.84Å
349	G	90.8	Very high	92.9	Very high	4 Å²	4	27.8 Å²	27.8	4%	0.041	14%	0.14	C	C	.	.	H	α-helix	trans	-63.7	-16.2	171.8	0	0	0	0	0	113.6	A138 L345 E346 A347 P354	A138-G349 WeakPolarHBondContact CB-O 3.35Å; L345-G349 PolarHBondContact O-N 3.29Å; L345-G349 VanDerWaalsContact O-N 3.12Å; E346-G349 WeakPolarHBondContact O-CA 3.43Å; E346-G349 PolarHBondContact O-N 3.28Å; A347-G349 VanDerWaalsContact C-N 3.25Å; A347-G349 PolarHBondContact O-N 3.47Å; G349-P354 VanDerWaalsContact O-CB 3.3Å; G349-P354 WeakPolarHBondContact O-CB 3.4Å
350	H	89.6	Confident	93.2	Very high	52 Å²	52	29 Å²	29	24%	0.241	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	1.2	175.2	-68.6	-63.4	0	0	0	114.6	A138 C140 K325 C326 E346 A347 V348	A138-H350 PolarHBondContact O-CE1 3.4Å; A138-H350 PolarHBondContact O-NE2 3.1Å; C140-H350 PolarHBondContact SG-CE1 3.33Å; C140-H350 PolarHBondContact SG-NE2 3.47Å; C140-H350 VanDerWaalsContact SG-NE2 3.38Å; K325-H350 HydrophobicContact CG-CB 4.29Å; C326-H350 PolarHBondContact SG-NE2 2.75Å; C326-H350 VanDerWaalsContact SG-NE2 3.39Å; E346-H350 PolarHBondContact O-CD2 3.35Å; A347-H350 PolarHBondContact O-N 2.82Å; V348-H350 PolarHBondContact O-N 3.07Å
351	F	91.8	Very high	93.4	Very high	10 Å²	10	29.1 Å²	29.1	4%	0.044	15%	0.146	C	C	.	.	S	Bend	trans	-79.5	155	174.5	-68.5	-12.9	0	0	0	112.1	K234 T238 L318 H321 V348 Q353 P354 W357	K234-F351 HydrophobicContact CB-CE2 4.46Å; K234-F351 HydrophobicContact CG-CD2 3.76Å; K234-F351 HydrophobicContact CG-CE2 3.49Å; K234-F351 VanDerWaalsContact CG-CE2 3.49Å; K234-F351 HydrophobicContact CG-CZ 4.04Å; T238-F351 HydrophobicContact CG2-CD1 4.09Å; T238-F351 HydrophobicContact CG2-CE1 3.3Å; T238-F351 HydrophobicContact CG2-CZ 3.76Å; L318-F351 HydrophobicContact CD2-CE2 3.84Å; L318-F351 HydrophobicContact CD2-CZ 3.53Å; H321-F351 AromaticContact CD2-CD1 3.97Å; H321-F351 AromaticContact CD2-CE1 3.43Å; H321-F351 VanDerWaalsContact CD2-CE1 3.43Å; H321-F351 WeakPolarHBondContact CD2-CE1 3.29Å; H321-F351 AromaticContact CG-CE1 3.97Å; H321-F351 AromaticContact NE2-CD1 3.57Å; H321-F351 AromaticContact NE2-CE1 3.47Å; H321-F351 WeakPolarHBondContact NE2-CE1 3.22Å; V348-F351 HydrophobicContact CB-CD2 4.21Å; V348-F351 HydrophobicContact CB-CE2 4.4Å; V348-F351 HydrophobicContact CG1-CD2 4.29Å; V348-F351 HydrophobicContact CG1-CE2 4Å; V348-F351 WeakPolarHBondContact O-CB 3.43Å; V348-F351 PolarHBondContact O-N 3.35Å; V348-F351 VanDerWaalsContact O-N 3.16Å; F351-Q353 PolarHBondContact O-N 3.42Å; F351-P354 WeakPolarHBondContact O-CD 3.22Å; F351-W357 HydrophobicContact CB-CB 4.45Å; F351-W357 HydrophobicContact CB-CG 4.01Å; F351-W357 HydrophobicContact CD2-CB 3.92Å; F351-W357 AromaticContact CD2-CD1 3.96Å; F351-W357 AromaticContact CD2-CD2 3.83Å; F351-W357 HydrophobicContact CD2-CD2 3.83Å; F351-W357 HydrophobicContact CD2-CE3 4.29Å; F351-W357 AromaticContact CD2-CG 3.63Å; F351-W357 HydrophobicContact CD2-CG 3.63Å; F351-W357 HydrophobicContact CG-CG 4.34Å
352	E	88.1	Confident	93.5	Very high	159 Å²	159	29 Å²	29	74%	0.743	15%	0.145	S	C	*	.	S	Bend	trans	-55.3	128.2	163	-64.8	173.7	179.1	0	0	109.3	W357	E352-W357 PolarHBondContact O-NE1 3.3Å
353	Q	91.5	Very high	93.7	Very high	132 Å²	132	32.2 Å²	32.2	62%	0.617	16%	0.162	S	C	*	.	S	Bend	trans	64.8	61.8	-170.6	-52.3	174.8	-17.2	0	0	113.2	F351 H355 L356 W357	F351-Q353 PolarHBondContact O-N 3.42Å; Q353-H355 PolarHBondContact O-N 3.32Å; Q353-L356 HydrophobicContact CB-CB 4.17Å; Q353-L356 WeakPolarHBondContact O-CB 3.38Å; Q353-L356 PolarHBondContact O-N 3.11Å; Q353-W357 VanDerWaalsContact O-CD1 3.26Å; Q353-W357 PolarHBondContact O-N 3.49Å
354	P	92.2	Very high	94	Very high	16 Å²	16	32.1 Å²	32.1	10%	0.104	16%	0.161	C	C	.	.	H	α-helix	trans	-62.2	-30.1	-170.8	26.9	-35.8	0	0	0	113.4	T134 P135 G349 F351 S358	T134-P354 HydrophobicContact CG2-CG 4.46Å; P135-P354 HydrophobicContact CG-CB 4.09Å; G349-P354 VanDerWaalsContact O-CB 3.3Å; G349-P354 WeakPolarHBondContact O-CB 3.4Å; F351-P354 WeakPolarHBondContact O-CD 3.22Å; P354-S358 WeakPolarHBondContact O-CB 3.36Å; P354-S358 PolarHBondContact O-N 2.94Å; P354-S358 PolarHBondContact O-OG 3.13Å
355	H	92.7	Very high	94.3	Very high	35 Å²	35	32.2 Å²	32.2	16%	0.162	16%	0.161	C	C	.	.	H	α-helix	trans	-64.2	-41.5	175.2	-57.3	66.5	0	0	0	112.5	L126 S129 N132 Q353 A359	L126-H355 HydrophobicContact CD1-CB 4.25Å; S129-H355 PolarHBondContact O-NE2 3.08Å; N132-H355 PolarHBondContact O-CE1 2.82Å; N132-H355 PolarHBondContact O-NE2 2.83Å; Q353-H355 PolarHBondContact O-N 3.32Å; H355-A359 VanDerWaalsContact O-CB 3.32Å; H355-A359 WeakPolarHBondContact O-CB 3.19Å; H355-A359 PolarHBondContact O-N 2.9Å
356	L	94.5	Very high	94.4	Very high	81 Å²	81	32.9 Å²	32.9	42%	0.424	16%	0.164	S	C	.	.	H	α-helix	trans	-62.7	-53.2	178.2	174.4	62.9	0	0	0	110.2	Q353 S358 A359 L360	Q353-L356 HydrophobicContact CB-CB 4.17Å; Q353-L356 WeakPolarHBondContact O-CB 3.38Å; Q353-L356 PolarHBondContact O-N 3.11Å; L356-S358 VanDerWaalsContact C-N 3.34Å; L356-S358 PolarHBondContact O-N 3.42Å; L356-A359 WeakPolarHBondContact O-CB 3.17Å; L356-A359 PolarHBondContact O-N 2.87Å; L356-A359 VanDerWaalsContact O-N 3.17Å; L356-L360 HydrophobicContact CD1-CD1 4.15Å; L356-L360 HydrophobicContact CD1-CG 4.17Å; L356-L360 HydrophobicContact CG-CD1 4.14Å; L356-L360 HydrophobicContact CG-CG 4.5Å; L356-L360 WeakPolarHBondContact O-CG 3.27Å; L356-L360 PolarHBondContact O-N 3.44Å
357	W	95.9	Very high	94.8	Very high	32 Å²	32	33.5 Å²	33.5	12%	0.121	17%	0.168	C	C	.	.	H	α-helix	trans	-67.4	-35.5	-175.7	-64.7	104.8	0	0	0	112.9	T230 L231 K234 V348 F351 E352 Q353 L360 L361	T230-W357 HydrophobicContact CG2-CH2 4.26Å; T230-W357 HydrophobicContact CG2-CZ3 4.1Å; L231-W357 HydrophobicContact CD2-CE3 4.07Å; L231-W357 HydrophobicContact CD2-CZ3 4.44Å; K234-W357 HydrophobicContact CB-CE3 4.26Å; K234-W357 HydrophobicContact CB-CH2 3.39Å; K234-W357 HydrophobicContact CB-CZ2 4.07Å; K234-W357 HydrophobicContact CB-CZ3 3.48Å; K234-W357 VanDerWaalsContact CB-CZ3 3.48Å; K234-W357 HydrophobicContact CD-CH2 3.84Å; K234-W357 HydrophobicContact CD-CZ2 3.58Å; K234-W357 HydrophobicContact CG-CD2 4.16Å; K234-W357 HydrophobicContact CG-CE3 4.01Å; K234-W357 HydrophobicContact CG-CH2 3.45Å; K234-W357 VanDerWaalsContact CG-CH2 3.45Å; K234-W357 HydrophobicContact CG-CZ2 3.59Å; K234-W357 HydrophobicContact CG-CZ3 3.65Å; V348-W357 HydrophobicContact CB-CB 3.92Å; F351-W357 HydrophobicContact CB-CB 4.45Å; F351-W357 HydrophobicContact CB-CG 4.01Å; F351-W357 HydrophobicContact CD2-CB 3.92Å; F351-W357 AromaticContact CD2-CD1 3.96Å; F351-W357 AromaticContact CD2-CD2 3.83Å; F351-W357 HydrophobicContact CD2-CD2 3.83Å; F351-W357 HydrophobicContact CD2-CE3 4.29Å; F351-W357 AromaticContact CD2-CG 3.63Å; F351-W357 HydrophobicContact CD2-CG 3.63Å; F351-W357 HydrophobicContact CG-CG 4.34Å; E352-W357 PolarHBondContact O-NE1 3.3Å; Q353-W357 VanDerWaalsContact O-CD1 3.26Å; Q353-W357 PolarHBondContact O-N 3.49Å; W357-L360 HydrophobicContact CE3-CD1 4.12Å; W357-L360 HydrophobicContact CZ3-CD1 4.27Å; W357-L360 PolarHBondContact O-N 3.44Å; W357-L361 WeakPolarHBondContact O-CB 3.31Å; W357-L361 PolarHBondContact O-N 2.89Å
358	S	96	Very high	95	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.1	-45	171.3	-62.3	0	0	0	0	111.7	W137 P354 L356 L360 L361 L362	W137-S358 PolarHBondContact NE1-OG 3.46Å; P354-S358 WeakPolarHBondContact O-CB 3.36Å; P354-S358 PolarHBondContact O-N 2.94Å; P354-S358 PolarHBondContact O-OG 3.13Å; L356-S358 VanDerWaalsContact C-N 3.34Å; L356-S358 PolarHBondContact O-N 3.42Å; S358-L360 PolarHBondContact O-N 3.31Å; S358-L361 PolarHBondContact O-N 3Å; S358-L362 WeakPolarHBondContact O-CB 3.39Å; S358-L362 VanDerWaalsContact O-CG 3.25Å; S358-L362 WeakPolarHBondContact O-CG 3.43Å; S358-L362 PolarHBondContact O-N 3.45Å
359	A	96.6	Very high	95.3	Very high	27 Å²	27	34 Å²	34	22%	0.223	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-42.6	177.7	0	0	0	0	0	111.7	L126 H355 L356 L362 L363	L126-A359 HydrophobicContact CD2-CB 3.78Å; H355-A359 VanDerWaalsContact O-CB 3.32Å; H355-A359 WeakPolarHBondContact O-CB 3.19Å; H355-A359 PolarHBondContact O-N 2.9Å; L356-A359 WeakPolarHBondContact O-CB 3.17Å; L356-A359 PolarHBondContact O-N 2.87Å; L356-A359 VanDerWaalsContact O-N 3.17Å; A359-L362 PolarHBondContact O-N 2.97Å; A359-L363 WeakPolarHBondContact O-CB 3.25Å; A359-L363 PolarHBondContact O-N 3.25Å
360	L	97.8	Very high	95.6	Very high	40 Å²	40	34.3 Å²	34.3	21%	0.209	17%	0.171	C	C	.	.	H	α-helix	trans	-63.9	-42.6	177.8	-65.9	177.7	0	0	0	112.1	L227 L356 W357 S358 F364	L227-L360 HydrophobicContact CD2-CB 4.27Å; L227-L360 HydrophobicContact CD2-CD2 3.61Å; L227-L360 HydrophobicContact CD2-CG 4.47Å; L356-L360 HydrophobicContact CD1-CD1 4.15Å; L356-L360 HydrophobicContact CD1-CG 4.17Å; L356-L360 HydrophobicContact CG-CD1 4.14Å; L356-L360 HydrophobicContact CG-CG 4.5Å; L356-L360 WeakPolarHBondContact O-CG 3.27Å; L356-L360 PolarHBondContact O-N 3.44Å; W357-L360 HydrophobicContact CE3-CD1 4.12Å; W357-L360 HydrophobicContact CZ3-CD1 4.27Å; W357-L360 PolarHBondContact O-N 3.44Å; S358-L360 PolarHBondContact O-N 3.31Å; L360-F364 WeakPolarHBondContact O-CB 3.28Å; L360-F364 PolarHBondContact O-N 3.11Å
361	L	97.9	Very high	96	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-64.7	-46.8	177	-174.9	76	0	0	0	111.8	L231 L318 L344 L345 V348 W357 S358 F364 F365	L231-L361 HydrophobicContact CD1-CD1 4Å; L318-L361 HydrophobicContact CD1-CD1 4.45Å; L344-L361 VanDerWaalsContact C-CD2 3.43Å; L344-L361 HydrophobicContact CB-CD1 4.46Å; L344-L361 HydrophobicContact CB-CD2 3.81Å; L344-L361 WeakPolarHBondContact O-CD2 3.4Å; L345-L361 HydrophobicContact CB-CD2 4.18Å; L345-L361 HydrophobicContact CD1-CD2 4.29Å; V348-L361 HydrophobicContact CG1-CD2 4.24Å; V348-L361 HydrophobicContact CG2-CB 4.32Å; V348-L361 HydrophobicContact CG2-CD2 3.84Å; W357-L361 WeakPolarHBondContact O-CB 3.31Å; W357-L361 PolarHBondContact O-N 2.89Å; S358-L361 PolarHBondContact O-N 3Å; L361-F364 WeakPolarHBondContact O-CB 3.27Å; L361-F364 PolarHBondContact O-N 3.42Å; L361-F365 HydrophobicContact CD1-CD2 4.23Å; L361-F365 HydrophobicContact CD1-CE2 3.78Å; L361-F365 HydrophobicContact CG-CD2 4.18Å; L361-F365 HydrophobicContact CG-CE2 4.14Å; L361-F365 WeakPolarHBondContact O-CD2 3.21Å; L361-F365 PolarHBondContact O-N 3.13Å; L361-F365 VanDerWaalsContact O-N 3.13Å
362	L	97.8	Very high	96.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.9	-42.3	178.8	-69.2	171.2	0	0	0	111.2	I119 L122 L123 L126 L341 L345 S358 A359 F364 F365 L366	I119-L362 HydrophobicContact CG2-CB 4.02Å; I119-L362 HydrophobicContact CG2-CD2 4.03Å; I119-L362 WeakPolarHBondContact CG2-O 3.29Å; L122-L362 HydrophobicContact CB-CD1 3.98Å; L122-L362 HydrophobicContact CB-CD2 4.06Å; L122-L362 HydrophobicContact CD1-CD2 4.04Å; L123-L362 HydrophobicContact CD1-CB 4.43Å; L123-L362 HydrophobicContact CD2-CB 3.72Å; L123-L362 HydrophobicContact CD2-CD1 3.87Å; L123-L362 HydrophobicContact CD2-CG 4.46Å; L123-L362 HydrophobicContact CG-CB 3.89Å; L123-L362 HydrophobicContact CG-CD1 3.98Å; L126-L362 HydrophobicContact CD2-CD1 4.4Å; L341-L362 HydrophobicContact CD2-CD2 4.2Å; L345-L362 HydrophobicContact CD1-CD1 4.01Å; L345-L362 HydrophobicContact CD1-CD2 4.08Å; L345-L362 HydrophobicContact CD1-CG 3.87Å; L345-L362 HydrophobicContact CD2-CD2 4.17Å; S358-L362 WeakPolarHBondContact O-CB 3.39Å; S358-L362 VanDerWaalsContact O-CG 3.25Å; S358-L362 WeakPolarHBondContact O-CG 3.43Å; S358-L362 PolarHBondContact O-N 3.45Å; A359-L362 PolarHBondContact O-N 2.97Å; L362-F364 VanDerWaalsContact C-N 3.32Å; L362-F364 PolarHBondContact O-N 3.19Å; L362-F365 PolarHBondContact O-N 2.94Å; L362-L366 VanDerWaalsContact O-CB 3.24Å; L362-L366 WeakPolarHBondContact O-CB 3.18Å; L362-L366 PolarHBondContact O-N 3.43Å
363	L	97.8	Very high	96.8	Very high	68 Å²	68	24.9 Å²	24.9	36%	0.356	13%	0.127	S	C	.	.	H	α-helix	trans	-61.8	-40.6	175.1	-178.9	63.1	0	0	0	111.6	L227 A359 L366 L367	L227-L363 HydrophobicContact CD1-CB 4.27Å; L227-L363 HydrophobicContact CD1-CD2 4.02Å; L227-L363 HydrophobicContact CD1-CG 3.89Å; A359-L363 WeakPolarHBondContact O-CB 3.25Å; A359-L363 PolarHBondContact O-N 3.25Å; L363-L366 PolarHBondContact O-N 3.48Å; L363-L367 HydrophobicContact CD1-CD1 4Å; L363-L367 HydrophobicContact CD1-CG 4.15Å; L363-L367 HydrophobicContact CG-CD1 3.93Å; L363-L367 HydrophobicContact CG-CG 4.48Å; L363-L367 WeakPolarHBondContact O-CB 3.38Å; L363-L367 VanDerWaalsContact O-CG 3.27Å; L363-L367 WeakPolarHBondContact O-CG 3.45Å; L363-L367 PolarHBondContact O-N 3.43Å
364	F	98.2	Very high	97.1	Very high	5 Å²	5	19 Å²	19	2%	0.022	10%	0.099	C	C	.	.	H	α-helix	trans	-57.4	-55.3	176.1	169.2	-114.7	0	0	0	111.4	F33 I38 P224 L227 V228 L231 L360 L361 L362 L366 L367 L368	F33-F364 HydrophobicContact CE1-CE2 4.46Å; F33-F364 HydrophobicContact CE2-CE2 4.17Å; F33-F364 HydrophobicContact CE2-CZ 4.18Å; F33-F364 AromaticContact CZ-CE2 3.77Å; F33-F364 HydrophobicContact CZ-CE2 3.77Å; F33-F364 HydrophobicContact CZ-CZ 4.2Å; I38-F364 HydrophobicContact CD1-CE1 4.06Å; I38-F364 HydrophobicContact CD1-CZ 3.58Å; P224-F364 HydrophobicContact CB-CD2 3.76Å; P224-F364 HydrophobicContact CB-CE2 3.97Å; P224-F364 WeakPolarHBondContact O-CD2 3.18Å; P224-F364 WeakPolarHBondContact O-CE2 3.24Å; L227-F364 HydrophobicContact CB-CB 4.04Å; L227-F364 HydrophobicContact CB-CD2 4.13Å; L227-F364 HydrophobicContact CB-CG 4.46Å; L227-F364 HydrophobicContact CD1-CB 4Å; V228-F364 HydrophobicContact CB-CD2 4.33Å; V228-F364 HydrophobicContact CB-CE2 3.7Å; V228-F364 HydrophobicContact CB-CZ 3.87Å; V228-F364 HydrophobicContact CG1-CE2 4.44Å; V228-F364 HydrophobicContact CG2-CE2 4.34Å; V228-F364 HydrophobicContact CG2-CZ 3.99Å; L231-F364 HydrophobicContact CD1-CB 4.32Å; L231-F364 HydrophobicContact CD1-CD1 4.39Å; L231-F364 HydrophobicContact CD1-CG 4.41Å; L360-F364 WeakPolarHBondContact O-CB 3.28Å; L360-F364 PolarHBondContact O-N 3.11Å; L361-F364 WeakPolarHBondContact O-CB 3.27Å; L361-F364 PolarHBondContact O-N 3.42Å; L362-F364 VanDerWaalsContact C-N 3.32Å; L362-F364 PolarHBondContact O-N 3.19Å; F364-L366 PolarHBondContact O-N 2.67Å; F364-L367 PolarHBondContact O-N 3.17Å; F364-L368 HydrophobicContact CD2-CG 4.41Å; F364-L368 HydrophobicContact CE1-CD1 3.94Å; F364-L368 HydrophobicContact CE2-CD1 3.87Å; F364-L368 HydrophobicContact CE2-CD2 4.1Å; F364-L368 HydrophobicContact CE2-CG 4.02Å; F364-L368 HydrophobicContact CZ-CD1 3.54Å; F364-L368 HydrophobicContact CZ-CG 4.2Å; F364-L368 WeakPolarHBondContact O-CG 3.47Å; F364-L368 PolarHBondContact O-N 3.49Å; F364-L368 VanDerWaalsContact O-N 3.09Å
365	F	98.3	Very high	97.4	Very high	3 Å²	3	18.3 Å²	18.3	1%	0.013	9%	0.094	C	C	.	.	H	α-helix	trans	-66.9	-35.3	179.9	-78.4	-69	0	0	0	113.1	I38 L39 I119 L341 L344 L361 L362 L367 L368 I369	I38-F365 HydrophobicContact CG2-CE1 4.27Å; I38-F365 HydrophobicContact CG2-CZ 4.2Å; L39-F365 HydrophobicContact CD1-CD1 4.32Å; L39-F365 HydrophobicContact CD1-CE1 3.9Å; L39-F365 HydrophobicContact CD2-CE1 3.64Å; L39-F365 HydrophobicContact CD2-CE2 4.34Å; L39-F365 HydrophobicContact CD2-CZ 3.47Å; L39-F365 VanDerWaalsContact CD2-CZ 3.47Å; L39-F365 HydrophobicContact CG-CE1 3.67Å; L39-F365 HydrophobicContact CG-CZ 4.04Å; I119-F365 HydrophobicContact CD1-CB 3.89Å; L341-F365 HydrophobicContact CD1-CB 3.64Å; L341-F365 HydrophobicContact CD1-CD1 4.16Å; L341-F365 HydrophobicContact CD1-CD2 3.69Å; L341-F365 HydrophobicContact CD1-CE2 4.38Å; L341-F365 HydrophobicContact CD1-CG 3.56Å; L341-F365 HydrophobicContact CG-CD2 3.89Å; L341-F365 HydrophobicContact CG-CE2 4.22Å; L341-F365 HydrophobicContact CG-CG 4.27Å; L344-F365 HydrophobicContact CD1-CE2 4.1Å; L344-F365 HydrophobicContact CD1-CZ 4Å; L361-F365 HydrophobicContact CD1-CD2 4.23Å; L361-F365 HydrophobicContact CD1-CE2 3.78Å; L361-F365 HydrophobicContact CG-CD2 4.18Å; L361-F365 HydrophobicContact CG-CE2 4.14Å; L361-F365 WeakPolarHBondContact O-CD2 3.21Å; L361-F365 PolarHBondContact O-N 3.13Å; L361-F365 VanDerWaalsContact O-N 3.13Å; L362-F365 PolarHBondContact O-N 2.94Å; F365-L367 VanDerWaalsContact C-N 3.34Å; F365-L367 PolarHBondContact O-N 2.87Å; F365-L368 PolarHBondContact O-N 2.96Å; F365-I369 WeakPolarHBondContact O-CG1 2.92Å; F365-I369 PolarHBondContact O-N 2.99Å
366	L	98.2	Very high	97.7	Very high	13 Å²	13	16.6 Å²	16.6	7%	0.068	9%	0.087	C	C	.	.	H	α-helix	trans	-60.1	-44.7	175.2	-175.5	61.2	0	0	0	111.4	A116 I119 I120 L123 L362 L363 F364 I369 F370	A116-L366 HydrophobicContact CB-CD1 3.84Å; I119-L366 HydrophobicContact CG2-CB 3.94Å; I119-L366 HydrophobicContact CG2-CD1 4.38Å; I120-L366 HydrophobicContact CD1-CD1 4.31Å; I120-L366 HydrophobicContact CG1-CD1 4.08Å; I120-L366 HydrophobicContact CG1-CD2 4.16Å; L123-L366 HydrophobicContact CD1-CD2 4.11Å; L362-L366 VanDerWaalsContact O-CB 3.24Å; L362-L366 WeakPolarHBondContact O-CB 3.18Å; L362-L366 PolarHBondContact O-N 3.43Å; L363-L366 PolarHBondContact O-N 3.48Å; F364-L366 PolarHBondContact O-N 2.67Å; L366-I369 PolarHBondContact O-N 2.99Å; L366-F370 HydrophobicContact CD1-CD2 4.29Å; L366-F370 HydrophobicContact CD1-CE2 3.82Å; L366-F370 HydrophobicContact CD1-CZ 4.49Å; L366-F370 HydrophobicContact CD2-CE2 4.12Å; L366-F370 HydrophobicContact CG-CD2 3.97Å; L366-F370 HydrophobicContact CG-CE2 3.65Å; L366-F370 VanDerWaalsContact O-CD2 3.24Å; L366-F370 WeakPolarHBondContact O-CD2 3.2Å; L366-F370 PolarHBondContact O-N 2.88Å
367	L	98.1	Very high	97.9	Very high	23 Å²	23	12.8 Å²	12.8	12%	0.12	7%	0.066	C	C	.	.	H	α-helix	trans	-67.4	-37.7	178.3	-71.2	169.1	0	0	0	112.5	I223 P224 L227 L363 F364 F365 I369 F370 N371	I223-L367 HydrophobicContact CB-CD1 4.02Å; I223-L367 HydrophobicContact CG2-CD1 3.41Å; I223-L367 VanDerWaalsContact CG2-CD1 3.41Å; P224-L367 HydrophobicContact CB-CB 4.31Å; P224-L367 HydrophobicContact CG-CB 4.32Å; L227-L367 HydrophobicContact CD1-CD1 4.06Å; L363-L367 HydrophobicContact CD1-CD1 4Å; L363-L367 HydrophobicContact CD1-CG 4.15Å; L363-L367 HydrophobicContact CG-CD1 3.93Å; L363-L367 HydrophobicContact CG-CG 4.48Å; L363-L367 WeakPolarHBondContact O-CB 3.38Å; L363-L367 VanDerWaalsContact O-CG 3.27Å; L363-L367 WeakPolarHBondContact O-CG 3.45Å; L363-L367 PolarHBondContact O-N 3.43Å; F364-L367 PolarHBondContact O-N 3.17Å; F365-L367 VanDerWaalsContact C-N 3.34Å; F365-L367 PolarHBondContact O-N 2.87Å; L367-I369 VanDerWaalsContact C-N 3.31Å; L367-I369 PolarHBondContact O-N 3.21Å; L367-F370 PolarHBondContact O-N 2.87Å; L367-N371 WeakPolarHBondContact O-CB 3.48Å; L367-N371 PolarHBondContact O-N 3.27Å; L367-N371 PolarHBondContact O-ND2 3.07Å
368	L	98.2	Very high	97.9	Very high	2 Å²	2	11.4 Å²	11.4	1%	0.01	6%	0.061	C	C	.	.	H	α-helix	trans	-62.5	-39.3	172.9	-64.6	-167.8	0	0	0	112.1	F33 I38 P224 F364 F365 N371 F372	F33-L368 HydrophobicContact CB-CD2 4.16Å; F33-L368 HydrophobicContact CD1-CD2 3.74Å; F33-L368 HydrophobicContact CD2-CD1 4.39Å; F33-L368 HydrophobicContact CD2-CD2 3.81Å; F33-L368 HydrophobicContact CE1-CD2 4.06Å; F33-L368 HydrophobicContact CE2-CD1 4.49Å; F33-L368 HydrophobicContact CE2-CD2 4.15Å; F33-L368 HydrophobicContact CG-CD2 3.6Å; F33-L368 HydrophobicContact CZ-CD2 4.25Å; I38-L368 HydrophobicContact CD1-CD1 3.7Å; P224-L368 HydrophobicContact CB-CD2 3.85Å; P224-L368 HydrophobicContact CG-CD2 4.27Å; F364-L368 HydrophobicContact CD2-CG 4.41Å; F364-L368 HydrophobicContact CE1-CD1 3.94Å; F364-L368 HydrophobicContact CE2-CD1 3.87Å; F364-L368 HydrophobicContact CE2-CD2 4.1Å; F364-L368 HydrophobicContact CE2-CG 4.02Å; F364-L368 HydrophobicContact CZ-CD1 3.54Å; F364-L368 HydrophobicContact CZ-CG 4.2Å; F364-L368 WeakPolarHBondContact O-CG 3.47Å; F364-L368 PolarHBondContact O-N 3.49Å; F364-L368 VanDerWaalsContact O-N 3.09Å; F365-L368 PolarHBondContact O-N 2.96Å; L368-N371 WeakPolarHBondContact O-CB 3.4Å; L368-N371 PolarHBondContact O-N 3.39Å; L368-F372 PolarHBondContact O-N 3.05Å; L368-F372 VanDerWaalsContact O-N 3.15Å
369	I	98.3	Very high	98	Very high	9 Å²	9	11.4 Å²	11.4	5%	0.046	6%	0.061	C	C	.	.	H	α-helix	trans	-65.2	-44.9	175.4	-69.1	175.9	0	0	0	110.7	Y112 A116 I119 F365 L366 L367 N371 F372 L373	Y112-I369 HydrophobicContact CD1-CG1 4.2Å; Y112-I369 HydrophobicContact CD1-CG2 4.14Å; Y112-I369 WeakPolarHBondContact O-CG2 3.35Å; A116-I369 HydrophobicContact CB-CG2 3.87Å; I119-I369 HydrophobicContact CD1-CD1 3.67Å; F365-I369 WeakPolarHBondContact O-CG1 2.92Å; F365-I369 PolarHBondContact O-N 2.99Å; L366-I369 PolarHBondContact O-N 2.99Å; L367-I369 VanDerWaalsContact C-N 3.31Å; L367-I369 PolarHBondContact O-N 3.21Å; I369-N371 VanDerWaalsContact C-N 3.32Å; I369-N371 PolarHBondContact O-N 3.47Å; I369-F372 PolarHBondContact O-N 3.25Å; I369-L373 HydrophobicContact CG2-CD1 3.51Å; I369-L373 HydrophobicContact CG2-CG 4.11Å; I369-L373 WeakPolarHBondContact O-CB 3.42Å; I369-L373 VanDerWaalsContact O-CG 3.24Å; I369-L373 WeakPolarHBondContact O-CG 3.27Å; I369-L373 PolarHBondContact O-N 3.49Å
370	F	98.4	Very high	98.1	Very high	11 Å²	11	10.5 Å²	10.5	5%	0.048	5%	0.053	C	C	.	.	H	α-helix	trans	-57.1	-46	174.9	-82.9	-59.4	0	0	0	112.4	F197 V198 V201 L366 L367 F372 L373 Y374	F197-F370 HydrophobicContact CE1-CZ 4.21Å; V198-F370 HydrophobicContact CB-CE1 4.08Å; V198-F370 HydrophobicContact CB-CZ 4.34Å; V198-F370 HydrophobicContact CG1-CD1 4.32Å; V198-F370 HydrophobicContact CG1-CE1 3.66Å; V198-F370 HydrophobicContact CG1-CZ 4.29Å; V198-F370 HydrophobicContact CG2-CE1 4.16Å; V198-F370 HydrophobicContact CG2-CZ 3.95Å; V201-F370 HydrophobicContact CB-CE1 3.74Å; V201-F370 HydrophobicContact CB-CZ 4.15Å; V201-F370 HydrophobicContact CG1-CD1 3.99Å; V201-F370 HydrophobicContact CG1-CE1 3.63Å; V201-F370 HydrophobicContact CG1-CZ 4.08Å; V201-F370 HydrophobicContact CG2-CE1 4.41Å; V201-F370 HydrophobicContact CG2-CZ 4.33Å; L366-F370 HydrophobicContact CD1-CD2 4.29Å; L366-F370 HydrophobicContact CD1-CE2 3.82Å; L366-F370 HydrophobicContact CD1-CZ 4.49Å; L366-F370 HydrophobicContact CD2-CE2 4.12Å; L366-F370 HydrophobicContact CG-CD2 3.97Å; L366-F370 HydrophobicContact CG-CE2 3.65Å; L366-F370 VanDerWaalsContact O-CD2 3.24Å; L366-F370 WeakPolarHBondContact O-CD2 3.2Å; L366-F370 PolarHBondContact O-N 2.88Å; L367-F370 PolarHBondContact O-N 2.87Å; F370-F372 VanDerWaalsContact C-N 3.33Å; F370-F372 PolarHBondContact O-N 3.37Å; F370-L373 PolarHBondContact O-N 3.21Å; F370-L373 VanDerWaalsContact O-N 3.16Å; F370-Y374 HydrophobicContact CB-CE1 4.46Å; F370-Y374 HydrophobicContact CB-CE2 4.18Å; F370-Y374 HydrophobicContact CD1-CE1 4.42Å; F370-Y374 VanDerWaalsContact O-CD2 3.26Å; F370-Y374 WeakPolarHBondContact O-CD2 3.38Å; F370-Y374 PolarHBondContact O-N 3.47Å
371	N	98.1	Very high	97.9	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-53.8	-48.1	177.5	-78.7	-12.1	0	0	0	112.5	V30 T220 L367 L368 I369	V30-N371 HydrophobicContact CB-CB 4.26Å; V30-N371 HydrophobicContact CG1-CB 3.36Å; V30-N371 VanDerWaalsContact CG1-CG 3.48Å; T220-N371 WeakPolarHBondContact CB-OD1 3.23Å; T220-N371 PolarHBondContact O-ND2 3.18Å; T220-N371 PolarHBondContact O-OD1 3Å; T220-N371 PolarHBondContact OG1-OD1 3.43Å; L367-N371 WeakPolarHBondContact O-CB 3.48Å; L367-N371 PolarHBondContact O-N 3.27Å; L367-N371 PolarHBondContact O-ND2 3.07Å; L368-N371 WeakPolarHBondContact O-CB 3.4Å; L368-N371 PolarHBondContact O-N 3.39Å; I369-N371 VanDerWaalsContact C-N 3.32Å; I369-N371 PolarHBondContact O-N 3.47Å
372	F	98	Very high	97.8	Very high	22 Å²	22	8.6 Å²	8.6	10%	0.096	4%	0.043	C	C	.	.	H	α-helix	trans	-66.5	-43.1	177.1	-175.2	-118.3	0	0	0	112.2	Y31 T108 Y112 F277 L368 I369 F370 Y374 V375 L376	Y31-F372 AromaticContact CD2-CD2 3.93Å; Y31-F372 HydrophobicContact CD2-CD2 3.93Å; Y31-F372 HydrophobicContact CD2-CE2 4.35Å; Y31-F372 AromaticContact CE2-CD2 3.57Å; Y31-F372 HydrophobicContact CE2-CD2 3.57Å; Y31-F372 AromaticContact CE2-CE2 3.54Å; Y31-F372 HydrophobicContact CE2-CE2 3.54Å; T108-F372 HydrophobicContact CG2-CE1 3.87Å; T108-F372 HydrophobicContact CG2-CZ 4.31Å; Y112-F372 AromaticContact CD1-CD1 3.66Å; Y112-F372 HydrophobicContact CD1-CD1 3.66Å; Y112-F372 HydrophobicContact CD1-CE1 4.16Å; Y112-F372 HydrophobicContact CD2-CD1 4.25Å; Y112-F372 AromaticContact CD2-CE1 3.97Å; Y112-F372 HydrophobicContact CD2-CE1 3.97Å; Y112-F372 AromaticContact CE1-CD1 3.59Å; Y112-F372 HydrophobicContact CE1-CD1 3.59Å; Y112-F372 AromaticContact CE1-CE1 3.87Å; Y112-F372 HydrophobicContact CE1-CE1 3.87Å; Y112-F372 HydrophobicContact CE1-CG 4.48Å; Y112-F372 HydrophobicContact CE2-CD1 4.18Å; Y112-F372 AromaticContact CE2-CE1 3.66Å; Y112-F372 HydrophobicContact CE2-CE1 3.66Å; Y112-F372 AromaticContact CG-CD1 3.98Å; Y112-F372 HydrophobicContact CG-CD1 3.98Å; Y112-F372 HydrophobicContact CG-CE1 4.18Å; Y112-F372 AromaticContact CZ-CD1 3.84Å; Y112-F372 AromaticContact CZ-CE1 3.59Å; F277-F372 HydrophobicContact CE1-CZ 4.45Å; F277-F372 HydrophobicContact CE2-CE2 4.32Å; F277-F372 AromaticContact CE2-CZ 3.94Å; F277-F372 HydrophobicContact CE2-CZ 3.94Å; F277-F372 AromaticContact CZ-CZ 3.88Å; F277-F372 HydrophobicContact CZ-CZ 3.88Å; L368-F372 PolarHBondContact O-N 3.05Å; L368-F372 VanDerWaalsContact O-N 3.15Å; I369-F372 PolarHBondContact O-N 3.25Å; F370-F372 VanDerWaalsContact C-N 3.33Å; F370-F372 PolarHBondContact O-N 3.37Å; F372-Y374 VanDerWaalsContact C-N 3.34Å; F372-Y374 PolarHBondContact O-N 3.25Å; F372-V375 PolarHBondContact O-N 3.45Å; F372-L376 HydrophobicContact CD1-CD1 3.83Å; F372-L376 HydrophobicContact CD1-CG 4.25Å; F372-L376 HydrophobicContact CE1-CD1 3.26Å; F372-L376 HydrophobicContact CE1-CG 3.93Å; F372-L376 HydrophobicContact CE2-CD1 4.37Å; F372-L376 HydrophobicContact CE2-CD2 4.23Å; F372-L376 HydrophobicContact CE2-CG 4.21Å; F372-L376 HydrophobicContact CZ-CD1 3.57Å; F372-L376 HydrophobicContact CZ-CD2 4.01Å; F372-L376 HydrophobicContact CZ-CG 3.89Å; F372-L376 PolarHBondContact O-N 3.49Å; F372-L376 VanDerWaalsContact O-N 3.09Å
373	L	98.4	Very high	97.6	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-62.3	-37.3	179.8	-74.1	170.5	0	0	0	112.8	S109 V113 V198 I202 I369 F370 V375 L376 V377	S109-L373 WeakPolarHBondContact O-CD2 3.1Å; V113-L373 HydrophobicContact CG2-CD1 3.8Å; V113-L373 HydrophobicContact CG2-CD2 4Å; V198-L373 HydrophobicContact CG1-CD1 3.89Å; I202-L373 HydrophobicContact CD1-CB 3.85Å; I202-L373 HydrophobicContact CD1-CD1 3.97Å; I202-L373 HydrophobicContact CD1-CG 4.34Å; I202-L373 HydrophobicContact CG1-CB 4.33Å; I369-L373 HydrophobicContact CG2-CD1 3.51Å; I369-L373 HydrophobicContact CG2-CG 4.11Å; I369-L373 WeakPolarHBondContact O-CB 3.42Å; I369-L373 VanDerWaalsContact O-CG 3.24Å; I369-L373 WeakPolarHBondContact O-CG 3.27Å; I369-L373 PolarHBondContact O-N 3.49Å; F370-L373 PolarHBondContact O-N 3.21Å; F370-L373 VanDerWaalsContact O-N 3.16Å; L373-V375 VanDerWaalsContact C-N 3.29Å; L373-V375 PolarHBondContact O-N 2.84Å; L373-L376 PolarHBondContact O-N 2.98Å; L373-V377 WeakPolarHBondContact O-CB 3.03Å; L373-V377 VanDerWaalsContact O-CG2 3.28Å; L373-V377 WeakPolarHBondContact O-CG2 3.4Å; L373-V377 PolarHBondContact O-N 2.91Å
374	Y	98.2	Very high	97.4	Very high	8 Å²	8	8.4 Å²	8.4	3%	0.031	5%	0.045	C	C	.	.	H	α-helix	trans	-56.7	-44.6	176.8	-61.7	-35	0	0	0	112.2	I202 S205 L213 V216 T220 F370 F372 L378	I202-Y374 HydrophobicContact CG1-CD1 4.5Å; I202-Y374 HydrophobicContact CG1-CE1 4.5Å; S205-Y374 VanDerWaalsContact CB-CE1 3.49Å; S205-Y374 VanDerWaalsContact OG-CE1 3.23Å; S205-Y374 WeakPolarHBondContact OG-CE1 3.34Å; L213-Y374 HydrophobicContact CD1-CD2 4.36Å; L213-Y374 HydrophobicContact CD1-CG 4.04Å; V216-Y374 HydrophobicContact CG1-CE2 4.21Å; T220-Y374 HydrophobicContact CG2-CE2 3.98Å; F370-Y374 HydrophobicContact CB-CE1 4.46Å; F370-Y374 HydrophobicContact CB-CE2 4.18Å; F370-Y374 HydrophobicContact CD1-CE1 4.42Å; F370-Y374 VanDerWaalsContact O-CD2 3.26Å; F370-Y374 WeakPolarHBondContact O-CD2 3.38Å; F370-Y374 PolarHBondContact O-N 3.47Å; F372-Y374 VanDerWaalsContact C-N 3.34Å; F372-Y374 PolarHBondContact O-N 3.25Å; Y374-L378 WeakPolarHBondContact O-CB 3.42Å; Y374-L378 PolarHBondContact O-N 3.13Å
375	V	98.3	Very high	97	Very high	2 Å²	2	9.8 Å²	9.8	1%	0.012	5%	0.051	C	C	.	.	H	α-helix	trans	-74.2	-42	-178.4	179.3	0	0	0	0	111.2	V27 Y31 A279 L283 F372 L373 V377 L378 N379	V27-V375 HydrophobicContact CG1-CG2 3.97Å; Y31-V375 HydrophobicContact CD2-CB 3.57Å; Y31-V375 HydrophobicContact CD2-CG1 3.59Å; Y31-V375 HydrophobicContact CD2-CG2 3.84Å; Y31-V375 HydrophobicContact CE2-CB 3.97Å; Y31-V375 HydrophobicContact CE2-CG1 3.73Å; Y31-V375 HydrophobicContact CG-CB 4.27Å; Y31-V375 HydrophobicContact CG-CG1 4.03Å; Y31-V375 HydrophobicContact CG-CG2 4.16Å; A279-V375 HydrophobicContact CB-CG1 3.88Å; L283-V375 HydrophobicContact CD1-CG1 4.07Å; L283-V375 HydrophobicContact CD2-CG1 4.25Å; L283-V375 HydrophobicContact CG-CG1 4.24Å; F372-V375 PolarHBondContact O-N 3.45Å; L373-V375 VanDerWaalsContact C-N 3.29Å; L373-V375 PolarHBondContact O-N 2.84Å; V375-V377 PolarHBondContact O-N 3.33Å; V375-L378 PolarHBondContact O-N 3.34Å; V375-N379 WeakPolarHBondContact O-CB 3.29Å; V375-N379 PolarHBondContact O-N 3.21Å
376	L	98.1	Very high	96.6	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.9	-41.7	176.7	-71.2	-165.9	0	0	0	112.4	T108 F277 F372 L373 N379 I380	T108-L376 HydrophobicContact CG2-CD1 3.71Å; F277-L376 HydrophobicContact CB-CD2 4.21Å; F277-L376 HydrophobicContact CD1-CD2 3.87Å; F277-L376 HydrophobicContact CE1-CD2 4.41Å; F277-L376 HydrophobicContact CG-CD2 3.98Å; F372-L376 HydrophobicContact CD1-CD1 3.83Å; F372-L376 HydrophobicContact CD1-CG 4.25Å; F372-L376 HydrophobicContact CE1-CD1 3.26Å; F372-L376 HydrophobicContact CE1-CG 3.93Å; F372-L376 HydrophobicContact CE2-CD1 4.37Å; F372-L376 HydrophobicContact CE2-CD2 4.23Å; F372-L376 HydrophobicContact CE2-CG 4.21Å; F372-L376 HydrophobicContact CZ-CD1 3.57Å; F372-L376 HydrophobicContact CZ-CD2 4.01Å; F372-L376 HydrophobicContact CZ-CG 3.89Å; F372-L376 PolarHBondContact O-N 3.49Å; F372-L376 VanDerWaalsContact O-N 3.09Å; L373-L376 PolarHBondContact O-N 2.98Å; L376-N379 CarbonylContact O-C 3.45Å; L376-N379 WeakPolarHBondContact O-CA 3.48Å; L376-N379 VanDerWaalsContact O-CB 3.31Å; L376-N379 WeakPolarHBondContact O-CB 3.46Å; L376-N379 PolarHBondContact O-N 2.91Å; L376-N379 VanDerWaalsContact O-N 3.15Å; L376-I380 WeakPolarHBondContact O-CG1 3.25Å; L376-I380 PolarHBondContact O-N 2.77Å; L376-I380 VanDerWaalsContact O-N 3.13Å
377	V	98.3	Very high	96.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-72.2	-35.2	-179.9	178.5	0	0	0	0	111	W199 I202 L206 L373 V375 N379 I380 Q381 V405	W199-V377 HydrophobicContact CH2-CG2 4.1Å; W199-V377 HydrophobicContact CZ3-CG1 4.48Å; W199-V377 HydrophobicContact CZ3-CG2 3.8Å; I202-V377 HydrophobicContact CG2-CB 3.95Å; I202-V377 HydrophobicContact CG2-CG1 3.82Å; I202-V377 HydrophobicContact CG2-CG2 3.94Å; L206-V377 HydrophobicContact CD1-CB 3.71Å; L206-V377 HydrophobicContact CD1-CG1 3.52Å; L373-V377 WeakPolarHBondContact O-CB 3.03Å; L373-V377 VanDerWaalsContact O-CG2 3.28Å; L373-V377 WeakPolarHBondContact O-CG2 3.4Å; L373-V377 PolarHBondContact O-N 2.91Å; V375-V377 PolarHBondContact O-N 3.33Å; V377-N379 VanDerWaalsContact C-N 3.27Å; V377-N379 PolarHBondContact O-N 2.91Å; V377-I380 PolarHBondContact O-N 3.13Å; V377-I380 VanDerWaalsContact O-N 3.12Å; V377-Q381 WeakPolarHBondContact O-CB 3.41Å; V377-Q381 PolarHBondContact O-N 3.11Å; V377-V405 HydrophobicContact CG1-CG1 3.98Å
378	L	97.5	Very high	95.6	Very high	3 Å²	3	15.9 Å²	15.9	2%	0.016	10%	0.096	C	C	.	.	H	α-helix	trans	-59.3	-40.1	167.5	-177.5	65.9	0	0	0	111.6	L206 V210 L213 T282 L283 F286 Y374 V375 I380 Q381 T382	L206-L378 HydrophobicContact CD2-CB 4.24Å; L206-L378 HydrophobicContact CD2-CD1 4.44Å; V210-L378 HydrophobicContact CG1-CD1 3.94Å; V210-L378 HydrophobicContact CG1-CD2 4.11Å; L213-L378 HydrophobicContact CD2-CD2 3.88Å; T282-L378 HydrophobicContact CG2-CD2 4.28Å; T282-L378 HydrophobicContact CG2-CG 3.99Å; L283-L378 HydrophobicContact CD2-CD2 4.16Å; F286-L378 HydrophobicContact CD2-CD2 4.49Å; F286-L378 HydrophobicContact CE2-CD1 4.07Å; F286-L378 HydrophobicContact CE2-CD2 3.93Å; F286-L378 HydrophobicContact CE2-CG 4.13Å; F286-L378 HydrophobicContact CZ-CD1 4.2Å; Y374-L378 WeakPolarHBondContact O-CB 3.42Å; Y374-L378 PolarHBondContact O-N 3.13Å; V375-L378 PolarHBondContact O-N 3.34Å; L378-I380 PolarHBondContact O-N 3.39Å; L378-Q381 PolarHBondContact O-N 3.06Å; L378-T382 WeakPolarHBondContact O-CB 3.33Å; L378-T382 PolarHBondContact O-N 3.07Å; L378-T382 PolarHBondContact O-OG1 2.96Å
379	N	97.7	Very high	94.5	Very high	0 Å²	0	17 Å²	17	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-67.7	-16	176.9	-162.8	45.8	0	0	0	113.8	P83 S105 F277 G278 T282 V375 L376 V377 P383	P83-N379 WeakPolarHBondContact CG-OD1 3.47Å; S105-N379 PolarHBondContact OG-ND2 3.05Å; F277-N379 PolarHBondContact O-ND2 3.18Å; G278-N379 PolarHBondContact O-OD1 3.33Å; T282-N379 WeakPolarHBondContact CB-OD1 3.02Å; T282-N379 PolarHBondContact OG1-OD1 3.1Å; V375-N379 WeakPolarHBondContact O-CB 3.29Å; V375-N379 PolarHBondContact O-N 3.21Å; L376-N379 CarbonylContact O-C 3.45Å; L376-N379 WeakPolarHBondContact O-CA 3.48Å; L376-N379 VanDerWaalsContact O-CB 3.31Å; L376-N379 WeakPolarHBondContact O-CB 3.46Å; L376-N379 PolarHBondContact O-N 2.91Å; L376-N379 VanDerWaalsContact O-N 3.15Å; V377-N379 VanDerWaalsContact C-N 3.27Å; V377-N379 PolarHBondContact O-N 2.91Å; N379-P383 WeakPolarHBondContact O-CD 3.45Å; N379-P383 WeakPolarHBondContact O-CG 3.38Å
380	I	97.9	Very high	93.1	Very high	9 Å²	9	20.1 Å²	20.1	5%	0.046	12%	0.124	C	C	.	.	H	α-helix	trans	-92.6	-45.1	171.7	-58.7	158.4	0	0	0	110.9	T102 L106 L376 V377 L378 P383 V384 V405	T102-I380 HydrophobicContact CG2-CG2 4.35Å; L106-I380 VanDerWaalsContact CA-CD1 3.42Å; L106-I380 HydrophobicContact CB-CD1 3.95Å; L106-I380 HydrophobicContact CB-CG1 4.37Å; L106-I380 HydrophobicContact CD1-CD1 4.09Å; L376-I380 WeakPolarHBondContact O-CG1 3.25Å; L376-I380 PolarHBondContact O-N 2.77Å; L376-I380 VanDerWaalsContact O-N 3.13Å; V377-I380 PolarHBondContact O-N 3.13Å; V377-I380 VanDerWaalsContact O-N 3.12Å; L378-I380 PolarHBondContact O-N 3.39Å; I380-P383 WeakPolarHBondContact O-CD 3.47Å; I380-V384 WeakPolarHBondContact O-CG2 3.23Å; I380-V405 HydrophobicContact CB-CG1 4.15Å; I380-V405 HydrophobicContact CG2-CG1 3.74Å; I380-V405 HydrophobicContact CG2-CG2 4.26Å
381	Q	95.2	Very high	91.6	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-63.3	-43.8	-177.8	179.8	178.7	-35.7	0	0	111.8	V377 L378 V384 E385 I401 C402	V377-Q381 WeakPolarHBondContact O-CB 3.41Å; V377-Q381 PolarHBondContact O-N 3.11Å; L378-Q381 PolarHBondContact O-N 3.06Å; Q381-V384 WeakPolarHBondContact O-CB 3.33Å; Q381-V384 PolarHBondContact O-N 2.99Å; Q381-E385 HydrophobicContact CG-CG 4.39Å; Q381-E385 WeakPolarHBondContact CG-OE1 3.32Å; Q381-E385 PolarHBondContact NE2-OE1 3.33Å; Q381-E385 PolarHBondContact O-N 3.35Å; Q381-I401 HydrophobicContact CG-CG2 4.08Å; Q381-C402 PolarHBondContact OE1-SG 3.23Å; Q381-C402 VanDerWaalsContact OE1-SG 3.39Å
382	T	94.6	Very high	90.2	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.006	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-44.7	-174.9	-47.6	0	0	0	0	112.9	T282 F286 L378 V384 E385 D386	T282-T382 HydrophobicContact CG2-CG2 4.42Å; F286-T382 HydrophobicContact CE1-CG2 4.34Å; F286-T382 HydrophobicContact CE2-CG2 4.29Å; F286-T382 HydrophobicContact CZ-CG2 3.63Å; L378-T382 WeakPolarHBondContact O-CB 3.33Å; L378-T382 PolarHBondContact O-N 3.07Å; L378-T382 PolarHBondContact O-OG1 2.96Å; T382-V384 VanDerWaalsContact C-N 3.29Å; T382-V384 PolarHBondContact O-N 3.46Å; T382-E385 PolarHBondContact O-N 3.14Å; T382-D386 VanDerWaalsContact O-CG 3.31Å; T382-D386 PolarHBondContact O-N 3.16Å
383	P	94.6	Very high	88.9	Confident	13 Å²	13	28.5 Å²	28.5	8%	0.084	19%	0.189	C	C	.	.	H	α-helix	trans	-54.9	-38.2	168.8	-28.8	32.8	0	0	0	115.7	S82 P84 T102 N379 I380 D386 A387	S82-P383 WeakPolarHBondContact OG-CA 3.18Å; P84-P383 HydrophobicContact CG-CB 4.05Å; P84-P383 HydrophobicContact CG-CG 4.27Å; T102-P383 HydrophobicContact CG2-CB 4.2Å; T102-P383 HydrophobicContact CG2-CG 4.05Å; T102-P383 WeakPolarHBondContact OG1-CG 3.4Å; N379-P383 WeakPolarHBondContact O-CD 3.45Å; N379-P383 WeakPolarHBondContact O-CG 3.38Å; I380-P383 WeakPolarHBondContact O-CD 3.47Å; P383-D386 PolarHBondContact O-N 3.22Å; P383-A387 WeakPolarHBondContact O-CB 3.41Å; P383-A387 PolarHBondContact O-N 3.34Å
384	V	93.2	Very high	87.5	Confident	52 Å²	52	36.1 Å²	36.1	32%	0.315	23%	0.225	S	C	.	.	H	α-helix	trans	-70.3	-41.4	179.6	178.8	0	0	0	0	110.3	I380 Q381 T382 D386 A387 I388 I401	I380-V384 WeakPolarHBondContact O-CG2 3.23Å; Q381-V384 WeakPolarHBondContact O-CB 3.33Å; Q381-V384 PolarHBondContact O-N 2.99Å; T382-V384 VanDerWaalsContact C-N 3.29Å; T382-V384 PolarHBondContact O-N 3.46Å; V384-D386 VanDerWaalsContact C-N 3.34Å; V384-D386 PolarHBondContact O-N 3.38Å; V384-A387 PolarHBondContact O-N 2.9Å; V384-I388 HydrophobicContact CG1-CD1 3.86Å; V384-I388 HydrophobicContact CG1-CG1 4.49Å; V384-I388 WeakPolarHBondContact O-CG1 3.14Å; V384-I388 PolarHBondContact O-N 2.86Å; V384-I401 HydrophobicContact CB-CG2 3.97Å; V384-I401 HydrophobicContact CG1-CG2 3.64Å
385	E	90.2	Very high	86.2	Confident	34 Å²	34	43.4 Å²	43.4	16%	0.159	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-46.2	172.6	-70.7	-178.4	-167	0	0	111.3	Q381 T382 A387 I388 G389 R398 I401	Q381-E385 HydrophobicContact CG-CG 4.39Å; Q381-E385 WeakPolarHBondContact CG-OE1 3.32Å; Q381-E385 PolarHBondContact NE2-OE1 3.33Å; Q381-E385 PolarHBondContact O-N 3.35Å; T382-E385 PolarHBondContact O-N 3.14Å; E385-A387 VanDerWaalsContact C-N 3.32Å; E385-A387 PolarHBondContact O-N 3.16Å; E385-I388 PolarHBondContact O-N 3.43Å; E385-G389 PolarHBondContact O-N 2.96Å; E385-R398 VanDerWaalsContact OE1-CG 3.3Å; E385-R398 WeakPolarHBondContact OE1-CG 3.5Å; E385-R398 IonicContact OE1-CZ 3.96Å; E385-R398 IonicContact OE1-NE 2.87Å; E385-R398 PolarHBondContact OE1-NE 3.24Å; E385-R398 IonicContact OE2-CZ 3.77Å; E385-R398 VanDerWaalsContact OE2-CZ 3.24Å; E385-R398 IonicContact OE2-NE 2.61Å; E385-R398 PolarHBondContact OE2-NE 3.25Å; E385-R398 VanDerWaalsContact OE2-NE 3.09Å; E385-R398 IonicContact OE2-NH2 2.71Å; E385-R398 PolarHBondContact OE2-NH2 3.3Å; E385-I401 HydrophobicContact CG-CD1 3.69Å; E385-I401 HydrophobicContact CG-CG2 4.37Å
386	D	89.4	Confident	85.2	Confident	29 Å²	29	48.8 Å²	48.8	16%	0.155	28%	0.28	C	S	.	.	H	α-helix	trans	-64.7	-34.4	178.8	-70.1	-7.3	0	0	0	113.2	R15 S82 K85 T382 P383 V384	R15-D386 IonicContact CZ-OD1 3.11Å; R15-D386 IonicContact CZ-OD2 3.07Å; R15-D386 IonicContact NH2-OD1 2.74Å; R15-D386 PolarHBondContact NH2-OD1 2.93Å; R15-D386 IonicContact NH2-OD2 2.91Å; R15-D386 PolarHBondContact NH2-OD2 3.04Å; S82-D386 WeakPolarHBondContact CB-OD2 3.41Å; S82-D386 PolarHBondContact N-OD2 3.25Å; S82-D386 PolarHBondContact OG-OD2 2.96Å; K85-D386 HydrophobicContact CD-CB 4.38Å; T382-D386 VanDerWaalsContact O-CG 3.31Å; T382-D386 PolarHBondContact O-N 3.16Å; P383-D386 PolarHBondContact O-N 3.22Å; V384-D386 VanDerWaalsContact C-N 3.34Å; V384-D386 PolarHBondContact O-N 3.38Å
387	A	89.3	Confident	84.6	Confident	87 Å²	87	51.5 Å²	51.5	72%	0.719	30%	0.297	S	S	*	.	H	α-helix	trans	-75.3	-35.9	179.6	0	0	0	0	0	112.7	P383 V384 E385	P383-A387 WeakPolarHBondContact O-CB 3.41Å; P383-A387 PolarHBondContact O-N 3.34Å; V384-A387 PolarHBondContact O-N 2.9Å; E385-A387 VanDerWaalsContact C-N 3.32Å; E385-A387 PolarHBondContact O-N 3.16Å
388	I	85	Confident	84.1	Confident	51 Å²	51	53.8 Å²	53.8	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-69.9	-42.6	175.2	-70.9	170.5	0	0	0	110	V384 E385 A392 F396 I401	V384-I388 HydrophobicContact CG1-CD1 3.86Å; V384-I388 HydrophobicContact CG1-CG1 4.49Å; V384-I388 WeakPolarHBondContact O-CG1 3.14Å; V384-I388 PolarHBondContact O-N 2.86Å; E385-I388 PolarHBondContact O-N 3.43Å; I388-A392 HydrophobicContact CG2-CB 3.54Å; I388-F396 HydrophobicContact CD1-CB 4.09Å; I388-F396 HydrophobicContact CG2-CB 4.36Å; I388-I401 HydrophobicContact CD1-CD1 3.59Å; I388-I401 HydrophobicContact CD1-CG1 3.82Å
389	G	75.8	Confident	83.7	Confident	26 Å²	26	56.5 Å²	56.5	27%	0.268	32%	0.323	S	S	.	.	H	α-helix	trans	69.1	174.4	177.2	0	0	0	0	0	114.8	E385 S391 A392 S393	E385-G389 PolarHBondContact O-N 2.96Å; G389-S391 VanDerWaalsContact C-N 3.3Å; G389-S391 PolarHBondContact O-N 3.45Å; G389-A392 PolarHBondContact O-N 3.14Å; G389-S393 PolarHBondContact O-N 2.75Å
390	D	69.2	Low	83.4	Confident	73 Å²	73	58.4 Å²	58.4	39%	0.39	34%	0.338	S	S	.	.	H	α-helix	trans	-57.5	-37.8	-171.2	-64.9	-12.1	0	0	0	114	A392 S393	D390-A392 PolarHBondContact O-N 2.87Å; D390-S393 PolarHBondContact O-OG 2.92Å
391	S	65.9	Low	83.2	Confident	119 Å²	119	58.5 Å²	58.5	83%	0.832	34%	0.339	S	S	*	.	H	α-helix	trans	-72.2	-29.7	-173.2	-59.8	0	0	0	0	113.5	G389	G389-S391 VanDerWaalsContact C-N 3.3Å; G389-S391 PolarHBondContact O-N 3.45Å
392	A	69	Low	83.2	Confident	31 Å²	31	58.5 Å²	58.5	26%	0.256	34%	0.339	S	S	.	.	H	α-helix	trans	-100.2	-8.8	-179.8	0	0	0	0	0	113.1	I388 G389 D390 H394 F395 F396	I388-A392 HydrophobicContact CG2-CB 3.54Å; G389-A392 PolarHBondContact O-N 3.14Å; D390-A392 PolarHBondContact O-N 2.87Å; A392-H394 PolarHBondContact O-N 3.15Å; A392-F395 PolarHBondContact O-N 2.7Å; A392-F396 PolarHBondContact O-N 2.68Å
393	S	70.7	Confident	83.3	Confident	59 Å²	59	62.8 Å²	62.8	41%	0.413	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.6	177.8	72.6	0	0	0	0	113.6	G389 D390 F395 F396	G389-S393 PolarHBondContact O-N 2.75Å; D390-S393 PolarHBondContact O-OG 2.92Å; S393-F395 VanDerWaalsContact C-N 3.31Å; S393-F395 PolarHBondContact O-N 3.25Å; S393-F396 CarbonylContact O-C 3.23Å; S393-F396 VanDerWaalsContact O-C 3.23Å
394	H	69.3	Low	83.4	Confident	161 Å²	161	65 Å²	65	75%	0.745	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-32.1	173.5	-171.6	-69.1	0	0	0	112.6	A392	A392-H394 PolarHBondContact O-N 3.15Å
395	F	70.9	Confident	83.5	Confident	160 Å²	160	63.1 Å²	63.1	70%	0.702	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-33.2	177.3	-67.1	-76.6	0	0	0	112.2	A392 S393 P397	A392-F395 PolarHBondContact O-N 2.7Å; S393-F395 VanDerWaalsContact C-N 3.31Å; S393-F395 PolarHBondContact O-N 3.25Å; F395-P397 VanDerWaalsContact O-CD 3.3Å; F395-P397 WeakPolarHBondContact O-CD 3.47Å
396	F	78.6	Confident	83.9	Confident	116 Å²	116	61.8 Å²	61.8	51%	0.509	36%	0.364	S	S	.	.	S	Bend	trans	-117.5	79.1	178.9	-61.3	-74.9	0	0	0	109.5	I388 A392 S393 I401	I388-F396 HydrophobicContact CD1-CB 4.09Å; I388-F396 HydrophobicContact CG2-CB 4.36Å; A392-F396 PolarHBondContact O-N 2.68Å; S393-F396 CarbonylContact O-C 3.23Å; S393-F396 VanDerWaalsContact O-C 3.23Å; F396-I401 HydrophobicContact CB-CG1 4.35Å
397	P	84.7	Confident	84.3	Confident	56 Å²	56	64 Å²	64	36%	0.364	38%	0.378	S	S	.	.			trans	-62.3	155.9	176.7	27.7	-34.9	0	0	0	110	F395 T399 A400 I401	F395-P397 VanDerWaalsContact O-CD 3.3Å; F395-P397 WeakPolarHBondContact O-CD 3.47Å; P397-T399 PolarHBondContact O-N 3.34Å; P397-A400 HydrophobicContact CG-CB 3.94Å; P397-A400 WeakPolarHBondContact O-CA 3.45Å; P397-A400 WeakPolarHBondContact O-CB 3.32Å; P397-A400 PolarHBondContact O-N 2.79Å; P397-I401 PolarHBondContact O-N 2.95Å; P397-I401 VanDerWaalsContact O-N 3.13Å
398	R	86.5	Confident	84.7	Confident	49 Å²	49	64.3 Å²	64.3	19%	0.185	37%	0.367	C	S	.	.	H	α-helix	trans	-46.2	-41.1	177	172.1	166.5	-66	178	24.4	113.2	D16 E385 A400 I401 C402	D16-R398 IonicContact OD2-CZ 2.67Å; D16-R398 IonicContact OD2-NH1 3.2Å; D16-R398 PolarHBondContact OD2-NH1 2.84Å; D16-R398 IonicContact OD2-NH2 3.26Å; D16-R398 PolarHBondContact OD2-NH2 3.14Å; E385-R398 VanDerWaalsContact OE1-CG 3.3Å; E385-R398 WeakPolarHBondContact OE1-CG 3.5Å; E385-R398 IonicContact OE1-CZ 3.96Å; E385-R398 IonicContact OE1-NE 2.87Å; E385-R398 PolarHBondContact OE1-NE 3.24Å; E385-R398 IonicContact OE2-CZ 3.77Å; E385-R398 VanDerWaalsContact OE2-CZ 3.24Å; E385-R398 IonicContact OE2-NE 2.61Å; E385-R398 PolarHBondContact OE2-NE 3.25Å; E385-R398 VanDerWaalsContact OE2-NE 3.09Å; E385-R398 IonicContact OE2-NH2 2.71Å; E385-R398 PolarHBondContact OE2-NH2 3.3Å; R398-A400 VanDerWaalsContact C-N 3.33Å; R398-A400 PolarHBondContact O-N 2.96Å; R398-I401 PolarHBondContact O-N 3.47Å; R398-C402 WeakPolarHBondContact O-CB 3.39Å; R398-C402 PolarHBondContact O-N 3.33Å
399	T	90.4	Very high	85.3	Confident	59 Å²	59	61.9 Å²	61.9	36%	0.362	36%	0.355	S	S	.	.	H	α-helix	trans	-60.4	-40.2	178.1	52.2	0	0	0	0	112.5	F207 P397 L403	F207-T399 HydrophobicContact CB-CG2 4.28Å; F207-T399 HydrophobicContact CD2-CG2 4Å; F207-T399 WeakPolarHBondContact O-CG2 3.5Å; P397-T399 PolarHBondContact O-N 3.34Å; T399-L403 WeakPolarHBondContact O-CB 3.32Å; T399-L403 PolarHBondContact O-N 3.42Å
400	A	92	Very high	86.4	Confident	40 Å²	40	63.1 Å²	63.1	33%	0.331	35%	0.353	S	S	.	.	H	α-helix	trans	-70.1	-39.8	176.8	0	0	0	0	0	111.6	P397 R398 L403 A404	P397-A400 HydrophobicContact CG-CB 3.94Å; P397-A400 WeakPolarHBondContact O-CA 3.45Å; P397-A400 WeakPolarHBondContact O-CB 3.32Å; P397-A400 PolarHBondContact O-N 2.79Å; R398-A400 VanDerWaalsContact C-N 3.33Å; R398-A400 PolarHBondContact O-N 2.96Å; A400-L403 PolarHBondContact O-N 3Å; A400-A404 WeakPolarHBondContact O-CB 3.37Å; A400-A404 PolarHBondContact O-N 2.91Å
401	I	92.8	Very high	87.8	Confident	12 Å²	12	63.9 Å²	63.9	6%	0.062	36%	0.36	C	S	.	.	H	α-helix	trans	-62.6	-47.9	175	-61.2	169.1	0	0	0	110.1	Q381 V384 E385 I388 F396 P397 R398 L403 A404 V405	Q381-I401 HydrophobicContact CG-CG2 4.08Å; V384-I401 HydrophobicContact CB-CG2 3.97Å; V384-I401 HydrophobicContact CG1-CG2 3.64Å; E385-I401 HydrophobicContact CG-CD1 3.69Å; E385-I401 HydrophobicContact CG-CG2 4.37Å; I388-I401 HydrophobicContact CD1-CD1 3.59Å; I388-I401 HydrophobicContact CD1-CG1 3.82Å; F396-I401 HydrophobicContact CB-CG1 4.35Å; P397-I401 PolarHBondContact O-N 2.95Å; P397-I401 VanDerWaalsContact O-N 3.13Å; R398-I401 PolarHBondContact O-N 3.47Å; I401-L403 VanDerWaalsContact C-N 3.32Å; I401-L403 PolarHBondContact O-N 2.99Å; I401-A404 PolarHBondContact O-N 3.37Å; I401-A404 VanDerWaalsContact O-N 3.15Å; I401-V405 HydrophobicContact CG2-CG2 4.39Å; I401-V405 WeakPolarHBondContact O-CG2 3.45Å; I401-V405 PolarHBondContact O-N 3.11Å
402	C	95	Very high	89.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-57.7	-45.6	177.1	-169.8	0	0	0	0	111.3	F203 Q381 R398 A404 V405 C406	F203-C402 HydrophobicContact CD2-CB 4.28Å; F203-C402 HydrophobicContact CE2-CB 4.33Å; Q381-C402 PolarHBondContact OE1-SG 3.23Å; Q381-C402 VanDerWaalsContact OE1-SG 3.39Å; R398-C402 WeakPolarHBondContact O-CB 3.39Å; R398-C402 PolarHBondContact O-N 3.33Å; C402-A404 PolarHBondContact O-N 2.87Å; C402-V405 PolarHBondContact O-N 3.48Å; C402-C406 WeakPolarHBondContact O-CB 3.37Å; C402-C406 PolarHBondContact O-N 2.98Å; C402-C406 PolarHBondContact O-SG 3.4Å
403	L	96.5	Very high	90.6	Very high	92 Å²	92	59.2 Å²	59.2	48%	0.482	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-43.7	175.8	-176.4	64.1	0	0	0	111.6	F203 T399 A400 I401 C406 T407	F203-L403 HydrophobicContact CD2-CB 4.32Å; F203-L403 HydrophobicContact CD2-CD1 4.38Å; F203-L403 HydrophobicContact CE2-CB 3.79Å; F203-L403 HydrophobicContact CE2-CD1 4.17Å; F203-L403 HydrophobicContact CZ-CD1 4.49Å; T399-L403 WeakPolarHBondContact O-CB 3.32Å; T399-L403 PolarHBondContact O-N 3.42Å; A400-L403 PolarHBondContact O-N 3Å; I401-L403 VanDerWaalsContact C-N 3.32Å; I401-L403 PolarHBondContact O-N 2.99Å; L403-C406 PolarHBondContact O-N 3.16Å; L403-T407 VanDerWaalsContact O-CB 3.29Å; L403-T407 WeakPolarHBondContact O-CB 3.46Å; L403-T407 PolarHBondContact O-N 3.15Å; L403-T407 PolarHBondContact O-OG1 3.13Å
404	A	96.2	Very high	91.9	Very high	60 Å²	60	58.7 Å²	58.7	50%	0.496	31%	0.313	S	S	.	.	H	α-helix	trans	-64.6	-44.5	179.5	0	0	0	0	0	112	A400 I401 C402 T407 L408	A400-A404 WeakPolarHBondContact O-CB 3.37Å; A400-A404 PolarHBondContact O-N 2.91Å; I401-A404 PolarHBondContact O-N 3.37Å; I401-A404 VanDerWaalsContact O-N 3.15Å; C402-A404 PolarHBondContact O-N 2.87Å; A404-T407 PolarHBondContact O-N 3.41Å; A404-L408 WeakPolarHBondContact O-CB 3.46Å; A404-L408 PolarHBondContact O-N 3.33Å
405	V	96.7	Very high	93	Very high	11 Å²	11	53.2 Å²	53.2	7%	0.067	30%	0.301	C	S	.	.	H	α-helix	trans	-61.9	-47.1	176.3	172.3	0	0	0	0	110.8	V377 I380 I401 C402 T407 L408 G409	V377-V405 HydrophobicContact CG1-CG1 3.98Å; I380-V405 HydrophobicContact CB-CG1 4.15Å; I380-V405 HydrophobicContact CG2-CG1 3.74Å; I380-V405 HydrophobicContact CG2-CG2 4.26Å; I401-V405 HydrophobicContact CG2-CG2 4.39Å; I401-V405 WeakPolarHBondContact O-CG2 3.45Å; I401-V405 PolarHBondContact O-N 3.11Å; C402-V405 PolarHBondContact O-N 3.48Å; V405-T407 VanDerWaalsContact C-N 3.34Å; V405-T407 PolarHBondContact O-N 2.84Å; V405-L408 PolarHBondContact O-N 3.39Å; V405-G409 PolarHBondContact O-N 3.2Å
406	C	98.2	Very high	94	Very high	7 Å²	7	46.6 Å²	46.6	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-39.1	177.8	-65.1	0	0	0	0	112	W199 F203 C402 L403 G409 F410	W199-C406 HydrophobicContact CE3-CB 3.83Å; W199-C406 HydrophobicContact CZ3-CB 4.4Å; F203-C406 HydrophobicContact CB-CB 4.47Å; C402-C406 WeakPolarHBondContact O-CB 3.37Å; C402-C406 PolarHBondContact O-N 2.98Å; C402-C406 PolarHBondContact O-SG 3.4Å; L403-C406 PolarHBondContact O-N 3.16Å; C406-G409 PolarHBondContact O-N 2.67Å; C406-F410 WeakPolarHBondContact O-CB 3.49Å; C406-F410 PolarHBondContact O-N 3.22Å
407	T	98.1	Very high	94.8	Very high	74 Å²	74	41 Å²	41	45%	0.454	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-45.2	177.4	-56.2	0	0	0	0	111.3	L403 A404 V405 F410 V411	L403-T407 VanDerWaalsContact O-CB 3.29Å; L403-T407 WeakPolarHBondContact O-CB 3.46Å; L403-T407 PolarHBondContact O-N 3.15Å; L403-T407 PolarHBondContact O-OG1 3.13Å; A404-T407 PolarHBondContact O-N 3.41Å; V405-T407 VanDerWaalsContact C-N 3.34Å; V405-T407 PolarHBondContact O-N 2.84Å; T407-F410 PolarHBondContact O-N 2.96Å; T407-V411 WeakPolarHBondContact O-CG2 3.49Å; T407-V411 PolarHBondContact O-N 3.06Å
408	L	97.8	Very high	95.3	Very high	94 Å²	94	39.2 Å²	39.2	49%	0.492	24%	0.235	S	C	.	.	H	α-helix	trans	-61.3	-46.9	175.6	177	62.7	0	0	0	111.1	L106 A404 V405 F410 V411 I412	L106-L408 HydrophobicContact CD2-CD2 4.12Å; A404-L408 WeakPolarHBondContact O-CB 3.46Å; A404-L408 PolarHBondContact O-N 3.33Å; V405-L408 PolarHBondContact O-N 3.39Å; L408-F410 VanDerWaalsContact C-N 3.32Å; L408-F410 PolarHBondContact O-N 3.13Å; L408-V411 PolarHBondContact O-N 3.24Å; L408-I412 HydrophobicContact CD1-CD1 4.28Å; L408-I412 HydrophobicContact CG-CD1 4.15Å; L408-I412 WeakPolarHBondContact O-CG1 3.43Å; L408-I412 PolarHBondContact O-N 3.19Å
409	G	98	Very high	95.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.6	-40.9	176.5	0	0	0	0	0	112.7	V405 C406 I412 T413	V405-G409 PolarHBondContact O-N 3.2Å; C406-G409 PolarHBondContact O-N 2.67Å; G409-I412 PolarHBondContact O-N 3.39Å; G409-T413 WeakPolarHBondContact O-CB 3.07Å; G409-T413 PolarHBondContact O-N 3.17Å; G409-T413 PolarHBondContact O-OG1 3.39Å
410	F	98.2	Very high	95.7	Very high	53 Å²	53	35.6 Å²	35.6	23%	0.232	22%	0.216	C	C	.	.	H	α-helix	trans	-61.1	-48	174.2	176.8	-111.1	0	0	0	111.8	I192 A196 W199 C406 T407 L408 I412 T413 L414	I192-F410 HydrophobicContact CG2-CE2 4.43Å; I192-F410 HydrophobicContact CG2-CZ 4.08Å; A196-F410 HydrophobicContact CB-CD2 4.44Å; A196-F410 HydrophobicContact CB-CE2 3.71Å; A196-F410 HydrophobicContact CB-CZ 4.15Å; W199-F410 AromaticContact CD1-CD2 3.78Å; W199-F410 HydrophobicContact CG-CB 4.02Å; C406-F410 WeakPolarHBondContact O-CB 3.49Å; C406-F410 PolarHBondContact O-N 3.22Å; T407-F410 PolarHBondContact O-N 2.96Å; L408-F410 VanDerWaalsContact C-N 3.32Å; L408-F410 PolarHBondContact O-N 3.13Å; F410-I412 VanDerWaalsContact C-N 3.31Å; F410-I412 PolarHBondContact O-N 3.17Å; F410-T413 WeakPolarHBondContact O-CB 3.46Å; F410-T413 PolarHBondContact O-N 2.76Å; F410-T413 VanDerWaalsContact O-N 3.07Å; F410-L414 HydrophobicContact CE1-CD1 4.35Å; F410-L414 HydrophobicContact CE1-CD2 4.25Å; F410-L414 HydrophobicContact CE1-CG 4.46Å; F410-L414 HydrophobicContact CE2-CD2 4.12Å; F410-L414 HydrophobicContact CZ-CD2 3.83Å; F410-L414 HydrophobicContact CZ-CG 4.48Å; F410-L414 WeakPolarHBondContact O-CG 3.33Å; F410-L414 PolarHBondContact O-N 2.97Å
411	V	98.1	Very high	95.7	Very high	88 Å²	88	33.7 Å²	33.7	53%	0.533	20%	0.2	S	C	.	.	H	α-helix	trans	-58.8	-42	177.8	171.3	0	0	0	0	111.6	T407 L408 L414	T407-V411 WeakPolarHBondContact O-CG2 3.49Å; T407-V411 PolarHBondContact O-N 3.06Å; L408-V411 PolarHBondContact O-N 3.24Å; V411-L414 WeakPolarHBondContact O-CB 3.44Å; V411-L414 PolarHBondContact O-N 3.07Å
412	I	96.9	Very high	95.7	Very high	52 Å²	52	33.4 Å²	33.4	27%	0.267	20%	0.199	S	C	.	.	H	α-helix	trans	-64.5	-42.4	175.4	-64.1	167.5	0	0	0	110.6	L106 S110 L408 G409 F410 L414 G415 Y416	L106-I412 HydrophobicContact CD1-CD1 4.07Å; L106-I412 HydrophobicContact CD2-CD1 3.83Å; L106-I412 HydrophobicContact CG-CD1 3.88Å; S110-I412 WeakPolarHBondContact OG-CG2 3.26Å; L408-I412 HydrophobicContact CD1-CD1 4.28Å; L408-I412 HydrophobicContact CG-CD1 4.15Å; L408-I412 WeakPolarHBondContact O-CG1 3.43Å; L408-I412 PolarHBondContact O-N 3.19Å; G409-I412 PolarHBondContact O-N 3.39Å; F410-I412 VanDerWaalsContact C-N 3.31Å; F410-I412 PolarHBondContact O-N 3.17Å; I412-L414 PolarHBondContact O-N 3.35Å; I412-G415 PolarHBondContact O-N 3.32Å; I412-Y416 HydrophobicContact CG2-CE2 4.39Å
413	T	97.8	Very high	95.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-30.5	180	-52.4	0	0	0	0	112.5	V113 A114 S195 W199 G409 F410 G415 Y416 N417	V113-T413 HydrophobicContact CB-CG2 4.09Å; V113-T413 HydrophobicContact CG1-CG2 3.83Å; A114-T413 HydrophobicContact CB-CG2 4.41Å; S195-T413 WeakPolarHBondContact OG-CG2 3.44Å; W199-T413 PolarHBondContact NE1-OG1 3.08Å; W199-T413 VanDerWaalsContact NE1-OG1 3.09Å; G409-T413 WeakPolarHBondContact O-CB 3.07Å; G409-T413 PolarHBondContact O-N 3.17Å; G409-T413 PolarHBondContact O-OG1 3.39Å; F410-T413 WeakPolarHBondContact O-CB 3.46Å; F410-T413 PolarHBondContact O-N 2.76Å; F410-T413 VanDerWaalsContact O-N 3.07Å; T413-G415 PolarHBondContact O-N 3.44Å; T413-G415 VanDerWaalsContact O-N 3.15Å; T413-Y416 PolarHBondContact O-N 3.28Å; T413-N417 PolarHBondContact O-N 3.18Å
414	L	96.5	Very high	95.1	Very high	48 Å²	48	32.2 Å²	32.2	25%	0.251	20%	0.196	S	C	.	.	H	α-helix	trans	-56.1	-31.6	175.4	-65.3	177.9	0	0	0	112.2	L187 I192 F410 V411 I412 Y416 N417	L187-L414 VanDerWaalsContact CD2-O 3.27Å; L187-L414 WeakPolarHBondContact CD2-O 3.4Å; I192-L414 HydrophobicContact CD1-CD2 4.26Å; I192-L414 HydrophobicContact CG1-CD2 3.89Å; I192-L414 HydrophobicContact CG2-CD2 4.03Å; F410-L414 HydrophobicContact CE1-CD1 4.35Å; F410-L414 HydrophobicContact CE1-CD2 4.25Å; F410-L414 HydrophobicContact CE1-CG 4.46Å; F410-L414 HydrophobicContact CE2-CD2 4.12Å; F410-L414 HydrophobicContact CZ-CD2 3.83Å; F410-L414 HydrophobicContact CZ-CG 4.48Å; F410-L414 WeakPolarHBondContact O-CG 3.33Å; F410-L414 PolarHBondContact O-N 2.97Å; V411-L414 WeakPolarHBondContact O-CB 3.44Å; V411-L414 PolarHBondContact O-N 3.07Å; I412-L414 PolarHBondContact O-N 3.35Å; L414-Y416 PolarHBondContact O-N 3.02Å; L414-N417 PolarHBondContact O-N 2.93Å; L414-N417 VanDerWaalsContact O-N 3.15Å
415	G	92.5	Very high	95	Very high	47 Å²	47	29.3 Å²	29.3	49%	0.485	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-22	174.7	0	0	0	0	0	113.9	I412 T413	I412-G415 PolarHBondContact O-N 3.32Å; T413-G415 PolarHBondContact O-N 3.44Å; T413-G415 VanDerWaalsContact O-N 3.15Å
416	Y	93.1	Very high	94.7	Very high	20 Å²	20	33.8 Å²	33.8	8%	0.078	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-3.6	178.8	-49.5	-49.5	0	0	0	114.2	L107 S110 I111 A114 Y118 I412 T413 L414 T418 G421 V424 I425 I428	L107-Y416 WeakPolarHBondContact CD1-OH 3.11Å; S110-Y416 WeakPolarHBondContact OG-CE2 3.43Å; I111-Y416 HydrophobicContact CG1-CE2 4.08Å; A114-Y416 HydrophobicContact CB-CD2 4.34Å; A114-Y416 HydrophobicContact CB-CG 4.46Å; Y118-Y416 PolarHBondContact OH-O 3.27Å; I412-Y416 HydrophobicContact CG2-CE2 4.39Å; T413-Y416 PolarHBondContact O-N 3.28Å; L414-Y416 PolarHBondContact O-N 3.02Å; Y416-T418 VanDerWaalsContact C-N 3.25Å; Y416-T418 PolarHBondContact O-N 3.4Å; Y416-G421 WeakPolarHBondContact O-CA 3.34Å; Y416-V424 HydrophobicContact CE1-CG1 4.47Å; Y416-I425 HydrophobicContact CD1-CD1 4.35Å; Y416-I425 HydrophobicContact CD1-CG1 3.74Å; Y416-I425 HydrophobicContact CE1-CG1 4.34Å; Y416-I425 HydrophobicContact CG-CD1 4.01Å; Y416-I425 HydrophobicContact CG-CG1 3.88Å; Y416-I428 HydrophobicContact CE1-CD1 3.62Å
417	N	95.6	Very high	94.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-92.5	17.7	178.2	-61.1	154.5	0	0	0	112.6	L187 Q188 L191 I192 S195 T413 L414	L187-N417 HydrophobicContact CD2-CB 4.43Å; Q188-N417 PolarHBondContact N-O 3.49Å; L191-N417 HydrophobicContact CB-CB 3.99Å; I192-N417 HydrophobicContact CG1-CB 3.89Å; S195-N417 WeakPolarHBondContact CB-OD1 3.28Å; S195-N417 PolarHBondContact OG-ND2 2.95Å; S195-N417 VanDerWaalsContact OG-ND2 3.13Å; S195-N417 PolarHBondContact OG-OD1 3.17Å; T413-N417 PolarHBondContact O-N 3.18Å; L414-N417 PolarHBondContact O-N 2.93Å; L414-N417 VanDerWaalsContact O-N 3.15Å
418	T	94.7	Very high	93.9	Very high	18 Å²	18	31.6 Å²	31.6	11%	0.11	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-86	164.6	171	62.9	0	0	0	0	110.9	T184 K186 L187 Y416 S420 G421	T184-T418 VanDerWaalsContact O-CB 3.32Å; T184-T418 WeakPolarHBondContact O-CB 3.31Å; K186-T418 WeakPolarHBondContact O-CA 3.01Å; L187-T418 HydrophobicContact CD2-CG2 3.71Å; L187-T418 HydrophobicContact CG-CG2 4.37Å; Y416-T418 VanDerWaalsContact C-N 3.25Å; Y416-T418 PolarHBondContact O-N 3.4Å; T418-S420 PolarHBondContact O-N 2.89Å; T418-S420 PolarHBondContact OG1-OG 3.49Å; T418-G421 PolarHBondContact O-N 2.9Å; T418-G421 PolarHBondContact OG1-N 3.22Å
419	Q	94.2	Very high	93.6	Very high	31 Å²	31	29.1 Å²	29.1	15%	0.145	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-27.1	175.6	-70.5	173.2	-68	0	0	113.5	N176 A177 T178 K186 Q188	N176-Q419 PolarHBondContact ND2-NE2 3.34Å; N176-Q419 WeakPolarHBondContact O-CB 3.4Å; N176-Q419 VanDerWaalsContact O-CD 3.3Å; N176-Q419 WeakPolarHBondContact O-CG 3.43Å; N176-Q419 PolarHBondContact O-NE2 2.82Å; A177-Q419 WeakPolarHBondContact CA-O 3.22Å; T178-Q419 HydrophobicContact CG2-CB 3.82Å; K186-Q419 PolarHBondContact O-N 2.91Å; Q188-Q419 HydrophobicContact CG-CG 4.24Å
420	S	90.9	Very high	93.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.007	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1.2	174.1	60.9	0	0	0	0	114	T184 T418 F422 P423 V424	T184-S420 WeakPolarHBondContact CA-OG 3.13Å; T184-S420 PolarHBondContact O-N 3.35Å; T184-S420 PolarHBondContact O-OG 3.48Å; T418-S420 PolarHBondContact O-N 2.89Å; T418-S420 PolarHBondContact OG1-OG 3.49Å; S420-F422 PolarHBondContact O-N 2.92Å; S420-P423 WeakPolarHBondContact O-CD 3.23Å; S420-P423 WeakPolarHBondContact O-CG 3.21Å; S420-V424 VanDerWaalsContact O-CG2 3.29Å; S420-V424 WeakPolarHBondContact O-CG2 3.28Å; S420-V424 PolarHBondContact O-N 2.77Å; S420-V424 VanDerWaalsContact O-N 3.14Å
421	G	92.5	Very high	92.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-39.7	-170.2	0	0	0	0	0	113.7	Y416 T418 V424 I425	Y416-G421 WeakPolarHBondContact O-CA 3.34Å; T418-G421 PolarHBondContact O-N 2.9Å; T418-G421 PolarHBondContact OG1-N 3.22Å; G421-V424 PolarHBondContact O-N 2.97Å; G421-I425 VanDerWaalsContact O-CG1 3.32Å; G421-I425 WeakPolarHBondContact O-CG1 3.34Å; G421-I425 PolarHBondContact O-N 3.47Å
422	F	92.2	Very high	92.3	Very high	5 Å²	5	29.5 Å²	29.5	2%	0.022	16%	0.156	C	C	.	.	H	α-helix	trans	-64.5	-49.2	-179.7	-174.6	-110.9	0	0	0	113.9	Y115 Y118 F170 L175 F338 S420 V424 I425 R426	Y115-F422 HydrophobicContact CE1-CD2 4.37Å; Y115-F422 HydrophobicContact CE1-CE2 4.03Å; Y118-F422 HydrophobicContact CD2-CD2 4.09Å; Y118-F422 HydrophobicContact CE2-CB 4.43Å; Y118-F422 AromaticContact CE2-CD2 3.62Å; Y118-F422 HydrophobicContact CE2-CD2 3.62Å; Y118-F422 HydrophobicContact CE2-CE2 4.41Å; Y118-F422 PolarHBondContact OH-N 3.13Å; F170-F422 HydrophobicContact CD1-CE1 4.34Å; F170-F422 HydrophobicContact CD1-CZ 4.45Å; F170-F422 HydrophobicContact CE1-CD1 4.03Å; F170-F422 AromaticContact CE1-CD2 3.94Å; F170-F422 HydrophobicContact CE1-CD2 3.94Å; F170-F422 AromaticContact CE1-CE1 3.83Å; F170-F422 HydrophobicContact CE1-CE1 3.83Å; F170-F422 AromaticContact CE1-CE2 3.79Å; F170-F422 HydrophobicContact CE1-CE2 3.79Å; F170-F422 HydrophobicContact CE1-CG 4.06Å; F170-F422 AromaticContact CE1-CZ 3.72Å; F170-F422 HydrophobicContact CE1-CZ 3.72Å; F170-F422 HydrophobicContact CZ-CD2 4.33Å; F170-F422 HydrophobicContact CZ-CE2 4.29Å; L175-F422 HydrophobicContact CD1-CB 3.48Å; L175-F422 VanDerWaalsContact CD1-CB 3.48Å; L175-F422 HydrophobicContact CD1-CD1 3.89Å; L175-F422 HydrophobicContact CD1-CG 3.77Å; L175-F422 HydrophobicContact CD2-CB 4.43Å; F338-F422 HydrophobicContact CB-CE2 4.01Å; F338-F422 HydrophobicContact CB-CZ 4.25Å; F338-F422 AromaticContact CD1-CE2 3.8Å; F338-F422 HydrophobicContact CD1-CE2 3.8Å; F338-F422 HydrophobicContact CD1-CZ 4.02Å; F338-F422 AromaticContact CG-CE2 4Å; F338-F422 HydrophobicContact CG-CE2 4Å; F338-F422 HydrophobicContact CG-CZ 4.44Å; S420-F422 PolarHBondContact O-N 2.92Å; F422-V424 VanDerWaalsContact C-N 3.33Å; F422-V424 PolarHBondContact O-N 3.2Å; F422-I425 PolarHBondContact O-N 3.28Å; F422-R426 WeakPolarHBondContact O-CG 3.27Å; F422-R426 PolarHBondContact O-N 2.88Å; F422-R426 VanDerWaalsContact O-N 3.09Å
423	P	89.2	Confident	91.9	Very high	42 Å²	42	30 Å²	30	27%	0.273	16%	0.159	S	C	.	.	H	α-helix	trans	-66	-33	173.6	24.5	-33.4	0	0	0	113	V181 S420 R426 I427	V181-P423 HydrophobicContact CG2-CB 3.96Å; V181-P423 HydrophobicContact CG2-CG 4.36Å; S420-P423 WeakPolarHBondContact O-CD 3.23Å; S420-P423 WeakPolarHBondContact O-CG 3.21Å; P423-R426 PolarHBondContact O-N 2.88Å; P423-I427 WeakPolarHBondContact O-CG1 3.26Å; P423-I427 PolarHBondContact O-N 3.15Å; P423-I427 VanDerWaalsContact O-N 3.13Å
424	V	90.4	Very high	91.4	Very high	25 Å²	25	30.5 Å²	30.5	15%	0.152	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-47.2	171.7	170.8	0	0	0	0	111	V181 Y416 S420 G421 F422 R426 I427 I428	V181-V424 HydrophobicContact CG1-CG2 3.54Å; Y416-V424 HydrophobicContact CE1-CG1 4.47Å; S420-V424 VanDerWaalsContact O-CG2 3.29Å; S420-V424 WeakPolarHBondContact O-CG2 3.28Å; S420-V424 PolarHBondContact O-N 2.77Å; S420-V424 VanDerWaalsContact O-N 3.14Å; G421-V424 PolarHBondContact O-N 2.97Å; F422-V424 VanDerWaalsContact C-N 3.33Å; F422-V424 PolarHBondContact O-N 3.2Å; V424-R426 VanDerWaalsContact C-N 3.32Å; V424-R426 PolarHBondContact O-N 3.38Å; V424-I427 WeakPolarHBondContact O-CB 3.05Å; V424-I427 PolarHBondContact O-N 3.15Å; V424-I428 HydrophobicContact CG1-CD1 3.76Å; V424-I428 HydrophobicContact CG1-CG1 4.42Å; V424-I428 WeakPolarHBondContact O-CG1 3.28Å; V424-I428 PolarHBondContact O-N 2.9Å
425	I	92.9	Very high	90.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57.6	-45.8	176.4	-74	163.7	0	0	0	110.7	I111 A114 Y115 Y118 Y416 G421 F422 I427 I428 V429	I111-I425 HydrophobicContact CG2-CG2 3.64Å; A114-I425 HydrophobicContact CB-CD1 3.63Å; Y115-I425 HydrophobicContact CE1-CG2 4.17Å; Y115-I425 HydrophobicContact CE2-CG2 4.19Å; Y115-I425 VanDerWaalsContact OH-CG2 3.24Å; Y115-I425 WeakPolarHBondContact OH-CG2 3.34Å; Y118-I425 HydrophobicContact CE2-CD1 4.1Å; Y118-I425 WeakPolarHBondContact OH-CD1 3.13Å; Y416-I425 HydrophobicContact CD1-CD1 4.35Å; Y416-I425 HydrophobicContact CD1-CG1 3.74Å; Y416-I425 HydrophobicContact CE1-CG1 4.34Å; Y416-I425 HydrophobicContact CG-CD1 4.01Å; Y416-I425 HydrophobicContact CG-CG1 3.88Å; G421-I425 VanDerWaalsContact O-CG1 3.32Å; G421-I425 WeakPolarHBondContact O-CG1 3.34Å; G421-I425 PolarHBondContact O-N 3.47Å; F422-I425 PolarHBondContact O-N 3.28Å; I425-I427 VanDerWaalsContact C-N 3.27Å; I425-I427 PolarHBondContact O-N 3.24Å; I425-I428 PolarHBondContact O-N 3.31Å; I425-I428 VanDerWaalsContact O-N 3.13Å; I425-V429 HydrophobicContact CG2-CG2 3.94Å; I425-V429 WeakPolarHBondContact O-CB 2.98Å; I425-V429 WeakPolarHBondContact O-CG2 3.36Å; I425-V429 PolarHBondContact O-N 3.43Å
426	R	90	Very high	90.3	Very high	105 Å²	105	28.2 Å²	28.2	40%	0.396	14%	0.136	S	C	.	.	H	α-helix	trans	-57.6	-41.1	179.5	-74	176.7	169.2	-165.9	-8.3	112.1	S339 F422 P423 V424 K430	S339-R426 PolarHBondContact OG-NH2 3.04Å; F422-R426 WeakPolarHBondContact O-CG 3.27Å; F422-R426 PolarHBondContact O-N 2.88Å; F422-R426 VanDerWaalsContact O-N 3.09Å; P423-R426 PolarHBondContact O-N 2.88Å; V424-R426 VanDerWaalsContact C-N 3.32Å; V424-R426 PolarHBondContact O-N 3.38Å; R426-K430 WeakPolarHBondContact O-CB 3.41Å; R426-K430 PolarHBondContact O-N 3.21Å; R426-K430 VanDerWaalsContact O-N 3.09Å
427	I	88.5	Confident	90.3	Very high	25 Å²	25	27.5 Å²	27.5	13%	0.128	13%	0.134	C	C	.	.	H	α-helix	trans	-64.4	-49.2	175.4	-69	159.7	0	0	0	110.5	V181 P423 V424 I425 V429 K430 Y431 V511 I514	V181-I427 HydrophobicContact CB-CD1 4.45Å; V181-I427 HydrophobicContact CG1-CD1 3.88Å; V181-I427 HydrophobicContact CG2-CD1 3.96Å; P423-I427 WeakPolarHBondContact O-CG1 3.26Å; P423-I427 PolarHBondContact O-N 3.15Å; P423-I427 VanDerWaalsContact O-N 3.13Å; V424-I427 WeakPolarHBondContact O-CB 3.05Å; V424-I427 PolarHBondContact O-N 3.15Å; I425-I427 VanDerWaalsContact C-N 3.27Å; I425-I427 PolarHBondContact O-N 3.24Å; I427-V429 PolarHBondContact O-N 2.98Å; I427-K430 WeakPolarHBondContact O-CB 3.34Å; I427-K430 PolarHBondContact O-N 3.3Å; I427-Y431 HydrophobicContact CG2-CD2 3.79Å; I427-Y431 HydrophobicContact CG2-CE2 3.79Å; I427-Y431 VanDerWaalsContact O-CD2 3.27Å; I427-Y431 WeakPolarHBondContact O-CD2 3.14Å; I427-Y431 PolarHBondContact O-N 3.2Å; I427-Y431 VanDerWaalsContact O-N 3.1Å; I427-V511 HydrophobicContact CD1-CG2 3.95Å; I427-V511 HydrophobicContact CG1-CG1 4.42Å; I427-V511 HydrophobicContact CG2-CG1 3.82Å; I427-I514 HydrophobicContact CG2-CB 4.37Å; I427-I514 HydrophobicContact CG2-CG2 3.99Å
428	I	91.4	Very high	90.3	Very high	9 Å²	9	27.6 Å²	27.6	5%	0.046	14%	0.135	C	C	.	.	H	α-helix	trans	-58.7	-49.9	-179.8	-71.4	170.4	0	0	0	111	L107 I111 Y416 V424 I425 K430 Y431 L432 I514 M518	L107-I428 HydrophobicContact CD2-CG2 4.29Å; I111-I428 HydrophobicContact CD1-CG2 3.73Å; Y416-I428 HydrophobicContact CE1-CD1 3.62Å; V424-I428 HydrophobicContact CG1-CD1 3.76Å; V424-I428 HydrophobicContact CG1-CG1 4.42Å; V424-I428 WeakPolarHBondContact O-CG1 3.28Å; V424-I428 PolarHBondContact O-N 2.9Å; I425-I428 PolarHBondContact O-N 3.31Å; I425-I428 VanDerWaalsContact O-N 3.13Å; I428-K430 VanDerWaalsContact C-N 3.31Å; I428-K430 PolarHBondContact O-N 3.35Å; I428-Y431 PolarHBondContact O-N 3.49Å; I428-Y431 VanDerWaalsContact O-N 3.15Å; I428-L432 HydrophobicContact CG2-CD1 3.77Å; I428-L432 HydrophobicContact CG2-CG 4.12Å; I428-L432 WeakPolarHBondContact O-CG 3.46Å; I428-L432 PolarHBondContact O-N 3.41Å; I428-I514 HydrophobicContact CD1-CG2 4.42Å; I428-I514 HydrophobicContact CG1-CG2 3.52Å; I428-M518 HydrophobicContact CG1-SD 4.47Å; I428-M518 HydrophobicContact CG2-CG 4.47Å; I428-M518 HydrophobicContact CG2-SD 3.66Å
429	V	91.4	Very high	90.3	Very high	43 Å²	43	31 Å²	31	26%	0.261	15%	0.148	S	C	.	.	H	α-helix	trans	-59.9	-42.2	179.9	171.6	0	0	0	0	110.8	I111 I425 I427 Y431 L432 D433	I111-V429 HydrophobicContact CD1-CG2 4.24Å; I111-V429 HydrophobicContact CG2-CG2 4.09Å; I425-V429 HydrophobicContact CG2-CG2 3.94Å; I425-V429 WeakPolarHBondContact O-CB 2.98Å; I425-V429 WeakPolarHBondContact O-CG2 3.36Å; I425-V429 PolarHBondContact O-N 3.43Å; I427-V429 PolarHBondContact O-N 2.98Å; V429-Y431 VanDerWaalsContact C-N 3.34Å; V429-Y431 PolarHBondContact O-N 3.01Å; V429-L432 PolarHBondContact O-N 3.32Å; V429-D433 WeakPolarHBondContact O-CB 3.19Å; V429-D433 PolarHBondContact O-N 2.93Å
430	K	88.8	Confident	90.4	Very high	119 Å²	119	29.5 Å²	29.5	52%	0.517	14%	0.141	S	C	.	.	H	α-helix	trans	-57.9	-44.3	175.5	-177.1	179.2	179	-179.6	0	112.2	R426 I427 I428 L434	R426-K430 WeakPolarHBondContact O-CB 3.41Å; R426-K430 PolarHBondContact O-N 3.21Å; R426-K430 VanDerWaalsContact O-N 3.09Å; I427-K430 WeakPolarHBondContact O-CB 3.34Å; I427-K430 PolarHBondContact O-N 3.3Å; I428-K430 VanDerWaalsContact C-N 3.31Å; I428-K430 PolarHBondContact O-N 3.35Å; K430-L434 PolarHBondContact O-N 3.08Å
431	Y	88	Confident	90.7	Very high	17 Å²	17	29.4 Å²	29.4	7%	0.067	14%	0.141	C	C	.	.	H	α-helix	trans	-74	-36.8	178.7	-80.3	-69.2	0	0	0	113.3	I427 I428 V429 L434 F435 Y499 V511 G515	I427-Y431 HydrophobicContact CG2-CD2 3.79Å; I427-Y431 HydrophobicContact CG2-CE2 3.79Å; I427-Y431 VanDerWaalsContact O-CD2 3.27Å; I427-Y431 WeakPolarHBondContact O-CD2 3.14Å; I427-Y431 PolarHBondContact O-N 3.2Å; I427-Y431 VanDerWaalsContact O-N 3.1Å; I428-Y431 PolarHBondContact O-N 3.49Å; I428-Y431 VanDerWaalsContact O-N 3.15Å; V429-Y431 VanDerWaalsContact C-N 3.34Å; V429-Y431 PolarHBondContact O-N 3.01Å; Y431-L434 PolarHBondContact O-N 3.28Å; Y431-F435 HydrophobicContact CD1-CD2 4.44Å; Y431-F435 AromaticContact CD1-CE2 3.93Å; Y431-F435 HydrophobicContact CD1-CE2 3.93Å; Y431-F435 WeakPolarHBondContact O-CD2 3.35Å; Y431-F435 PolarHBondContact O-N 3.27Å; Y431-Y499 PolarHBondContact OH-OH 3.49Å; Y431-V511 HydrophobicContact CE2-CG1 3.89Å; Y431-V511 VanDerWaalsContact CE2-O 3.3Å; Y431-V511 WeakPolarHBondContact CE2-O 3.4Å; Y431-G515 VanDerWaalsContact CD2-CA 3.41Å
432	L	90.9	Very high	90.9	Very high	13 Å²	13	30 Å²	30	7%	0.068	15%	0.145	C	C	.	.	H	α-helix	trans	-60.7	-48.2	173.7	-73.3	176.3	0	0	0	110.7	L104 L107 I111 I428 V429 L434 F435 C436 P437 M518 I521	L104-L432 HydrophobicContact CD1-CD2 4.11Å; L107-L432 HydrophobicContact CD2-CD1 3.69Å; L107-L432 HydrophobicContact CD2-CD2 3.83Å; L107-L432 HydrophobicContact CD2-CG 4.22Å; L107-L432 HydrophobicContact CG-CD1 4.25Å; I111-L432 HydrophobicContact CD1-CD1 4.01Å; I428-L432 HydrophobicContact CG2-CD1 3.77Å; I428-L432 HydrophobicContact CG2-CG 4.12Å; I428-L432 WeakPolarHBondContact O-CG 3.46Å; I428-L432 PolarHBondContact O-N 3.41Å; V429-L432 PolarHBondContact O-N 3.32Å; L432-L434 PolarHBondContact O-N 3.26Å; L432-F435 PolarHBondContact O-N 3.31Å; L432-C436 HydrophobicContact CD2-CB 4.31Å; L432-C436 PolarHBondContact O-N 3.13Å; L432-P437 WeakPolarHBondContact O-CD 3.43Å; L432-M518 HydrophobicContact CD2-CB 4.06Å; L432-M518 HydrophobicContact CD2-CG 4.18Å; L432-M518 HydrophobicContact CD2-SD 3.96Å; L432-M518 HydrophobicContact CG-CG 4.33Å; L432-M518 HydrophobicContact CG-SD 4.18Å; L432-I521 HydrophobicContact CD2-CD1 3.54Å
433	D	88.5	Confident	91.2	Very high	62 Å²	62	32.3 Å²	32.3	33%	0.332	16%	0.157	S	C	.	.	H	α-helix	trans	-63.7	-26.9	179.5	-178.2	51.1	0	0	0	113.2	V429 W438 K495	V429-D433 WeakPolarHBondContact O-CB 3.19Å; V429-D433 PolarHBondContact O-N 2.93Å; D433-W438 VanDerWaalsContact O-CD1 3.3Å; D433-W438 PolarHBondContact O-NE1 3.2Å; D433-K495 IonicContact OD1-NZ 3.24Å; D433-K495 PolarHBondContact OD1-NZ 3.45Å; D433-K495 IonicContact OD2-NZ 3.72Å; D433-K495 PolarHBondContact OD2-NZ 2.92Å
434	L	87.2	Confident	91.6	Very high	11 Å²	11	30.3 Å²	30.3	6%	0.058	14%	0.144	C	C	.	.	H	α-helix	trans	-74.1	-42.9	177.1	-175.5	59.4	0	0	0	112.7	K430 Y431 L432 K495 Y499	K430-L434 PolarHBondContact O-N 3.08Å; Y431-L434 PolarHBondContact O-N 3.28Å; L432-L434 PolarHBondContact O-N 3.26Å; L434-K495 HydrophobicContact CD1-CB 3.92Å; L434-Y499 HydrophobicContact CD2-CD1 3.94Å; L434-Y499 HydrophobicContact CD2-CD2 3.93Å; L434-Y499 HydrophobicContact CD2-CE1 4.36Å; L434-Y499 HydrophobicContact CD2-CE2 4.33Å; L434-Y499 HydrophobicContact CD2-CG 3.71Å
435	F	79.2	Confident	92	Very high	46 Å²	46	29.1 Å²	29.1	20%	0.202	14%	0.137	C	C	.	.	H	α-helix	trans	-110	-60.4	-169.2	-61.4	-65.1	0	0	0	112.7	Y431 L432 F439 L496 V519	Y431-F435 HydrophobicContact CD1-CD2 4.44Å; Y431-F435 AromaticContact CD1-CE2 3.93Å; Y431-F435 HydrophobicContact CD1-CE2 3.93Å; Y431-F435 WeakPolarHBondContact O-CD2 3.35Å; Y431-F435 PolarHBondContact O-N 3.27Å; L432-F435 PolarHBondContact O-N 3.31Å; F435-F439 HydrophobicContact CB-CD2 4.45Å; F435-F439 HydrophobicContact CD1-CE2 4.12Å; F435-F439 WeakPolarHBondContact O-CD2 3.37Å; F435-F439 PolarHBondContact O-N 3.15Å; F435-L496 HydrophobicContact CE1-CD1 4.37Å; F435-V519 HydrophobicContact CD2-CG2 4.18Å; F435-V519 HydrophobicContact CE2-CG2 4.48Å; F435-V519 HydrophobicContact CG-CG2 4.46Å
436	C	87.8	Confident	92.2	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.4	-56.1	-156	-66.1	0	0	0	0	115.7	L104 L432 W438 L440	L104-C436 HydrophobicContact CD1-CB 4.26Å; L432-C436 HydrophobicContact CD2-CB 4.31Å; L432-C436 PolarHBondContact O-N 3.13Å; C436-W438 PolarHBondContact O-N 3.22Å; C436-L440 WeakPolarHBondContact O-CB 3.44Å; C436-L440 VanDerWaalsContact O-CG 3.32Å; C436-L440 WeakPolarHBondContact O-CG 3.41Å; C436-L440 PolarHBondContact O-N 2.94Å; C436-L440 VanDerWaalsContact O-N 3.1Å
437	P	92.8	Very high	92.5	Very high	6 Å²	6	28.1 Å²	28.1	4%	0.039	14%	0.136	C	C	.	.	H	α-helix	trans	-66.1	-40.6	-167.9	24.8	-31.5	0	0	0	112	C276 L432 L441	C276-P437 HydrophobicContact CB-CB 3.51Å; L432-P437 WeakPolarHBondContact O-CD 3.43Å; P437-L441 VanDerWaalsContact O-CB 3.26Å; P437-L441 WeakPolarHBondContact O-CB 3.49Å; P437-L441 PolarHBondContact O-N 3.02Å
438	W	94.9	Very high	92.9	Very high	1 Å²	1	26.9 Å²	26.9	0%	0.004	13%	0.13	C	C	.	.	H	α-helix	trans	-71.6	-42.6	-176.1	-44.7	118.9	0	0	0	112	L270 D433 C436 A442 P488 I491 A492	L270-W438 HydrophobicContact CB-CZ3 4.07Å; L270-W438 HydrophobicContact CD1-CZ3 3.92Å; D433-W438 VanDerWaalsContact O-CD1 3.3Å; D433-W438 PolarHBondContact O-NE1 3.2Å; C436-W438 PolarHBondContact O-N 3.22Å; W438-A442 VanDerWaalsContact O-CB 3.29Å; W438-A442 WeakPolarHBondContact O-CB 3.27Å; W438-A442 PolarHBondContact O-N 3.12Å; W438-P488 HydrophobicContact CB-CB 4.28Å; W438-P488 WeakPolarHBondContact O-CB 3.34Å; W438-I491 HydrophobicContact CD2-CB 4.17Å; W438-I491 HydrophobicContact CD2-CD1 4.42Å; W438-I491 HydrophobicContact CD2-CG2 3.55Å; W438-I491 HydrophobicContact CE3-CB 4.35Å; W438-I491 HydrophobicContact CE3-CD1 3.79Å; W438-I491 HydrophobicContact CE3-CG2 4.02Å; W438-I491 HydrophobicContact CG-CB 4.38Å; W438-I491 HydrophobicContact CG-CG2 3.92Å; W438-I491 HydrophobicContact CH2-CD1 4.41Å; W438-I491 HydrophobicContact CH2-CG2 4.44Å; W438-I491 HydrophobicContact CZ2-CG2 4Å; W438-I491 HydrophobicContact CZ3-CD1 3.79Å; W438-I491 HydrophobicContact CZ3-CG2 4.43Å; W438-A492 HydrophobicContact CB-CB 3.93Å
439	F	94.2	Very high	93.1	Very high	89 Å²	89	26.5 Å²	26.5	39%	0.39	13%	0.128	S	C	.	.	H	α-helix	trans	-64.8	-43.1	175.5	-74.6	-64.5	0	0	0	111.7	F435 A442 L443 A492 L522	F435-F439 HydrophobicContact CB-CD2 4.45Å; F435-F439 HydrophobicContact CD1-CE2 4.12Å; F435-F439 WeakPolarHBondContact O-CD2 3.37Å; F435-F439 PolarHBondContact O-N 3.15Å; F439-A442 PolarHBondContact O-N 3.14Å; F439-L443 WeakPolarHBondContact O-CB 3.24Å; F439-L443 VanDerWaalsContact O-CG 3.23Å; F439-L443 WeakPolarHBondContact O-CG 3.35Å; F439-L443 PolarHBondContact O-N 3.05Å; F439-L443 VanDerWaalsContact O-N 3.1Å; F439-A492 HydrophobicContact CE2-CB 4.48Å; F439-A492 HydrophobicContact CZ-CB 4.22Å; F439-L522 HydrophobicContact CB-CD1 4.26Å; F439-L522 HydrophobicContact CB-CD2 4.44Å; F439-L522 HydrophobicContact CD2-CD1 4.31Å
440	L	96.7	Very high	93.3	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-47	178.3	-68.8	176.2	0	0	0	112	V97 S100 Y101 L104 C436 A442 L443 E444 L522 V525	V97-L440 HydrophobicContact CG1-CD2 4.41Å; S100-L440 VanDerWaalsContact CB-CD2 3.4Å; Y101-L440 HydrophobicContact CD1-CB 4.28Å; Y101-L440 HydrophobicContact CD1-CD1 3.86Å; Y101-L440 HydrophobicContact CE1-CB 3.56Å; Y101-L440 HydrophobicContact CE1-CD1 3.98Å; Y101-L440 HydrophobicContact CE1-CG 4.37Å; L104-L440 HydrophobicContact CD2-CD1 4.18Å; C436-L440 WeakPolarHBondContact O-CB 3.44Å; C436-L440 VanDerWaalsContact O-CG 3.32Å; C436-L440 WeakPolarHBondContact O-CG 3.41Å; C436-L440 PolarHBondContact O-N 2.94Å; C436-L440 VanDerWaalsContact O-N 3.1Å; L440-A442 PolarHBondContact O-N 3.18Å; L440-L443 PolarHBondContact O-N 3.19Å; L440-E444 WeakPolarHBondContact O-CB 3.49Å; L440-E444 PolarHBondContact O-N 3.31Å; L440-L522 HydrophobicContact CD1-CD2 4.17Å; L440-L522 HydrophobicContact CD2-CD2 3.58Å; L440-L522 HydrophobicContact CG-CD2 3.57Å; L440-V525 HydrophobicContact CD2-CG2 4.14Å
441	L	97.4	Very high	93.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.3	-42.2	178.3	-177.5	63	0	0	0	111.6	L68 L270 P437 L443 E444 I445 P488	L68-L441 HydrophobicContact CD1-CD2 4.31Å; L270-L441 HydrophobicContact CD1-CD2 4.05Å; L270-L441 HydrophobicContact CD2-CD2 4.3Å; P437-L441 VanDerWaalsContact O-CB 3.26Å; P437-L441 WeakPolarHBondContact O-CB 3.49Å; P437-L441 PolarHBondContact O-N 3.02Å; L441-L443 VanDerWaalsContact C-N 3.33Å; L441-L443 PolarHBondContact O-N 3.05Å; L441-E444 PolarHBondContact O-N 3.34Å; L441-I445 HydrophobicContact CD1-CD1 3.94Å; L441-I445 HydrophobicContact CD1-CG1 4.08Å; L441-I445 HydrophobicContact CD2-CD1 4.44Å; L441-I445 HydrophobicContact CG-CD1 3.76Å; L441-I445 HydrophobicContact CG-CG1 4.35Å; L441-I445 WeakPolarHBondContact O-CD1 3.44Å; L441-I445 WeakPolarHBondContact O-CG1 3.37Å; L441-I445 PolarHBondContact O-N 3.36Å; L441-P488 HydrophobicContact CB-CB 4.34Å; L441-P488 HydrophobicContact CD2-CB 4.29Å; L441-P488 HydrophobicContact CD2-CG 4.44Å; L441-P488 HydrophobicContact CG-CB 4.42Å; L441-P488 HydrophobicContact CG-CG 4.3Å
442	A	97.3	Very high	93.8	Very high	11 Å²	11	26.3 Å²	26.3	9%	0.091	12%	0.122	C	C	.	.	H	α-helix	trans	-59	-45	176.7	0	0	0	0	0	112.1	W438 F439 L440 F446 P488 I489	W438-A442 VanDerWaalsContact O-CB 3.29Å; W438-A442 WeakPolarHBondContact O-CB 3.27Å; W438-A442 PolarHBondContact O-N 3.12Å; F439-A442 PolarHBondContact O-N 3.14Å; L440-A442 PolarHBondContact O-N 3.18Å; A442-F446 VanDerWaalsContact O-CB 3.26Å; A442-F446 WeakPolarHBondContact O-CB 3.48Å; A442-F446 PolarHBondContact O-N 3Å; A442-P488 HydrophobicContact CB-CB 4.16Å; A442-P488 HydrophobicContact CB-CG 3.72Å; A442-I489 HydrophobicContact CB-CG1 3.97Å
443	L	97.2	Very high	93.9	Very high	54 Å²	54	27.1 Å²	27.1	28%	0.283	13%	0.129	S	C	.	.	H	α-helix	trans	-69.6	-37.3	179.5	-69.1	172.6	0	0	0	112.4	F94 V97 F439 L440 L441 F446 A447 V525	F94-L443 HydrophobicContact CD1-CD2 4.48Å; F94-L443 HydrophobicContact CE1-CD2 4.01Å; V97-L443 HydrophobicContact CG2-CB 3.89Å; F439-L443 WeakPolarHBondContact O-CB 3.24Å; F439-L443 VanDerWaalsContact O-CG 3.23Å; F439-L443 WeakPolarHBondContact O-CG 3.35Å; F439-L443 PolarHBondContact O-N 3.05Å; F439-L443 VanDerWaalsContact O-N 3.1Å; L440-L443 PolarHBondContact O-N 3.19Å; L441-L443 VanDerWaalsContact C-N 3.33Å; L441-L443 PolarHBondContact O-N 3.05Å; L443-F446 PolarHBondContact O-N 3.32Å; L443-A447 VanDerWaalsContact O-CB 3.25Å; L443-A447 WeakPolarHBondContact O-CB 3.34Å; L443-A447 PolarHBondContact O-N 3.37Å; L443-V525 HydrophobicContact CD1-CG1 3.86Å; L443-V525 HydrophobicContact CD1-CG2 4.4Å
444	E	98	Very high	94.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.3	-52.6	175.5	-165.7	-158.5	144.8	0	0	111.2	M71 E72 M87 V97 Y101 L440 L441 F446 A447 I448	M71-E444 WeakPolarHBondContact CE-OE1 3.38Å; E72-E444 VanDerWaalsContact CG-OE1 3.31Å; E72-E444 WeakPolarHBondContact CG-OE1 3.45Å; M87-E444 HydrophobicContact CE-CG 3.98Å; M87-E444 HydrophobicContact SD-CG 3.97Å; V97-E444 HydrophobicContact CG1-CB 4.02Å; V97-E444 HydrophobicContact CG1-CG 4.41Å; Y101-E444 HydrophobicContact CE2-CB 4.48Å; Y101-E444 HydrophobicContact CE2-CG 4.26Å; Y101-E444 WeakPolarHBondContact CE2-OE2 3.39Å; Y101-E444 PolarHBondContact OH-OE2 3.31Å; L440-E444 WeakPolarHBondContact O-CB 3.49Å; L440-E444 PolarHBondContact O-N 3.31Å; L441-E444 PolarHBondContact O-N 3.34Å; E444-F446 VanDerWaalsContact C-N 3.29Å; E444-F446 PolarHBondContact O-N 3.48Å; E444-A447 PolarHBondContact O-N 3.37Å; E444-I448 HydrophobicContact CG-CD1 3.78Å; E444-I448 WeakPolarHBondContact O-CG1 3.42Å; E444-I448 PolarHBondContact O-N 2.84Å
445	I	98.2	Very high	94.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.3	-42.5	178.7	-57.5	162.7	0	0	0	109.6	L68 M71 L441 A447 I448 A449 T481 L484 P485 P488	L68-I445 HydrophobicContact CD1-CD1 4.07Å; L68-I445 HydrophobicContact CD2-CD1 3.43Å; L68-I445 VanDerWaalsContact CD2-CD1 3.43Å; L68-I445 HydrophobicContact CD2-CG1 3.49Å; L68-I445 VanDerWaalsContact CD2-CG1 3.49Å; L68-I445 HydrophobicContact CD2-CG2 4.41Å; L68-I445 HydrophobicContact CG-CD1 4.41Å; M71-I445 HydrophobicContact CE-CG1 4.03Å; L441-I445 HydrophobicContact CD1-CD1 3.94Å; L441-I445 HydrophobicContact CD1-CG1 4.08Å; L441-I445 HydrophobicContact CD2-CD1 4.44Å; L441-I445 HydrophobicContact CG-CD1 3.76Å; L441-I445 HydrophobicContact CG-CG1 4.35Å; L441-I445 WeakPolarHBondContact O-CD1 3.44Å; L441-I445 WeakPolarHBondContact O-CG1 3.37Å; L441-I445 PolarHBondContact O-N 3.36Å; I445-A447 PolarHBondContact O-N 3.33Å; I445-I448 PolarHBondContact O-N 3.23Å; I445-A449 HydrophobicContact CG2-CB 4.19Å; I445-A449 WeakPolarHBondContact O-CA 3.47Å; I445-A449 WeakPolarHBondContact O-CB 3.42Å; I445-A449 PolarHBondContact O-N 3.39Å; I445-T481 WeakPolarHBondContact CG2-O 3.38Å; I445-L484 HydrophobicContact CD1-CB 4.33Å; I445-L484 HydrophobicContact CG2-CB 4.24Å; I445-P485 HydrophobicContact CB-CG 4.14Å; I445-P485 HydrophobicContact CG2-CG 3.66Å; I445-P488 HydrophobicContact CD1-CG 4.18Å
446	F	97.6	Very high	95.2	Very high	84 Å²	84	26.5 Å²	26.5	37%	0.368	13%	0.125	S	C	.	.	I	π-helix	trans	-60.1	-46.7	175.9	179.2	-98.3	0	0	0	112.1	F94 A442 L443 E444 I448 W450 V451	F94-F446 HydrophobicContact CE1-CD1 4.43Å; F94-F446 HydrophobicContact CE2-CD1 4.09Å; F94-F446 HydrophobicContact CE2-CE1 4.03Å; F94-F446 AromaticContact CZ-CD1 3.79Å; F94-F446 HydrophobicContact CZ-CD1 3.79Å; F94-F446 AromaticContact CZ-CE1 3.78Å; F94-F446 HydrophobicContact CZ-CE1 3.78Å; A442-F446 VanDerWaalsContact O-CB 3.26Å; A442-F446 WeakPolarHBondContact O-CB 3.48Å; A442-F446 PolarHBondContact O-N 3Å; L443-F446 PolarHBondContact O-N 3.32Å; E444-F446 VanDerWaalsContact C-N 3.29Å; E444-F446 PolarHBondContact O-N 3.48Å; F446-I448 PolarHBondContact O-N 3.39Å; F446-W450 HydrophobicContact CD2-CB 3.92Å; F446-W450 HydrophobicContact CD2-CG 4.01Å; F446-W450 HydrophobicContact CE2-CB 3.9Å; F446-W450 HydrophobicContact CE2-CG 4.13Å; F446-W450 HydrophobicContact CZ-CB 4.5Å; F446-W450 WeakPolarHBondContact O-CA 3.24Å; F446-W450 VanDerWaalsContact O-CB 3.29Å; F446-W450 WeakPolarHBondContact O-CB 3.32Å; F446-W450 PolarHBondContact O-N 2.93Å; F446-V451 HydrophobicContact CD1-CG2 4.23Å; F446-V451 HydrophobicContact CE1-CG2 3.84Å; F446-V451 HydrophobicContact CZ-CG2 4.43Å; F446-V451 PolarHBondContact O-N 3.45Å
447	A	96.3	Very high	95.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.125	C	C	.	.	I	π-helix	trans	-61.8	-42.2	179.3	0	0	0	0	0	112.3	M87 F94 L443 E444 I445 V451 Y452	M87-A447 HydrophobicContact CE-CB 3.74Å; F94-A447 HydrophobicContact CB-CB 3.57Å; F94-A447 HydrophobicContact CD2-CB 3.69Å; F94-A447 HydrophobicContact CG-CB 3.67Å; L443-A447 VanDerWaalsContact O-CB 3.25Å; L443-A447 WeakPolarHBondContact O-CB 3.34Å; L443-A447 PolarHBondContact O-N 3.37Å; E444-A447 PolarHBondContact O-N 3.37Å; I445-A447 PolarHBondContact O-N 3.33Å; A447-V451 VanDerWaalsContact O-CB 3.31Å; A447-V451 WeakPolarHBondContact O-CB 3.45Å; A447-V451 PolarHBondContact O-N 3.12Å; A447-Y452 PolarHBondContact O-N 3.36Å
448	I	96.7	Very high	95.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.124	C	C	.	.	I	π-helix	trans	-80.8	-52.6	-177.9	-62.6	162.4	0	0	0	111	M71 V75 M87 M90 E444 I445 F446 Y452 C453 L457	M71-I448 HydrophobicContact CE-CD1 3.65Å; M71-I448 HydrophobicContact CG-CB 4.36Å; M71-I448 HydrophobicContact CG-CD1 4.06Å; M71-I448 HydrophobicContact CG-CG2 3.69Å; M71-I448 HydrophobicContact SD-CB 3.81Å; M71-I448 HydrophobicContact SD-CD1 3.8Å; M71-I448 HydrophobicContact SD-CG1 4.44Å; M71-I448 HydrophobicContact SD-CG2 3.72Å; V75-I448 HydrophobicContact CG2-CD1 3.79Å; V75-I448 HydrophobicContact CG2-CG1 4.19Å; V75-I448 HydrophobicContact CG2-CG2 4.19Å; M87-I448 HydrophobicContact SD-CD1 4.2Å; M87-I448 HydrophobicContact SD-CG1 4.36Å; M90-I448 HydrophobicContact CE-CG2 4.07Å; E444-I448 HydrophobicContact CG-CD1 3.78Å; E444-I448 WeakPolarHBondContact O-CG1 3.42Å; E444-I448 PolarHBondContact O-N 2.84Å; I445-I448 PolarHBondContact O-N 3.23Å; F446-I448 PolarHBondContact O-N 3.39Å; I448-Y452 WeakPolarHBondContact O-CB 3.2Å; I448-C453 PolarHBondContact O-N 3.38Å; I448-C453 VanDerWaalsContact O-N 3.15Å; I448-L457 HydrophobicContact CG2-CD2 3.57Å
449	A	96.7	Very high	95.4	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.145	C	C	.	.	I	π-helix	trans	-72.2	-43.2	-174.3	0	0	0	0	0	112.1	I445 C453 A454 T481 Y482	I445-A449 HydrophobicContact CG2-CB 4.19Å; I445-A449 WeakPolarHBondContact O-CA 3.47Å; I445-A449 WeakPolarHBondContact O-CB 3.42Å; I445-A449 PolarHBondContact O-N 3.39Å; A449-C453 CarbonylContact O-C 3.42Å; A449-C453 WeakPolarHBondContact O-CA 3.41Å; A449-A454 HydrophobicContact CB-CB 4.2Å; A449-A454 PolarHBondContact O-N 2.98Å; A449-T481 WeakPolarHBondContact CB-O 3.48Å; A449-T481 WeakPolarHBondContact CB-OG1 3.39Å; A449-Y482 HydrophobicContact CB-CD1 4.44Å; A449-Y482 WeakPolarHBondContact O-CE1 3.47Å; A449-Y482 VanDerWaalsContact O-CZ 3.31Å; A449-Y482 PolarHBondContact O-OH 3.48Å
450	W	95.6	Very high	95.3	Very high	138 Å²	138	28.8 Å²	28.8	52%	0.523	13%	0.132	S	C	.	.	I	π-helix	trans	-96.9	-42.2	-174.2	-72.9	83.7	0	0	0	114.2	F446 Y482	F446-W450 HydrophobicContact CD2-CB 3.92Å; F446-W450 HydrophobicContact CD2-CG 4.01Å; F446-W450 HydrophobicContact CE2-CB 3.9Å; F446-W450 HydrophobicContact CE2-CG 4.13Å; F446-W450 HydrophobicContact CZ-CB 4.5Å; F446-W450 WeakPolarHBondContact O-CA 3.24Å; F446-W450 VanDerWaalsContact O-CB 3.29Å; F446-W450 WeakPolarHBondContact O-CB 3.32Å; F446-W450 PolarHBondContact O-N 2.93Å; W450-Y482 HydrophobicContact CD2-CD1 4.02Å; W450-Y482 HydrophobicContact CD2-CE1 4.45Å; W450-Y482 AromaticContact CE2-CD1 3.88Å; W450-Y482 HydrophobicContact CE3-CD1 4.5Å; W450-Y482 HydrophobicContact CG-CD1 4.27Å; W450-Y482 HydrophobicContact CZ2-CD1 4.27Å; W450-Y482 PolarHBondContact NE1-O 2.82Å
451	V	93.1	Very high	95	Very high	30 Å²	30	28.8 Å²	28.8	18%	0.182	13%	0.132	C	C	.	.	I	π-helix	trans	-82.6	-49.8	-176.8	-174.9	0	0	0	0	111.5	S91 F94 F446 A447 C453 F553	S91-V451 WeakPolarHBondContact OG-CG1 3.49Å; F94-V451 HydrophobicContact CD2-CG2 4.45Å; F94-V451 HydrophobicContact CE2-CG2 3.98Å; F446-V451 HydrophobicContact CD1-CG2 4.23Å; F446-V451 HydrophobicContact CE1-CG2 3.84Å; F446-V451 HydrophobicContact CZ-CG2 4.43Å; F446-V451 PolarHBondContact O-N 3.45Å; A447-V451 VanDerWaalsContact O-CB 3.31Å; A447-V451 WeakPolarHBondContact O-CB 3.45Å; A447-V451 PolarHBondContact O-N 3.12Å; V451-C453 VanDerWaalsContact C-N 3.35Å; V451-F553 HydrophobicContact CG1-CB 4.38Å; V451-F553 HydrophobicContact CG1-CD1 4.03Å
452	Y	92.9	Very high	94.7	Very high	8 Å²	8	29.9 Å²	29.9	3%	0.031	14%	0.14	C	C	.	.	I	π-helix	trans	-75	-27.9	174.9	-175.3	-96.1	0	0	0	113	M90 A447 I448 L456 L457 D460 L557 R558	M90-Y452 HydrophobicContact CB-CD2 4.48Å; M90-Y452 HydrophobicContact CE-CD1 3.22Å; M90-Y452 HydrophobicContact CE-CD2 3.79Å; M90-Y452 HydrophobicContact CE-CE1 3.44Å; M90-Y452 VanDerWaalsContact CE-CE1 3.44Å; M90-Y452 HydrophobicContact CE-CE2 3.97Å; M90-Y452 HydrophobicContact CE-CG 3.38Å; M90-Y452 WeakPolarHBondContact O-CD2 3.25Å; M90-Y452 HydrophobicContact SD-CD1 4.44Å; M90-Y452 HydrophobicContact SD-CD2 4.13Å; M90-Y452 HydrophobicContact SD-CE1 4.29Å; M90-Y452 HydrophobicContact SD-CE2 3.97Å; M90-Y452 HydrophobicContact SD-CG 4.33Å; A447-Y452 PolarHBondContact O-N 3.36Å; I448-Y452 WeakPolarHBondContact O-CB 3.2Å; Y452-L456 HydrophobicContact CE1-CB 4.33Å; Y452-L457 HydrophobicContact CD1-CB 4.21Å; Y452-L457 HydrophobicContact CE1-CB 4.07Å; Y452-D460 PolarHBondContact OH-OD2 3.36Å; Y452-L557 HydrophobicContact CE2-CD1 4.07Å; Y452-R558 PolarHBondContact O-NH2 2.75Å
453	C	94.5	Very high	94.4	Very high	30 Å²	30	35.9 Å²	35.9	20%	0.203	17%	0.166	C	C	.	.	I	π-helix	trans	81.1	115.2	-173.9	-55	0	0	0	0	114.1	I448 A449 V451 H455 L456 L457 Y482	I448-C453 PolarHBondContact O-N 3.38Å; I448-C453 VanDerWaalsContact O-N 3.15Å; A449-C453 CarbonylContact O-C 3.42Å; A449-C453 WeakPolarHBondContact O-CA 3.41Å; V451-C453 VanDerWaalsContact C-N 3.35Å; C453-H455 VanDerWaalsContact C-N 3.31Å; C453-H455 VanDerWaalsContact CB-CE1 3.43Å; C453-H455 WeakPolarHBondContact CB-CE1 3.5Å; C453-H455 PolarHBondContact O-N 3.31Å; C453-L456 HydrophobicContact CB-CB 4.33Å; C453-L456 HydrophobicContact CB-CD1 3.9Å; C453-L456 HydrophobicContact CB-CG 3.99Å; C453-L456 WeakPolarHBondContact O-CB 3.44Å; C453-L456 PolarHBondContact O-N 3.23Å; C453-L457 PolarHBondContact O-N 3.43Å; C453-Y482 WeakPolarHBondContact CA-OH 3.42Å; C453-Y482 WeakPolarHBondContact CB-OH 3.4Å
454	A	95.5	Very high	94	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.9	-37.8	-178.8	0	0	0	0	0	113.7	A449 L456 L457 A458 F478 T481 Y482	A449-A454 HydrophobicContact CB-CB 4.2Å; A449-A454 PolarHBondContact O-N 2.98Å; A454-L456 PolarHBondContact O-N 3.23Å; A454-L457 PolarHBondContact O-N 2.92Å; A454-A458 PolarHBondContact O-N 3.38Å; A454-F478 VanDerWaalsContact CB-O 3.24Å; A454-F478 WeakPolarHBondContact CB-O 3.25Å; A454-T481 VanDerWaalsContact CB-OG1 3.25Å; A454-T481 WeakPolarHBondContact CB-OG1 3.47Å; A454-Y482 HydrophobicContact CB-CD2 3.95Å; A454-Y482 HydrophobicContact CB-CE2 3.57Å; A454-Y482 PolarHBondContact N-OH 3.13Å; A454-Y482 VanDerWaalsContact N-OH 3.15Å
455	H	94.1	Very high	93.6	Very high	82 Å²	82	33.9 Å²	33.9	38%	0.38	16%	0.155	S	C	.	.	H	α-helix	trans	-64	-27.9	176.8	65.9	-92.2	0	0	0	113.1	C453 R459 E479 Y482	C453-H455 VanDerWaalsContact C-N 3.31Å; C453-H455 VanDerWaalsContact CB-CE1 3.43Å; C453-H455 WeakPolarHBondContact CB-CE1 3.5Å; C453-H455 PolarHBondContact O-N 3.31Å; H455-R459 PolarHBondContact O-N 3.07Å; H455-R459 VanDerWaalsContact O-N 3.14Å; H455-E479 WeakPolarHBondContact CB-OE1 3.2Å; H455-Y482 AromaticContact ND1-CZ 3.94Å; H455-Y482 PolarHBondContact ND1-OH 2.7Å
456	L	91.2	Very high	93.2	Very high	24 Å²	24	39.2 Å²	39.2	13%	0.126	19%	0.188	C	C	.	.	H	α-helix	trans	-76.7	-42.7	174.5	-63.9	179	0	0	0	110.7	Y452 C453 A454 A458 R459 D460	Y452-L456 HydrophobicContact CE1-CB 4.33Å; C453-L456 HydrophobicContact CB-CB 4.33Å; C453-L456 HydrophobicContact CB-CD1 3.9Å; C453-L456 HydrophobicContact CB-CG 3.99Å; C453-L456 WeakPolarHBondContact O-CB 3.44Å; C453-L456 PolarHBondContact O-N 3.23Å; A454-L456 PolarHBondContact O-N 3.23Å; L456-A458 VanDerWaalsContact C-N 3.27Å; L456-A458 PolarHBondContact O-N 3.38Å; L456-R459 WeakPolarHBondContact O-CA 3.26Å; L456-R459 WeakPolarHBondContact O-CB 3.47Å; L456-R459 PolarHBondContact O-N 2.92Å; L456-D460 PolarHBondContact O-N 3.25Å
457	L	93.8	Very high	92.8	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-57.3	-43.1	171.5	-177.4	59.5	0	0	0	111.2	M71 A74 V75 L78 M90 I448 Y452 C453 A454 R459 D460 V461 F478	M71-L457 HydrophobicContact CG-CD2 4.05Å; A74-L457 HydrophobicContact CB-CD1 4.2Å; A74-L457 HydrophobicContact CB-CD2 4.43Å; A74-L457 HydrophobicContact CB-CG 4.43Å; V75-L457 HydrophobicContact CG2-CD2 4.18Å; L78-L457 HydrophobicContact CD2-CD1 4.01Å; M90-L457 HydrophobicContact CE-CD1 4.1Å; I448-L457 HydrophobicContact CG2-CD2 3.57Å; Y452-L457 HydrophobicContact CD1-CB 4.21Å; Y452-L457 HydrophobicContact CE1-CB 4.07Å; C453-L457 PolarHBondContact O-N 3.43Å; A454-L457 PolarHBondContact O-N 2.92Å; L457-R459 VanDerWaalsContact C-N 3.3Å; L457-R459 PolarHBondContact O-N 2.94Å; L457-D460 PolarHBondContact O-N 2.96Å; L457-V461 HydrophobicContact CD1-CG2 4.29Å; L457-V461 HydrophobicContact CG-CG2 4.48Å; L457-V461 WeakPolarHBondContact O-CB 3.49Å; L457-V461 VanDerWaalsContact O-CG2 3.3Å; L457-V461 WeakPolarHBondContact O-CG2 3.49Å; L457-V461 PolarHBondContact O-N 2.96Å; L457-F478 HydrophobicContact CD2-CD1 3.96Å; L457-F478 HydrophobicContact CD2-CE1 3.59Å; L457-F478 HydrophobicContact CG-CD1 4.13Å; L457-F478 HydrophobicContact CG-CE1 3.76Å; L457-F478 HydrophobicContact CG-CZ 4.38Å
458	A	94.5	Very high	92.6	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-58.8	-41.3	174.8	0	0	0	0	0	112.5	A454 L456 S462 Y475 F478	A454-A458 PolarHBondContact O-N 3.38Å; L456-A458 VanDerWaalsContact C-N 3.27Å; L456-A458 PolarHBondContact O-N 3.38Å; A458-S462 VanDerWaalsContact O-CB 3.24Å; A458-S462 WeakPolarHBondContact O-CB 3.24Å; A458-S462 PolarHBondContact O-N 2.85Å; A458-Y475 HydrophobicContact CB-CD1 3.66Å; A458-Y475 HydrophobicContact CB-CE1 3.77Å; A458-Y475 HydrophobicContact CB-CG 4.34Å; A458-F478 HydrophobicContact CB-CB 3.71Å; A458-F478 HydrophobicContact CB-CD2 3.66Å; A458-F478 HydrophobicContact CB-CG 3.86Å
459	R	92	Very high	92.4	Very high	120 Å²	120	52.3 Å²	52.3	45%	0.453	25%	0.249	S	C	.	.	H	α-helix	trans	-65.4	-42.9	176.1	-174.2	-172.6	69.3	176.5	-0	111.7	H455 L456 L457 S462 Q463	H455-R459 PolarHBondContact O-N 3.07Å; H455-R459 VanDerWaalsContact O-N 3.14Å; L456-R459 WeakPolarHBondContact O-CA 3.26Å; L456-R459 WeakPolarHBondContact O-CB 3.47Å; L456-R459 PolarHBondContact O-N 2.92Å; L457-R459 VanDerWaalsContact C-N 3.3Å; L457-R459 PolarHBondContact O-N 2.94Å; R459-S462 WeakPolarHBondContact O-CB 3.44Å; R459-S462 PolarHBondContact O-N 3.43Å; R459-Q463 WeakPolarHBondContact O-CG 3.27Å; R459-Q463 PolarHBondContact O-N 3.35Å; R459-Q463 VanDerWaalsContact O-N 3.1Å
460	D	91.5	Very high	92.2	Very high	21 Å²	21	54.7 Å²	54.7	11%	0.112	26%	0.26	C	S	.	.	H	α-helix	trans	-69.1	-40.1	-178.4	-60.3	-25.6	0	0	0	110.4	L78 Y452 L456 L457 S462 Q463 M464	L78-D460 HydrophobicContact CD1-CB 4.32Å; L78-D460 HydrophobicContact CD2-CB 4.27Å; Y452-D460 PolarHBondContact OH-OD2 3.36Å; L456-D460 PolarHBondContact O-N 3.25Å; L457-D460 PolarHBondContact O-N 2.96Å; D460-S462 VanDerWaalsContact C-N 3.34Å; D460-S462 PolarHBondContact O-N 3.37Å; D460-Q463 WeakPolarHBondContact O-CB 3.38Å; D460-Q463 PolarHBondContact O-N 3.26Å; D460-Q463 VanDerWaalsContact O-N 3.13Å; D460-M464 WeakPolarHBondContact O-CG 3.25Å; D460-M464 PolarHBondContact O-N 3.34Å; D460-M464 VanDerWaalsContact O-N 3.09Å
461	V	91.7	Very high	92	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-40.3	170.3	172.2	0	0	0	0	111.8	A74 L293 L457 Q463 M464 I465 F478	A74-V461 HydrophobicContact CB-CG2 3.5Å; L293-V461 HydrophobicContact CD1-CG1 4.46Å; L293-V461 HydrophobicContact CD2-CG1 4.22Å; L293-V461 HydrophobicContact CD2-CG2 4.47Å; L293-V461 HydrophobicContact CG-CG1 4.49Å; L457-V461 HydrophobicContact CD1-CG2 4.29Å; L457-V461 HydrophobicContact CG-CG2 4.48Å; L457-V461 WeakPolarHBondContact O-CB 3.49Å; L457-V461 VanDerWaalsContact O-CG2 3.3Å; L457-V461 WeakPolarHBondContact O-CG2 3.49Å; L457-V461 PolarHBondContact O-N 2.96Å; V461-Q463 PolarHBondContact O-N 2.91Å; V461-M464 WeakPolarHBondContact O-CB 3.46Å; V461-M464 PolarHBondContact O-N 3.17Å; V461-I465 HydrophobicContact CG1-CD1 4.3Å; V461-I465 HydrophobicContact CG1-CG2 4.3Å; V461-I465 WeakPolarHBondContact O-CG1 3.28Å; V461-I465 PolarHBondContact O-N 3.18Å; V461-F478 HydrophobicContact CB-CE2 4.09Å; V461-F478 HydrophobicContact CB-CZ 4.33Å; V461-F478 HydrophobicContact CG1-CE2 4.07Å; V461-F478 HydrophobicContact CG1-CZ 4.41Å; V461-F478 HydrophobicContact CG2-CE2 4.04Å; V461-F478 HydrophobicContact CG2-CZ 3.76Å
462	S	91.3	Very high	92	Very high	24 Å²	24	54.5 Å²	54.5	17%	0.168	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-27.6	176.2	-177.1	0	0	0	0	112.7	A458 R459 D460 K471	A458-S462 VanDerWaalsContact O-CB 3.24Å; A458-S462 WeakPolarHBondContact O-CB 3.24Å; A458-S462 PolarHBondContact O-N 2.85Å; R459-S462 WeakPolarHBondContact O-CB 3.44Å; R459-S462 PolarHBondContact O-N 3.43Å; D460-S462 VanDerWaalsContact C-N 3.34Å; D460-S462 PolarHBondContact O-N 3.37Å; S462-K471 VanDerWaalsContact O-CE 3.29Å; S462-K471 WeakPolarHBondContact O-CE 3.46Å; S462-K471 PolarHBondContact O-NZ 3.04Å
463	Q	89.9	Confident	92	Very high	136 Å²	136	56.4 Å²	56.4	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-79.6	-30.5	172.8	-66.9	175.6	4.7	0	0	112.6	R459 D460 V461	R459-Q463 WeakPolarHBondContact O-CG 3.27Å; R459-Q463 PolarHBondContact O-N 3.35Å; R459-Q463 VanDerWaalsContact O-N 3.1Å; D460-Q463 WeakPolarHBondContact O-CB 3.38Å; D460-Q463 PolarHBondContact O-N 3.26Å; D460-Q463 VanDerWaalsContact O-N 3.13Å; V461-Q463 PolarHBondContact O-N 2.91Å
464	M	88.8	Confident	92	Very high	11 Å²	11	55.1 Å²	55.1	5%	0.054	27%	0.266	C	S	.	.	H	α-helix	trans	-73.1	-52.3	179.3	-72.4	164.8	64.6	0	0	112.7	Q77 L78 R289 N290 D460 V461	Q77-M464 VanDerWaalsContact C-CE 3.48Å; Q77-M464 HydrophobicContact CB-CE 3.73Å; Q77-M464 HydrophobicContact CG-CE 3.49Å; Q77-M464 VanDerWaalsContact CG-CE 3.49Å; Q77-M464 WeakPolarHBondContact O-CE 3.42Å; L78-M464 HydrophobicContact CB-CE 4.23Å; L78-M464 HydrophobicContact CB-SD 3.95Å; L78-M464 HydrophobicContact CD1-SD 3.7Å; L78-M464 HydrophobicContact CG-SD 4.41Å; R289-M464 HydrophobicContact CG-CE 4.47Å; R289-M464 HydrophobicContact CG-CG 4.18Å; R289-M464 WeakPolarHBondContact O-CB 3.35Å; N290-M464 WeakPolarHBondContact CA-O 3.44Å; D460-M464 WeakPolarHBondContact O-CG 3.25Å; D460-M464 PolarHBondContact O-N 3.34Å; D460-M464 VanDerWaalsContact O-N 3.09Å; V461-M464 WeakPolarHBondContact O-CB 3.46Å; V461-M464 PolarHBondContact O-N 3.17Å
465	I	90.6	Very high	92	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.01	28%	0.282	C	S	.	.			trans	-81.9	151	-172.5	71.1	-176.6	0	0	0	112	N291 V294 V461 F470 K471	N291-I465 WeakPolarHBondContact O-CG2 3.26Å; V294-I465 HydrophobicContact CG2-CD1 3.88Å; V461-I465 HydrophobicContact CG1-CD1 4.3Å; V461-I465 HydrophobicContact CG1-CG2 4.3Å; V461-I465 WeakPolarHBondContact O-CG1 3.28Å; V461-I465 PolarHBondContact O-N 3.18Å; I465-F470 HydrophobicContact CD1-CB 4.07Å; I465-K471 HydrophobicContact CD1-CG 3.86Å; I465-K471 HydrophobicContact CG1-CG 3.68Å; I465-K471 WeakPolarHBondContact O-CE 3.34Å; I465-K471 PolarHBondContact O-NZ 3.34Å
466	T	88.3	Confident	92.1	Very high	112 Å²	112	59 Å²	59	69%	0.687	29%	0.289	S	S	*	.			trans	-88.9	-39	-178.2	-43.6	0	0	0	0	113.3	R468	T466-R468 PolarHBondContact O-N 2.63Å
467	S	90.4	Very high	92.3	Very high	47 Å²	47	60 Å²	60	33%	0.329	29%	0.292	S	S	.	.			trans	-69.3	122.2	-171.1	175.8	0	0	0	0	113.1	L469 F470 K471	S467-L469 VanDerWaalsContact C-N 3.34Å; S467-L469 PolarHBondContact O-N 3.49Å; S467-F470 PolarHBondContact O-N 3.39Å; S467-F470 WeakPolarHBondContact OG-CD2 3.41Å; S467-K471 WeakPolarHBondContact O-CG 3.21Å; S467-K471 PolarHBondContact O-N 3.42Å; S467-K471 VanDerWaalsContact O-N 3.17Å
468	R	90.9	Very high	92.5	Very high	202 Å²	202	60 Å²	60	76%	0.762	29%	0.292	S	S	*	.	H	α-helix	trans	-62	-38.7	178.7	-172.2	177.6	-176.7	178.5	0.8	113	T466 K471 I472	T466-R468 PolarHBondContact O-N 2.63Å; R468-K471 PolarHBondContact O-N 3.41Å; R468-I472 HydrophobicContact CG-CD1 4.34Å; R468-I472 WeakPolarHBondContact O-CG1 3.21Å; R468-I472 PolarHBondContact O-N 3.37Å
469	L	92.1	Very high	92.5	Very high	109 Å²	109	63.7 Å²	63.7	57%	0.571	31%	0.309	S	S	*	.	H	α-helix	trans	-60.3	-49.9	179.5	177.1	63.3	0	0	0	110.7	S467 K471 I472 I473	S467-L469 VanDerWaalsContact C-N 3.34Å; S467-L469 PolarHBondContact O-N 3.49Å; L469-K471 VanDerWaalsContact C-N 3.32Å; L469-K471 PolarHBondContact O-N 2.94Å; L469-I472 PolarHBondContact O-N 3.49Å; L469-I473 HydrophobicContact CD1-CD1 3.97Å; L469-I473 HydrophobicContact CD1-CG1 4.47Å; L469-I473 HydrophobicContact CG-CD1 3.86Å; L469-I473 WeakPolarHBondContact O-CG1 3.36Å; L469-I473 PolarHBondContact O-N 3.22Å
470	F	93.8	Very high	92.7	Very high	51 Å²	51	60.4 Å²	60.4	22%	0.224	30%	0.3	C	S	.	.	H	α-helix	trans	-69.1	-28.8	-178.4	-69.9	-60.4	0	0	0	113.1	N292 V294 I465 S467 I473 A474	N292-F470 VanDerWaalsContact CG-CD2 3.46Å; N292-F470 WeakPolarHBondContact ND2-CD2 3.33Å; N292-F470 WeakPolarHBondContact ND2-CE2 3.18Å; N292-F470 WeakPolarHBondContact OD1-CB 3.32Å; N292-F470 VanDerWaalsContact OD1-CD2 3.27Å; N292-F470 WeakPolarHBondContact OD1-CD2 3.31Å; N292-F470 VanDerWaalsContact OD1-CG 3.28Å; N292-F470 WeakPolarHBondContact OD1-CG 3.27Å; V294-F470 HydrophobicContact CB-CB 3.98Å; V294-F470 HydrophobicContact CB-CD1 4.08Å; V294-F470 HydrophobicContact CB-CG 4.32Å; V294-F470 HydrophobicContact CG1-CB 4.16Å; V294-F470 HydrophobicContact CG1-CD1 3.79Å; V294-F470 HydrophobicContact CG1-CG 4.4Å; V294-F470 HydrophobicContact CG2-CB 4.38Å; I465-F470 HydrophobicContact CD1-CB 4.07Å; S467-F470 PolarHBondContact O-N 3.39Å; S467-F470 WeakPolarHBondContact OG-CD2 3.41Å; F470-I473 HydrophobicContact CD1-CD1 4.35Å; F470-I473 PolarHBondContact O-N 3.09Å; F470-A474 VanDerWaalsContact O-CB 3.3Å; F470-A474 WeakPolarHBondContact O-CB 3.08Å; F470-A474 PolarHBondContact O-N 3.1Å
471	K	91.9	Very high	93	Very high	52 Å²	52	59.5 Å²	59.5	23%	0.226	30%	0.295	C	S	.	.	H	α-helix	trans	-59.7	-48.5	169.7	-66.7	176.1	-162.6	-140.5	0	111.6	S462 I465 S467 R468 L469 I473 A474 Y475	S462-K471 VanDerWaalsContact O-CE 3.29Å; S462-K471 WeakPolarHBondContact O-CE 3.46Å; S462-K471 PolarHBondContact O-NZ 3.04Å; I465-K471 HydrophobicContact CD1-CG 3.86Å; I465-K471 HydrophobicContact CG1-CG 3.68Å; I465-K471 WeakPolarHBondContact O-CE 3.34Å; I465-K471 PolarHBondContact O-NZ 3.34Å; S467-K471 WeakPolarHBondContact O-CG 3.21Å; S467-K471 PolarHBondContact O-N 3.42Å; S467-K471 VanDerWaalsContact O-N 3.17Å; R468-K471 PolarHBondContact O-N 3.41Å; L469-K471 VanDerWaalsContact C-N 3.32Å; L469-K471 PolarHBondContact O-N 2.94Å; K471-I473 VanDerWaalsContact C-N 3.34Å; K471-A474 PolarHBondContact O-N 3.15Å; K471-Y475 WeakPolarHBondContact O-CD2 3.18Å
472	I	92.6	Very high	93.3	Very high	111 Å²	111	61.5 Å²	61.5	57%	0.569	30%	0.303	S	S	*	.	H	α-helix	trans	-64.4	-42.5	-178.8	-64.5	167.8	0	0	0	110.4	R468 L469 A474 P476	R468-I472 HydrophobicContact CG-CD1 4.34Å; R468-I472 WeakPolarHBondContact O-CG1 3.21Å; R468-I472 PolarHBondContact O-N 3.37Å; L469-I472 PolarHBondContact O-N 3.49Å; I472-A474 VanDerWaalsContact C-N 3.33Å; I472-A474 PolarHBondContact O-N 2.91Å; I472-P476 VanDerWaalsContact O-CD 3.31Å; I472-P476 WeakPolarHBondContact O-CD 3.45Å
473	I	93.6	Very high	93.6	Very high	49 Å²	49	66.2 Å²	66.2	25%	0.251	33%	0.326	S	S	.	.	H	α-helix	trans	-64.8	-38	178.1	-65.6	169.8	0	0	0	111.1	V294 F298 L469 F470 K471 Y475 P476 F477	V294-I473 HydrophobicContact CG1-CG2 4.2Å; F298-I473 HydrophobicContact CE2-CG2 3.67Å; F298-I473 HydrophobicContact CZ-CG2 3.94Å; L469-I473 HydrophobicContact CD1-CD1 3.97Å; L469-I473 HydrophobicContact CD1-CG1 4.47Å; L469-I473 HydrophobicContact CG-CD1 3.86Å; L469-I473 WeakPolarHBondContact O-CG1 3.36Å; L469-I473 PolarHBondContact O-N 3.22Å; F470-I473 HydrophobicContact CD1-CD1 4.35Å; F470-I473 PolarHBondContact O-N 3.09Å; K471-I473 VanDerWaalsContact C-N 3.34Å; I473-Y475 PolarHBondContact O-N 3.44Å; I473-P476 VanDerWaalsContact O-CD 3.24Å; I473-P476 WeakPolarHBondContact O-CD 3.38Å; I473-P476 VanDerWaalsContact O-CG 3.31Å; I473-P476 WeakPolarHBondContact O-CG 3.21Å; I473-F477 HydrophobicContact CG2-CD2 4.18Å; I473-F477 HydrophobicContact CG2-CE2 4.07Å; I473-F477 WeakPolarHBondContact O-CD2 3.4Å
474	A	93.8	Very high	93.9	Very high	3 Å²	3	60 Å²	60	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-43	-175.5	0	0	0	0	0	114.1	M70 V294 F470 K471 I472 F477 F478	M70-A474 HydrophobicContact SD-CB 4.27Å; V294-A474 HydrophobicContact CG2-CB 3.79Å; F470-A474 VanDerWaalsContact O-CB 3.3Å; F470-A474 WeakPolarHBondContact O-CB 3.08Å; F470-A474 PolarHBondContact O-N 3.1Å; K471-A474 PolarHBondContact O-N 3.15Å; I472-A474 VanDerWaalsContact C-N 3.33Å; I472-A474 PolarHBondContact O-N 2.91Å; A474-F477 PolarHBondContact O-N 3.33Å; A474-F477 VanDerWaalsContact O-N 3.16Å; A474-F478 HydrophobicContact CB-CD2 4.04Å; A474-F478 HydrophobicContact CB-CE2 3.94Å; A474-F478 VanDerWaalsContact O-CD2 3.26Å; A474-F478 WeakPolarHBondContact O-CD2 3.38Å; A474-F478 PolarHBondContact O-N 3.16Å
475	Y	94.4	Very high	94.3	Very high	85 Å²	85	60 Å²	60	33%	0.333	30%	0.298	S	S	.	.	H	α-helix	trans	-51.1	-57.1	-174.3	-83.5	-82.7	0	0	0	114.2	A458 K471 I473 F477 F478 E479	A458-Y475 HydrophobicContact CB-CD1 3.66Å; A458-Y475 HydrophobicContact CB-CE1 3.77Å; A458-Y475 HydrophobicContact CB-CG 4.34Å; K471-Y475 WeakPolarHBondContact O-CD2 3.18Å; I473-Y475 PolarHBondContact O-N 3.44Å; Y475-F477 VanDerWaalsContact C-N 3.27Å; Y475-F477 PolarHBondContact O-N 3.01Å; Y475-F478 PolarHBondContact O-N 3.26Å; Y475-F478 VanDerWaalsContact O-N 3.17Å; Y475-E479 WeakPolarHBondContact O-CG 3.35Å; Y475-E479 PolarHBondContact O-N 3.49Å
476	P	96	Very high	94.6	Very high	79 Å²	79	62.9 Å²	62.9	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-61.4	-33.3	-179	23.7	-35.1	0	0	0	113.3	I472 I473 E479 L480	I472-P476 VanDerWaalsContact O-CD 3.31Å; I472-P476 WeakPolarHBondContact O-CD 3.45Å; I473-P476 VanDerWaalsContact O-CD 3.24Å; I473-P476 WeakPolarHBondContact O-CD 3.38Å; I473-P476 VanDerWaalsContact O-CG 3.31Å; I473-P476 WeakPolarHBondContact O-CG 3.21Å; P476-E479 PolarHBondContact O-N 2.95Å; P476-L480 WeakPolarHBondContact O-CB 3.33Å; P476-L480 PolarHBondContact O-N 3.4Å
477	F	96.5	Very high	95	Very high	44 Å²	44	58.7 Å²	58.7	19%	0.193	30%	0.296	C	S	.	.	H	α-helix	trans	-68.2	-42	176	-79.1	-85.3	0	0	0	111.5	I66 P67 M70 F298 I473 A474 Y475 L480 T481	I66-F477 HydrophobicContact CB-CD1 4.22Å; I66-F477 HydrophobicContact CB-CE1 3.94Å; I66-F477 HydrophobicContact CG2-CD1 3.52Å; I66-F477 HydrophobicContact CG2-CE1 3.39Å; I66-F477 HydrophobicContact CG2-CG 4.31Å; I66-F477 HydrophobicContact CG2-CZ 4.08Å; P67-F477 HydrophobicContact CB-CD1 4.42Å; P67-F477 HydrophobicContact CG-CD1 3.77Å; P67-F477 HydrophobicContact CG-CE1 4.49Å; M70-F477 HydrophobicContact CE-CB 4.03Å; M70-F477 HydrophobicContact CE-CD2 4.47Å; M70-F477 HydrophobicContact CE-CG 4.16Å; M70-F477 HydrophobicContact SD-CB 4.09Å; F298-F477 HydrophobicContact CE1-CE2 4.48Å; F298-F477 HydrophobicContact CE1-CZ 4.12Å; F298-F477 HydrophobicContact CE2-CE2 4.41Å; F298-F477 HydrophobicContact CZ-CD2 4.36Å; F298-F477 HydrophobicContact CZ-CE1 4.44Å; F298-F477 AromaticContact CZ-CE2 3.6Å; F298-F477 HydrophobicContact CZ-CE2 3.6Å; F298-F477 AromaticContact CZ-CZ 3.65Å; F298-F477 HydrophobicContact CZ-CZ 3.65Å; I473-F477 HydrophobicContact CG2-CD2 4.18Å; I473-F477 HydrophobicContact CG2-CE2 4.07Å; I473-F477 WeakPolarHBondContact O-CD2 3.4Å; A474-F477 PolarHBondContact O-N 3.33Å; A474-F477 VanDerWaalsContact O-N 3.16Å; Y475-F477 VanDerWaalsContact C-N 3.27Å; Y475-F477 PolarHBondContact O-N 3.01Å; F477-L480 WeakPolarHBondContact O-CB 3.3Å; F477-L480 PolarHBondContact O-N 3.45Å; F477-T481 PolarHBondContact O-N 3.24Å
478	F	96.8	Very high	95.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-44.4	172.7	-78.2	-65.4	0	0	0	111.9	M70 A74 A454 L457 A458 V461 A474 Y475 L480 T481	M70-F478 HydrophobicContact CG-CE1 4.49Å; M70-F478 HydrophobicContact CG-CE2 4.21Å; M70-F478 HydrophobicContact CG-CZ 3.86Å; M70-F478 HydrophobicContact SD-CD2 4.37Å; M70-F478 HydrophobicContact SD-CE2 3.88Å; M70-F478 HydrophobicContact SD-CZ 4.13Å; A74-F478 HydrophobicContact CB-CE1 4.06Å; A74-F478 HydrophobicContact CB-CZ 3.76Å; A454-F478 VanDerWaalsContact CB-O 3.24Å; A454-F478 WeakPolarHBondContact CB-O 3.25Å; L457-F478 HydrophobicContact CD2-CD1 3.96Å; L457-F478 HydrophobicContact CD2-CE1 3.59Å; L457-F478 HydrophobicContact CG-CD1 4.13Å; L457-F478 HydrophobicContact CG-CE1 3.76Å; L457-F478 HydrophobicContact CG-CZ 4.38Å; A458-F478 HydrophobicContact CB-CB 3.71Å; A458-F478 HydrophobicContact CB-CD2 3.66Å; A458-F478 HydrophobicContact CB-CG 3.86Å; V461-F478 HydrophobicContact CB-CE2 4.09Å; V461-F478 HydrophobicContact CB-CZ 4.33Å; V461-F478 HydrophobicContact CG1-CE2 4.07Å; V461-F478 HydrophobicContact CG1-CZ 4.41Å; V461-F478 HydrophobicContact CG2-CE2 4.04Å; V461-F478 HydrophobicContact CG2-CZ 3.76Å; A474-F478 HydrophobicContact CB-CD2 4.04Å; A474-F478 HydrophobicContact CB-CE2 3.94Å; A474-F478 VanDerWaalsContact O-CD2 3.26Å; A474-F478 WeakPolarHBondContact O-CD2 3.38Å; A474-F478 PolarHBondContact O-N 3.16Å; Y475-F478 PolarHBondContact O-N 3.26Å; Y475-F478 VanDerWaalsContact O-N 3.17Å; F478-L480 VanDerWaalsContact C-N 3.25Å; F478-L480 PolarHBondContact O-N 3.32Å; F478-T481 WeakPolarHBondContact O-CB 3.5Å; F478-T481 PolarHBondContact O-N 3.04Å; F478-T481 PolarHBondContact O-OG1 3.33Å
479	E	95.3	Very high	95.6	Very high	80 Å²	80	51.3 Å²	51.3	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-60	-36.5	176.6	-66.1	-61.8	162.1	0	0	112.4	H455 Y475 P476 T481 Y482	H455-E479 WeakPolarHBondContact CB-OE1 3.2Å; Y475-E479 WeakPolarHBondContact O-CG 3.35Å; Y475-E479 PolarHBondContact O-N 3.49Å; P476-E479 PolarHBondContact O-N 2.95Å; E479-T481 PolarHBondContact O-N 3.19Å; E479-Y482 WeakPolarHBondContact O-CB 3.46Å; E479-Y482 WeakPolarHBondContact O-CD2 3.48Å; E479-Y482 PolarHBondContact O-N 3Å; E479-Y482 VanDerWaalsContact O-N 3.12Å; E479-Y482 WeakPolarHBondContact OE2-CD2 3.45Å; E479-Y482 VanDerWaalsContact OE2-CE2 3.26Å; E479-Y482 WeakPolarHBondContact OE2-CE2 3.17Å
480	L	96.4	Very high	95.8	Very high	51 Å²	51	49 Å²	49	27%	0.267	25%	0.252	S	S	.	.	H	α-helix	trans	-59.3	-29.7	176.5	-173.9	57.5	0	0	0	112.3	V63 P67 P476 F477 F478 Y482 L483	V63-L480 HydrophobicContact CG1-CD2 4.13Å; V63-L480 VanDerWaalsContact O-CD2 3.28Å; V63-L480 WeakPolarHBondContact O-CD2 3.21Å; P67-L480 HydrophobicContact CG-CD2 3.84Å; P67-L480 HydrophobicContact CG-CG 4.38Å; P476-L480 WeakPolarHBondContact O-CB 3.33Å; P476-L480 PolarHBondContact O-N 3.4Å; F477-L480 WeakPolarHBondContact O-CB 3.3Å; F477-L480 PolarHBondContact O-N 3.45Å; F478-L480 VanDerWaalsContact C-N 3.25Å; F478-L480 PolarHBondContact O-N 3.32Å; L480-Y482 PolarHBondContact O-N 2.99Å; L480-Y482 VanDerWaalsContact O-N 3.1Å; L480-L483 HydrophobicContact CD1-CD1 4.27Å; L480-L483 PolarHBondContact O-N 3.24Å
481	T	97.3	Very high	96	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.006	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-20	178.3	69.9	0	0	0	0	113.7	P67 M71 I445 A449 A454 F477 F478 E479 L483 L484 P485	P67-T481 HydrophobicContact CB-CG2 3.9Å; M71-T481 HydrophobicContact CB-CG2 4.48Å; M71-T481 HydrophobicContact SD-CG2 4.46Å; I445-T481 WeakPolarHBondContact CG2-O 3.38Å; A449-T481 WeakPolarHBondContact CB-O 3.48Å; A449-T481 WeakPolarHBondContact CB-OG1 3.39Å; A454-T481 VanDerWaalsContact CB-OG1 3.25Å; A454-T481 WeakPolarHBondContact CB-OG1 3.47Å; F477-T481 PolarHBondContact O-N 3.24Å; F478-T481 WeakPolarHBondContact O-CB 3.5Å; F478-T481 PolarHBondContact O-N 3.04Å; F478-T481 PolarHBondContact O-OG1 3.33Å; E479-T481 PolarHBondContact O-N 3.19Å; T481-L483 PolarHBondContact O-N 3.09Å; T481-L484 HydrophobicContact CG2-CD1 4.41Å; T481-L484 PolarHBondContact O-N 3.28Å; T481-P485 WeakPolarHBondContact O-CD 3.46Å
482	Y	97.9	Very high	96.1	Very high	42 Å²	42	44.4 Å²	44.4	17%	0.165	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-33.6	171.8	-81.1	-68.8	0	0	0	112.8	A449 W450 C453 A454 H455 E479 L480 P485	A449-Y482 HydrophobicContact CB-CD1 4.44Å; A449-Y482 WeakPolarHBondContact O-CE1 3.47Å; A449-Y482 VanDerWaalsContact O-CZ 3.31Å; A449-Y482 PolarHBondContact O-OH 3.48Å; W450-Y482 HydrophobicContact CD2-CD1 4.02Å; W450-Y482 HydrophobicContact CD2-CE1 4.45Å; W450-Y482 AromaticContact CE2-CD1 3.88Å; W450-Y482 HydrophobicContact CE3-CD1 4.5Å; W450-Y482 HydrophobicContact CG-CD1 4.27Å; W450-Y482 HydrophobicContact CZ2-CD1 4.27Å; W450-Y482 PolarHBondContact NE1-O 2.82Å; C453-Y482 WeakPolarHBondContact CA-OH 3.42Å; C453-Y482 WeakPolarHBondContact CB-OH 3.4Å; A454-Y482 HydrophobicContact CB-CD2 3.95Å; A454-Y482 HydrophobicContact CB-CE2 3.57Å; A454-Y482 PolarHBondContact N-OH 3.13Å; A454-Y482 VanDerWaalsContact N-OH 3.15Å; H455-Y482 AromaticContact ND1-CZ 3.94Å; H455-Y482 PolarHBondContact ND1-OH 2.7Å; E479-Y482 WeakPolarHBondContact O-CB 3.46Å; E479-Y482 WeakPolarHBondContact O-CD2 3.48Å; E479-Y482 PolarHBondContact O-N 3Å; E479-Y482 VanDerWaalsContact O-N 3.12Å; E479-Y482 WeakPolarHBondContact OE2-CD2 3.45Å; E479-Y482 VanDerWaalsContact OE2-CE2 3.26Å; E479-Y482 WeakPolarHBondContact OE2-CE2 3.17Å; L480-Y482 PolarHBondContact O-N 2.99Å; L480-Y482 VanDerWaalsContact O-N 3.1Å; Y482-P485 WeakPolarHBondContact O-CD 3.43Å
483	L	97.2	Very high	96.1	Very high	123 Å²	123	42.3 Å²	42.3	64%	0.644	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-21.2	-177.8	-56.4	-178.7	0	0	0	112.6	L480 T481 A486	L480-L483 HydrophobicContact CD1-CD1 4.27Å; L480-L483 PolarHBondContact O-N 3.24Å; T481-L483 PolarHBondContact O-N 3.09Å; L483-A486 WeakPolarHBondContact O-CB 3.12Å; L483-A486 PolarHBondContact O-N 3.32Å
484	L	97.5	Very high	96.1	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.026	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.8	-171.1	-64.4	-177.7	0	0	0	116.8	P67 L68 I445 T481 A486 V487 P488	P67-L484 HydrophobicContact CB-CD1 3.7Å; P67-L484 HydrophobicContact CG-CD1 3.95Å; L68-L484 HydrophobicContact CD1-CD1 4.37Å; L68-L484 HydrophobicContact CD2-CB 4.35Å; L68-L484 HydrophobicContact CD2-CD1 3.8Å; L68-L484 HydrophobicContact CG-CD1 3.8Å; I445-L484 HydrophobicContact CD1-CB 4.33Å; I445-L484 HydrophobicContact CG2-CB 4.24Å; T481-L484 HydrophobicContact CG2-CD1 4.41Å; T481-L484 PolarHBondContact O-N 3.28Å; L484-A486 PolarHBondContact O-N 2.97Å; L484-A486 VanDerWaalsContact O-N 3.11Å; L484-V487 HydrophobicContact CD2-CG2 4.15Å; L484-V487 WeakPolarHBondContact O-CB 3.27Å; L484-V487 PolarHBondContact O-N 3.21Å; L484-P488 WeakPolarHBondContact O-CD 3.44Å
485	P	96.9	Very high	96	Very high	13 Å²	13	41.5 Å²	41.5	8%	0.084	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.2	171.7	-25	34	0	0	0	112.9	I445 T481 Y482 V487 P488 I489	I445-P485 HydrophobicContact CB-CG 4.14Å; I445-P485 HydrophobicContact CG2-CG 3.66Å; T481-P485 WeakPolarHBondContact O-CD 3.46Å; Y482-P485 WeakPolarHBondContact O-CD 3.43Å; P485-V487 PolarHBondContact O-N 2.81Å; P485-P488 WeakPolarHBondContact O-CD 3.26Å; P485-I489 VanDerWaalsContact O-CD1 3.27Å; P485-I489 WeakPolarHBondContact O-CD1 3.47Å; P485-I489 WeakPolarHBondContact O-CG1 3.5Å; P485-I489 PolarHBondContact O-N 3.24Å
486	A	96.9	Very high	95.8	Very high	62 Å²	62	41.5 Å²	41.5	51%	0.512	23%	0.226	S	C	.	.	H	α-helix	trans	-64	-27.9	177.6	0	0	0	0	0	113.1	L483 L484 F490	L483-A486 WeakPolarHBondContact O-CB 3.12Å; L483-A486 PolarHBondContact O-N 3.32Å; L484-A486 PolarHBondContact O-N 2.97Å; L484-A486 VanDerWaalsContact O-N 3.11Å; A486-F490 WeakPolarHBondContact O-CB 3.46Å; A486-F490 PolarHBondContact O-N 3.13Å
487	V	97.3	Very high	95.5	Very high	24 Å²	24	42.7 Å²	42.7	15%	0.145	23%	0.225	C	C	.	.	H	α-helix	trans	-68.3	-59	-177.6	173.1	0	0	0	0	112.4	L266 L270 L484 P485 I489 F490 I491	L266-V487 HydrophobicContact CB-CG1 4.35Å; L266-V487 HydrophobicContact CD1-CG1 4.24Å; L266-V487 HydrophobicContact CD2-CG1 3.72Å; L266-V487 HydrophobicContact CG-CG1 4.33Å; L270-V487 HydrophobicContact CD1-CG1 4.12Å; L484-V487 HydrophobicContact CD2-CG2 4.15Å; L484-V487 WeakPolarHBondContact O-CB 3.27Å; L484-V487 PolarHBondContact O-N 3.21Å; P485-V487 PolarHBondContact O-N 2.81Å; V487-I489 VanDerWaalsContact C-N 3.26Å; V487-I489 PolarHBondContact O-N 3.45Å; V487-F490 WeakPolarHBondContact O-CB 3.38Å; V487-F490 PolarHBondContact O-N 3.07Å; V487-I491 HydrophobicContact CG1-CD1 4.16Å; V487-I491 WeakPolarHBondContact O-CG1 3.45Å; V487-I491 PolarHBondContact O-N 3.01Å
488	P	97.1	Very high	95	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-64.5	-30.7	176.4	25.8	-32.9	0	0	0	112.4	W438 L441 A442 I445 L484 P485 I491 A492	W438-P488 HydrophobicContact CB-CB 4.28Å; W438-P488 WeakPolarHBondContact O-CB 3.34Å; L441-P488 HydrophobicContact CB-CB 4.34Å; L441-P488 HydrophobicContact CD2-CB 4.29Å; L441-P488 HydrophobicContact CD2-CG 4.44Å; L441-P488 HydrophobicContact CG-CB 4.42Å; L441-P488 HydrophobicContact CG-CG 4.3Å; A442-P488 HydrophobicContact CB-CB 4.16Å; A442-P488 HydrophobicContact CB-CG 3.72Å; I445-P488 HydrophobicContact CD1-CG 4.18Å; L484-P488 WeakPolarHBondContact O-CD 3.44Å; P485-P488 WeakPolarHBondContact O-CD 3.26Å; P488-I491 PolarHBondContact O-N 3.39Å; P488-A492 WeakPolarHBondContact O-CB 3.49Å; P488-A492 PolarHBondContact O-N 3.29Å
489	I	96.5	Very high	94.4	Very high	92 Å²	92	46.3 Å²	46.3	47%	0.472	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-46.7	172.2	-67.5	169.8	0	0	0	110.6	A442 P485 V487 A492 V493	A442-I489 HydrophobicContact CB-CG1 3.97Å; P485-I489 VanDerWaalsContact O-CD1 3.27Å; P485-I489 WeakPolarHBondContact O-CD1 3.47Å; P485-I489 WeakPolarHBondContact O-CG1 3.5Å; P485-I489 PolarHBondContact O-N 3.24Å; V487-I489 VanDerWaalsContact C-N 3.26Å; V487-I489 PolarHBondContact O-N 3.45Å; I489-A492 PolarHBondContact O-N 3.43Å; I489-V493 HydrophobicContact CG2-CG2 4.41Å; I489-V493 VanDerWaalsContact O-CG2 3.31Å; I489-V493 WeakPolarHBondContact O-CG2 3.06Å; I489-V493 PolarHBondContact O-N 3.47Å
490	F	96.7	Very high	93.8	Very high	60 Å²	60	47.6 Å²	47.6	26%	0.263	25%	0.251	S	S	.	.	H	α-helix	trans	-56.5	-51.4	175	163.5	-98.8	0	0	0	111	M259 M263 L266 A486 V487 A492 V493 V494	M259-F490 HydrophobicContact CE-CD2 4.1Å; M259-F490 HydrophobicContact CE-CE2 3.55Å; M259-F490 HydrophobicContact CE-CZ 4.35Å; M259-F490 HydrophobicContact CG-CE2 3.51Å; M259-F490 HydrophobicContact CG-CZ 3.57Å; M259-F490 HydrophobicContact SD-CE2 3.94Å; M263-F490 HydrophobicContact CB-CE1 3.91Å; M263-F490 HydrophobicContact CB-CZ 4.28Å; L266-F490 HydrophobicContact CD1-CD1 3.99Å; L266-F490 HydrophobicContact CD1-CE1 3.89Å; A486-F490 WeakPolarHBondContact O-CB 3.46Å; A486-F490 PolarHBondContact O-N 3.13Å; V487-F490 WeakPolarHBondContact O-CB 3.38Å; V487-F490 PolarHBondContact O-N 3.07Å; F490-A492 VanDerWaalsContact C-N 3.34Å; F490-A492 PolarHBondContact O-N 3.04Å; F490-V493 PolarHBondContact O-N 2.93Å; F490-V494 HydrophobicContact CD1-CG2 4.31Å; F490-V494 HydrophobicContact CD2-CG2 3.88Å; F490-V494 HydrophobicContact CE1-CG2 4.07Å; F490-V494 HydrophobicContact CE2-CG2 3.64Å; F490-V494 HydrophobicContact CG-CG2 4.22Å; F490-V494 HydrophobicContact CZ-CG2 3.73Å; F490-V494 WeakPolarHBondContact O-CG2 3.45Å; F490-V494 PolarHBondContact O-N 3.46Å
491	I	96.5	Very high	92.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56.4	-48.6	178.6	-62.2	165.8	0	0	0	110.6	M263 L266 L270 W438 V487 P488 V493 V494 K495	M263-I491 HydrophobicContact CG-CG2 4.31Å; L266-I491 HydrophobicContact CB-CD1 3.85Å; L266-I491 HydrophobicContact CB-CG1 4.17Å; L270-I491 HydrophobicContact CD1-CD1 3.75Å; W438-I491 HydrophobicContact CD2-CB 4.17Å; W438-I491 HydrophobicContact CD2-CD1 4.42Å; W438-I491 HydrophobicContact CD2-CG2 3.55Å; W438-I491 HydrophobicContact CE3-CB 4.35Å; W438-I491 HydrophobicContact CE3-CD1 3.79Å; W438-I491 HydrophobicContact CE3-CG2 4.02Å; W438-I491 HydrophobicContact CG-CB 4.38Å; W438-I491 HydrophobicContact CG-CG2 3.92Å; W438-I491 HydrophobicContact CH2-CD1 4.41Å; W438-I491 HydrophobicContact CH2-CG2 4.44Å; W438-I491 HydrophobicContact CZ2-CG2 4Å; W438-I491 HydrophobicContact CZ3-CD1 3.79Å; W438-I491 HydrophobicContact CZ3-CG2 4.43Å; V487-I491 HydrophobicContact CG1-CD1 4.16Å; V487-I491 WeakPolarHBondContact O-CG1 3.45Å; V487-I491 PolarHBondContact O-N 3.01Å; P488-I491 PolarHBondContact O-N 3.39Å; I491-V493 PolarHBondContact O-N 3.03Å; I491-V494 PolarHBondContact O-N 3.28Å; I491-K495 HydrophobicContact CG2-CD 4.02Å; I491-K495 HydrophobicContact CG2-CG 4.28Å; I491-K495 WeakPolarHBondContact O-CB 3.49Å; I491-K495 WeakPolarHBondContact O-CG 3.37Å; I491-K495 PolarHBondContact O-N 3.35Å
492	A	94.2	Very high	91.7	Very high	7 Å²	7	54.3 Å²	54.3	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-44.6	179.7	0	0	0	0	0	112.2	W438 F439 P488 I489 F490 L496	W438-A492 HydrophobicContact CB-CB 3.93Å; F439-A492 HydrophobicContact CE2-CB 4.48Å; F439-A492 HydrophobicContact CZ-CB 4.22Å; P488-A492 WeakPolarHBondContact O-CB 3.49Å; P488-A492 PolarHBondContact O-N 3.29Å; I489-A492 PolarHBondContact O-N 3.43Å; F490-A492 VanDerWaalsContact C-N 3.34Å; F490-A492 PolarHBondContact O-N 3.04Å; A492-L496 VanDerWaalsContact O-CB 3.25Å; A492-L496 WeakPolarHBondContact O-CB 3.4Å; A492-L496 PolarHBondContact O-N 2.83Å
493	V	93.9	Very high	90.3	Very high	68 Å²	68	56.8 Å²	56.8	41%	0.412	31%	0.308	S	S	.	.	H	α-helix	trans	-64.9	-47	179.3	170.6	0	0	0	0	111.3	I489 F490 I491 L496 Q497	I489-V493 HydrophobicContact CG2-CG2 4.41Å; I489-V493 VanDerWaalsContact O-CG2 3.31Å; I489-V493 WeakPolarHBondContact O-CG2 3.06Å; I489-V493 PolarHBondContact O-N 3.47Å; F490-V493 PolarHBondContact O-N 2.93Å; I491-V493 PolarHBondContact O-N 3.03Å; V493-L496 PolarHBondContact O-N 2.89Å; V493-Q497 WeakPolarHBondContact O-CG 3.1Å; V493-Q497 PolarHBondContact O-N 3.42Å
494	V	93.8	Very high	88.2	Confident	8 Å²	8	56.6 Å²	56.6	5%	0.048	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-49.1	179.2	-172.9	0	0	0	0	110.3	M259 M263 F490 I491 L496 Q497 M498	M259-V494 HydrophobicContact CE-CB 4.07Å; M259-V494 HydrophobicContact CE-CG1 4.23Å; M259-V494 HydrophobicContact CE-CG2 3.11Å; M259-V494 HydrophobicContact CG-CG2 4.24Å; M259-V494 HydrophobicContact SD-CG2 4.46Å; M263-V494 HydrophobicContact CB-CB 4.29Å; M263-V494 HydrophobicContact CB-CG1 4.06Å; M263-V494 HydrophobicContact CB-CG2 4.22Å; M263-V494 HydrophobicContact CE-CG1 4.28Å; M263-V494 HydrophobicContact CG-CB 3.82Å; M263-V494 HydrophobicContact CG-CG1 3.88Å; M263-V494 HydrophobicContact CG-CG2 4.15Å; F490-V494 HydrophobicContact CD1-CG2 4.31Å; F490-V494 HydrophobicContact CD2-CG2 3.88Å; F490-V494 HydrophobicContact CE1-CG2 4.07Å; F490-V494 HydrophobicContact CE2-CG2 3.64Å; F490-V494 HydrophobicContact CG-CG2 4.22Å; F490-V494 HydrophobicContact CZ-CG2 3.73Å; F490-V494 WeakPolarHBondContact O-CG2 3.45Å; F490-V494 PolarHBondContact O-N 3.46Å; I491-V494 PolarHBondContact O-N 3.28Å; V494-L496 VanDerWaalsContact C-N 3.28Å; V494-L496 PolarHBondContact O-N 3.08Å; V494-Q497 WeakPolarHBondContact O-CB 3.42Å; V494-Q497 PolarHBondContact O-N 2.97Å; V494-Q497 VanDerWaalsContact O-N 3.16Å; V494-M498 HydrophobicContact CG1-CG 4.41Å; V494-M498 HydrophobicContact CG1-SD 4.07Å; V494-M498 WeakPolarHBondContact O-CG 3.17Å; V494-M498 PolarHBondContact O-N 3.4Å
495	K	91.7	Very high	86	Confident	26 Å²	26	64.3 Å²	64.3	11%	0.113	35%	0.353	C	S	.	.	H	α-helix	trans	-61.1	-38.6	179.9	-73.7	-168.5	177.7	-159.4	0	111.6	M263 D433 L434 I491 M498 Y499	M263-K495 HydrophobicContact SD-CD 4.44Å; M263-K495 HydrophobicContact SD-CG 3.87Å; D433-K495 IonicContact OD1-NZ 3.24Å; D433-K495 PolarHBondContact OD1-NZ 3.45Å; D433-K495 IonicContact OD2-NZ 3.72Å; D433-K495 PolarHBondContact OD2-NZ 2.92Å; L434-K495 HydrophobicContact CD1-CB 3.92Å; I491-K495 HydrophobicContact CG2-CD 4.02Å; I491-K495 HydrophobicContact CG2-CG 4.28Å; I491-K495 WeakPolarHBondContact O-CB 3.49Å; I491-K495 WeakPolarHBondContact O-CG 3.37Å; I491-K495 PolarHBondContact O-N 3.35Å; K495-M498 PolarHBondContact O-N 3.32Å; K495-Y499 WeakPolarHBondContact O-CB 3.43Å; K495-Y499 PolarHBondContact O-N 3.04Å
496	L	89.4	Confident	84	Confident	86 Å²	86	72.6 Å²	72.6	45%	0.45	39%	0.391	S	S	.	.	H	α-helix	trans	-66	-40.9	175.4	-172.9	64.5	0	0	0	112.6	F435 A492 V493 V494 Y499 N500	F435-L496 HydrophobicContact CE1-CD1 4.37Å; A492-L496 VanDerWaalsContact O-CB 3.25Å; A492-L496 WeakPolarHBondContact O-CB 3.4Å; A492-L496 PolarHBondContact O-N 2.83Å; V493-L496 PolarHBondContact O-N 2.89Å; V494-L496 VanDerWaalsContact C-N 3.28Å; V494-L496 PolarHBondContact O-N 3.08Å; L496-Y499 PolarHBondContact O-N 3.22Å; L496-N500 WeakPolarHBondContact O-CB 3.3Å; L496-N500 PolarHBondContact O-N 2.99Å
497	Q	89.9	Confident	82.4	Confident	104 Å²	104	78.7 Å²	78.7	49%	0.486	40%	0.401	S	S	.	.	H	α-helix	trans	-62.7	-46.4	174.3	-73.1	174.8	-15.4	0	0	111.6	V493 V494 Y499 N500 N501	V493-Q497 WeakPolarHBondContact O-CG 3.1Å; V493-Q497 PolarHBondContact O-N 3.42Å; V494-Q497 WeakPolarHBondContact O-CB 3.42Å; V494-Q497 PolarHBondContact O-N 2.97Å; V494-Q497 VanDerWaalsContact O-N 3.16Å; Q497-Y499 VanDerWaalsContact C-N 3.35Å; Q497-Y499 PolarHBondContact O-N 3.26Å; Q497-N500 PolarHBondContact O-N 3.07Å; Q497-N501 VanDerWaalsContact O-CG 3.26Å; Q497-N501 PolarHBondContact O-N 3.09Å; Q497-N501 PolarHBondContact O-ND2 3.29Å
498	M	86.8	Confident	81.4	Confident	77 Å²	77	80.5 Å²	80.5	38%	0.379	41%	0.41	S	S	.	.	H	α-helix	trans	-61.7	-43.2	176.8	-68.6	177.7	77.7	0	0	111.6	E260 M263 V494 K495 N501 S502	E260-M498 HydrophobicContact CG-CE 4.27Å; E260-M498 WeakPolarHBondContact OE1-CE 3.29Å; M263-M498 HydrophobicContact CE-CE 4.41Å; M263-M498 HydrophobicContact CE-SD 3.56Å; M263-M498 VanDerWaalsContact CE-SD 3.56Å; V494-M498 HydrophobicContact CG1-CG 4.41Å; V494-M498 HydrophobicContact CG1-SD 4.07Å; V494-M498 WeakPolarHBondContact O-CG 3.17Å; V494-M498 PolarHBondContact O-N 3.4Å; K495-M498 PolarHBondContact O-N 3.32Å; M498-N501 PolarHBondContact O-N 3.35Å; M498-S502 PolarHBondContact O-N 2.87Å; M498-S502 VanDerWaalsContact O-N 3.13Å
499	Y	84.2	Confident	80.6	Confident	43 Å²	43	86.1 Å²	86.1	17%	0.169	44%	0.438	C	S	.	.	H	α-helix	trans	-59.6	-47.8	175.6	177.2	-98.2	0	0	0	111.3	Y431 L434 K495 L496 Q497 N501 S502 L503	Y431-Y499 PolarHBondContact OH-OH 3.49Å; L434-Y499 HydrophobicContact CD2-CD1 3.94Å; L434-Y499 HydrophobicContact CD2-CD2 3.93Å; L434-Y499 HydrophobicContact CD2-CE1 4.36Å; L434-Y499 HydrophobicContact CD2-CE2 4.33Å; L434-Y499 HydrophobicContact CD2-CG 3.71Å; K495-Y499 WeakPolarHBondContact O-CB 3.43Å; K495-Y499 PolarHBondContact O-N 3.04Å; L496-Y499 PolarHBondContact O-N 3.22Å; Q497-Y499 VanDerWaalsContact C-N 3.35Å; Q497-Y499 PolarHBondContact O-N 3.26Å; Y499-N501 VanDerWaalsContact C-N 3.3Å; Y499-N501 PolarHBondContact O-N 3.14Å; Y499-S502 PolarHBondContact O-N 3.16Å; Y499-S502 PolarHBondContact O-OG 3.47Å; Y499-L503 HydrophobicContact CE1-CD1 4.33Å; Y499-L503 HydrophobicContact CE1-CD2 4.11Å; Y499-L503 HydrophobicContact CE1-CG 4.42Å; Y499-L503 PolarHBondContact O-N 3.31Å
500	N	81.9	Confident	79.7	Confident	106 Å²	106	89.4 Å²	89.4	57%	0.567	45%	0.445	S	S	*	.	H	α-helix	trans	-62	-37.8	-179.5	-165.2	47.9	0	0	0	112.3	L496 Q497 S502 L503	L496-N500 WeakPolarHBondContact O-CB 3.3Å; L496-N500 PolarHBondContact O-N 2.99Å; Q497-N500 PolarHBondContact O-N 3.07Å; N500-S502 VanDerWaalsContact C-N 3.27Å; N500-S502 PolarHBondContact O-N 3.24Å; N500-L503 PolarHBondContact O-N 2.95Å
501	N	78.1	Confident	78.9	Confident	132 Å²	132	88.2 Å²	88.2	71%	0.706	44%	0.443	S	S	*	.	H	α-helix	trans	-69.8	-24.2	176.2	-66.9	-14	0	0	0	113	Q497 M498 Y499 L503	Q497-N501 VanDerWaalsContact O-CG 3.26Å; Q497-N501 PolarHBondContact O-N 3.09Å; Q497-N501 PolarHBondContact O-ND2 3.29Å; M498-N501 PolarHBondContact O-N 3.35Å; Y499-N501 VanDerWaalsContact C-N 3.3Å; Y499-N501 PolarHBondContact O-N 3.14Å; N501-L503 VanDerWaalsContact C-N 3.34Å
502	S	72.3	Confident	78.2	Confident	62 Å²	62	89.9 Å²	89.9	43%	0.434	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-2.6	178.9	75	0	0	0	0	114.5	M498 Y499 N500 T504	M498-S502 PolarHBondContact O-N 2.87Å; M498-S502 VanDerWaalsContact O-N 3.13Å; Y499-S502 PolarHBondContact O-N 3.16Å; Y499-S502 PolarHBondContact O-OG 3.47Å; N500-S502 VanDerWaalsContact C-N 3.27Å; N500-S502 PolarHBondContact O-N 3.24Å; S502-T504 VanDerWaalsContact C-N 3.25Å; S502-T504 PolarHBondContact O-N 3.12Å
503	L	67.4	Low	77.8	Confident	93 Å²	93	94.1 Å²	94.1	49%	0.487	47%	0.472	S	S	.	.			trans	-74.1	76.2	178.4	-68.4	170.5	0	0	0	110.6	Y499 N500 N501	Y499-L503 HydrophobicContact CE1-CD1 4.33Å; Y499-L503 HydrophobicContact CE1-CD2 4.11Å; Y499-L503 HydrophobicContact CE1-CG 4.42Å; Y499-L503 PolarHBondContact O-N 3.31Å; N500-L503 PolarHBondContact O-N 2.95Å; N501-L503 VanDerWaalsContact C-N 3.34Å
504	T	54.4	Low	77.3	Confident	120 Å²	120	92.7 Å²	92.7	74%	0.736	46%	0.461	S	S	*	.			trans	-94.2	92.2	170.1	48.6	0	0	0	0	110	S502 Q506	S502-T504 VanDerWaalsContact C-N 3.25Å; S502-T504 PolarHBondContact O-N 3.12Å; T504-Q506 PolarHBondContact O-N 3.25Å
505	D	50.5	Low	76.7	Confident	166 Å²	166	92.5 Å²	92.5	89%	0.888	46%	0.46	S	S	*	.	S	Bend	trans	60.1	4.3	149.7	-69.4	-24.4	0	0	0	122.9
506	Q	54.9	Low	76.2	Confident	188 Å²	188	99.3 Å²	99.3	88%	0.879	49%	0.486	S	S	*	.			trans	-127.3	84.6	168.8	-72.2	-169.1	-13.1	0	0	113.1	T504 N508	T504-Q506 PolarHBondContact O-N 3.25Å; Q506-N508 PolarHBondContact O-N 3.19Å
507	R	64	Low	76.1	Confident	189 Å²	189	97.1 Å²	97.1	71%	0.713	48%	0.48	S	S	*	.			trans	-81.3	92.7	176.7	-167.6	176	163.5	156.7	15.1	110.2	E512	R507-E512 VanDerWaalsContact CD-OE1 3.24Å; R507-E512 WeakPolarHBondContact CD-OE1 3.32Å; R507-E512 VanDerWaalsContact CG-CD 3.44Å; R507-E512 HydrophobicContact CG-CG 4.27Å; R507-E512 WeakPolarHBondContact CG-OE1 3.45Å; R507-E512 IonicContact CZ-OE1 3.18Å; R507-E512 IonicContact CZ-OE2 2.89Å; R507-E512 IonicContact NE-OE1 2.75Å; R507-E512 PolarHBondContact NE-OE1 3.37Å; R507-E512 IonicContact NE-OE2 2.68Å; R507-E512 PolarHBondContact NE-OE2 2.87Å; R507-E512 IonicContact NH2-OE1 2.75Å; R507-E512 PolarHBondContact NH2-OE1 2.94Å; R507-E512 IonicContact NH2-OE2 2.7Å; R507-E512 PolarHBondContact NH2-OE2 3.49Å
508	N	74.7	Confident	76	Confident	63 Å²	63	93.3 Å²	93.3	34%	0.337	46%	0.462	S	S	.	.			trans	-79.8	116.9	173.6	-176.2	-25.1	0	0	0	110.5	E182 Q506 W510 V511 E512	E182-N508 VanDerWaalsContact OE1-CG 3.29Å; E182-N508 PolarHBondContact OE1-ND2 3.16Å; E182-N508 PolarHBondContact OE1-OD1 3.03Å; E182-N508 VanDerWaalsContact OE1-OD1 3.11Å; Q506-N508 PolarHBondContact O-N 3.19Å; N508-W510 VanDerWaalsContact C-N 3.28Å; N508-W510 PolarHBondContact O-N 3.22Å; N508-W510 PolarHBondContact OD1-N 3.09Å; N508-V511 HydrophobicContact CB-CB 4.14Å; N508-V511 HydrophobicContact CB-CG2 3.8Å; N508-V511 WeakPolarHBondContact O-CB 3.48Å; N508-V511 PolarHBondContact O-N 3.2Å; N508-E512 PolarHBondContact O-N 3.32Å; N508-E512 VanDerWaalsContact O-N 3.14Å
509	I	81.3	Confident	76	Confident	119 Å²	119	91.8 Å²	91.8	61%	0.61	46%	0.457	S	S	*	.	H	α-helix	trans	-57.1	-39.1	-177.7	-65.1	168.1	0	0	0	112.1	E512 L513	I509-E512 PolarHBondContact O-N 2.79Å; I509-L513 HydrophobicContact CG2-CD1 3.96Å; I509-L513 HydrophobicContact CG2-CG 4.25Å; I509-L513 WeakPolarHBondContact O-CG 3.35Å; I509-L513 PolarHBondContact O-N 3.42Å
510	W	77.5	Confident	76.3	Confident	161 Å²	161	94.9 Å²	94.9	61%	0.61	48%	0.476	S	S	*	.	H	α-helix	trans	-65.3	-42.7	-179.9	-78.5	107.8	0	0	0	112.3	E182 N508 E512 L513 I514	E182-W510 VanDerWaalsContact CD-CD1 3.42Å; E182-W510 WeakPolarHBondContact OE2-CB 3.5Å; N508-W510 VanDerWaalsContact C-N 3.28Å; N508-W510 PolarHBondContact O-N 3.22Å; N508-W510 PolarHBondContact OD1-N 3.09Å; W510-E512 VanDerWaalsContact C-N 3.27Å; W510-E512 PolarHBondContact O-N 3.09Å; W510-L513 PolarHBondContact O-N 2.93Å; W510-I514 WeakPolarHBondContact O-CG1 3.41Å; W510-I514 PolarHBondContact O-N 2.91Å
511	V	79.8	Confident	76.8	Confident	35 Å²	35	90.6 Å²	90.6	21%	0.212	45%	0.453	C	S	.	.	H	α-helix	trans	-59.9	-41.6	175.3	177.1	0	0	0	0	110.4	I427 Y431 N508 I514 G515	I427-V511 HydrophobicContact CD1-CG2 3.95Å; I427-V511 HydrophobicContact CG1-CG1 4.42Å; I427-V511 HydrophobicContact CG2-CG1 3.82Å; Y431-V511 HydrophobicContact CE2-CG1 3.89Å; Y431-V511 VanDerWaalsContact CE2-O 3.3Å; Y431-V511 WeakPolarHBondContact CE2-O 3.4Å; N508-V511 HydrophobicContact CB-CB 4.14Å; N508-V511 HydrophobicContact CB-CG2 3.8Å; N508-V511 WeakPolarHBondContact O-CB 3.48Å; N508-V511 PolarHBondContact O-N 3.2Å; V511-I514 PolarHBondContact O-N 3.45Å; V511-G515 PolarHBondContact O-N 3.3Å
512	E	81.9	Confident	77.6	Confident	35 Å²	35	85.7 Å²	85.7	16%	0.164	43%	0.427	C	S	.	.	H	α-helix	trans	-69.1	-40.7	177.2	-65.3	-161.3	145.5	0	0	113.6	R507 N508 I509 W510 I514 G515 W516	R507-E512 VanDerWaalsContact CD-OE1 3.24Å; R507-E512 WeakPolarHBondContact CD-OE1 3.32Å; R507-E512 VanDerWaalsContact CG-CD 3.44Å; R507-E512 HydrophobicContact CG-CG 4.27Å; R507-E512 WeakPolarHBondContact CG-OE1 3.45Å; R507-E512 IonicContact CZ-OE1 3.18Å; R507-E512 IonicContact CZ-OE2 2.89Å; R507-E512 IonicContact NE-OE1 2.75Å; R507-E512 PolarHBondContact NE-OE1 3.37Å; R507-E512 IonicContact NE-OE2 2.68Å; R507-E512 PolarHBondContact NE-OE2 2.87Å; R507-E512 IonicContact NH2-OE1 2.75Å; R507-E512 PolarHBondContact NH2-OE1 2.94Å; R507-E512 IonicContact NH2-OE2 2.7Å; R507-E512 PolarHBondContact NH2-OE2 3.49Å; N508-E512 PolarHBondContact O-N 3.32Å; N508-E512 VanDerWaalsContact O-N 3.14Å; I509-E512 PolarHBondContact O-N 2.79Å; W510-E512 VanDerWaalsContact C-N 3.27Å; W510-E512 PolarHBondContact O-N 3.09Å; E512-I514 VanDerWaalsContact C-N 3.28Å; E512-I514 PolarHBondContact O-N 3.16Å; E512-G515 CarbonylContact O-C 3.58Å; E512-G515 WeakPolarHBondContact O-CA 3.29Å; E512-G515 PolarHBondContact O-N 3.48Å; E512-W516 PolarHBondContact O-N 3.44Å
513	L	84.8	Confident	78.6	Confident	96 Å²	96	86.7 Å²	86.7	50%	0.503	43%	0.427	S	S	.	.	H	α-helix	trans	-59.8	-42.1	176.1	-75.6	171.4	0	0	0	110.9	I509 W510 G515 W516 A517	I509-L513 HydrophobicContact CG2-CD1 3.96Å; I509-L513 HydrophobicContact CG2-CG 4.25Å; I509-L513 WeakPolarHBondContact O-CG 3.35Å; I509-L513 PolarHBondContact O-N 3.42Å; W510-L513 PolarHBondContact O-N 2.93Å; L513-G515 VanDerWaalsContact C-N 3.33Å; L513-W516 PolarHBondContact O-N 2.87Å; L513-A517 WeakPolarHBondContact O-CB 3.34Å; L513-A517 PolarHBondContact O-N 3.13Å
514	I	83.1	Confident	80	Confident	38 Å²	38	83.4 Å²	83.4	20%	0.195	41%	0.411	C	S	.	.	H	α-helix	trans	-60	-45.7	172.3	-67	168.6	0	0	0	110.1	I427 I428 W510 V511 E512 A517 M518	I427-I514 HydrophobicContact CG2-CB 4.37Å; I427-I514 HydrophobicContact CG2-CG2 3.99Å; I428-I514 HydrophobicContact CD1-CG2 4.42Å; I428-I514 HydrophobicContact CG1-CG2 3.52Å; W510-I514 WeakPolarHBondContact O-CG1 3.41Å; W510-I514 PolarHBondContact O-N 2.91Å; V511-I514 PolarHBondContact O-N 3.45Å; E512-I514 VanDerWaalsContact C-N 3.28Å; E512-I514 PolarHBondContact O-N 3.16Å; I514-A517 WeakPolarHBondContact O-CB 3.49Å; I514-A517 PolarHBondContact O-N 3.04Å; I514-M518 WeakPolarHBondContact O-CG 3.41Å; I514-M518 PolarHBondContact O-N 3.31Å; I514-M518 VanDerWaalsContact O-N 3.17Å
515	G	81.6	Confident	82	Confident	3 Å²	3	78.1 Å²	78.1	3%	0.031	38%	0.378	C	S	.	.	H	α-helix	trans	-59.5	-47.5	177.8	0	0	0	0	0	113.7	Y431 V511 E512 L513 A517 M518	Y431-G515 VanDerWaalsContact CD2-CA 3.41Å; V511-G515 PolarHBondContact O-N 3.3Å; E512-G515 CarbonylContact O-C 3.58Å; E512-G515 WeakPolarHBondContact O-CA 3.29Å; E512-G515 PolarHBondContact O-N 3.48Å; L513-G515 VanDerWaalsContact C-N 3.33Å; G515-A517 VanDerWaalsContact C-N 3.31Å; G515-A517 PolarHBondContact O-N 3.46Å; G515-M518 WeakPolarHBondContact O-CB 3.47Å; G515-M518 PolarHBondContact O-N 2.95Å; G515-M518 VanDerWaalsContact O-N 3.16Å
516	W	82.1	Confident	84.2	Confident	170 Å²	170	73.4 Å²	73.4	64%	0.644	36%	0.357	S	S	*	.	H	α-helix	trans	-65	-34.1	176	-74	113.2	0	0	0	112.4	E512 L513 M518 V519	E512-W516 PolarHBondContact O-N 3.44Å; L513-W516 PolarHBondContact O-N 2.87Å; W516-M518 VanDerWaalsContact C-N 3.26Å; W516-M518 PolarHBondContact O-N 3.29Å; W516-V519 HydrophobicContact CE3-CG2 4.32Å; W516-V519 WeakPolarHBondContact O-CB 3.33Å; W516-V519 PolarHBondContact O-N 3.45Å
517	A	87	Confident	86.1	Confident	40 Å²	40	69.1 Å²	69.1	33%	0.331	34%	0.339	S	S	.	.	H	α-helix	trans	-63	-33.2	174.3	0	0	0	0	0	112.1	L513 I514 G515 V519 L520	L513-A517 WeakPolarHBondContact O-CB 3.34Å; L513-A517 PolarHBondContact O-N 3.13Å; I514-A517 WeakPolarHBondContact O-CB 3.49Å; I514-A517 PolarHBondContact O-N 3.04Å; G515-A517 VanDerWaalsContact C-N 3.31Å; G515-A517 PolarHBondContact O-N 3.46Å; A517-V519 VanDerWaalsContact C-N 3.27Å; A517-V519 PolarHBondContact O-N 3.27Å; A517-L520 VanDerWaalsContact O-CB 3.23Å; A517-L520 WeakPolarHBondContact O-CB 3.5Å; A517-L520 WeakPolarHBondContact O-CG 3.32Å; A517-L520 PolarHBondContact O-N 3.2Å; A517-L520 VanDerWaalsContact O-N 3.15Å
518	M	87.4	Confident	87.6	Confident	23 Å²	23	61.6 Å²	61.6	11%	0.113	31%	0.313	C	S	.	.	H	α-helix	trans	-66.6	-29.9	176.9	-62.8	-52.1	98.5	0	0	112.5	L107 I428 L432 I514 G515 W516 L520 I521	L107-M518 HydrophobicContact CD2-CE 4.41Å; L107-M518 HydrophobicContact CD2-SD 3.46Å; L107-M518 WeakPolarHBondContact CD2-SD 3.4Å; I428-M518 HydrophobicContact CG1-SD 4.47Å; I428-M518 HydrophobicContact CG2-CG 4.47Å; I428-M518 HydrophobicContact CG2-SD 3.66Å; L432-M518 HydrophobicContact CD2-CB 4.06Å; L432-M518 HydrophobicContact CD2-CG 4.18Å; L432-M518 HydrophobicContact CD2-SD 3.96Å; L432-M518 HydrophobicContact CG-CG 4.33Å; L432-M518 HydrophobicContact CG-SD 4.18Å; I514-M518 WeakPolarHBondContact O-CG 3.41Å; I514-M518 PolarHBondContact O-N 3.31Å; I514-M518 VanDerWaalsContact O-N 3.17Å; G515-M518 WeakPolarHBondContact O-CB 3.47Å; G515-M518 PolarHBondContact O-N 2.95Å; G515-M518 VanDerWaalsContact O-N 3.16Å; W516-M518 VanDerWaalsContact C-N 3.26Å; W516-M518 PolarHBondContact O-N 3.29Å; M518-L520 PolarHBondContact O-N 3.16Å; M518-I521 WeakPolarHBondContact O-CB 3.44Å; M518-I521 WeakPolarHBondContact O-CG1 3.37Å; M518-I521 PolarHBondContact O-N 3.45Å; M518-I521 VanDerWaalsContact O-N 3.16Å
519	V	86.6	Confident	88.4	Confident	46 Å²	46	60.9 Å²	60.9	28%	0.279	31%	0.309	S	S	.	.	H	α-helix	trans	-63.9	-23.2	175.8	-177.7	0	0	0	0	111.7	F435 W516 A517 I521 L522	F435-V519 HydrophobicContact CD2-CG2 4.18Å; F435-V519 HydrophobicContact CE2-CG2 4.48Å; F435-V519 HydrophobicContact CG-CG2 4.46Å; W516-V519 HydrophobicContact CE3-CG2 4.32Å; W516-V519 WeakPolarHBondContact O-CB 3.33Å; W516-V519 PolarHBondContact O-N 3.45Å; A517-V519 VanDerWaalsContact C-N 3.27Å; A517-V519 PolarHBondContact O-N 3.27Å; V519-I521 PolarHBondContact O-N 3.43Å; V519-I521 VanDerWaalsContact O-N 3.13Å; V519-L522 WeakPolarHBondContact O-CB 2.82Å; V519-L522 PolarHBondContact O-N 2.98Å
520	L	90.3	Very high	89	Confident	107 Å²	107	60 Å²	60	56%	0.56	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-61.7	-20.6	176.4	-59.7	176.4	0	0	0	113	A517 M518 L522 L523	A517-L520 VanDerWaalsContact O-CB 3.23Å; A517-L520 WeakPolarHBondContact O-CB 3.5Å; A517-L520 WeakPolarHBondContact O-CG 3.32Å; A517-L520 PolarHBondContact O-N 3.2Å; A517-L520 VanDerWaalsContact O-N 3.15Å; M518-L520 PolarHBondContact O-N 3.16Å; L520-L522 PolarHBondContact O-N 3.24Å; L520-L523 HydrophobicContact CD2-CD2 4.4Å; L520-L523 WeakPolarHBondContact O-CB 3.37Å; L520-L523 PolarHBondContact O-N 3.38Å; L520-L523 VanDerWaalsContact O-N 3.07Å
521	I	94	Very high	89.6	Confident	16 Å²	16	58.5 Å²	58.5	8%	0.082	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-61.8	-29	172.7	-64.3	172.4	0	0	0	111.2	S100 L103 L104 L107 L432 M518 V519 P524	S100-I521 WeakPolarHBondContact CB-O 3.32Å; S100-I521 PolarHBondContact OG-O 3Å; L103-I521 HydrophobicContact CB-CG2 4.29Å; L104-I521 HydrophobicContact CB-CG2 4.07Å; L104-I521 HydrophobicContact CD1-CD1 4.41Å; L107-I521 HydrophobicContact CD2-CD1 3.6Å; L432-I521 HydrophobicContact CD2-CD1 3.54Å; M518-I521 WeakPolarHBondContact O-CB 3.44Å; M518-I521 WeakPolarHBondContact O-CG1 3.37Å; M518-I521 PolarHBondContact O-N 3.45Å; M518-I521 VanDerWaalsContact O-N 3.16Å; V519-I521 PolarHBondContact O-N 3.43Å; V519-I521 VanDerWaalsContact O-N 3.13Å; I521-P524 VanDerWaalsContact O-CD 3.27Å; I521-P524 WeakPolarHBondContact O-CD 3.46Å
522	L	93.9	Very high	90	Very high	29 Å²	29	57.2 Å²	57.2	15%	0.152	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-82	-14.6	177.3	-58.9	179.7	0	0	0	112.9	F439 L440 V519 L520 V525 P526	F439-L522 HydrophobicContact CB-CD1 4.26Å; F439-L522 HydrophobicContact CB-CD2 4.44Å; F439-L522 HydrophobicContact CD2-CD1 4.31Å; L440-L522 HydrophobicContact CD1-CD2 4.17Å; L440-L522 HydrophobicContact CD2-CD2 3.58Å; L440-L522 HydrophobicContact CG-CD2 3.57Å; V519-L522 WeakPolarHBondContact O-CB 2.82Å; V519-L522 PolarHBondContact O-N 2.98Å; L520-L522 PolarHBondContact O-N 3.24Å; L522-V525 WeakPolarHBondContact O-CB 3.48Å; L522-V525 PolarHBondContact O-N 3.36Å; L522-P526 WeakPolarHBondContact O-CD 3.3Å
523	L	94	Very high	90.3	Very high	84 Å²	84	58 Å²	58	44%	0.44	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-34.5	-174.8	-170.8	66.1	0	0	0	115.1	L520 V525 P526 I527	L520-L523 HydrophobicContact CD2-CD2 4.4Å; L520-L523 WeakPolarHBondContact O-CB 3.37Å; L520-L523 PolarHBondContact O-N 3.38Å; L520-L523 VanDerWaalsContact O-N 3.07Å; L523-V525 PolarHBondContact O-N 3.47Å; L523-P526 WeakPolarHBondContact O-CD 3.5Å; L523-P526 WeakPolarHBondContact O-CG 3.47Å; L523-I527 HydrophobicContact CD1-CD1 4.21Å; L523-I527 HydrophobicContact CD1-CG1 4.36Å; L523-I527 HydrophobicContact CD2-CD1 3.98Å; L523-I527 HydrophobicContact CG-CD1 3.62Å; L523-I527 HydrophobicContact CG-CG1 4.18Å; L523-I527 WeakPolarHBondContact O-CG1 3.34Å; L523-I527 PolarHBondContact O-N 2.93Å
524	P	96.8	Very high	90.4	Very high	23 Å²	23	55.2 Å²	55.2	15%	0.149	29%	0.292	C	S	.	.	H	α-helix	trans	-56.3	-28.9	174.1	-27	35.7	0	0	0	114.2	T99 L103 I521 N528	T99-P524 HydrophobicContact CG2-CB 3.96Å; T99-P524 HydrophobicContact CG2-CG 4.06Å; L103-P524 HydrophobicContact CD1-CG 3.8Å; I521-P524 VanDerWaalsContact O-CD 3.27Å; I521-P524 WeakPolarHBondContact O-CD 3.46Å; P524-N528 WeakPolarHBondContact O-CB 3.27Å; P524-N528 PolarHBondContact O-N 3.36Å
525	V	96.4	Very high	90.5	Very high	9 Å²	9	58.6 Å²	58.6	6%	0.055	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-63.4	179.9	179	0	0	0	0	111.9	V97 L440 L443 L522 L523 I527 N528 I529	V97-V525 HydrophobicContact CG2-CG2 4Å; L440-V525 HydrophobicContact CD2-CG2 4.14Å; L443-V525 HydrophobicContact CD1-CG1 3.86Å; L443-V525 HydrophobicContact CD1-CG2 4.4Å; L522-V525 WeakPolarHBondContact O-CB 3.48Å; L522-V525 PolarHBondContact O-N 3.36Å; L523-V525 PolarHBondContact O-N 3.47Å; V525-I527 VanDerWaalsContact C-N 3.31Å; V525-I527 PolarHBondContact O-N 3.38Å; V525-N528 PolarHBondContact O-N 3.29Å; V525-I529 HydrophobicContact CG1-CD1 3.98Å; V525-I529 WeakPolarHBondContact O-CG1 3.44Å; V525-I529 PolarHBondContact O-N 3.26Å
526	P	95.8	Very high	90.4	Very high	67 Å²	67	59.7 Å²	59.7	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-63.4	-35.3	179.9	25.6	-35.1	0	0	0	112.4	L522 L523 N528 I529 V530	L522-P526 WeakPolarHBondContact O-CD 3.3Å; L523-P526 WeakPolarHBondContact O-CD 3.5Å; L523-P526 WeakPolarHBondContact O-CG 3.47Å; P526-N528 VanDerWaalsContact C-N 3.33Å; P526-N528 PolarHBondContact O-N 2.88Å; P526-I529 PolarHBondContact O-N 3.39Å; P526-V530 WeakPolarHBondContact O-CG2 3.41Å; P526-V530 PolarHBondContact O-N 3.01Å
527	I	95.5	Very high	90.3	Very high	99 Å²	99	53.3 Å²	53.3	51%	0.508	29%	0.292	S	S	.	.	H	α-helix	trans	-58.7	-47.5	175	-70.1	179.4	0	0	0	110.2	L523 V525 V530 Y531	L523-I527 HydrophobicContact CD1-CD1 4.21Å; L523-I527 HydrophobicContact CD1-CG1 4.36Å; L523-I527 HydrophobicContact CD2-CD1 3.98Å; L523-I527 HydrophobicContact CG-CD1 3.62Å; L523-I527 HydrophobicContact CG-CG1 4.18Å; L523-I527 WeakPolarHBondContact O-CG1 3.34Å; L523-I527 PolarHBondContact O-N 2.93Å; V525-I527 VanDerWaalsContact C-N 3.31Å; V525-I527 PolarHBondContact O-N 3.38Å; I527-V530 PolarHBondContact O-N 3.34Å; I527-Y531 VanDerWaalsContact O-CB 3.26Å; I527-Y531 WeakPolarHBondContact O-CB 3.46Å; I527-Y531 PolarHBondContact O-N 3.06Å
528	N	94	Very high	90	Very high	30 Å²	30	59.6 Å²	59.6	16%	0.16	31%	0.312	C	S	.	.	H	α-helix	trans	-68.7	-36.9	-178.8	-172.5	71.1	0	0	0	112.5	P92 L93 A95 G96 P524 V525 P526 Y531 C532	P92-N528 PolarHBondContact O-ND2 2.81Å; L93-N528 PolarHBondContact O-ND2 3.24Å; A95-N528 WeakPolarHBondContact CB-ND2 3.38Å; A95-N528 PolarHBondContact N-ND2 2.88Å; G96-N528 PolarHBondContact N-ND2 2.75Å; P524-N528 WeakPolarHBondContact O-CB 3.27Å; P524-N528 PolarHBondContact O-N 3.36Å; V525-N528 PolarHBondContact O-N 3.29Å; P526-N528 VanDerWaalsContact C-N 3.33Å; P526-N528 PolarHBondContact O-N 2.88Å; N528-Y531 PolarHBondContact O-N 3.14Å; N528-C532 VanDerWaalsContact O-CB 3.28Å; N528-C532 WeakPolarHBondContact O-CB 3.21Å; N528-C532 PolarHBondContact O-N 3.4Å; N528-C532 PolarHBondContact O-SG 2.96Å
529	I	93.3	Very high	89.4	Confident	49 Å²	49	67.2 Å²	67.2	25%	0.251	35%	0.345	S	S	.	.	H	α-helix	trans	-59.2	-52.2	173.6	-69.4	169.7	0	0	0	110.1	L93 F94 V525 P526 Y531 C532 I533	L93-I529 HydrophobicContact CD2-CG2 4.38Å; L93-I529 VanDerWaalsContact O-CG1 3.29Å; L93-I529 WeakPolarHBondContact O-CG1 3.36Å; F94-I529 HydrophobicContact CE1-CD1 4.29Å; V525-I529 HydrophobicContact CG1-CD1 3.98Å; V525-I529 WeakPolarHBondContact O-CG1 3.44Å; V525-I529 PolarHBondContact O-N 3.26Å; P526-I529 PolarHBondContact O-N 3.39Å; I529-Y531 PolarHBondContact O-N 3.38Å; I529-C532 PolarHBondContact O-N 3.33Å; I529-I533 HydrophobicContact CG2-CD1 3.73Å; I529-I533 VanDerWaalsContact O-CG1 3.27Å; I529-I533 WeakPolarHBondContact O-CG1 3.36Å; I529-I533 PolarHBondContact O-N 2.89Å
530	V	92.4	Very high	88.3	Confident	99 Å²	99	65.6 Å²	65.6	60%	0.6	34%	0.337	S	S	*	.	H	α-helix	trans	-62.4	-45.2	179.5	173	0	0	0	0	111	P526 I527 I533 A534	P526-V530 WeakPolarHBondContact O-CG2 3.41Å; P526-V530 PolarHBondContact O-N 3.01Å; I527-V530 PolarHBondContact O-N 3.34Å; V530-I533 PolarHBondContact O-N 3.35Å; V530-A534 VanDerWaalsContact O-CB 3.24Å; V530-A534 WeakPolarHBondContact O-CB 3.34Å; V530-A534 PolarHBondContact O-N 2.87Å
531	Y	91.1	Very high	87.1	Confident	130 Å²	130	64.7 Å²	64.7	51%	0.51	34%	0.338	S	S	.	.	H	α-helix	trans	-59.5	-47.6	177.9	171.9	-101	0	0	0	112	I527 N528 I529 A534 K535	I527-Y531 VanDerWaalsContact O-CB 3.26Å; I527-Y531 WeakPolarHBondContact O-CB 3.46Å; I527-Y531 PolarHBondContact O-N 3.06Å; N528-Y531 PolarHBondContact O-N 3.14Å; I529-Y531 PolarHBondContact O-N 3.38Å; Y531-A534 PolarHBondContact O-N 3.42Å; Y531-K535 HydrophobicContact CE1-CD 4.02Å; Y531-K535 WeakPolarHBondContact O-CB 3.33Å; Y531-K535 PolarHBondContact O-N 3.46Å
532	C	88	Confident	85.6	Confident	9 Å²	9	65.4 Å²	65.4	6%	0.061	35%	0.349	C	S	.	.	H	α-helix	trans	-63.1	-48.7	179.8	-79.8	0	0	0	0	111.2	P92 L93 N528 I529 A534 K535 T536	P92-C532 PolarHBondContact O-SG 3.35Å; P92-C532 VanDerWaalsContact O-SG 3.34Å; L93-C532 HydrophobicContact CD2-CB 4.02Å; N528-C532 VanDerWaalsContact O-CB 3.28Å; N528-C532 WeakPolarHBondContact O-CB 3.21Å; N528-C532 PolarHBondContact O-N 3.4Å; N528-C532 PolarHBondContact O-SG 2.96Å; I529-C532 PolarHBondContact O-N 3.33Å; C532-A534 PolarHBondContact O-N 3.22Å; C532-K535 PolarHBondContact O-N 2.87Å; C532-T536 PolarHBondContact O-N 3.43Å; C532-T536 PolarHBondContact O-OG1 2.91Å
533	I	87.1	Confident	84.3	Confident	51 Å²	51	74.2 Å²	74.2	26%	0.262	39%	0.387	S	S	.	.	H	α-helix	trans	-59.1	-48.8	177.9	-67.3	169.4	0	0	0	110.6	L93 I529 V530 K535 T536 C537 F549	L93-I533 HydrophobicContact CD2-CD1 4.21Å; L93-I533 HydrophobicContact CD2-CG1 3.69Å; I529-I533 HydrophobicContact CG2-CD1 3.73Å; I529-I533 VanDerWaalsContact O-CG1 3.27Å; I529-I533 WeakPolarHBondContact O-CG1 3.36Å; I529-I533 PolarHBondContact O-N 2.89Å; V530-I533 PolarHBondContact O-N 3.35Å; I533-K535 PolarHBondContact O-N 2.98Å; I533-T536 WeakPolarHBondContact CA-OG1 3.27Å; I533-T536 PolarHBondContact O-N 2.88Å; I533-T536 PolarHBondContact O-OG1 3.31Å; I533-C537 WeakPolarHBondContact O-CB 3.41Å; I533-C537 PolarHBondContact O-N 3.5Å; I533-C537 PolarHBondContact O-SG 2.96Å; I533-F549 HydrophobicContact CD1-CE2 4.23Å; I533-F549 HydrophobicContact CG1-CE2 4.35Å; I533-F549 HydrophobicContact CG2-CD2 4.46Å
534	A	87.3	Confident	83.6	Confident	37 Å²	37	72.6 Å²	72.6	31%	0.306	38%	0.382	S	S	.	.	H	α-helix	trans	-59.9	-49.6	178.8	0	0	0	0	0	111	V530 Y531 C532 T536 C537 F538	V530-A534 VanDerWaalsContact O-CB 3.24Å; V530-A534 WeakPolarHBondContact O-CB 3.34Å; V530-A534 PolarHBondContact O-N 2.87Å; Y531-A534 PolarHBondContact O-N 3.42Å; C532-A534 PolarHBondContact O-N 3.22Å; A534-T536 VanDerWaalsContact C-N 3.33Å; A534-T536 PolarHBondContact O-N 3.14Å; A534-C537 PolarHBondContact O-N 3.43Å; A534-F538 HydrophobicContact CB-CD2 4.33Å; A534-F538 HydrophobicContact CB-CE2 4.28Å; A534-F538 WeakPolarHBondContact O-CD2 3.47Å; A534-F538 PolarHBondContact O-N 3.28Å
535	K	84.9	Confident	82.6	Confident	109 Å²	109	77.8 Å²	77.8	47%	0.474	41%	0.408	S	S	.	.	H	α-helix	trans	-57.3	-44.6	179.1	-176.1	-178.9	-179.7	178.7	0	111.8	Y531 C532 I533 K539	Y531-K535 HydrophobicContact CE1-CD 4.02Å; Y531-K535 WeakPolarHBondContact O-CB 3.33Å; Y531-K535 PolarHBondContact O-N 3.46Å; C532-K535 PolarHBondContact O-N 2.87Å; I533-K535 PolarHBondContact O-N 2.98Å; K535-K539 PolarHBondContact O-N 3.46Å
536	T	80.7	Confident	81.6	Confident	27 Å²	27	84.8 Å²	84.8	17%	0.166	43%	0.434	C	S	.	.	H	α-helix	trans	-71.3	-35.8	177.8	47	0	0	0	0	113.2	C532 I533 A534 G540 A552	C532-T536 PolarHBondContact O-N 3.43Å; C532-T536 PolarHBondContact O-OG1 2.91Å; I533-T536 WeakPolarHBondContact CA-OG1 3.27Å; I533-T536 PolarHBondContact O-N 2.88Å; I533-T536 PolarHBondContact O-OG1 3.31Å; A534-T536 VanDerWaalsContact C-N 3.33Å; A534-T536 PolarHBondContact O-N 3.14Å; T536-G540 WeakPolarHBondContact O-CA 3.33Å; T536-G540 PolarHBondContact O-N 2.83Å; T536-A552 HydrophobicContact CG2-CB 4.03Å; T536-A552 WeakPolarHBondContact OG1-CB 3.06Å
537	C	80	Confident	80.8	Confident	36 Å²	36	85.4 Å²	85.4	24%	0.243	43%	0.431	C	S	.	.	H	α-helix	trans	-67.2	-40.5	176.8	-73.1	0	0	0	0	111.8	I533 A534	I533-C537 WeakPolarHBondContact O-CB 3.41Å; I533-C537 PolarHBondContact O-N 3.5Å; I533-C537 PolarHBondContact O-SG 2.96Å; A534-C537 PolarHBondContact O-N 3.43Å
538	F	80.4	Confident	79.8	Confident	171 Å²	171	83 Å²	83	75%	0.75	42%	0.417	S	S	*	.	H	α-helix	trans	-80.5	-39.4	-179.2	-70.5	-63.5	0	0	0	113.9	A534	A534-F538 HydrophobicContact CB-CD2 4.33Å; A534-F538 HydrophobicContact CB-CE2 4.28Å; A534-F538 WeakPolarHBondContact O-CD2 3.47Å; A534-F538 PolarHBondContact O-N 3.28Å
539	K	73.8	Confident	79	Confident	184 Å²	184	84.7 Å²	84.7	80%	0.8	42%	0.423	S	S	*	.	H	α-helix	trans	-124.6	-1.4	-171.3	-62.9	-173.6	178.3	-177.4	0	114.5	K535	K535-K539 PolarHBondContact O-N 3.46Å
540	G	64.9	Low	78.2	Confident	12 Å²	12	88.2 Å²	88.2	12%	0.124	44%	0.436	C	S	.	.			trans	-71.9	148.8	-176	0	0	0	0	0	112.7	T536 K548	T536-G540 WeakPolarHBondContact O-CA 3.33Å; T536-G540 PolarHBondContact O-N 2.83Å; G540-K548 VanDerWaalsContact O-CE 3.32Å; G540-K548 WeakPolarHBondContact O-CE 3.41Å
541	P	64.7	Low	77.6	Confident	87 Å²	87	88.7 Å²	88.7	57%	0.565	43%	0.428	S	S	*	.	S	Bend	trans	-65	144.3	170.1	28.7	-33.1	0	0	0	110.5	Y551	P541-Y551 HydrophobicContact CG-CG 4.47Å; P541-Y551 WeakPolarHBondContact O-CD2 3.46Å
542	G	61.8	Low	77	Confident	32 Å²	32	82.6 Å²	82.6	33%	0.33	40%	0.404	S	S	.	.			trans	139.4	145.6	178.4	0	0	0	0	0	112.8	K548	G542-K548 WeakPolarHBondContact O-CE 3.45Å
543	F	66.8	Low	76.6	Confident	214 Å²	214	86 Å²	86	94%	0.939	42%	0.419	S	S	*	.	S	Bend	trans	-82.2	-30.7	180	-66.3	-80.3	0	0	0	111.6	E547	F543-E547 PolarHBondContact N-OE2 3.49Å
544	S	79.4	Confident	76.2	Confident	49 Å²	49	85 Å²	85	34%	0.343	42%	0.418	S	S	.	.	S	Bend	trans	-115.3	155.2	179.4	69.8	0	0	0	0	113.6	W546 E547 K548	S544-W546 PolarHBondContact O-N 2.85Å; S544-E547 PolarHBondContact N-OE2 2.65Å; S544-E547 PolarHBondContact O-N 2.8Å; S544-E547 VanDerWaalsContact OG-CG 3.32Å; S544-E547 WeakPolarHBondContact OG-CG 3.2Å; S544-E547 PolarHBondContact OG-N 3.05Å; S544-E547 PolarHBondContact OG-OE2 3.27Å; S544-K548 PolarHBondContact O-N 3.49Å; S544-K548 VanDerWaalsContact O-N 3.1Å
545	L	76.3	Confident	76.1	Confident	132 Å²	132	83.6 Å²	83.6	69%	0.691	41%	0.406	S	S	*	.	H	α-helix	trans	-55.8	-35.8	174.6	-79.9	165.4	0	0	0	112.4	K548 F549	L545-K548 PolarHBondContact O-N 2.7Å; L545-F549 WeakPolarHBondContact O-CB 3.44Å; L545-F549 PolarHBondContact O-N 2.84Å
546	W	76.2	Confident	75.8	Confident	157 Å²	157	80.2 Å²	80.2	60%	0.595	40%	0.395	S	S	*	.	H	α-helix	trans	-70.5	-39.6	179.6	-176.5	-122.9	0	0	0	112.9	S544 F549 K550	S544-W546 PolarHBondContact O-N 2.85Å; W546-F549 AromaticContact CE3-CD1 3.96Å; W546-F549 HydrophobicContact CE3-CD1 3.96Å; W546-F549 HydrophobicContact CH2-CD1 4.39Å; W546-F549 AromaticContact CZ3-CD1 3.65Å; W546-F549 HydrophobicContact CZ3-CD1 3.65Å; W546-F549 HydrophobicContact CZ3-CE1 4.01Å; W546-F549 PolarHBondContact O-N 3.11Å; W546-K550 WeakPolarHBondContact O-CG 3.22Å; W546-K550 PolarHBondContact O-N 2.84Å
547	E	77.1	Confident	75.4	Confident	80 Å²	80	79.8 Å²	79.8	37%	0.374	39%	0.391	S	S	.	.	H	α-helix	trans	-62.9	-46.7	172.9	-74.1	168.4	167.6	0	0	110.8	F543 S544 F549 K550 Y551	F543-E547 PolarHBondContact N-OE2 3.49Å; S544-E547 PolarHBondContact N-OE2 2.65Å; S544-E547 PolarHBondContact O-N 2.8Å; S544-E547 VanDerWaalsContact OG-CG 3.32Å; S544-E547 WeakPolarHBondContact OG-CG 3.2Å; S544-E547 PolarHBondContact OG-N 3.05Å; S544-E547 PolarHBondContact OG-OE2 3.27Å; E547-F549 VanDerWaalsContact C-N 3.27Å; E547-F549 PolarHBondContact O-N 3.08Å; E547-K550 WeakPolarHBondContact O-CB 3.18Å; E547-K550 PolarHBondContact O-N 3.16Å; E547-K550 VanDerWaalsContact O-N 3.13Å; E547-Y551 WeakPolarHBondContact O-CD2 3.36Å; E547-Y551 PolarHBondContact O-N 3.37Å
548	K	75.6	Confident	74.4	Confident	48 Å²	48	84.5 Å²	84.5	21%	0.209	40%	0.404	C	S	.	.	H	α-helix	trans	-58.2	-39.7	175.7	-68.9	-178.4	-178.9	-173.8	0	112.2	G540 G542 S544 L545 Y551 A552	G540-K548 VanDerWaalsContact O-CE 3.32Å; G540-K548 WeakPolarHBondContact O-CE 3.41Å; G542-K548 WeakPolarHBondContact O-CE 3.45Å; S544-K548 PolarHBondContact O-N 3.49Å; S544-K548 VanDerWaalsContact O-N 3.1Å; L545-K548 PolarHBondContact O-N 2.7Å; K548-Y551 WeakPolarHBondContact O-CB 3.36Å; K548-Y551 PolarHBondContact O-N 3.35Å; K548-A552 PolarHBondContact O-N 2.7Å
549	F	76.9	Confident	72.8	Confident	65 Å²	65	83.4 Å²	83.4	29%	0.285	40%	0.396	S	S	.	.	H	α-helix	trans	-65	-44.6	175	-177.9	-103.7	0	0	0	112.1	I533 L545 W546 E547 Y551 A552 F553	I533-F549 HydrophobicContact CD1-CE2 4.23Å; I533-F549 HydrophobicContact CG1-CE2 4.35Å; I533-F549 HydrophobicContact CG2-CD2 4.46Å; L545-F549 WeakPolarHBondContact O-CB 3.44Å; L545-F549 PolarHBondContact O-N 2.84Å; W546-F549 AromaticContact CE3-CD1 3.96Å; W546-F549 HydrophobicContact CE3-CD1 3.96Å; W546-F549 HydrophobicContact CH2-CD1 4.39Å; W546-F549 AromaticContact CZ3-CD1 3.65Å; W546-F549 HydrophobicContact CZ3-CD1 3.65Å; W546-F549 HydrophobicContact CZ3-CE1 4.01Å; W546-F549 PolarHBondContact O-N 3.11Å; E547-F549 VanDerWaalsContact C-N 3.27Å; E547-F549 PolarHBondContact O-N 3.08Å; F549-Y551 VanDerWaalsContact C-N 3.25Å; F549-Y551 PolarHBondContact O-N 2.67Å; F549-A552 WeakPolarHBondContact O-CB 3.47Å; F549-A552 PolarHBondContact O-N 3.41Å; F549-F553 HydrophobicContact CD1-CE2 4.11Å; F549-F553 AromaticContact CE1-CE2 3.53Å; F549-F553 HydrophobicContact CE1-CE2 3.53Å; F549-F553 HydrophobicContact CE1-CZ 4.17Å; F549-F553 HydrophobicContact CE2-CE2 4.13Å; F549-F553 AromaticContact CZ-CE2 3.55Å; F549-F553 HydrophobicContact CZ-CE2 3.55Å; F549-F553 AromaticContact CZ-CZ 3.94Å; F549-F553 HydrophobicContact CZ-CZ 3.94Å; F549-F553 WeakPolarHBondContact O-CD2 3.2Å
550	K	77.8	Confident	71.4	Confident	123 Å²	123	77.5 Å²	77.5	54%	0.535	37%	0.371	S	S	.	.	H	α-helix	trans	-59	-37.3	174	-75.5	-179.1	175.2	175.6	0	112.4	W546 E547 A552 F553	W546-K550 WeakPolarHBondContact O-CG 3.22Å; W546-K550 PolarHBondContact O-N 2.84Å; E547-K550 WeakPolarHBondContact O-CB 3.18Å; E547-K550 PolarHBondContact O-N 3.16Å; E547-K550 VanDerWaalsContact O-N 3.13Å; K550-A552 PolarHBondContact O-N 3.29Å; K550-F553 PolarHBondContact O-N 3.49Å
551	Y	78.2	Confident	69.8	Low	109 Å²	109	82.7 Å²	82.7	43%	0.427	40%	0.4	S	S	.	.	H	α-helix	trans	-62.7	-24.5	175.5	-83.5	-70.4	0	0	0	113.3	P541 E547 K548 F549 F553 A554	P541-Y551 HydrophobicContact CG-CG 4.47Å; P541-Y551 WeakPolarHBondContact O-CD2 3.46Å; E547-Y551 WeakPolarHBondContact O-CD2 3.36Å; E547-Y551 PolarHBondContact O-N 3.37Å; K548-Y551 WeakPolarHBondContact O-CB 3.36Å; K548-Y551 PolarHBondContact O-N 3.35Å; F549-Y551 VanDerWaalsContact C-N 3.25Å; F549-Y551 PolarHBondContact O-N 2.67Å; Y551-F553 PolarHBondContact O-N 2.87Å; Y551-A554 WeakPolarHBondContact O-CB 3.35Å; Y551-A554 PolarHBondContact O-N 3.42Å; Y551-A554 VanDerWaalsContact O-N 3.15Å
552	A	78.9	Confident	68.5	Low	2 Å²	2	81.4 Å²	81.4	2%	0.017	39%	0.392	C	S	.	.	H	α-helix	trans	-64.5	-27.5	175.6	0	0	0	0	0	113.2	L93 T536 K548 F549 K550	L93-A552 HydrophobicContact CD1-CB 4.4Å; L93-A552 HydrophobicContact CD2-CB 4.33Å; L93-A552 HydrophobicContact CG-CB 4.45Å; L93-A552 WeakPolarHBondContact CG-O 3.24Å; T536-A552 HydrophobicContact CG2-CB 4.03Å; T536-A552 WeakPolarHBondContact OG1-CB 3.06Å; K548-A552 PolarHBondContact O-N 2.7Å; F549-A552 WeakPolarHBondContact O-CB 3.47Å; F549-A552 PolarHBondContact O-N 3.41Å; K550-A552 PolarHBondContact O-N 3.29Å
553	F	79.7	Confident	67.1	Low	82 Å²	82	87.9 Å²	87.9	36%	0.36	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-12.1	177.3	-67.2	-96.8	0	0	0	112.9	L93 V451 F549 K550 Y551 S555	L93-F553 HydrophobicContact CD1-CB 4.31Å; L93-F553 HydrophobicContact CD1-CD1 3.32Å; L93-F553 HydrophobicContact CD1-CD2 3.72Å; L93-F553 HydrophobicContact CD1-CE1 3.33Å; L93-F553 HydrophobicContact CD1-CE2 3.7Å; L93-F553 HydrophobicContact CD1-CG 3.52Å; L93-F553 HydrophobicContact CD1-CZ 3.52Å; V451-F553 HydrophobicContact CG1-CB 4.38Å; V451-F553 HydrophobicContact CG1-CD1 4.03Å; F549-F553 HydrophobicContact CD1-CE2 4.11Å; F549-F553 AromaticContact CE1-CE2 3.53Å; F549-F553 HydrophobicContact CE1-CE2 3.53Å; F549-F553 HydrophobicContact CE1-CZ 4.17Å; F549-F553 HydrophobicContact CE2-CE2 4.13Å; F549-F553 AromaticContact CZ-CE2 3.55Å; F549-F553 HydrophobicContact CZ-CE2 3.55Å; F549-F553 AromaticContact CZ-CZ 3.94Å; F549-F553 HydrophobicContact CZ-CZ 3.94Å; F549-F553 WeakPolarHBondContact O-CD2 3.2Å; K550-F553 PolarHBondContact O-N 3.49Å; Y551-F553 PolarHBondContact O-N 2.87Å; F553-S555 PolarHBondContact O-N 3.05Å
554	A	79.4	Confident	65.6	Low	30 Å²	30	84 Å²	84	25%	0.248	40%	0.404	C	S	.	.			trans	-74.9	123.8	-172.4	0	0	0	0	0	111.3	Y551 Y559	Y551-A554 WeakPolarHBondContact O-CB 3.35Å; Y551-A554 PolarHBondContact O-N 3.42Å; Y551-A554 VanDerWaalsContact O-N 3.15Å; A554-Y559 HydrophobicContact CB-CE2 4.18Å
555	S	83.7	Confident	63.6	Low	7 Å²	7	85.3 Å²	85.3	5%	0.049	41%	0.414	C	S	.	.			trans	-64.6	129.9	173.8	167.3	0	0	0	0	111.2	N89 M90 F553 L557 R558	N89-S555 PolarHBondContact O-OG 2.9Å; M90-S555 WeakPolarHBondContact O-CB 3.48Å; F553-S555 PolarHBondContact O-N 3.05Å; S555-L557 PolarHBondContact O-N 3.4Å; S555-L557 WeakPolarHBondContact OG-CB 3.12Å; S555-L557 PolarHBondContact OG-N 3.09Å; S555-R558 PolarHBondContact O-N 3.26Å
556	P	78.7	Confident	61.9	Low	38 Å²	38	85.3 Å²	85.3	25%	0.247	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-66.6	-24	175.3	27.4	-36.2	0	0	0	113.1	F88 N89 R558 Y559	F88-P556 HydrophobicContact CD1-CG 4.39Å; F88-P556 HydrophobicContact CE1-CG 4.17Å; N89-P556 WeakPolarHBondContact O-CD 3.12Å; P556-R558 PolarHBondContact O-N 2.69Å; P556-Y559 PolarHBondContact O-N 2.75Å
557	L	73.1	Confident	59.8	Low	17 Å²	17	82.6 Å²	82.6	9%	0.089	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-56	-25	177.6	-69.9	169.2	0	0	0	113.1	I10 L78 N89 M90 Y452 S555	I10-L557 HydrophobicContact CD1-CD2 4.28Å; L78-L557 HydrophobicContact CD2-CD1 4.35Å; N89-L557 HydrophobicContact CB-CD1 4.07Å; N89-L557 HydrophobicContact CB-CD2 4.14Å; N89-L557 HydrophobicContact CB-CG 3.91Å; M90-L557 HydrophobicContact SD-CD1 3.79Å; Y452-L557 HydrophobicContact CE2-CD1 4.07Å; S555-L557 PolarHBondContact O-N 3.4Å; S555-L557 WeakPolarHBondContact OG-CB 3.12Å; S555-L557 PolarHBondContact OG-N 3.09Å
558	R	58.3	Low	57.7	Low	135 Å²	135	83.2 Å²	83.2	51%	0.509	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-80.6	-16.4	178.7	-63.3	-168	-170	176.8	14	114.2	Y452 S555 P556	Y452-R558 PolarHBondContact O-NH2 2.75Å; S555-R558 PolarHBondContact O-N 3.26Å; P556-R558 PolarHBondContact O-N 2.69Å
559	Y	47.6	Very low	56	Low	148 Å²	148	87.5 Å²	87.5	58%	0.58	45%	0.446	S	S	*	.			trans	-114.5	12.1	-169.4	-67.5	-77.6	0	0	0	114.2	A554 P556 V561	A554-Y559 HydrophobicContact CB-CE2 4.18Å; P556-Y559 PolarHBondContact O-N 2.75Å; Y559-V561 VanDerWaalsContact C-N 3.25Å; Y559-V561 PolarHBondContact O-N 3.44Å
560	E	43.5	Very low	54	Low	61 Å²	61	88.3 Å²	88.3	29%	0.285	45%	0.448	S	S	.	.			trans	-68.2	88.5	174	-69	-163.1	176	0	0	110.5	F9 I10 I11	F9-E560 VanDerWaalsContact O-OE2 3.14Å; I10-E560 WeakPolarHBondContact CA-OE2 3.4Å; I11-E560 PolarHBondContact N-OE2 3.08Å
561	V	33	Very low	52	Low	120 Å²	120	85.5 Å²	85.5	73%	0.727	44%	0.441	S	S	*	.			trans	-54.2	127.3	159.4	179.6	0	0	0	0	106.2	Y559 K563	Y559-V561 VanDerWaalsContact C-N 3.25Å; Y559-V561 PolarHBondContact O-N 3.44Å; V561-K563 PolarHBondContact O-N 3.36Å
562	P	36.4	Very low	50.3	Low	61 Å²	61	86.5 Å²	86.5	40%	0.396	46%	0.464	S	S	.	.			trans	-51.4	113.2	177.3	-22.7	30.3	0	0	0	108.7	F9 V564	F9-P562 HydrophobicContact CD2-CB 4.37Å; P562-V564 PolarHBondContact O-N 3.03Å
563	K	33.3	Very low	48.3	Very low	167 Å²	167	92 Å²	92	73%	0.726	50%	0.497	S	S	*	.			trans	-63.6	107.6	166.7	-83.2	-173.3	-176.3	168.6	0	105.6	I11 V561 S565	I11-K563 HydrophobicContact CD1-CD 3.84Å; I11-K563 HydrophobicContact CD1-CG 4.37Å; V561-K563 PolarHBondContact O-N 3.36Å; K563-S565 PolarHBondContact O-N 3.1Å
564	V	34.2	Very low	46.1	Very low	132 Å²	132	89.3 Å²	89.3	80%	0.8	49%	0.491	S	S	*	.			trans	-68.1	77.2	168.3	-175.4	0	0	0	0	106.9	P562 T566	P562-V564 PolarHBondContact O-N 3.03Å; V564-T566 PolarHBondContact O-N 3.34Å
565	S	38.7	Very low	43.9	Very low	77 Å²	77	94.4 Å²	94.4	54%	0.538	52%	0.521	S	S	.	.			trans	-75.9	112.9	167.4	65.1	0	0	0	0	107.1	K563 T567	K563-S565 PolarHBondContact O-N 3.1Å; S565-T567 PolarHBondContact O-N 3.21Å; S565-T567 VanDerWaalsContact O-N 3.13Å
566	T	40.2	Very low	41.8	Very low	132 Å²	132	97.7 Å²	97.7	81%	0.81	56%	0.556	S	S	*	*	S	Bend	trans	-68.2	-5.4	-177.9	44.3	0	0	0	0	114	V564	V564-T566 PolarHBondContact O-N 3.34Å
567	T	32.3	Very low	39.5	Very low	101 Å²	101	101.6 Å²	101.6	62%	0.62	57%	0.567	S	S	*	*	S	Bend	trans	-121.3	124.6	173.8	42.3	0	0	0	0	109.7	S565 R569	S565-T567 PolarHBondContact O-N 3.21Å; S565-T567 VanDerWaalsContact O-N 3.13Å; T567-R569 PolarHBondContact O-N 3.29Å
568	P	32.3	Very low	37.4	Very low	92 Å²	92	106.9 Å²	106.9	60%	0.597	60%	0.599	S	S	*	*			trans	-61.6	111.1	169.1	23.8	-29.1	0	0	0	107.4	Y570 T571	P568-Y570 PolarHBondContact O-N 3.2Å; P568-T571 HydrophobicContact CB-CG2 4.39Å; P568-T571 HydrophobicContact CG-CG2 4.01Å
569	R	39.6	Very low	36.1	Very low	139 Å²	139	106.4 Å²	106.4	53%	0.525	61%	0.606	S	S	.	*	S	Bend	trans	-58.5	-13.2	-175.9	-174.3	178.3	-81.4	-149.5	-5.1	113.2	T567	T567-R569 PolarHBondContact O-N 3.29Å
570	Y	35.7	Very low	35.4	Very low	81 Å²	81	105.4 Å²	105.4	32%	0.318	61%	0.61	S	S	.	*			trans	-123.6	63.5	-173.9	-61.1	-92.1	0	0	0	111.9	E12 W14 P568 P588	E12-Y570 PolarHBondContact O-OH 2.8Å; W14-Y570 AromaticContact CD2-CE1 3.51Å; W14-Y570 HydrophobicContact CD2-CE1 3.51Å; W14-Y570 AromaticContact CD2-CZ 3.96Å; W14-Y570 AromaticContact CE2-CD1 3.81Å; W14-Y570 AromaticContact CE2-CE1 3.05Å; W14-Y570 AromaticContact CE2-CZ 3.51Å; W14-Y570 AromaticContact CE3-CE1 3.75Å; W14-Y570 HydrophobicContact CE3-CE1 3.75Å; W14-Y570 HydrophobicContact CG-CE1 4.37Å; W14-Y570 AromaticContact CH2-CD1 3.19Å; W14-Y570 HydrophobicContact CH2-CD1 3.19Å; W14-Y570 AromaticContact CH2-CE1 3.12Å; W14-Y570 HydrophobicContact CH2-CE1 3.12Å; W14-Y570 HydrophobicContact CH2-CG 4.46Å; W14-Y570 AromaticContact CZ2-CD1 3.13Å; W14-Y570 HydrophobicContact CZ2-CD1 3.13Å; W14-Y570 AromaticContact CZ2-CE1 2.9Å; W14-Y570 HydrophobicContact CZ2-CE1 2.9Å; W14-Y570 HydrophobicContact CZ2-CG 4.19Å; W14-Y570 AromaticContact CZ2-CZ 3.77Å; W14-Y570 AromaticContact CZ3-CD1 3.99Å; W14-Y570 HydrophobicContact CZ3-CD1 3.99Å; W14-Y570 AromaticContact CZ3-CE1 3.55Å; W14-Y570 HydrophobicContact CZ3-CE1 3.55Å; W14-Y570 AromaticContact NE1-CE1 3.66Å; W14-Y570 AromaticContact NE1-CZ 3.6Å; W14-Y570 PolarHBondContact NE1-OH 2.79Å; P568-Y570 PolarHBondContact O-N 3.2Å; Y570-P588 HydrophobicContact CD1-CB 3.64Å; Y570-P588 HydrophobicContact CD1-CG 3.73Å; Y570-P588 HydrophobicContact CE1-CB 4.03Å; Y570-P588 HydrophobicContact CG-CB 3.91Å; Y570-P588 HydrophobicContact CG-CG 4.04Å
571	T	36.3	Very low	35	Very low	64 Å²	64	107.6 Å²	107.6	39%	0.393	63%	0.63	S	S	.	*	S	Bend	trans	-120	151.4	159.7	55.8	0	0	0	0	107.8	P568 T573 A574	P568-T571 HydrophobicContact CB-CG2 4.39Å; P568-T571 HydrophobicContact CG-CG2 4.01Å; T571-T573 PolarHBondContact O-N 2.85Å; T571-T573 PolarHBondContact OG1-OG1 3.36Å; T571-T573 VanDerWaalsContact OG1-OG1 3.14Å; T571-A574 PolarHBondContact O-N 2.06Å
572	S	41.3	Very low	34.9	Very low	131 Å²	131	110.3 Å²	110.3	92%	0.916	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-0.2	178.6	55.5	0	0	0	0	114.4
573	T	37.5	Very low	34.9	Very low	116 Å²	116	110.2 Å²	110.2	71%	0.712	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	8.7	177.4	52.4	0	0	0	0	113.7	T571	T571-T573 PolarHBondContact O-N 2.85Å; T571-T573 PolarHBondContact OG1-OG1 3.36Å; T571-T573 VanDerWaalsContact OG1-OG1 3.14Å
574	A	34.1	Very low	34.9	Very low	27 Å²	27	107.1 Å²	107.1	22%	0.223	64%	0.636	C	S	.	*			trans	-71.6	131.2	176.1	0	0	0	0	0	111.8	T571 G576	T571-A574 PolarHBondContact O-N 2.06Å; A574-G576 PolarHBondContact O-N 3.11Å
575	P	32.8	Very low	34.8	Very low	136 Å²	136	106.1 Å²	106.1	88%	0.883	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	129.2	-179	-13.4	26.4	0	0	0	111.5
576	G	38.9	Very low	34.7	Very low	76 Å²	76	103.8 Å²	103.8	78%	0.784	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	115.1	-7.4	177.6	0	0	0	0	0	115.2	A574 V578	A574-G576 PolarHBondContact O-N 3.11Å; G576-V578 PolarHBondContact O-N 3.39Å
577	Y	29.5	Very low	34.3	Very low	121 Å²	121	105 Å²	105	48%	0.475	61%	0.607	S	S	.	*			trans	-83	91.3	172.4	-95.9	-85.5	0	0	0	111.5	W14 L579	W14-Y577 HydrophobicContact CH2-CE1 4.31Å; W14-Y577 AromaticContact CH2-CE2 3.77Å; W14-Y577 HydrophobicContact CH2-CE2 3.77Å; W14-Y577 AromaticContact CH2-CZ 3.35Å; W14-Y577 WeakPolarHBondContact CH2-OH 3.34Å; W14-Y577 AromaticContact CZ2-CE2 3.55Å; W14-Y577 HydrophobicContact CZ2-CE2 3.55Å; W14-Y577 AromaticContact CZ2-CZ 3.58Å; W14-Y577 WeakPolarHBondContact CZ2-OH 3.2Å; W14-Y577 AromaticContact CZ3-CZ 3.9Å; W14-Y577 WeakPolarHBondContact CZ3-OH 3.34Å; Y577-L579 PolarHBondContact O-N 2.67Å
578	V	30.7	Very low	34.3	Very low	127 Å²	127	103.1 Å²	103.1	77%	0.77	60%	0.597	S	S	*	*			trans	-84.1	99.8	155.2	-179.6	0	0	0	0	106.2	G576 L580	G576-V578 PolarHBondContact O-N 3.39Å; V578-L580 PolarHBondContact O-N 2.97Å
579	L	30.1	Very low	34.3	Very low	126 Å²	126	101.1 Å²	101.1	66%	0.66	58%	0.58	S	S	*	*			trans	-54.5	102.1	168.3	-74.9	161.4	0	0	0	108.2	Y577 P581 L585	Y577-L579 PolarHBondContact O-N 2.67Å; L579-P581 VanDerWaalsContact O-CD 3.22Å; L579-P581 WeakPolarHBondContact O-CD 3.29Å; L579-L585 HydrophobicContact CD2-CD2 3.98Å
580	L	33.3	Very low	33.7	Very low	126 Å²	126	103.4 Å²	103.4	66%	0.66	60%	0.596	S	S	*	*			trans	-69.2	114.4	162.4	-77.3	167.3	0	0	0	106	V578 H582 A583	V578-L580 PolarHBondContact O-N 2.97Å; L580-H582 PolarHBondContact O-N 2.96Å; L580-A583 HydrophobicContact CB-CB 4.24Å; L580-A583 PolarHBondContact O-N 2.86Å; L580-A583 VanDerWaalsContact O-N 3.13Å
581	P	34.1	Very low	33.5	Very low	108 Å²	108	105.7 Å²	105.7	70%	0.701	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-4	-171.2	20.7	-30.8	0	0	0	114.8	L579	L579-P581 VanDerWaalsContact O-CD 3.22Å; L579-P581 WeakPolarHBondContact O-CD 3.29Å
582	H	32.1	Very low	33.2	Very low	176 Å²	176	107.9 Å²	107.9	82%	0.815	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	2	-176.9	-53.6	-50	0	0	0	114.4	L580 P584	L580-H582 PolarHBondContact O-N 2.96Å; H582-P584 WeakPolarHBondContact O-CD 3.29Å
583	A	35.2	Very low	33	Very low	59 Å²	59	106.1 Å²	106.1	49%	0.488	60%	0.599	S	S	.	*	S	Bend	trans	-96.3	108	174.5	0	0	0	0	0	109.8	L580 L585	L580-A583 HydrophobicContact CB-CB 4.24Å; L580-A583 PolarHBondContact O-N 2.86Å; L580-A583 VanDerWaalsContact O-N 3.13Å; A583-L585 PolarHBondContact O-N 3.38Å
584	P	33.2	Very low	32.9	Very low	103 Å²	103	105.2 Å²	105.2	67%	0.669	59%	0.593	S	S	*	*			trans	-64	131.7	178.1	23.5	-29.8	0	0	0	110.1	R211 H582	R211-P584 VanDerWaalsContact NH1-C 3.31Å; R211-P584 PolarHBondContact NH1-O 2.82Å; H582-P584 WeakPolarHBondContact O-CD 3.29Å
585	L	32.3	Very low	32.9	Very low	111 Å²	111	112.5 Å²	112.5	58%	0.581	62%	0.616	S	S	*	*			trans	-65.1	141.3	-164.1	-64.5	150.3	0	0	0	113.8	R211 L579 A583 E587	R211-L585 VanDerWaalsContact CZ-O 3.29Å; R211-L585 PolarHBondContact NH1-O 3.31Å; R211-L585 PolarHBondContact NH2-O 3.12Å; L579-L585 HydrophobicContact CD2-CD2 3.98Å; A583-L585 PolarHBondContact O-N 3.38Å; L585-E587 PolarHBondContact O-N 3.2Å
586	A	36.8	Very low	33.2	Very low	28 Å²	28	109.9 Å²	109.9	23%	0.231	59%	0.594	C	S	.	*			trans	-73.9	106.5	156.4	0	0	0	0	0	107.2	W14 P588	W14-A586 HydrophobicContact CE3-CB 4.47Å; W14-A586 HydrophobicContact CZ3-CB 4.37Å; A586-P588 WeakPolarHBondContact O-CD 3.37Å
587	E	32.1	Very low	33.1	Very low	156 Å²	156	110.8 Å²	110.8	73%	0.729	58%	0.581	S	S	*	*			trans	-75.7	120.7	175.5	-69.7	-179.8	177.4	0	0	108.5	L585 E589	L585-E587 PolarHBondContact O-N 3.2Å; E587-E589 PolarHBondContact O-N 3.16Å
588	P	33	Very low	33.5	Very low	62 Å²	62	113.2 Å²	113.2	40%	0.403	59%	0.59	S	S	.	*			trans	-66.8	125.1	169.7	25.1	-29.7	0	0	0	109.1	Y570 A586 Q590	Y570-P588 HydrophobicContact CD1-CB 3.64Å; Y570-P588 HydrophobicContact CD1-CG 3.73Å; Y570-P588 HydrophobicContact CE1-CB 4.03Å; Y570-P588 HydrophobicContact CG-CB 3.91Å; Y570-P588 HydrophobicContact CG-CG 4.04Å; A586-P588 WeakPolarHBondContact O-CD 3.37Å; P588-Q590 PolarHBondContact O-N 3.14Å; P588-Q590 VanDerWaalsContact O-N 3.17Å
589	E	32.5	Very low	33.9	Very low	51 Å²	51	111.2 Å²	111.2	24%	0.238	57%	0.572	C	S	.	*			trans	-64.2	115.8	177.5	-75.1	-168.4	161.8	0	0	109.7	R288 E587 Y591	R288-E589 WeakPolarHBondContact CB-OE1 3.33Å; R288-E589 WeakPolarHBondContact CD-OE1 3.36Å; R288-E589 WeakPolarHBondContact CG-OE1 3.22Å; E587-E589 PolarHBondContact O-N 3.16Å; E589-Y591 HydrophobicContact CB-CD2 4.35Å; E589-Y591 HydrophobicContact CB-CE2 4.14Å; E589-Y591 PolarHBondContact O-N 2.7Å; E589-Y591 VanDerWaalsContact O-N 3.16Å; E589-Y591 PolarHBondContact OE2-OH 2.98Å
590	Q	26.3	Very low	34.3	Very low	187 Å²	187	111.5 Å²	111.5	87%	0.874	57%	0.57	S	S	*	*			trans	-75.4	100.7	169.2	-73.5	-173.1	-15.1	0	0	109.4	P588 T592	P588-Q590 PolarHBondContact O-N 3.14Å; P588-Q590 VanDerWaalsContact O-N 3.17Å; Q590-T592 PolarHBondContact O-N 3.23Å
591	Y	30.6	Very low	34.6	Very low	128 Å²	128	111.5 Å²	111.5	50%	0.502	57%	0.568	S	S	.	*			trans	-73	106.4	169.1	-86.6	-93.4	0	0	0	110.2	R289 E589 D593	R289-Y591 WeakPolarHBondContact CB-OH 3.11Å; E589-Y591 HydrophobicContact CB-CD2 4.35Å; E589-Y591 HydrophobicContact CB-CE2 4.14Å; E589-Y591 PolarHBondContact O-N 2.7Å; E589-Y591 VanDerWaalsContact O-N 3.16Å; E589-Y591 PolarHBondContact OE2-OH 2.98Å; Y591-D593 PolarHBondContact O-N 3.02Å
592	T	30.3	Very low	34.8	Very low	111 Å²	111	115.8 Å²	115.8	68%	0.681	57%	0.57	S	S	*	*			trans	-77.4	111.9	160.5	33.9	0	0	0	0	107.8	Q590 V594	Q590-T592 PolarHBondContact O-N 3.23Å; T592-V594 VanDerWaalsContact C-N 3.32Å; T592-V594 PolarHBondContact O-N 3.29Å
593	D	38	Very low	35.5	Very low	94 Å²	94	112.5 Å²	112.5	50%	0.503	56%	0.562	S	S	.	*			trans	-57.5	94.6	171.4	-94.8	-34.9	0	0	0	109.4	Y591 Y595 N596	Y591-D593 PolarHBondContact O-N 3.02Å; D593-Y595 PolarHBondContact O-N 2.88Å; D593-N596 HydrophobicContact CB-CB 4.04Å; D593-N596 PolarHBondContact O-N 3.49Å
594	V	35.5	Very low	36	Very low	96 Å²	96	114.2 Å²	114.2	58%	0.582	57%	0.57	S	S	*	*	H	α-helix	trans	-58.2	-16.1	172.6	179.6	0	0	0	0	111.1	T592	T592-V594 VanDerWaalsContact C-N 3.32Å; T592-V594 PolarHBondContact O-N 3.29Å
595	Y	34.5	Very low	36.5	Very low	181 Å²	181	118.6 Å²	118.6	71%	0.71	58%	0.579	S	S	*	*	H	α-helix	trans	-74.9	-31.1	171.9	-135.2	-89.2	0	0	0	113.7	D593 Q599	D593-Y595 PolarHBondContact O-N 2.88Å; Y595-Q599 PolarHBondContact O-N 2.69Å
596	N	38.7	Very low	36.7	Very low	80 Å²	80	119.9 Å²	119.9	43%	0.428	61%	0.605	S	S	.	*	H	α-helix	trans	-73.8	-38.5	177.1	-91.4	-23.7	0	0	0	111.8	D593 R598 Q599 Q600	D593-N596 HydrophobicContact CB-CB 4.04Å; D593-N596 PolarHBondContact O-N 3.49Å; N596-R598 VanDerWaalsContact C-N 3.32Å; N596-R598 PolarHBondContact O-N 3.15Å; N596-Q599 PolarHBondContact O-N 3.35Å; N596-Q599 VanDerWaalsContact O-N 3.14Å; N596-Q600 PolarHBondContact O-N 3.46Å
597	D	35.7	Very low	36.7	Very low	95 Å²	95	124.5 Å²	124.5	51%	0.508	62%	0.624	S	S	.	*	H	α-helix	trans	-65.3	-35.6	178.1	-82.1	-10.3	0	0	0	112.5	M601	D597-M601 WeakPolarHBondContact O-CB 3Å; D597-M601 PolarHBondContact O-N 2.65Å
598	R	37.9	Very low	36.9	Very low	173 Å²	173	122.8 Å²	122.8	65%	0.653	62%	0.619	S	S	*	*	H	α-helix	trans	-72.2	-29.4	174.4	-70.9	-168.1	-164.6	-170.9	5.1	113.1	N596 R602	N596-R598 VanDerWaalsContact C-N 3.32Å; N596-R598 PolarHBondContact O-N 3.15Å; R598-R602 WeakPolarHBondContact O-CG 3.28Å; R598-R602 PolarHBondContact O-N 2.89Å
599	Q	39.1	Very low	37.2	Very low	84 Å²	84	126.2 Å²	126.2	39%	0.393	63%	0.631	S	S	.	*	H	α-helix	trans	-75.6	-40.8	172.2	-79.2	-158.9	-15.1	0	0	111.7	Y595 N596 M601 R602 V603	Y595-Q599 PolarHBondContact O-N 2.69Å; N596-Q599 PolarHBondContact O-N 3.35Å; N596-Q599 VanDerWaalsContact O-N 3.14Å; Q599-M601 VanDerWaalsContact C-N 3.34Å; Q599-M601 PolarHBondContact O-N 3.42Å; Q599-R602 PolarHBondContact O-N 3.35Å; Q599-R602 VanDerWaalsContact O-N 3.08Å; Q599-V603 WeakPolarHBondContact O-CG2 3.25Å; Q599-V603 PolarHBondContact O-N 3.17Å
600	Q	39.2	Very low	37.4	Very low	133 Å²	133	130.6 Å²	130.6	62%	0.621	65%	0.654	S	S	*	*	H	α-helix	trans	-64.8	-37.7	175.8	-73.8	-169.9	-6.8	0	0	112	N596 R602 V603 S604	N596-Q600 PolarHBondContact O-N 3.46Å; Q600-R602 VanDerWaalsContact C-N 3.28Å; Q600-R602 PolarHBondContact O-N 2.92Å; Q600-V603 PolarHBondContact O-N 3.08Å; Q600-S604 PolarHBondContact O-N 3.03Å; Q600-S604 PolarHBondContact O-OG 2.78Å
601	M	39	Very low	38.1	Very low	125 Å²	125	127.1 Å²	127.1	62%	0.616	64%	0.64	S	S	*	*	H	α-helix	trans	-67.5	-23.7	171.9	-84	-157.7	-83	0	0	114.3	D597 Q599	D597-M601 WeakPolarHBondContact O-CB 3Å; D597-M601 PolarHBondContact O-N 2.65Å; Q599-M601 VanDerWaalsContact C-N 3.34Å; Q599-M601 PolarHBondContact O-N 3.42Å
602	R	39.3	Very low	38.6	Very low	198 Å²	198	127 Å²	127	75%	0.747	65%	0.649	S	S	*	*	H	α-helix	trans	-83	-31.8	172.6	-78.1	-172.4	-167.4	-177.5	3.8	112.5	R598 Q599 Q600 A606	R598-R602 WeakPolarHBondContact O-CG 3.28Å; R598-R602 PolarHBondContact O-N 2.89Å; Q599-R602 PolarHBondContact O-N 3.35Å; Q599-R602 VanDerWaalsContact O-N 3.08Å; Q600-R602 VanDerWaalsContact C-N 3.28Å; Q600-R602 PolarHBondContact O-N 2.92Å; R602-A606 PolarHBondContact O-N 2.73Å
603	V	45.4	Very low	39.2	Very low	108 Å²	108	128.1 Å²	128.1	66%	0.655	65%	0.647	S	S	*	*	H	α-helix	trans	-78.6	-25.3	176.9	178.1	0	0	0	0	111.6	Q599 Q600 A606	Q599-V603 WeakPolarHBondContact O-CG2 3.25Å; Q599-V603 PolarHBondContact O-N 3.17Å; Q600-V603 PolarHBondContact O-N 3.08Å; V603-A606 VanDerWaalsContact O-OXT 3.08Å
604	S	46.8	Very low	39.3	Very low	94 Å²	94	130.8 Å²	130.8	66%	0.657	66%	0.658	S	S	*	*	S	Bend	trans	-83.2	-9.9	172.8	69.5	0	0	0	0	114.4	Q600	Q600-S604 PolarHBondContact O-N 3.03Å; Q600-S604 PolarHBondContact O-OG 2.78Å
605	K	42.6	Very low	39.6	Very low	196 Å²	196	133.7 Å²	133.7	85%	0.852	66%	0.664	S	S	*	*			trans	-104.1	-2.4	173.7	-80.6	-169.7	175	-175.8	0	114
606	A	37.7	Very low	40.1	Very low	137 Å²	137	129.4 Å²	129.4	100%	1.132	66%	0.66	S	S	*	*			trans	-103.1	0	167.7	0	0	0	0	0	108	R602 V603	R602-A606 PolarHBondContact O-N 2.73Å; V603-A606 VanDerWaalsContact O-OXT 3.08Å

Retrieved 606 of 606 residues in 209.4 ms (Link to these results)

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