A0A3Q0KGC7_SCHMA Loading...

Putative g-protein coupled receptor

AlphaFold DB , UniProt , Accession A0A3Q0KGC7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 539 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	29	Very low	32.7	Very low	223 Å²	223	151.4 Å²	151.4	100%	1.099	79%	0.789	S	S	*	*				0	105.1	0	-70.7	-156.1	-58.4	0	0	104.6
2	D	29.6	Very low	33.5	Very low	165 Å²	165	148.7 Å²	148.7	88%	0.882	78%	0.784	S	S	*	*			trans	-120.6	121.4	-135.8	-44.4	-59.1	0	0	0	108.4
3	E	35.7	Very low	34.4	Very low	191 Å²	191	145.8 Å²	145.8	89%	0.893	78%	0.776	S	S	*	*			trans	-136.1	140.5	176.5	-157.3	159.5	-136.5	0	0	108.1
4	S	33.4	Very low	35.5	Very low	111 Å²	111	144 Å²	144	78%	0.776	77%	0.767	S	S	*	*			trans	-82.5	130.3	-157.6	53.4	0	0	0	0	113.6
5	I	38.7	Very low	37.3	Very low	134 Å²	134	143.1 Å²	143.1	69%	0.687	76%	0.762	S	S	*	*			trans	-125.6	92.7	162.9	-56.1	179.8	0	0	0	108.8	I8	I5-I8 HydrophobicContact CG2-CD1 4.06Å; I5-I8 HydrophobicContact CG2-CG1 3.97Å
6	N	31.5	Very low	39.6	Very low	141 Å²	141	140.4 Å²	140.4	75%	0.754	75%	0.747	S	S	*	*			trans	-78.8	168.3	142.9	-69.3	-32	0	0	0	107.7
7	D	32.2	Very low	42.1	Very low	159 Å²	159	133.9 Å²	133.9	85%	0.85	72%	0.715	S	S	*	*			trans	65.9	61.1	174	-54.7	-20	0	0	0	117.1
8	I	35.3	Very low	44.7	Very low	138 Å²	138	126.9 Å²	126.9	71%	0.708	68%	0.677	S	S	*	*			trans	-127.8	99.5	146.1	-56.9	-179	0	0	0	109.1	I5	I5-I8 HydrophobicContact CG2-CD1 4.06Å; I5-I8 HydrophobicContact CG2-CG1 3.97Å
9	Q	30.1	Very low	47.1	Very low	190 Å²	190	124.1 Å²	124.1	89%	0.888	67%	0.665	S	S	*	*			trans	-106.4	114.2	173	-170.7	168.7	-54.1	0	0	109.8
10	D	30.8	Very low	49.3	Very low	143 Å²	143	126.7 Å²	126.7	77%	0.765	67%	0.67	S	S	*	*	S	Bend	trans	66.2	56.5	160.2	-147.8	18.1	0	0	0	119.2
11	D	33.4	Very low	51.4	Low	70 Å²	70	124.6 Å²	124.6	37%	0.374	67%	0.666	S	S	.	*			trans	-132.1	59.4	156.9	-168.9	5.4	0	0	0	112.4	T13 N14 N15	D11-T13 VanDerWaalsContact C-N 3.29Å; D11-T13 PolarHBondContact O-N 3.21Å; D11-N14 VanDerWaalsContact CG-ND2 3.31Å; D11-N14 PolarHBondContact OD1-ND2 3.21Å; D11-N14 PolarHBondContact OD2-ND2 3.37Å; D11-N15 PolarHBondContact O-ND2 2.92Å
12	T	42.2	Very low	54.4	Low	119 Å²	119	116.9 Å²	116.9	73%	0.73	63%	0.627	S	S	*	*			trans	-78.7	-7.6	-176.2	55.4	0	0	0	0	114.2
13	T	45	Very low	57.5	Low	112 Å²	112	110.5 Å²	110.5	69%	0.687	59%	0.592	S	S	*	*	S	Bend	trans	-93.2	-26.3	-176.3	37.5	0	0	0	0	115.4	D11	D11-T13 VanDerWaalsContact C-N 3.29Å; D11-T13 PolarHBondContact O-N 3.21Å
14	N	49.8	Very low	60.3	Low	120 Å²	120	105.3 Å²	105.3	64%	0.642	57%	0.574	S	S	*	*	S	Bend	trans	-88.9	-18	-172.1	-72.2	-42.3	0	0	0	114.7	D11	D11-N14 VanDerWaalsContact CG-ND2 3.31Å; D11-N14 PolarHBondContact OD1-ND2 3.21Å; D11-N14 PolarHBondContact OD2-ND2 3.37Å
15	N	62.8	Low	63.3	Low	131 Å²	131	106.3 Å²	106.3	70%	0.701	57%	0.565	S	S	*	*	S	Bend	trans	-100.5	-2.8	-169.8	-68	-59.2	0	0	0	115.3	D11	D11-N15 PolarHBondContact O-ND2 2.92Å
16	L	74.6	Confident	66	Low	99 Å²	99	101.5 Å²	101.5	52%	0.518	54%	0.54	S	S	.	.			trans	-74.4	131.3	177.2	-161.8	72.9	0	0	0	110.2	F18 L204	L16-F18 PolarHBondContact O-N 3.45Å; L16-F18 VanDerWaalsContact O-N 3.11Å; L16-L204 HydrophobicContact CD1-CD1 4.08Å
17	P	82.3	Confident	69	Low	30 Å²	30	97 Å²	97	20%	0.195	52%	0.518	C	S	.	.	S	Bend	trans	-68.4	-14.7	-170.7	24.8	-34.9	0	0	0	115	L204 I423 K424	P17-L204 HydrophobicContact CG-CD1 3.58Å; P17-I423 HydrophobicContact CB-CG2 3.43Å; P17-I423 VanDerWaalsContact CB-CG2 3.43Å; P17-I423 HydrophobicContact CG-CD1 4.39Å; P17-I423 HydrophobicContact CG-CG2 4.03Å; P17-K424 WeakPolarHBondContact O-CE 3.37Å
18	F	88.1	Confident	72.1	Confident	9 Å²	9	94 Å²	94	4%	0.039	50%	0.5	C	S	.	.	S	Bend	trans	-127.1	137.5	171.9	-64.5	-80.3	0	0	0	110.7	L16 E22 I23 L26 L204 I423 K424 A427	L16-F18 PolarHBondContact O-N 3.45Å; L16-F18 VanDerWaalsContact O-N 3.11Å; F18-E22 HydrophobicContact CB-CB 4.47Å; F18-E22 HydrophobicContact CD1-CB 4.36Å; F18-I23 HydrophobicContact CB-CD1 4.1Å; F18-I23 HydrophobicContact CB-CG1 3.59Å; F18-I23 HydrophobicContact CG-CG1 4.46Å; F18-L26 HydrophobicContact CD1-CD1 4.01Å; F18-L26 HydrophobicContact CE1-CD1 3.78Å; F18-L26 HydrophobicContact CZ-CD1 4.42Å; F18-L204 HydrophobicContact CD2-CD2 4.46Å; F18-I423 HydrophobicContact CE2-CD1 4.3Å; F18-I423 HydrophobicContact CE2-CG1 4.1Å; F18-I423 HydrophobicContact CE2-CG2 4.46Å; F18-K424 HydrophobicContact CD1-CG 4.17Å; F18-K424 HydrophobicContact CE1-CB 4.27Å; F18-K424 HydrophobicContact CE1-CD 4.45Å; F18-K424 HydrophobicContact CE1-CG 3.73Å; F18-K424 HydrophobicContact CZ-CG 4.23Å; F18-A427 HydrophobicContact CZ-CB 3.8Å
19	T	91.3	Very high	75	Confident	73 Å²	73	89.9 Å²	89.9	45%	0.448	48%	0.48	S	S	.	.			trans	-73.5	155	169.7	59	0	0	0	0	111.1	S21 E22 I23	T19-S21 PolarHBondContact O-N 3.04Å; T19-S21 VanDerWaalsContact O-N 3.14Å; T19-S21 PolarHBondContact OG1-OG 2.96Å; T19-E22 WeakPolarHBondContact CB-OE2 3.39Å; T19-E22 PolarHBondContact N-OE2 2.86Å; T19-E22 WeakPolarHBondContact O-CB 3.48Å; T19-E22 PolarHBondContact O-N 3.36Å; T19-E22 VanDerWaalsContact OG1-CD 3.31Å; T19-E22 WeakPolarHBondContact OG1-CG 3.49Å; T19-E22 PolarHBondContact OG1-N 3.32Å; T19-E22 PolarHBondContact OG1-OE2 2.87Å; T19-I23 WeakPolarHBondContact O-CG1 3.45Å; T19-I23 PolarHBondContact O-N 3.49Å
20	K	90.9	Very high	78.2	Confident	175 Å²	175	81.1 Å²	81.1	76%	0.761	44%	0.438	S	S	*	.	H	α-helix	trans	-57	-31.8	-179.6	-66.2	178.4	180	174.7	0	113.2	T24	K20-T24 WeakPolarHBondContact O-CB 3.15Å; K20-T24 PolarHBondContact O-N 3Å; K20-T24 VanDerWaalsContact O-N 3.11Å; K20-T24 PolarHBondContact O-OG1 3.06Å
21	S	92.7	Very high	81.3	Confident	84 Å²	84	76.3 Å²	76.3	59%	0.587	42%	0.419	S	S	*	.	H	α-helix	trans	-71.1	-42.1	173.9	43	0	0	0	0	112.7	T19 T24 F25	T19-S21 PolarHBondContact O-N 3.04Å; T19-S21 VanDerWaalsContact O-N 3.14Å; T19-S21 PolarHBondContact OG1-OG 2.96Å; S21-T24 PolarHBondContact O-N 3.1Å; S21-F25 VanDerWaalsContact O-CB 3.3Å; S21-F25 WeakPolarHBondContact O-CB 3.5Å; S21-F25 PolarHBondContact O-N 3.01Å
22	E	93.1	Very high	84.4	Confident	60 Å²	60	77.1 Å²	77.1	28%	0.28	42%	0.422	S	S	.	.	H	α-helix	trans	-62.4	-45.3	173.8	-73.1	171.1	119.7	0	0	111.9	F18 T19 T24 F25 L26 K424	F18-E22 HydrophobicContact CB-CB 4.47Å; F18-E22 HydrophobicContact CD1-CB 4.36Å; T19-E22 WeakPolarHBondContact CB-OE2 3.39Å; T19-E22 PolarHBondContact N-OE2 2.86Å; T19-E22 WeakPolarHBondContact O-CB 3.48Å; T19-E22 PolarHBondContact O-N 3.36Å; T19-E22 VanDerWaalsContact OG1-CD 3.31Å; T19-E22 WeakPolarHBondContact OG1-CG 3.49Å; T19-E22 PolarHBondContact OG1-N 3.32Å; T19-E22 PolarHBondContact OG1-OE2 2.87Å; E22-T24 PolarHBondContact O-N 3.32Å; E22-F25 PolarHBondContact O-N 3.23Å; E22-L26 WeakPolarHBondContact O-CB 3.4Å; E22-L26 VanDerWaalsContact O-CG 3.29Å; E22-L26 WeakPolarHBondContact O-CG 3.4Å; E22-L26 PolarHBondContact O-N 3.16Å; E22-K424 IonicContact OE1-NZ 2.88Å; E22-K424 PolarHBondContact OE1-NZ 3.05Å; E22-K424 IonicContact OE2-NZ 3.94Å; E22-K424 PolarHBondContact OE2-NZ 3.07Å
23	I	93.5	Very high	86.9	Confident	31 Å²	31	72 Å²	72	16%	0.159	39%	0.39	C	S	.	.	H	α-helix	trans	-57.6	-49.9	175.4	-63.2	172.6	0	0	0	109.9	F18 T19 F25 L26 V27 I201	F18-I23 HydrophobicContact CB-CD1 4.1Å; F18-I23 HydrophobicContact CB-CG1 3.59Å; F18-I23 HydrophobicContact CG-CG1 4.46Å; T19-I23 WeakPolarHBondContact O-CG1 3.45Å; T19-I23 PolarHBondContact O-N 3.49Å; I23-F25 PolarHBondContact O-N 3.4Å; I23-L26 PolarHBondContact O-N 3.12Å; I23-V27 HydrophobicContact CG2-CG2 4.33Å; I23-V27 WeakPolarHBondContact O-CB 3.47Å; I23-V27 VanDerWaalsContact O-CG2 3.26Å; I23-V27 WeakPolarHBondContact O-CG2 3.48Å; I23-V27 PolarHBondContact O-N 2.8Å; I23-I201 HydrophobicContact CG2-CG2 4.42Å
24	T	94.8	Very high	89.4	Confident	82 Å²	82	68.3 Å²	68.3	50%	0.503	37%	0.366	S	S	.	.	H	α-helix	trans	-59.5	-44.7	179.7	-57.4	0	0	0	0	111.8	K20 S21 E22 I28	K20-T24 WeakPolarHBondContact O-CB 3.15Å; K20-T24 PolarHBondContact O-N 3Å; K20-T24 VanDerWaalsContact O-N 3.11Å; K20-T24 PolarHBondContact O-OG1 3.06Å; S21-T24 PolarHBondContact O-N 3.1Å; E22-T24 PolarHBondContact O-N 3.32Å; T24-I28 HydrophobicContact CG2-CD1 3.95Å; T24-I28 WeakPolarHBondContact O-CD1 3.11Å; T24-I28 VanDerWaalsContact O-CG1 3.26Å; T24-I28 WeakPolarHBondContact O-CG1 3.49Å; T24-I28 PolarHBondContact O-N 3.16Å; T24-I28 VanDerWaalsContact O-N 3.07Å
25	F	95.7	Very high	91.7	Very high	133 Å²	133	67.6 Å²	67.6	58%	0.583	36%	0.361	S	S	*	.	H	α-helix	trans	-63.8	-46.4	178.2	176.3	-102.4	0	0	0	112.3	S21 E22 I23 I28 I29	S21-F25 VanDerWaalsContact O-CB 3.3Å; S21-F25 WeakPolarHBondContact O-CB 3.5Å; S21-F25 PolarHBondContact O-N 3.01Å; E22-F25 PolarHBondContact O-N 3.23Å; I23-F25 PolarHBondContact O-N 3.4Å; F25-I28 PolarHBondContact O-N 3.36Å; F25-I29 HydrophobicContact CD1-CD1 4.06Å; F25-I29 HydrophobicContact CD2-CD1 4.16Å; F25-I29 HydrophobicContact CE1-CD1 3.54Å; F25-I29 HydrophobicContact CE2-CD1 3.65Å; F25-I29 HydrophobicContact CG-CD1 4.36Å; F25-I29 HydrophobicContact CZ-CD1 3.32Å; F25-I29 WeakPolarHBondContact O-CG1 3.4Å; F25-I29 PolarHBondContact O-N 3.3Å
26	L	95.3	Very high	93.3	Very high	32 Å²	32	64.6 Å²	64.6	17%	0.168	35%	0.345	C	S	.	.	H	α-helix	trans	-61.2	-48.8	177	-73.3	169	0	0	0	111.3	F18 E22 I23 I28 I29 F30 I201	F18-L26 HydrophobicContact CD1-CD1 4.01Å; F18-L26 HydrophobicContact CE1-CD1 3.78Å; F18-L26 HydrophobicContact CZ-CD1 4.42Å; E22-L26 WeakPolarHBondContact O-CB 3.4Å; E22-L26 VanDerWaalsContact O-CG 3.29Å; E22-L26 WeakPolarHBondContact O-CG 3.4Å; E22-L26 PolarHBondContact O-N 3.16Å; I23-L26 PolarHBondContact O-N 3.12Å; L26-I28 VanDerWaalsContact C-N 3.32Å; L26-I28 PolarHBondContact O-N 3.24Å; L26-I29 PolarHBondContact O-N 3.32Å; L26-F30 WeakPolarHBondContact O-CB 3.42Å; L26-F30 WeakPolarHBondContact O-CD2 3.22Å; L26-F30 PolarHBondContact O-N 3.31Å; L26-I201 HydrophobicContact CB-CD1 4.28Å; L26-I201 HydrophobicContact CB-CG2 3.97Å; L26-I201 HydrophobicContact CD1-CD1 4.46Å; L26-I201 HydrophobicContact CD1-CG2 3.8Å
27	V	95.9	Very high	94.4	Very high	48 Å²	48	59.9 Å²	59.9	29%	0.291	32%	0.32	S	S	.	.	H	α-helix	trans	-57.9	-43.1	178.2	170.5	0	0	0	0	111.4	I23 A31 V197 I202	I23-V27 HydrophobicContact CG2-CG2 4.33Å; I23-V27 WeakPolarHBondContact O-CB 3.47Å; I23-V27 VanDerWaalsContact O-CG2 3.26Å; I23-V27 WeakPolarHBondContact O-CG2 3.48Å; I23-V27 PolarHBondContact O-N 2.8Å; V27-A31 VanDerWaalsContact O-CB 3.27Å; V27-A31 WeakPolarHBondContact O-CB 3.21Å; V27-A31 PolarHBondContact O-N 3.34Å; V27-V197 HydrophobicContact CG2-CG1 3.88Å; V27-I202 HydrophobicContact CG2-CD1 3.88Å; V27-I202 HydrophobicContact CG2-CG1 3.77Å
28	I	96.6	Very high	95.1	Very high	94 Å²	94	60.3 Å²	60.3	48%	0.482	32%	0.322	S	S	.	.	H	α-helix	trans	-62.8	-46.1	176.6	-71.2	166.9	0	0	0	111.5	T24 F25 L26 A31 I32	T24-I28 HydrophobicContact CG2-CD1 3.95Å; T24-I28 WeakPolarHBondContact O-CD1 3.11Å; T24-I28 VanDerWaalsContact O-CG1 3.26Å; T24-I28 WeakPolarHBondContact O-CG1 3.49Å; T24-I28 PolarHBondContact O-N 3.16Å; T24-I28 VanDerWaalsContact O-N 3.07Å; F25-I28 PolarHBondContact O-N 3.36Å; L26-I28 VanDerWaalsContact C-N 3.32Å; L26-I28 PolarHBondContact O-N 3.24Å; I28-A31 PolarHBondContact O-N 3.21Å; I28-I32 HydrophobicContact CG2-CD1 3.98Å; I28-I32 WeakPolarHBondContact O-CG1 3.24Å; I28-I32 PolarHBondContact O-N 3.22Å
29	I	96.6	Very high	95.4	Very high	53 Å²	53	63.7 Å²	63.7	27%	0.272	34%	0.343	S	S	.	.	H	α-helix	trans	-69.5	-41.2	-178.3	-66.9	-179.3	0	0	0	111.5	F25 L26 A31 I32 V33 F431	F25-I29 HydrophobicContact CD1-CD1 4.06Å; F25-I29 HydrophobicContact CD2-CD1 4.16Å; F25-I29 HydrophobicContact CE1-CD1 3.54Å; F25-I29 HydrophobicContact CE2-CD1 3.65Å; F25-I29 HydrophobicContact CG-CD1 4.36Å; F25-I29 HydrophobicContact CZ-CD1 3.32Å; F25-I29 WeakPolarHBondContact O-CG1 3.4Å; F25-I29 PolarHBondContact O-N 3.3Å; L26-I29 PolarHBondContact O-N 3.32Å; I29-A31 VanDerWaalsContact C-N 3.35Å; I29-A31 PolarHBondContact O-N 3.45Å; I29-I32 PolarHBondContact O-N 3.26Å; I29-V33 PolarHBondContact O-N 2.89Å; I29-F431 HydrophobicContact CG2-CE1 4.49Å; I29-F431 HydrophobicContact CG2-CE2 3.49Å; I29-F431 VanDerWaalsContact CG2-CE2 3.49Å; I29-F431 HydrophobicContact CG2-CZ 3.48Å; I29-F431 VanDerWaalsContact CG2-CZ 3.48Å
30	F	96.8	Very high	95.6	Very high	5 Å²	5	60.7 Å²	60.7	2%	0.022	33%	0.327	C	S	.	.	H	α-helix	trans	-62.4	-40.5	173.2	-88.6	-79.2	0	0	0	111.8	L26 I32 V33 I34 I193 V197 I201 F431 D434	L26-F30 WeakPolarHBondContact O-CB 3.42Å; L26-F30 WeakPolarHBondContact O-CD2 3.22Å; L26-F30 PolarHBondContact O-N 3.31Å; F30-I32 VanDerWaalsContact C-N 3.34Å; F30-I32 PolarHBondContact O-N 2.81Å; F30-V33 PolarHBondContact O-N 2.96Å; F30-I34 WeakPolarHBondContact O-CD1 2.95Å; F30-I34 VanDerWaalsContact O-CG1 3.3Å; F30-I34 WeakPolarHBondContact O-CG1 3.15Å; F30-I34 PolarHBondContact O-N 3.2Å; F30-I193 HydrophobicContact CD1-CG2 3.49Å; F30-I193 VanDerWaalsContact CD1-CG2 3.49Å; F30-I193 HydrophobicContact CE1-CG2 4Å; F30-V197 HydrophobicContact CB-CG2 3.62Å; F30-V197 HydrophobicContact CD1-CG2 3.64Å; F30-V197 HydrophobicContact CD2-CG2 3.78Å; F30-V197 HydrophobicContact CE1-CG2 4.11Å; F30-V197 HydrophobicContact CE2-CG2 4.27Å; F30-V197 HydrophobicContact CG-CG2 3.42Å; F30-V197 VanDerWaalsContact CG-CG2 3.42Å; F30-V197 HydrophobicContact CZ-CG2 4.4Å; F30-I201 HydrophobicContact CD2-CD1 3.82Å; F30-I201 HydrophobicContact CE2-CD1 3.38Å; F30-I201 HydrophobicContact CZ-CD1 4.15Å; F30-F431 HydrophobicContact CD1-CD2 4.05Å; F30-F431 HydrophobicContact CD2-CD2 4.05Å; F30-F431 HydrophobicContact CE1-CB 4.26Å; F30-F431 AromaticContact CE1-CD2 3.83Å; F30-F431 HydrophobicContact CE1-CD2 3.83Å; F30-F431 HydrophobicContact CE2-CB 3.95Å; F30-F431 AromaticContact CE2-CD2 3.79Å; F30-F431 HydrophobicContact CE2-CD2 3.79Å; F30-F431 HydrophobicContact CE2-CG 4.3Å; F30-F431 HydrophobicContact CG-CD2 4.2Å; F30-F431 HydrophobicContact CZ-CB 3.56Å; F30-F431 AromaticContact CZ-CD2 3.71Å; F30-F431 HydrophobicContact CZ-CD2 3.71Å; F30-F431 HydrophobicContact CZ-CG 4.14Å; F30-D434 HydrophobicContact CE1-CB 4.11Å
31	A	97	Very high	95.8	Very high	42 Å²	42	52.4 Å²	52.4	35%	0.347	29%	0.291	S	S	.	.	H	α-helix	trans	-61.2	-40.8	174.1	0	0	0	0	0	112.2	V27 I28 I29 I34 I35	V27-A31 VanDerWaalsContact O-CB 3.27Å; V27-A31 WeakPolarHBondContact O-CB 3.21Å; V27-A31 PolarHBondContact O-N 3.34Å; I28-A31 PolarHBondContact O-N 3.21Å; I29-A31 VanDerWaalsContact C-N 3.35Å; I29-A31 PolarHBondContact O-N 3.45Å; A31-I34 PolarHBondContact O-N 2.76Å; A31-I35 WeakPolarHBondContact O-CD1 3.4Å; A31-I35 VanDerWaalsContact O-CG1 3.26Å; A31-I35 WeakPolarHBondContact O-CG1 3.5Å; A31-I35 PolarHBondContact O-N 3.44Å
32	I	96.9	Very high	95.8	Very high	87 Å²	87	50.9 Å²	50.9	45%	0.446	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-45.3	173	-68.9	164.4	0	0	0	110.7	I28 I29 F30 I34 I35 L36	I28-I32 HydrophobicContact CG2-CD1 3.98Å; I28-I32 WeakPolarHBondContact O-CG1 3.24Å; I28-I32 PolarHBondContact O-N 3.22Å; I29-I32 PolarHBondContact O-N 3.26Å; F30-I32 VanDerWaalsContact C-N 3.34Å; F30-I32 PolarHBondContact O-N 2.81Å; I32-I34 PolarHBondContact O-N 2.73Å; I32-I35 PolarHBondContact O-N 3.46Å; I32-L36 HydrophobicContact CG2-CD1 3.81Å; I32-L36 HydrophobicContact CG2-CG 4.31Å; I32-L36 WeakPolarHBondContact O-CB 3.37Å; I32-L36 VanDerWaalsContact O-CG 3.26Å; I32-L36 WeakPolarHBondContact O-CG 3.28Å; I32-L36 PolarHBondContact O-N 3.04Å
33	V	96.5	Very high	95.7	Very high	11 Å²	11	50.4 Å²	50.4	7%	0.067	28%	0.277	C	S	.	.	H	α-helix	trans	-59.2	-46.9	175.9	164.5	0	0	0	0	111.6	I29 F30 I35 L36 A37 I193 F431	I29-V33 PolarHBondContact O-N 2.89Å; F30-V33 PolarHBondContact O-N 2.96Å; V33-I35 PolarHBondContact O-N 3.35Å; V33-L36 PolarHBondContact O-N 3.12Å; V33-A37 VanDerWaalsContact O-CB 3.23Å; V33-A37 WeakPolarHBondContact O-CB 3.47Å; V33-A37 PolarHBondContact O-N 3.35Å; V33-I193 HydrophobicContact CG1-CD1 4.33Å; V33-F431 HydrophobicContact CG2-CE2 3.75Å; V33-F431 HydrophobicContact CG2-CZ 4.11Å
34	I	97.1	Very high	95.6	Very high	35 Å²	35	48.9 Å²	48.9	18%	0.179	27%	0.27	C	S	.	.	H	α-helix	trans	-58	-50.1	177	-70.1	157.3	0	0	0	110.6	F30 A31 I32 L36 A37 V38 A189 I193 P194	F30-I34 WeakPolarHBondContact O-CD1 2.95Å; F30-I34 VanDerWaalsContact O-CG1 3.3Å; F30-I34 WeakPolarHBondContact O-CG1 3.15Å; F30-I34 PolarHBondContact O-N 3.2Å; A31-I34 PolarHBondContact O-N 2.76Å; I32-I34 PolarHBondContact O-N 2.73Å; I34-L36 PolarHBondContact O-N 2.88Å; I34-A37 PolarHBondContact O-N 2.87Å; I34-V38 HydrophobicContact CG2-CG2 4.3Å; I34-V38 WeakPolarHBondContact O-CB 3.42Å; I34-V38 VanDerWaalsContact O-CG2 3.3Å; I34-V38 WeakPolarHBondContact O-CG2 3.5Å; I34-V38 PolarHBondContact O-N 3.07Å; I34-A189 WeakPolarHBondContact CG2-O 3.27Å; I34-I193 HydrophobicContact CD1-CB 4.15Å; I34-I193 HydrophobicContact CD1-CG2 3.8Å; I34-I193 HydrophobicContact CG1-CB 3.9Å; I34-I193 HydrophobicContact CG1-CD1 4.32Å; I34-I193 HydrophobicContact CG1-CG2 3.73Å; I34-P194 HydrophobicContact CD1-CB 4.48Å; I34-P194 HydrophobicContact CD1-CG 3.92Å
35	I	97.2	Very high	95.4	Very high	105 Å²	105	45.6 Å²	45.6	54%	0.538	25%	0.25	S	S	.	.	H	α-helix	trans	-59.7	-46.6	179.7	-69.5	164	0	0	0	110.8	A31 I32 V33 V39	A31-I35 WeakPolarHBondContact O-CD1 3.4Å; A31-I35 VanDerWaalsContact O-CG1 3.26Å; A31-I35 WeakPolarHBondContact O-CG1 3.5Å; A31-I35 PolarHBondContact O-N 3.44Å; I32-I35 PolarHBondContact O-N 3.46Å; V33-I35 PolarHBondContact O-N 3.35Å; I35-V39 HydrophobicContact CG2-CG2 4.34Å; I35-V39 VanDerWaalsContact O-CB 3.26Å; I35-V39 WeakPolarHBondContact O-CB 3.2Å; I35-V39 VanDerWaalsContact O-CG2 3.25Å; I35-V39 WeakPolarHBondContact O-CG2 2.99Å; I35-V39 PolarHBondContact O-N 3.39Å
36	L	97	Very high	95	Very high	68 Å²	68	42.3 Å²	42.3	36%	0.356	24%	0.238	S	C	.	.	H	α-helix	trans	-67.4	-40.6	-179.7	-67.9	177.8	0	0	0	112.5	I32 V33 I34 G40 C438 F442	I32-L36 HydrophobicContact CG2-CD1 3.81Å; I32-L36 HydrophobicContact CG2-CG 4.31Å; I32-L36 WeakPolarHBondContact O-CB 3.37Å; I32-L36 VanDerWaalsContact O-CG 3.26Å; I32-L36 WeakPolarHBondContact O-CG 3.28Å; I32-L36 PolarHBondContact O-N 3.04Å; V33-L36 PolarHBondContact O-N 3.12Å; I34-L36 PolarHBondContact O-N 2.88Å; L36-G40 WeakPolarHBondContact O-CA 3.49Å; L36-G40 PolarHBondContact O-N 3.02Å; L36-C438 HydrophobicContact CB-CB 3.97Å; L36-F442 HydrophobicContact CB-CE2 4.29Å; L36-F442 HydrophobicContact CD1-CE2 4.08Å; L36-F442 HydrophobicContact CD1-CZ 4.03Å; L36-F442 HydrophobicContact CD2-CZ 3.97Å; L36-F442 HydrophobicContact CG-CZ 4.41Å
37	A	96.6	Very high	94.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.4	-50.4	176.1	0	0	0	0	0	111.6	V33 I34 N41 A189 T437 C438	V33-A37 VanDerWaalsContact O-CB 3.23Å; V33-A37 WeakPolarHBondContact O-CB 3.47Å; V33-A37 PolarHBondContact O-N 3.35Å; I34-A37 PolarHBondContact O-N 2.87Å; A37-N41 VanDerWaalsContact O-CB 3.23Å; A37-N41 WeakPolarHBondContact O-CB 3.23Å; A37-N41 PolarHBondContact O-N 3.08Å; A37-N41 PolarHBondContact O-ND2 3.49Å; A37-A189 HydrophobicContact CB-CB 3.68Å; A37-T437 WeakPolarHBondContact CB-OG1 3.45Å; A37-C438 HydrophobicContact CB-CB 3.95Å
38	V	97	Very high	93.8	Very high	39 Å²	39	39.3 Å²	39.3	24%	0.236	22%	0.22	C	C	.	.	H	α-helix	trans	-65.9	-50.5	-178.4	173.9	0	0	0	0	111.2	I34 T42 A189 V190	I34-V38 HydrophobicContact CG2-CG2 4.3Å; I34-V38 WeakPolarHBondContact O-CB 3.42Å; I34-V38 VanDerWaalsContact O-CG2 3.3Å; I34-V38 WeakPolarHBondContact O-CG2 3.5Å; I34-V38 PolarHBondContact O-N 3.07Å; V38-T42 WeakPolarHBondContact O-CB 3.47Å; V38-T42 PolarHBondContact O-N 2.99Å; V38-T42 PolarHBondContact O-OG1 3.26Å; V38-A189 HydrophobicContact CG2-CB 3.74Å; V38-V190 HydrophobicContact CG1-CG2 4.49Å; V38-V190 HydrophobicContact CG2-CG2 3.65Å
39	V	95.8	Very high	92.7	Very high	80 Å²	80	42.4 Å²	42.4	49%	0.485	23%	0.226	S	C	.	.	H	α-helix	trans	-65.3	-47	-179.3	173.5	0	0	0	0	110.6	I35 T42 I43	I35-V39 HydrophobicContact CG2-CG2 4.34Å; I35-V39 VanDerWaalsContact O-CB 3.26Å; I35-V39 WeakPolarHBondContact O-CB 3.2Å; I35-V39 VanDerWaalsContact O-CG2 3.25Å; I35-V39 WeakPolarHBondContact O-CG2 2.99Å; I35-V39 PolarHBondContact O-N 3.39Å; V39-T42 PolarHBondContact O-N 3.1Å; V39-I43 HydrophobicContact CG1-CD1 3.92Å; V39-I43 VanDerWaalsContact O-CG1 3.31Å; V39-I43 WeakPolarHBondContact O-CG1 3.45Å; V39-I43 PolarHBondContact O-N 3.43Å
40	G	94.7	Very high	90.8	Very high	11 Å²	11	45 Å²	45	11%	0.113	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-49.8	-178.2	0	0	0	0	0	112.7	L36 T42 I43 V44	L36-G40 WeakPolarHBondContact O-CA 3.49Å; L36-G40 PolarHBondContact O-N 3.02Å; G40-T42 VanDerWaalsContact C-N 3.32Å; G40-T42 PolarHBondContact O-N 3.03Å; G40-I43 WeakPolarHBondContact O-CB 3.49Å; G40-I43 PolarHBondContact O-N 3.1Å; G40-V44 WeakPolarHBondContact O-CG2 3.46Å; G40-V44 PolarHBondContact O-N 3.04Å
41	N	94.7	Very high	88.9	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-70.7	-29.7	178.7	-74	-63	0	0	0	112	A37 V44 C45 S182 D185 I186 T437	A37-N41 VanDerWaalsContact O-CB 3.23Å; A37-N41 WeakPolarHBondContact O-CB 3.23Å; A37-N41 PolarHBondContact O-N 3.08Å; A37-N41 PolarHBondContact O-ND2 3.49Å; N41-V44 PolarHBondContact O-N 3.24Å; N41-C45 WeakPolarHBondContact O-CB 3.2Å; N41-C45 PolarHBondContact O-N 3.24Å; N41-C45 PolarHBondContact O-SG 2.89Å; N41-C45 VanDerWaalsContact O-SG 3.38Å; N41-S182 WeakPolarHBondContact OD1-CB 3.23Å; N41-S182 PolarHBondContact OD1-OG 3.49Å; N41-D185 WeakPolarHBondContact ND2-CB 3.28Å; N41-I186 HydrophobicContact CB-CD1 4.01Å; N41-I186 HydrophobicContact CB-CG1 3.71Å; N41-T437 PolarHBondContact ND2-O 2.93Å
42	T	93.6	Very high	87	Confident	53 Å²	53	45.4 Å²	45.4	33%	0.325	23%	0.229	S	C	.	.	H	α-helix	trans	-64.7	-39.3	171.1	-68.2	0	0	0	0	111.3	V38 V39 G40 C45 I46	V38-T42 WeakPolarHBondContact O-CB 3.47Å; V38-T42 PolarHBondContact O-N 2.99Å; V38-T42 PolarHBondContact O-OG1 3.26Å; V39-T42 PolarHBondContact O-N 3.1Å; G40-T42 VanDerWaalsContact C-N 3.32Å; G40-T42 PolarHBondContact O-N 3.03Å; T42-C45 PolarHBondContact O-N 2.99Å; T42-I46 HydrophobicContact CG2-CD1 3.69Å; T42-I46 HydrophobicContact CG2-CG1 4.28Å; T42-I46 WeakPolarHBondContact O-CB 3.4Å; T42-I46 WeakPolarHBondContact O-CG1 3.45Å; T42-I46 PolarHBondContact O-N 3.02Å
43	I	91.5	Very high	84.9	Confident	49 Å²	49	43.8 Å²	43.8	25%	0.251	23%	0.225	S	C	.	.	H	α-helix	trans	-62	-44.2	172.6	-72.2	164.7	0	0	0	111.1	V39 G40 I46 L47 V455 L458	V39-I43 HydrophobicContact CG1-CD1 3.92Å; V39-I43 VanDerWaalsContact O-CG1 3.31Å; V39-I43 WeakPolarHBondContact O-CG1 3.45Å; V39-I43 PolarHBondContact O-N 3.43Å; G40-I43 WeakPolarHBondContact O-CB 3.49Å; G40-I43 PolarHBondContact O-N 3.1Å; I43-I46 PolarHBondContact O-N 2.88Å; I43-L47 HydrophobicContact CG2-CD1 4.05Å; I43-L47 WeakPolarHBondContact O-CG 3.42Å; I43-L47 PolarHBondContact O-N 3.25Å; I43-V455 HydrophobicContact CG2-CG2 3.72Å; I43-L458 HydrophobicContact CG2-CD2 4.4Å
44	V	90.9	Very high	82.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60	-51.3	174.4	175.9	0	0	0	0	110.6	G40 N41 I46 L47 L48 S182 P441 Y444 F451	G40-V44 WeakPolarHBondContact O-CG2 3.46Å; G40-V44 PolarHBondContact O-N 3.04Å; N41-V44 PolarHBondContact O-N 3.24Å; V44-I46 VanDerWaalsContact C-N 3.32Å; V44-I46 PolarHBondContact O-N 3Å; V44-L47 PolarHBondContact O-N 2.88Å; V44-L48 HydrophobicContact CG1-CD1 3.65Å; V44-L48 HydrophobicContact CG1-CG 4.28Å; V44-L48 WeakPolarHBondContact O-CB 3.1Å; V44-L48 VanDerWaalsContact O-CG 3.26Å; V44-L48 WeakPolarHBondContact O-CG 3.29Å; V44-L48 PolarHBondContact O-N 3.39Å; V44-S182 WeakPolarHBondContact CG1-OG 3.15Å; V44-P441 HydrophobicContact CG2-CB 4.39Å; V44-P441 HydrophobicContact CG2-CG 4.2Å; V44-Y444 HydrophobicContact CG1-CE2 4.21Å; V44-Y444 HydrophobicContact CG2-CD2 3.74Å; V44-Y444 HydrophobicContact CG2-CE2 3.94Å; V44-F451 HydrophobicContact CG2-CE2 3.99Å; V44-F451 HydrophobicContact CG2-CZ 3.74Å
45	C	90.4	Very high	80.3	Confident	13 Å²	13	48 Å²	48	9%	0.088	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-39.7	177.2	-77.5	0	0	0	0	112.8	N41 T42 R49 F179 S182	N41-C45 WeakPolarHBondContact O-CB 3.2Å; N41-C45 PolarHBondContact O-N 3.24Å; N41-C45 PolarHBondContact O-SG 2.89Å; N41-C45 VanDerWaalsContact O-SG 3.38Å; T42-C45 PolarHBondContact O-N 2.99Å; C45-R49 WeakPolarHBondContact O-CB 3.42Å; C45-R49 PolarHBondContact O-N 3.24Å; C45-F179 HydrophobicContact CB-CD2 4.26Å; C45-F179 HydrophobicContact CB-CE2 4Å; C45-S182 WeakPolarHBondContact SG-CB 3.35Å
46	I	86.4	Confident	77.7	Confident	64 Å²	64	48.1 Å²	48.1	33%	0.328	25%	0.247	S	C	.	.	H	α-helix	trans	-66.7	-50.6	177.8	-75.4	169.7	0	0	0	111	T42 I43 V44 L48 R49 F50 L458	T42-I46 HydrophobicContact CG2-CD1 3.69Å; T42-I46 HydrophobicContact CG2-CG1 4.28Å; T42-I46 WeakPolarHBondContact O-CB 3.4Å; T42-I46 WeakPolarHBondContact O-CG1 3.45Å; T42-I46 PolarHBondContact O-N 3.02Å; I43-I46 PolarHBondContact O-N 2.88Å; V44-I46 VanDerWaalsContact C-N 3.32Å; V44-I46 PolarHBondContact O-N 3Å; I46-L48 PolarHBondContact O-N 3.05Å; I46-R49 PolarHBondContact O-N 2.75Å; I46-F50 HydrophobicContact CG2-CD2 3.68Å; I46-F50 HydrophobicContact CG2-CE2 3.49Å; I46-F50 VanDerWaalsContact CG2-CE2 3.49Å; I46-F50 WeakPolarHBondContact O-CD2 3.18Å; I46-F50 PolarHBondContact O-N 3.15Å; I46-L458 HydrophobicContact CB-CD2 4.48Å; I46-L458 HydrophobicContact CG2-CD1 3.86Å; I46-L458 HydrophobicContact CG2-CD2 3.79Å
47	L	83.6	Confident	75	Confident	15 Å²	15	53.4 Å²	53.4	8%	0.079	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-48.6	179.5	-71.7	174.3	0	0	0	110.7	I43 V44 F50 H51 F451 D454 V455 L458	I43-L47 HydrophobicContact CG2-CD1 4.05Å; I43-L47 WeakPolarHBondContact O-CG 3.42Å; I43-L47 PolarHBondContact O-N 3.25Å; V44-L47 PolarHBondContact O-N 2.88Å; L47-F50 PolarHBondContact O-N 2.72Å; L47-H51 PolarHBondContact O-CD2 3.47Å; L47-H51 PolarHBondContact O-N 3.36Å; L47-F451 HydrophobicContact CD1-CD2 3.76Å; L47-F451 HydrophobicContact CD1-CE2 3.52Å; L47-F451 HydrophobicContact CD1-CZ 4.38Å; L47-D454 HydrophobicContact CD1-CB 4.1Å; L47-D454 HydrophobicContact CD2-CB 3.94Å; L47-V455 HydrophobicContact CD1-CG2 3.72Å; L47-L458 HydrophobicContact CD2-CB 4.09Å; L47-L458 HydrophobicContact CD2-CD2 4.01Å; L47-L458 HydrophobicContact CG-CD2 4.15Å
48	L	82.8	Confident	72.3	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-65.7	-41.7	178.8	-65.1	-177.8	0	0	0	112.8	V44 I46 F50 H51 Y52 W91 L178 F179	V44-L48 HydrophobicContact CG1-CD1 3.65Å; V44-L48 HydrophobicContact CG1-CG 4.28Å; V44-L48 WeakPolarHBondContact O-CB 3.1Å; V44-L48 VanDerWaalsContact O-CG 3.26Å; V44-L48 WeakPolarHBondContact O-CG 3.29Å; V44-L48 PolarHBondContact O-N 3.39Å; I46-L48 PolarHBondContact O-N 3.05Å; L48-F50 VanDerWaalsContact C-N 3.3Å; L48-F50 PolarHBondContact O-N 2.84Å; L48-H51 WeakPolarHBondContact O-CB 3.48Å; L48-H51 PolarHBondContact O-N 3.07Å; L48-H51 VanDerWaalsContact O-N 3.15Å; L48-Y52 WeakPolarHBondContact O-CD2 3.38Å; L48-Y52 PolarHBondContact O-N 3.39Å; L48-W91 HydrophobicContact CD1-CZ3 4.36Å; L48-W91 HydrophobicContact CD2-CD2 4.33Å; L48-W91 HydrophobicContact CD2-CE3 3.81Å; L48-W91 HydrophobicContact CD2-CH2 4.06Å; L48-W91 HydrophobicContact CD2-CZ3 3.65Å; L48-L178 HydrophobicContact CD1-CB 4.11Å; L48-F179 HydrophobicContact CB-CB 4.23Å; L48-F179 HydrophobicContact CB-CD2 4.02Å; L48-F179 HydrophobicContact CD1-CB 3.86Å
49	R	73.4	Confident	69.6	Low	159 Å²	159	62.1 Å²	62.1	60%	0.6	30%	0.298	S	S	*	.	H	α-helix	trans	-64.1	-32	175.4	-176	174.5	179.1	178.9	2.1	112.6	C45 I46 H51 Y52 C53 F179	C45-R49 WeakPolarHBondContact O-CB 3.42Å; C45-R49 PolarHBondContact O-N 3.24Å; I46-R49 PolarHBondContact O-N 2.75Å; R49-H51 VanDerWaalsContact C-N 3.31Å; R49-H51 PolarHBondContact O-N 3.29Å; R49-Y52 PolarHBondContact O-N 3Å; R49-C53 WeakPolarHBondContact O-CB 3.45Å; R49-C53 PolarHBondContact O-N 2.74Å; R49-F179 HydrophobicContact CB-CE2 4.23Å
50	F	57.7	Low	67.2	Low	108 Å²	108	62 Å²	62	47%	0.474	30%	0.297	S	S	.	.	H	α-helix	trans	-64.8	-33	174	-85.1	-57.1	0	0	0	112.8	I46 L47 L48 N54 L458	I46-F50 HydrophobicContact CG2-CD2 3.68Å; I46-F50 HydrophobicContact CG2-CE2 3.49Å; I46-F50 VanDerWaalsContact CG2-CE2 3.49Å; I46-F50 WeakPolarHBondContact O-CD2 3.18Å; I46-F50 PolarHBondContact O-N 3.15Å; L47-F50 PolarHBondContact O-N 2.72Å; L48-F50 VanDerWaalsContact C-N 3.3Å; L48-F50 PolarHBondContact O-N 2.84Å; F50-N54 PolarHBondContact O-ND2 3.41Å; F50-L458 HydrophobicContact CE2-CD1 4.12Å
51	H	57	Low	64.6	Low	25 Å²	25	67.4 Å²	67.4	12%	0.116	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-45	169.2	-68	-88.5	0	0	0	111.4	L47 L48 R49 I55	L47-H51 PolarHBondContact O-CD2 3.47Å; L47-H51 PolarHBondContact O-N 3.36Å; L48-H51 WeakPolarHBondContact O-CB 3.48Å; L48-H51 PolarHBondContact O-N 3.07Å; L48-H51 VanDerWaalsContact O-N 3.15Å; R49-H51 VanDerWaalsContact C-N 3.31Å; R49-H51 PolarHBondContact O-N 3.29Å; H51-I55 WeakPolarHBondContact O-CD1 3.36Å; H51-I55 WeakPolarHBondContact O-CG1 3.37Å
52	Y	57.2	Low	62.2	Low	30 Å²	30	71.9 Å²	71.9	12%	0.118	35%	0.351	C	S	.	.	H	α-helix	trans	-73.8	-45.5	-176.6	-64.3	-58	0	0	0	114.9	L48 R49 N54 I55 I56 S171 S175 L176	L48-Y52 WeakPolarHBondContact O-CD2 3.38Å; L48-Y52 PolarHBondContact O-N 3.39Å; R49-Y52 PolarHBondContact O-N 3Å; Y52-N54 VanDerWaalsContact C-N 3.27Å; Y52-N54 PolarHBondContact O-N 3.2Å; Y52-I55 PolarHBondContact O-N 3.01Å; Y52-I55 VanDerWaalsContact O-N 3.08Å; Y52-I56 PolarHBondContact O-N 2.83Å; Y52-S171 WeakPolarHBondContact CE1-OG 3.03Å; Y52-S171 PolarHBondContact OH-OG 2.86Å; Y52-S175 PolarHBondContact OH-OG 2.7Å; Y52-L176 HydrophobicContact CE1-CD2 3.78Å; Y52-L176 HydrophobicContact CE1-CG 4.3Å; Y52-L176 HydrophobicContact CE2-CD2 4.06Å; Y52-L176 VanDerWaalsContact CZ-CD2 3.48Å; Y52-L176 WeakPolarHBondContact OH-CA 3.42Å; Y52-L176 WeakPolarHBondContact OH-CD2 3.46Å; Y52-L176 WeakPolarHBondContact OH-CG 3.3Å; Y52-L176 PolarHBondContact OH-N 3.09Å
53	C	51.9	Low	59.9	Low	53 Å²	53	76.6 Å²	76.6	36%	0.358	37%	0.373	S	S	.	.	H	α-helix	trans	-65.4	-30.7	-177	-75.1	0	0	0	0	112.5	R49 R57	R49-C53 WeakPolarHBondContact O-CB 3.45Å; R49-C53 PolarHBondContact O-N 2.74Å; C53-R57 WeakPolarHBondContact O-CB 3.37Å; C53-R57 PolarHBondContact O-N 3.2Å; C53-R57 VanDerWaalsContact O-N 3.07Å
54	N	50	Low	57.1	Low	70 Å²	70	76.2 Å²	76.2	37%	0.374	38%	0.382	S	S	.	.	H	α-helix	trans	-67.5	-36.3	172.8	-75.8	-31.6	0	0	0	112.3	F50 Y52 R57 F58	F50-N54 PolarHBondContact O-ND2 3.41Å; Y52-N54 VanDerWaalsContact C-N 3.27Å; Y52-N54 PolarHBondContact O-N 3.2Å; N54-R57 PolarHBondContact O-N 3.42Å; N54-F58 PolarHBondContact O-N 3Å
55	I	46.1	Very low	54.1	Low	65 Å²	65	82.2 Å²	82.2	33%	0.333	42%	0.422	S	S	.	.	H	α-helix	trans	-68.6	-44.9	175.7	-66.2	167.2	0	0	0	111	H51 Y52 R57 F58 F59	H51-I55 WeakPolarHBondContact O-CD1 3.36Å; H51-I55 WeakPolarHBondContact O-CG1 3.37Å; Y52-I55 PolarHBondContact O-N 3.01Å; Y52-I55 VanDerWaalsContact O-N 3.08Å; I55-R57 VanDerWaalsContact C-N 3.29Å; I55-R57 PolarHBondContact O-N 2.8Å; I55-F58 WeakPolarHBondContact O-CB 3.4Å; I55-F58 PolarHBondContact O-N 3.31Å; I55-F58 VanDerWaalsContact O-N 3.12Å; I55-F59 HydrophobicContact CG2-CD2 3.87Å; I55-F59 HydrophobicContact CG2-CE2 4.07Å; I55-F59 PolarHBondContact O-N 2.8Å
56	I	43.7	Very low	51.1	Low	106 Å²	106	92 Å²	92	54%	0.544	46%	0.463	S	S	.	.	H	α-helix	trans	-58.9	-44.2	176	-65.3	171.9	0	0	0	110.2	Y52 F58 F59 T60	Y52-I56 PolarHBondContact O-N 2.83Å; I56-F58 VanDerWaalsContact C-N 3.28Å; I56-F58 PolarHBondContact O-N 2.99Å; I56-F59 PolarHBondContact O-N 3.48Å; I56-T60 HydrophobicContact CG2-CG2 4.38Å; I56-T60 WeakPolarHBondContact O-CG2 3.18Å; I56-T60 PolarHBondContact O-N 3.05Å; I56-T60 PolarHBondContact O-OG1 3.16Å
57	R	41	Very low	48.4	Very low	180 Å²	180	98.4 Å²	98.4	68%	0.679	49%	0.488	S	S	*	.	H	α-helix	trans	-66.4	-26.8	178.1	-152.2	174.2	-159.9	160.9	6.7	113.5	C53 N54 I55 T60 N61	C53-R57 WeakPolarHBondContact O-CB 3.37Å; C53-R57 PolarHBondContact O-N 3.2Å; C53-R57 VanDerWaalsContact O-N 3.07Å; N54-R57 PolarHBondContact O-N 3.42Å; I55-R57 VanDerWaalsContact C-N 3.29Å; I55-R57 PolarHBondContact O-N 2.8Å; R57-T60 WeakPolarHBondContact CA-OG1 3.44Å; R57-T60 PolarHBondContact O-OG1 2.85Å; R57-N61 WeakPolarHBondContact O-CB 3.45Å; R57-N61 PolarHBondContact O-N 3.17Å; R57-N61 PolarHBondContact O-ND2 2.74Å
58	F	39.6	Very low	45.6	Very low	103 Å²	103	107.3 Å²	107.3	45%	0.452	53%	0.526	S	S	.	.	H	α-helix	trans	-72.5	-46.3	170.6	-174.3	-97.3	0	0	0	111.4	N54 I55 I56 N61 T62 N112	N54-F58 PolarHBondContact O-N 3Å; I55-F58 WeakPolarHBondContact O-CB 3.4Å; I55-F58 PolarHBondContact O-N 3.31Å; I55-F58 VanDerWaalsContact O-N 3.12Å; I56-F58 VanDerWaalsContact C-N 3.28Å; I56-F58 PolarHBondContact O-N 2.99Å; F58-N61 PolarHBondContact O-N 3.33Å; F58-T62 PolarHBondContact O-N 2.89Å; F58-T62 PolarHBondContact O-OG1 3.03Å; F58-N112 HydrophobicContact CE1-CB 4.5Å; F58-N112 HydrophobicContact CZ-CB 4.12Å
59	F	40.4	Very low	43.2	Very low	119 Å²	119	112.6 Å²	112.6	52%	0.522	56%	0.564	S	S	.	*	H	α-helix	trans	-65.2	-41.2	178.7	-92.2	-83.1	0	0	0	113.2	I55 I56 N61 T62 L63	I55-F59 HydrophobicContact CG2-CD2 3.87Å; I55-F59 HydrophobicContact CG2-CE2 4.07Å; I55-F59 PolarHBondContact O-N 2.8Å; I56-F59 PolarHBondContact O-N 3.48Å; F59-N61 PolarHBondContact O-N 2.8Å; F59-T62 WeakPolarHBondContact CA-OG1 3.36Å; F59-T62 PolarHBondContact O-N 3.2Å; F59-T62 PolarHBondContact O-OG1 3.28Å; F59-L63 HydrophobicContact CD1-CD1 4.44Å; F59-L63 PolarHBondContact O-N 3.38Å
60	T	45.7	Very low	41	Very low	77 Å²	77	111.5 Å²	111.5	47%	0.472	58%	0.575	S	S	.	*	H	α-helix	trans	-63.1	-32.2	174.1	54.5	0	0	0	0	112.1	I56 R57 G64	I56-T60 HydrophobicContact CG2-CG2 4.38Å; I56-T60 WeakPolarHBondContact O-CG2 3.18Å; I56-T60 PolarHBondContact O-N 3.05Å; I56-T60 PolarHBondContact O-OG1 3.16Å; R57-T60 WeakPolarHBondContact CA-OG1 3.44Å; R57-T60 PolarHBondContact O-OG1 2.85Å; T60-G64 WeakPolarHBondContact O-CA 3.22Å; T60-G64 PolarHBondContact O-N 2.96Å
61	N	38.8	Very low	39.5	Very low	125 Å²	125	113.6 Å²	113.6	67%	0.668	59%	0.59	S	S	*	*	H	α-helix	trans	-77.4	-16.4	173.9	-71.2	-8.6	0	0	0	113.7	R57 F58 F59	R57-N61 WeakPolarHBondContact O-CB 3.45Å; R57-N61 PolarHBondContact O-N 3.17Å; R57-N61 PolarHBondContact O-ND2 2.74Å; F58-N61 PolarHBondContact O-N 3.33Å; F59-N61 PolarHBondContact O-N 2.8Å
62	T	45.6	Very low	38	Very low	93 Å²	93	118 Å²	118	57%	0.571	62%	0.624	S	S	*	*	H	α-helix	trans	-91.8	-26.2	173.5	6.2	0	0	0	0	113	F58 F59	F58-T62 PolarHBondContact O-N 2.89Å; F58-T62 PolarHBondContact O-OG1 3.03Å; F59-T62 WeakPolarHBondContact CA-OG1 3.36Å; F59-T62 PolarHBondContact O-N 3.2Å; F59-T62 PolarHBondContact O-OG1 3.28Å
63	L	43.5	Very low	36.7	Very low	152 Å²	152	124.6 Å²	124.6	80%	0.796	65%	0.653	S	S	*	*	H	α-helix	trans	-96.3	-17	176.5	-74.2	154.3	0	0	0	113.2	F59	F59-L63 HydrophobicContact CD1-CD1 4.44Å; F59-L63 PolarHBondContact O-N 3.38Å
64	G	32.6	Very low	35.4	Very low	42 Å²	42	127 Å²	127	43%	0.433	67%	0.67	S	S	.	*	S	Bend	trans	-105.2	107.2	179.7	0	0	0	0	0	114.1	T60	T60-G64 WeakPolarHBondContact O-CA 3.22Å; T60-G64 PolarHBondContact O-N 2.96Å
65	C	28.1	Very low	34.4	Very low	125 Å²	125	131.4 Å²	131.4	85%	0.845	69%	0.686	S	S	*	*			trans	52.5	110.4	163.7	-72.4	0	0	0	0	119	K67	C65-K67 PolarHBondContact O-N 3.3Å
66	K	27.3	Very low	33.4	Very low	219 Å²	219	135.5 Å²	135.5	95%	0.952	71%	0.709	S	S	*	*			trans	-60.7	87.8	162	-70.4	173.6	177.1	168.8	0	111.9	K68	K66-K68 PolarHBondContact O-N 2.81Å
67	K	30.1	Very low	32.7	Very low	198 Å²	198	137.9 Å²	137.9	86%	0.861	72%	0.718	S	S	*	*			trans	-87.1	94.6	163.6	-128.8	173.9	-173.8	175.8	0	109.8	C65 S69	C65-K67 PolarHBondContact O-N 3.3Å; K67-S69 PolarHBondContact O-N 2.8Å
68	K	26.3	Very low	32	Very low	202 Å²	202	138.3 Å²	138.3	88%	0.878	73%	0.727	S	S	*	*			trans	-61.3	115.2	168.9	-82.1	-176.6	174.2	-179.4	0	109	K66	K66-K68 PolarHBondContact O-N 2.81Å
69	S	30.3	Very low	31.5	Very low	114 Å²	114	141.6 Å²	141.6	80%	0.797	74%	0.743	S	S	*	*			trans	-125.2	96.7	159.7	51.3	0	0	0	0	109	K67 L71	K67-S69 PolarHBondContact O-N 2.8Å; S69-L71 PolarHBondContact O-N 2.96Å
70	T	27.3	Very low	30.9	Very low	136 Å²	136	144.5 Å²	144.5	83%	0.834	76%	0.758	S	S	*	*			trans	-74.8	104.1	176.2	43	0	0	0	0	110.2
71	L	27.2	Very low	30.1	Very low	152 Å²	152	148.8 Å²	148.8	80%	0.796	77%	0.772	S	S	*	*			trans	-136.7	95.8	160.7	-160.6	75.4	0	0	0	110.2	S69 K73	S69-L71 PolarHBondContact O-N 2.96Å; L71-K73 PolarHBondContact O-N 3.25Å
72	S	25.1	Very low	29.6	Very low	117 Å²	117	149.8 Å²	149.8	82%	0.818	78%	0.778	S	S	*	*			trans	-69.5	120.9	169.7	-177.7	0	0	0	0	109.5
73	K	30.7	Very low	28.7	Very low	169 Å²	169	151.3 Å²	151.3	74%	0.735	78%	0.783	S	S	*	*			trans	-134.4	99	154.6	-78.6	-164.1	172	-175.9	0	108.7	L71 F75	L71-K73 PolarHBondContact O-N 3.25Å; K73-F75 PolarHBondContact O-N 3.42Å
74	S	24.9	Very low	28	Very low	102 Å²	102	150.5 Å²	150.5	71%	0.713	78%	0.779	S	S	*	*			trans	-58.3	130.3	161.5	-177.6	0	0	0	0	108.8
75	F	28.9	Very low	28	Very low	163 Å²	163	155.5 Å²	155.5	72%	0.715	80%	0.796	S	S	*	*			trans	-142.9	102.9	169.9	-117.9	-88.1	0	0	0	108.9	K73 H77	K73-F75 PolarHBondContact O-N 3.42Å; F75-H77 AromaticContact CD1-NE2 3.9Å; F75-H77 PolarHBondContact O-N 3.43Å
76	N	23.7	Very low	28.2	Very low	152 Å²	152	156.3 Å²	156.3	81%	0.813	79%	0.792	S	S	*	*			trans	-64.9	130.4	169.4	-73.7	-26.5	0	0	0	109
77	H	29.5	Very low	28.8	Very low	156 Å²	156	150 Å²	150	72%	0.722	77%	0.766	S	S	*	*			trans	-137.2	129	164.9	-96.2	-66.8	0	0	0	111	F75 H79	F75-H77 AromaticContact CD1-NE2 3.9Å; F75-H77 PolarHBondContact O-N 3.43Å; H77-H79 PolarHBondContact O-N 2.95Å
78	H	26.9	Very low	29.2	Very low	189 Å²	189	144 Å²	144	88%	0.875	74%	0.741	S	S	*	*			trans	-61.9	121	175	-78.3	-99.6	0	0	0	111	H80	H78-H80 PolarHBondContact O-N 3.4Å
79	H	28.5	Very low	30	Very low	171 Å²	171	136 Å²	136	79%	0.792	71%	0.709	S	S	*	*			trans	-80.8	100.2	160.9	-94.8	-83.8	0	0	0	109.6	H77 H81	H77-H79 PolarHBondContact O-N 2.95Å; H79-H81 PolarHBondContact O-N 3.31Å
80	H	28.9	Very low	30.6	Very low	180 Å²	180	132.3 Å²	132.3	83%	0.833	68%	0.682	S	S	*	*			trans	-65.5	120.8	164.6	-110.7	-83	0	0	0	109.5	H78 N82	H78-H80 PolarHBondContact O-N 3.4Å; H80-N82 PolarHBondContact O-N 3.22Å
81	H	26.9	Very low	31.5	Very low	167 Å²	167	126.2 Å²	126.2	77%	0.773	64%	0.644	S	S	*	*			trans	-60.9	126.7	165	-96.3	-106.9	0	0	0	109.4	H79	H79-H81 PolarHBondContact O-N 3.31Å
82	N	28.8	Very low	32.3	Very low	147 Å²	147	120.1 Å²	120.1	79%	0.786	61%	0.612	S	S	*	*			trans	-124.9	99.6	155.3	-167.5	-15.9	0	0	0	107.6	H80 N84	H80-N82 PolarHBondContact O-N 3.22Å; N82-N84 PolarHBondContact O-N 2.92Å; N82-N84 VanDerWaalsContact O-N 3.16Å
83	N	27.3	Very low	33.1	Very low	125 Å²	125	115.6 Å²	115.6	67%	0.668	58%	0.579	S	S	*	*			trans	-92.6	66.7	-162.2	-168.2	16.5	0	0	0	111.7
84	N	29.7	Very low	33.6	Very low	134 Å²	134	109.9 Å²	109.9	72%	0.717	56%	0.555	S	S	*	*			trans	-145.5	149.9	175.2	-95.5	-50.1	0	0	0	112.2	N82	N82-N84 PolarHBondContact O-N 2.92Å; N82-N84 VanDerWaalsContact O-N 3.16Å
85	N	31.5	Very low	34	Very low	147 Å²	147	109.3 Å²	109.3	79%	0.786	55%	0.55	S	S	*	*			trans	69.9	43.2	177.5	-58.6	-27.3	0	0	0	118.1	Q87	N85-Q87 PolarHBondContact O-N 3.04Å
86	N	32.9	Very low	34.1	Very low	142 Å²	142	106 Å²	106	76%	0.759	55%	0.545	S	S	*	.			trans	-70.6	75.6	155	-86.3	-29.2	0	0	0	110.7
87	Q	38.5	Very low	34.8	Very low	87 Å²	87	105 Å²	105	41%	0.407	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-89.7	123.1	174.4	175.5	99.3	36.1	0	0	109	N85	N85-Q87 PolarHBondContact O-N 3.04Å
88	M	39.6	Very low	35.1	Very low	71 Å²	71	101.8 Å²	101.8	35%	0.35	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-68.9	138	-176.8	-155.3	71.4	171	0	0	111.9	E94 L378 A381	M88-E94 HydrophobicContact CE-CG 3.64Å; M88-E94 WeakPolarHBondContact CE-OE1 3.22Å; M88-L378 HydrophobicContact CE-CD1 4.27Å; M88-A381 HydrophobicContact CB-CB 3.6Å; M88-A381 HydrophobicContact CG-CB 3.62Å
89	D	43	Very low	35.4	Very low	36 Å²	36	100.4 Å²	100.4	19%	0.193	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-100.8	124	-173.5	-161	-33.8	0	0	0	112.3	W91 V92 N450	D89-W91 PolarHBondContact O-N 3.07Å; D89-W91 WeakPolarHBondContact OD1-CB 3.35Å; D89-W91 VanDerWaalsContact OD1-CD1 3.26Å; D89-W91 PolarHBondContact OD1-N 3.48Å; D89-V92 HydrophobicContact CB-CB 4.21Å; D89-V92 HydrophobicContact CB-CG2 3.77Å; D89-V92 PolarHBondContact O-N 2.99Å; D89-N450 VanDerWaalsContact CB-ND2 3.29Å; D89-N450 WeakPolarHBondContact CB-ND2 3.41Å; D89-N450 PolarHBondContact OD2-ND2 3.37Å
90	P	42	Very low	35.9	Very low	36 Å²	36	99.9 Å²	99.9	23%	0.234	54%	0.537	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20	173	-24.6	37.4	0	0	0	115.2	V92 N448	P90-V92 PolarHBondContact O-N 3.21Å; P90-N448 VanDerWaalsContact CD-OD1 3.3Å; P90-N448 WeakPolarHBondContact CD-OD1 3.37Å; P90-N448 HydrophobicContact CG-CB 4.21Å
91	W	47.9	Very low	36.1	Very low	8 Å²	8	98 Å²	98	3%	0.03	53%	0.528	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6	177.2	-59.9	125.3	0	0	0	114	L48 D89 S172 L178 N448 F451 D454	L48-W91 HydrophobicContact CD1-CZ3 4.36Å; L48-W91 HydrophobicContact CD2-CD2 4.33Å; L48-W91 HydrophobicContact CD2-CE3 3.81Å; L48-W91 HydrophobicContact CD2-CH2 4.06Å; L48-W91 HydrophobicContact CD2-CZ3 3.65Å; D89-W91 PolarHBondContact O-N 3.07Å; D89-W91 WeakPolarHBondContact OD1-CB 3.35Å; D89-W91 VanDerWaalsContact OD1-CD1 3.26Å; D89-W91 PolarHBondContact OD1-N 3.48Å; W91-S172 VanDerWaalsContact O-CB 3.23Å; W91-S172 WeakPolarHBondContact O-CB 3.02Å; W91-S172 PolarHBondContact O-N 2.72Å; W91-S172 PolarHBondContact O-OG 3.06Å; W91-L178 HydrophobicContact CH2-CD1 4.12Å; W91-L178 HydrophobicContact CZ3-CD1 3.59Å; W91-N448 PolarHBondContact NE1-ND2 3.46Å; W91-F451 HydrophobicContact CZ2-CB 4.33Å; W91-F451 AromaticContact CZ2-CD2 3.6Å; W91-F451 HydrophobicContact CZ2-CD2 3.6Å; W91-F451 HydrophobicContact CZ2-CE2 4.24Å; W91-F451 HydrophobicContact CZ2-CG 4.26Å; W91-D454 PolarHBondContact NE1-OD2 2.88Å
92	V	43.7	Very low	36.3	Very low	23 Å²	23	93 Å²	93	14%	0.139	51%	0.511	C	S	.	.	B	Isolated β-bridge	trans	-114.5	112.2	-168	177.6	0	0	0	0	111.3	D89 P90 E94 R169	D89-V92 HydrophobicContact CB-CB 4.21Å; D89-V92 HydrophobicContact CB-CG2 3.77Å; D89-V92 PolarHBondContact O-N 2.99Å; P90-V92 PolarHBondContact O-N 3.21Å; V92-E94 PolarHBondContact O-N 2.96Å; V92-R169 HydrophobicContact CB-CG 4.5Å; V92-R169 HydrophobicContact CG1-CB 4.5Å; V92-R169 HydrophobicContact CG1-CG 3.78Å; V92-R169 HydrophobicContact CG2-CB 3.66Å; V92-R169 HydrophobicContact CG2-CG 3.84Å
93	D	41.6	Very low	36.9	Very low	23 Å²	23	92.5 Å²	92.5	12%	0.123	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-69.2	116.6	163.8	-89.9	-48.7	0	0	0	109.7	S172 I173 R238 R249	D93-S172 WeakPolarHBondContact OD2-CA 3.31Å; D93-S172 WeakPolarHBondContact OD2-CB 3.17Å; D93-I173 PolarHBondContact OD2-N 3.34Å; D93-R238 IonicContact OD1-NH1 2.95Å; D93-R238 IonicContact OD1-NH2 2.66Å; D93-R238 PolarHBondContact OD1-NH2 3.48Å; D93-R249 IonicContact OD1-NH1 3.2Å; D93-R249 PolarHBondContact OD1-NH1 2.93Å
94	E	40.5	Very low	37.9	Very low	48 Å²	48	91 Å²	91	22%	0.224	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-55.8	142.6	176.1	-48	178.9	98.3	0	0	112.6	M88 V92 R249 L378 K382	M88-E94 HydrophobicContact CE-CG 3.64Å; M88-E94 WeakPolarHBondContact CE-OE1 3.22Å; V92-E94 PolarHBondContact O-N 2.96Å; E94-R249 PolarHBondContact O-NH1 2.78Å; E94-R249 PolarHBondContact O-NH2 3.46Å; E94-R249 VanDerWaalsContact O-NH2 3.1Å; E94-L378 VanDerWaalsContact CD-CD1 3.44Å; E94-L378 WeakPolarHBondContact OE1-CD1 3.17Å; E94-L378 WeakPolarHBondContact OE1-CD2 3.33Å; E94-L378 WeakPolarHBondContact OE2-CD1 3.29Å; E94-K382 WeakPolarHBondContact OE2-CE 3.43Å; E94-K382 IonicContact OE2-NZ 2.76Å; E94-K382 PolarHBondContact OE2-NZ 2.92Å
95	C	33.9	Very low	38.2	Very low	91 Å²	91	88 Å²	88	62%	0.615	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-64.4	152.2	159.7	-66.1	0	0	0	0	110.2	S97	C95-S97 PolarHBondContact O-N 3.19Å
96	P	31.5	Very low	38.4	Very low	92 Å²	92	88.8 Å²	88.8	60%	0.597	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-60.7	134.5	177.6	25.5	-34.2	0	0	0	111.1	S98	P96-S98 PolarHBondContact O-N 3.28Å
97	S	37.4	Very low	38.5	Very low	132 Å²	132	87.9 Å²	87.9	92%	0.923	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	40.5	-173.4	56.3	0	0	0	0	113.8	C95	C95-S97 PolarHBondContact O-N 3.19Å
98	S	36.7	Very low	38.2	Very low	89 Å²	89	88.2 Å²	88.2	62%	0.622	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.3	-3.1	-179.1	56.6	0	0	0	0	113.9	P96 H100	P96-S98 PolarHBondContact O-N 3.28Å; S98-H100 PolarHBondContact O-N 2.85Å
99	Q	33	Very low	37.9	Very low	159 Å²	159	92 Å²	92	74%	0.743	55%	0.548	S	S	*	.	S	Bend	trans	-83.3	106.5	168	-71.7	-168.5	-21.7	0	0	109.6
100	H	38.2	Very low	37.5	Very low	161 Å²	161	96.5 Å²	96.5	75%	0.745	57%	0.571	S	S	*	*			trans	-53.3	132.8	-175.4	-70.1	-110.8	0	0	0	113.1	S98 C102	S98-H100 PolarHBondContact O-N 2.85Å; H100-C102 PolarHBondContact O-N 2.9Å; H100-C102 VanDerWaalsContact O-N 3.16Å
101	E	33.1	Very low	37.1	Very low	139 Å²	139	102.6 Å²	102.6	65%	0.65	60%	0.596	S	S	*	*			trans	-62.5	108	144.6	-74.2	164	131.7	0	0	106.7	R374	E101-R374 IonicContact OE1-CZ 3.83Å; E101-R374 IonicContact OE1-NH2 3.2Å; E101-R374 PolarHBondContact OE1-NH2 3.47Å; E101-R374 IonicContact OE2-CZ 3.48Å; E101-R374 IonicContact OE2-NH1 2.72Å; E101-R374 PolarHBondContact OE2-NH1 3.5Å; E101-R374 IonicContact OE2-NH2 3.94Å; E101-R374 PolarHBondContact OE2-NH2 3.22Å
102	C	32.6	Very low	36.2	Very low	63 Å²	63	108 Å²	108	43%	0.426	63%	0.625	S	S	.	*			trans	-63.9	139.8	174.4	-69.7	0	0	0	0	109.5	H100 C104 G105	H100-C102 PolarHBondContact O-N 2.9Å; H100-C102 VanDerWaalsContact O-N 3.16Å; C102-C104 PolarHBondContact O-N 3.16Å; C102-G105 PolarHBondContact O-N 3.19Å; C102-G105 VanDerWaalsContact O-N 3.12Å
103	S	40.8	Very low	35.8	Very low	137 Å²	137	113 Å²	113	96%	0.958	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-0.7	-176.9	-44.4	0	0	0	0	115.2	G105	S103-G105 VanDerWaalsContact C-N 3.29Å
104	C	47.6	Very low	35.2	Very low	92 Å²	92	120.9 Å²	120.9	62%	0.622	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	2.2	171.9	65.2	0	0	0	0	114.5	C102 K106	C102-C104 PolarHBondContact O-N 3.16Å; C104-K106 VanDerWaalsContact C-N 3.27Å; C104-K106 PolarHBondContact O-N 2.84Å; C104-K106 VanDerWaalsContact O-N 3.16Å
105	G	35.6	Very low	34.7	Very low	73 Å²	73	129.4 Å²	129.4	75%	0.753	72%	0.722	S	S	*	*			trans	69	14.7	166.6	0	0	0	0	0	116.3	C102 S103	C102-G105 PolarHBondContact O-N 3.19Å; C102-G105 VanDerWaalsContact O-N 3.12Å; S103-G105 VanDerWaalsContact C-N 3.29Å
106	K	36.1	Very low	34.3	Very low	162 Å²	162	135.8 Å²	135.8	70%	0.704	74%	0.735	S	S	*	*			trans	-107.2	132.4	179.7	-68.5	177.8	-177.1	176.7	0	110.8	C104 C108	C104-K106 VanDerWaalsContact C-N 3.27Å; C104-K106 PolarHBondContact O-N 2.84Å; C104-K106 VanDerWaalsContact O-N 3.16Å; K106-C108 PolarHBondContact O-N 3.45Å
107	P	35.3	Very low	34.3	Very low	124 Å²	124	137.7 Å²	137.7	81%	0.805	75%	0.745	S	S	*	*			trans	-68.7	126.8	176.4	28.2	-33.7	0	0	0	110.6	I109	P107-I109 PolarHBondContact O-N 2.91Å
108	C	31.8	Very low	33.9	Very low	93 Å²	93	139 Å²	139	63%	0.628	74%	0.739	S	S	*	*			trans	-65.9	122.9	178.1	-66.4	0	0	0	0	111.2	K106 I110	K106-C108 PolarHBondContact O-N 3.45Å; C108-I110 PolarHBondContact O-N 2.88Å; C108-I110 VanDerWaalsContact O-N 3.1Å
109	I	34.5	Very low	33.5	Very low	152 Å²	152	144.1 Å²	144.1	78%	0.779	75%	0.751	S	S	*	*			trans	-75.3	99.1	173.9	-59	171.2	0	0	0	108	P107 Q111	P107-I109 PolarHBondContact O-N 2.91Å; I109-Q111 HydrophobicContact CG2-CG 4.21Å; I109-Q111 PolarHBondContact O-N 2.58Å
110	I	34.4	Very low	33.4	Very low	130 Å²	130	146 Å²	146	67%	0.667	76%	0.757	S	S	*	*			trans	-70.8	98.2	172.2	-60.8	175	0	0	0	108.3	C108	C108-I110 PolarHBondContact O-N 2.88Å; C108-I110 VanDerWaalsContact O-N 3.1Å
111	Q	32.6	Very low	32.9	Very low	164 Å²	164	143.5 Å²	143.5	77%	0.766	76%	0.758	S	S	*	*			trans	-77.2	135.6	167.1	-70	-172.2	-19.8	0	0	110	I109 T113	I109-Q111 HydrophobicContact CG2-CG 4.21Å; I109-Q111 PolarHBondContact O-N 2.58Å; Q111-T113 PolarHBondContact O-N 3.37Å
112	N	29.4	Very low	32.9	Very low	120 Å²	120	144.6 Å²	144.6	64%	0.642	77%	0.766	S	S	*	*	S	Bend	trans	-70.3	93.6	-177.2	-75.3	-13.2	0	0	0	112.8	F58	F58-N112 HydrophobicContact CE1-CB 4.5Å; F58-N112 HydrophobicContact CZ-CB 4.12Å
113	T	35.5	Very low	32.6	Very low	129 Å²	129	150 Å²	150	79%	0.791	79%	0.785	S	S	*	*			trans	-158.9	139.3	147.3	34.5	0	0	0	0	111.5	Q111 R115	Q111-T113 PolarHBondContact O-N 3.37Å; T113-R115 PolarHBondContact O-N 2.95Å
114	H	28.5	Very low	32.1	Very low	189 Å²	189	153.2 Å²	153.2	88%	0.875	78%	0.781	S	S	*	*			trans	-67.5	110.9	165.3	-77.3	-106.5	0	0	0	110.5
115	R	30.4	Very low	31.2	Very low	226 Å²	226	155 Å²	155	85%	0.853	79%	0.792	S	S	*	*			trans	-166.4	154.1	147.3	-108.3	160.1	-165.7	-158	1.5	111.7	T113	T113-R115 PolarHBondContact O-N 2.95Å
116	Y	26.2	Very low	30.6	Very low	225 Å²	225	160.3 Å²	160.3	88%	0.882	79%	0.79	S	S	*	*			trans	-64.8	144.5	-178.3	-44.1	-92.2	0	0	0	111.4
117	V	29.9	Very low	30.2	Very low	133 Å²	133	161.7 Å²	161.7	81%	0.806	80%	0.8	S	S	*	*			trans	-122.7	120	171	-179.6	0	0	0	0	108.5
118	I	30	Very low	29.7	Very low	158 Å²	158	162.8 Å²	162.8	81%	0.81	79%	0.794	S	S	*	*			trans	-85	130.4	174.2	-63.6	168.2	0	0	0	107.6
119	F	28.3	Very low	29.5	Very low	197 Å²	197	164.3 Å²	164.3	86%	0.864	81%	0.806	S	S	*	*			trans	-70.8	130.2	172.3	-87.7	-92.9	0	0	0	110.5
120	K	30.4	Very low	29	Very low	198 Å²	198	164.1 Å²	164.1	86%	0.861	81%	0.812	S	S	*	*			trans	-125.4	113.7	163.5	-152.7	177.8	-170.7	-177.5	0	107.3
121	S	27.8	Very low	28.8	Very low	110 Å²	110	163.8 Å²	163.8	77%	0.769	82%	0.821	S	S	*	*			trans	-76.9	143.9	-179.1	48.9	0	0	0	0	111.1
122	I	32.5	Very low	28.4	Very low	162 Å²	162	165.8 Å²	165.8	83%	0.831	83%	0.827	S	S	*	*			trans	-136.9	114.6	165.4	-60.9	-177.9	0	0	0	106.8
123	H	27.7	Very low	28.4	Very low	177 Å²	177	163.6 Å²	163.6	82%	0.819	83%	0.832	S	S	*	*			trans	-73.8	145.9	168.4	-88.7	-115.4	0	0	0	110.4
124	K	30.3	Very low	27.8	Very low	203 Å²	203	165 Å²	165	88%	0.883	84%	0.835	S	S	*	*			trans	-152.9	152.6	136.5	-109.5	-179.3	179.2	-173	0	109.9
125	P	28.6	Very low	27.8	Very low	129 Å²	129	167.3 Å²	167.3	84%	0.838	84%	0.838	S	S	*	*			trans	-91.4	-173.5	-160.9	37.6	-37.5	0	0	0	114.4
126	Y	22.2	Very low	27.6	Very low	185 Å²	185	163.3 Å²	163.3	73%	0.725	84%	0.839	S	S	*	*			trans	-96.4	145.6	-169.3	178.7	-97.8	0	0	0	111.7	Q128	Y126-Q128 HydrophobicContact CD1-CG 4.37Å; Y126-Q128 HydrophobicContact CE1-CG 3.49Å; Y126-Q128 VanDerWaalsContact CE1-CG 3.49Å; Y126-Q128 PolarHBondContact OH-NE2 3.28Å
127	E	28.5	Very low	27.7	Very low	192 Å²	192	155.8 Å²	155.8	90%	0.897	83%	0.83	S	S	*	*			trans	-143.4	144.4	168.6	-129.6	169.9	-146.1	0	0	109.8
128	Q	23.9	Very low	27.6	Very low	147 Å²	147	155 Å²	155	69%	0.687	83%	0.83	S	S	*	*			trans	-110.4	139.9	-179.7	-73.5	176.6	-10.8	0	0	110.5	Y126	Y126-Q128 HydrophobicContact CD1-CG 4.37Å; Y126-Q128 HydrophobicContact CE1-CG 3.49Å; Y126-Q128 VanDerWaalsContact CE1-CG 3.49Å; Y126-Q128 PolarHBondContact OH-NE2 3.28Å
129	S	27.9	Very low	27.4	Very low	125 Å²	125	155 Å²	155	87%	0.874	83%	0.83	S	S	*	*			trans	-146.6	128.7	159.6	53.7	0	0	0	0	110.2
130	T	24.8	Very low	27.6	Very low	147 Å²	147	152 Å²	152	90%	0.902	83%	0.828	S	S	*	*			trans	-104.5	136	-179.2	41.7	0	0	0	0	110.3
131	S	28.6	Very low	27.5	Very low	123 Å²	123	149.5 Å²	149.5	86%	0.86	82%	0.823	S	S	*	*			trans	-157.6	150.8	157.1	-167.2	0	0	0	0	111.1
132	K	25.3	Very low	27.7	Very low	207 Å²	207	149.1 Å²	149.1	90%	0.9	83%	0.827	S	S	*	*			trans	-103.8	140.8	173.5	-71.5	177.1	177.6	174.3	0	109.1
133	G	29.1	Very low	27.5	Very low	73 Å²	73	147.3 Å²	147.3	75%	0.753	82%	0.819	S	S	*	*			trans	-160	96.9	172.3	0	0	0	0	0	112.1
134	N	22.5	Very low	27.8	Very low	158 Å²	158	146.7 Å²	146.7	85%	0.845	82%	0.822	S	S	*	*			trans	-94	124.9	167.1	-80.6	-8.2	0	0	0	108.8
135	Y	28.5	Very low	27.9	Very low	238 Å²	238	144 Å²	144	93%	0.933	82%	0.815	S	S	*	*			trans	-143.7	146	152.2	-86.7	-67	0	0	0	111.1
136	T	25.7	Very low	28.3	Very low	143 Å²	143	143.2 Å²	143.2	88%	0.877	81%	0.81	S	S	*	*			trans	-90.9	153.7	-176.3	44.1	0	0	0	0	111.3
137	G	29.4	Very low	28.9	Very low	67 Å²	67	140.8 Å²	140.8	69%	0.691	81%	0.81	S	S	*	*			trans	-163.7	92.8	-176.3	0	0	0	0	0	116.5
138	S	28.1	Very low	29.4	Very low	115 Å²	115	136.2 Å²	136.2	80%	0.804	79%	0.792	S	S	*	*			trans	63.6	128.2	160.9	72.1	0	0	0	0	120
139	I	25.4	Very low	30	Very low	160 Å²	160	138.6 Å²	138.6	82%	0.821	80%	0.799	S	S	*	*			trans	-107.4	134.6	156.5	-65.8	169.9	0	0	0	106.5
140	T	32.4	Very low	30.2	Very low	133 Å²	133	141.6 Å²	141.6	82%	0.816	79%	0.792	S	S	*	*			trans	-120.4	126.1	168.5	42.3	0	0	0	0	110.4
141	L	27.9	Very low	30.9	Very low	146 Å²	146	137.2 Å²	137.2	76%	0.764	77%	0.765	S	S	*	*			trans	-94.8	104.6	-170.4	-155.3	82.8	0	0	0	110.8
142	A	32	Very low	31.2	Very low	102 Å²	102	135 Å²	135	84%	0.843	74%	0.744	S	S	*	*			trans	-98.1	99	176.2	0	0	0	0	0	111.1	N144	A142-N144 PolarHBondContact O-N 3.46Å
143	N	29.5	Very low	31.6	Very low	124 Å²	124	131 Å²	131	66%	0.663	73%	0.726	S	S	*	*			trans	-69.4	122.9	179.1	-69.9	-47.3	0	0	0	112.3
144	N	32.8	Very low	32.3	Very low	164 Å²	164	131.4 Å²	131.4	88%	0.877	71%	0.714	S	S	*	*			trans	-166.9	145.9	140.9	-101.1	-44.3	0	0	0	113.1	A142	A142-N144 PolarHBondContact O-N 3.46Å
145	I	33.5	Very low	33.2	Very low	145 Å²	145	128.3 Å²	128.3	74%	0.744	70%	0.697	S	S	*	*			trans	-145.9	146.6	-159.7	-55.6	172.4	0	0	0	107.9
146	P	35.3	Very low	33.7	Very low	114 Å²	114	124.1 Å²	124.1	74%	0.74	68%	0.683	S	S	*	*			cis	-133.7	142.1	-33.6	37.2	-20	0	0	0	113
147	N	35.2	Very low	34.6	Very low	134 Å²	134	121 Å²	121	72%	0.717	66%	0.658	S	S	*	*			trans	-139.6	-3.8	159.8	-139.8	-17.4	0	0	0	113.9	K149 R150	N147-K149 PolarHBondContact O-N 3.36Å; N147-R150 PolarHBondContact O-N 2.85Å
148	D	39.9	Very low	35.1	Very low	96 Å²	96	124 Å²	124	51%	0.513	65%	0.653	S	S	.	*	H	α-helix	trans	-79.7	-14	-153.6	-159.6	33.2	0	0	0	115.1	T151 N152	D148-T151 WeakPolarHBondContact CA-OG1 3.39Å; D148-T151 PolarHBondContact O-OG1 3.23Å; D148-T151 VanDerWaalsContact O-OG1 3.05Å; D148-T151 PolarHBondContact OD1-OG1 3.39Å; D148-N152 WeakPolarHBondContact O-CB 3.42Å; D148-N152 VanDerWaalsContact O-CG 3.32Å; D148-N152 PolarHBondContact O-N 3.29Å; D148-N152 PolarHBondContact O-ND2 3.15Å; D148-N152 VanDerWaalsContact O-ND2 3.15Å; D148-N152 PolarHBondContact OD1-ND2 3.22Å; D148-N152 PolarHBondContact OD2-ND2 3.28Å
149	K	35.9	Very low	35.4	Very low	196 Å²	196	126.3 Å²	126.3	85%	0.852	64%	0.644	S	S	*	*	H	α-helix	trans	-74.9	-29.2	179.4	-70.4	-171.9	177.4	-178.3	0	113.3	N147 F153	N147-K149 PolarHBondContact O-N 3.36Å; K149-F153 WeakPolarHBondContact O-CB 3.33Å; K149-F153 PolarHBondContact O-N 3.45Å
150	R	32.8	Very low	36	Very low	189 Å²	189	125.3 Å²	125.3	71%	0.713	63%	0.634	S	S	*	*	H	α-helix	trans	-84.6	-36.7	177.4	-175.8	175.4	-93.1	-179.7	-6.9	111.7	N147 T154	N147-R150 PolarHBondContact O-N 2.85Å; R150-T154 PolarHBondContact O-N 2.9Å; R150-T154 VanDerWaalsContact O-N 3.16Å; R150-T154 PolarHBondContact O-OG1 3.15Å
151	T	38.6	Very low	36.5	Very low	55 Å²	55	120.4 Å²	120.4	34%	0.337	61%	0.607	S	S	.	*	H	α-helix	trans	-63.4	-51.9	168.4	44.2	0	0	0	0	110.6	D148 F153 T154 I155	D148-T151 WeakPolarHBondContact CA-OG1 3.39Å; D148-T151 PolarHBondContact O-OG1 3.23Å; D148-T151 VanDerWaalsContact O-OG1 3.05Å; D148-T151 PolarHBondContact OD1-OG1 3.39Å; T151-F153 VanDerWaalsContact C-N 3.28Å; T151-F153 PolarHBondContact O-N 2.88Å; T151-T154 PolarHBondContact O-N 3.03Å; T151-T154 PolarHBondContact O-OG1 3Å; T151-T154 VanDerWaalsContact O-OG1 3.07Å; T151-I155 VanDerWaalsContact O-CB 3.24Å; T151-I155 WeakPolarHBondContact O-CB 3.42Å; T151-I155 WeakPolarHBondContact O-CG1 3.23Å; T151-I155 PolarHBondContact O-N 2.6Å
152	N	35.4	Very low	37	Very low	77 Å²	77	116.9 Å²	116.9	41%	0.412	59%	0.588	S	S	.	*	H	α-helix	trans	-64.3	-28.7	179	-76.7	-37.7	0	0	0	113.7	D148 K156	D148-N152 WeakPolarHBondContact O-CB 3.42Å; D148-N152 VanDerWaalsContact O-CG 3.32Å; D148-N152 PolarHBondContact O-N 3.29Å; D148-N152 PolarHBondContact O-ND2 3.15Å; D148-N152 VanDerWaalsContact O-ND2 3.15Å; D148-N152 PolarHBondContact OD1-ND2 3.22Å; D148-N152 PolarHBondContact OD2-ND2 3.28Å; N152-K156 WeakPolarHBondContact O-CA 3.43Å; N152-K156 WeakPolarHBondContact O-CB 3.31Å; N152-K156 PolarHBondContact O-N 3.39Å
153	F	34.8	Very low	37.2	Very low	121 Å²	121	115.3 Å²	115.3	53%	0.531	57%	0.566	S	S	.	*	H	α-helix	trans	-68	-50.1	172.9	-170.2	-95.9	0	0	0	111.8	K149 T151 K156 H157	K149-F153 WeakPolarHBondContact O-CB 3.33Å; K149-F153 PolarHBondContact O-N 3.45Å; T151-F153 VanDerWaalsContact C-N 3.28Å; T151-F153 PolarHBondContact O-N 2.88Å; F153-K156 PolarHBondContact O-N 3.08Å; F153-H157 AromaticContact CE1-CD2 3.88Å; F153-H157 AromaticContact CE1-NE2 3.97Å; F153-H157 AromaticContact CE2-CD2 3.87Å; F153-H157 AromaticContact CE2-NE2 3.58Å; F153-H157 AromaticContact CZ-CD2 3.69Å; F153-H157 AromaticContact CZ-CE1 3.87Å; F153-H157 AromaticContact CZ-NE2 3.35Å; F153-H157 WeakPolarHBondContact CZ-NE2 3.43Å; F153-H157 WeakPolarHBondContact O-CB 3.48Å; F153-H157 PolarHBondContact O-CD2 3.31Å; F153-H157 PolarHBondContact O-N 2.97Å
154	T	42.2	Very low	37.8	Very low	82 Å²	82	112.1 Å²	112.1	50%	0.503	55%	0.545	S	S	.	.	H	α-helix	trans	-67.5	-39.3	178.8	49	0	0	0	0	112.4	R150 T151 K158	R150-T154 PolarHBondContact O-N 2.9Å; R150-T154 VanDerWaalsContact O-N 3.16Å; R150-T154 PolarHBondContact O-OG1 3.15Å; T151-T154 PolarHBondContact O-N 3.03Å; T151-T154 PolarHBondContact O-OG1 3Å; T151-T154 VanDerWaalsContact O-OG1 3.07Å; T154-K158 WeakPolarHBondContact O-CB 3.49Å; T154-K158 PolarHBondContact O-N 2.87Å
155	I	42.3	Very low	38.2	Very low	93 Å²	93	108.6 Å²	108.6	48%	0.477	53%	0.525	S	S	.	.	H	α-helix	trans	-63.3	-48.7	171.7	-67	167.3	0	0	0	109.9	T151 H157 K158 W159	T151-I155 VanDerWaalsContact O-CB 3.24Å; T151-I155 WeakPolarHBondContact O-CB 3.42Å; T151-I155 WeakPolarHBondContact O-CG1 3.23Å; T151-I155 PolarHBondContact O-N 2.6Å; I155-H157 PolarHBondContact O-N 2.97Å; I155-K158 CarbonylContact O-C 3.51Å; I155-K158 PolarHBondContact O-N 3.36Å; I155-W159 VanDerWaalsContact O-CB 3.28Å; I155-W159 WeakPolarHBondContact O-CB 3.34Å; I155-W159 PolarHBondContact O-N 3.01Å
156	K	38.1	Very low	38.2	Very low	151 Å²	151	110.3 Å²	110.3	66%	0.657	53%	0.527	S	S	*	.	H	α-helix	trans	-66.6	-33.8	-179.1	-171.1	171.9	-175.4	173.9	0	113	N152 F153 K160	N152-K156 WeakPolarHBondContact O-CA 3.43Å; N152-K156 WeakPolarHBondContact O-CB 3.31Å; N152-K156 PolarHBondContact O-N 3.39Å; F153-K156 PolarHBondContact O-N 3.08Å; K156-K160 WeakPolarHBondContact O-CB 3.3Å; K156-K160 PolarHBondContact O-N 2.86Å
157	H	45.4	Very low	38.2	Very low	76 Å²	76	107.2 Å²	107.2	35%	0.352	52%	0.516	S	S	.	.	H	α-helix	trans	-70.6	-41.7	170.8	-87.6	-111.1	0	0	0	112.1	F153 I155 K160 A161	F153-H157 AromaticContact CE1-CD2 3.88Å; F153-H157 AromaticContact CE1-NE2 3.97Å; F153-H157 AromaticContact CE2-CD2 3.87Å; F153-H157 AromaticContact CE2-NE2 3.58Å; F153-H157 AromaticContact CZ-CD2 3.69Å; F153-H157 AromaticContact CZ-CE1 3.87Å; F153-H157 AromaticContact CZ-NE2 3.35Å; F153-H157 WeakPolarHBondContact CZ-NE2 3.43Å; F153-H157 WeakPolarHBondContact O-CB 3.48Å; F153-H157 PolarHBondContact O-CD2 3.31Å; F153-H157 PolarHBondContact O-N 2.97Å; I155-H157 PolarHBondContact O-N 2.97Å; H157-K160 WeakPolarHBondContact O-CB 3.16Å; H157-K160 PolarHBondContact O-N 3.39Å; H157-A161 PolarHBondContact O-N 3.19Å
158	K	39.2	Very low	38.4	Very low	132 Å²	132	103.5 Å²	103.5	57%	0.574	50%	0.495	S	S	*	.	H	α-helix	trans	-66.6	-42.2	175.1	-177.7	173.1	178.5	-179	0	112.3	T154 I155 K160 A161 D162	T154-K158 WeakPolarHBondContact O-CB 3.49Å; T154-K158 PolarHBondContact O-N 2.87Å; I155-K158 CarbonylContact O-C 3.51Å; I155-K158 PolarHBondContact O-N 3.36Å; K158-K160 VanDerWaalsContact C-N 3.31Å; K158-K160 PolarHBondContact O-N 3.02Å; K158-A161 CarbonylContact O-C 3.57Å; K158-A161 PolarHBondContact O-N 3.23Å; K158-A161 VanDerWaalsContact O-N 3.09Å; K158-D162 VanDerWaalsContact CE-OD2 3.27Å; K158-D162 WeakPolarHBondContact CE-OD2 3.42Å; K158-D162 WeakPolarHBondContact CG-OD2 3.12Å; K158-D162 WeakPolarHBondContact O-CB 3.06Å; K158-D162 VanDerWaalsContact O-CG 3.28Å; K158-D162 PolarHBondContact O-N 3.2Å
159	W	35.2	Very low	38.7	Very low	163 Å²	163	106.2 Å²	106.2	62%	0.617	50%	0.498	S	S	*	.	H	α-helix	trans	-66.7	-34.6	176	-135.6	70.2	0	0	0	111.2	I155 N163	I155-W159 VanDerWaalsContact O-CB 3.28Å; I155-W159 WeakPolarHBondContact O-CB 3.34Å; I155-W159 PolarHBondContact O-N 3.01Å; W159-N163 WeakPolarHBondContact CZ3-ND2 3.35Å; W159-N163 WeakPolarHBondContact O-CB 3.16Å; W159-N163 PolarHBondContact O-N 3.46Å; W159-N163 PolarHBondContact O-ND2 2.95Å
160	K	38.1	Very low	39.3	Very low	139 Å²	139	101.1 Å²	101.1	60%	0.604	48%	0.483	S	S	*	.	H	α-helix	trans	-61	-49	165.8	-93.5	-169.2	168.7	-169.5	0	111.5	K156 H157 K158 Y164	K156-K160 WeakPolarHBondContact O-CB 3.3Å; K156-K160 PolarHBondContact O-N 2.86Å; H157-K160 WeakPolarHBondContact O-CB 3.16Å; H157-K160 PolarHBondContact O-N 3.39Å; K158-K160 VanDerWaalsContact C-N 3.31Å; K158-K160 PolarHBondContact O-N 3.02Å; K160-Y164 WeakPolarHBondContact O-CA 3.48Å; K160-Y164 WeakPolarHBondContact O-CB 3.26Å; K160-Y164 PolarHBondContact O-N 3.49Å
161	A	42.5	Very low	40.5	Very low	30 Å²	30	93.6 Å²	93.6	25%	0.248	46%	0.46	C	S	.	.	H	α-helix	trans	-63	-50.4	179.5	0	0	0	0	0	112.3	H157 K158 N163 Y164 I165	H157-A161 PolarHBondContact O-N 3.19Å; K158-A161 CarbonylContact O-C 3.57Å; K158-A161 PolarHBondContact O-N 3.23Å; K158-A161 VanDerWaalsContact O-N 3.09Å; A161-N163 PolarHBondContact O-N 3.34Å; A161-Y164 PolarHBondContact O-N 3.5Å; A161-I165 WeakPolarHBondContact O-CB 3.48Å; A161-I165 WeakPolarHBondContact O-CD1 3.47Å; A161-I165 VanDerWaalsContact O-CG1 3.23Å; A161-I165 WeakPolarHBondContact O-CG1 3.21Å; A161-I165 PolarHBondContact O-N 3.25Å
162	D	39.4	Very low	42	Very low	71 Å²	71	91.1 Å²	91.1	38%	0.38	45%	0.445	S	S	.	.	H	α-helix	trans	-63.1	-38.3	-179.3	-67.5	-18.8	0	0	0	111.8	K158 K166	K158-D162 VanDerWaalsContact CE-OD2 3.27Å; K158-D162 WeakPolarHBondContact CE-OD2 3.42Å; K158-D162 WeakPolarHBondContact CG-OD2 3.12Å; K158-D162 WeakPolarHBondContact O-CB 3.06Å; K158-D162 VanDerWaalsContact O-CG 3.28Å; K158-D162 PolarHBondContact O-N 3.2Å; D162-K166 WeakPolarHBondContact O-CB 3.21Å; D162-K166 PolarHBondContact O-N 3.35Å
163	N	36.3	Very low	44.4	Very low	69 Å²	69	88.2 Å²	88.2	37%	0.369	43%	0.429	S	S	.	.	H	α-helix	trans	-83.5	-19.7	174.9	-71.3	-24.4	0	0	0	114.1	W159 A161 G167	W159-N163 WeakPolarHBondContact CZ3-ND2 3.35Å; W159-N163 WeakPolarHBondContact O-CB 3.16Å; W159-N163 PolarHBondContact O-N 3.46Å; W159-N163 PolarHBondContact O-ND2 2.95Å; A161-N163 PolarHBondContact O-N 3.34Å; N163-G167 VanDerWaalsContact O-CA 3.28Å; N163-G167 WeakPolarHBondContact O-CA 3.46Å; N163-G167 PolarHBondContact O-N 2.89Å
164	Y	41	Very low	46.7	Very low	58 Å²	58	82.8 Å²	82.8	23%	0.227	41%	0.406	C	S	.	.	H	α-helix	trans	-72.5	-43.6	168.4	170.5	-106.9	0	0	0	109.7	K160 A161 K166 G167 M168 D454 H457	K160-Y164 WeakPolarHBondContact O-CA 3.48Å; K160-Y164 WeakPolarHBondContact O-CB 3.26Å; K160-Y164 PolarHBondContact O-N 3.49Å; A161-Y164 PolarHBondContact O-N 3.5Å; Y164-K166 PolarHBondContact O-N 2.97Å; Y164-G167 CarbonylContact O-C 3.57Å; Y164-G167 WeakPolarHBondContact O-CA 3.29Å; Y164-G167 PolarHBondContact O-N 3.16Å; Y164-M168 HydrophobicContact CD1-CE 3.93Å; Y164-M168 HydrophobicContact CE1-CE 3.3Å; Y164-M168 HydrophobicContact CE2-CE 4.37Å; Y164-M168 PolarHBondContact O-N 2.96Å; Y164-D454 WeakPolarHBondContact OH-CA 3.45Å; Y164-D454 WeakPolarHBondContact OH-CB 3.44Å; Y164-D454 VanDerWaalsContact OH-CG 3.3Å; Y164-D454 PolarHBondContact OH-OD1 3.2Å; Y164-H457 HydrophobicContact CD1-CB 4.3Å; Y164-H457 HydrophobicContact CE1-CB 3.6Å; Y164-H457 AromaticContact CE1-CD2 3.89Å; Y164-H457 AromaticContact CE1-CG 3.74Å; Y164-H457 AromaticContact CE2-CD2 3.97Å; Y164-H457 AromaticContact CZ-CD2 3.76Å
165	I	41.7	Very low	48.8	Very low	89 Å²	89	79 Å²	79	46%	0.456	38%	0.382	S	S	.	.	H	α-helix	trans	-59.9	-43.8	171	-69.1	162.8	0	0	0	111.3	A161 G167	A161-I165 WeakPolarHBondContact O-CB 3.48Å; A161-I165 WeakPolarHBondContact O-CD1 3.47Å; A161-I165 VanDerWaalsContact O-CG1 3.23Å; A161-I165 WeakPolarHBondContact O-CG1 3.21Å; A161-I165 PolarHBondContact O-N 3.25Å; I165-G167 VanDerWaalsContact C-N 3.31Å
166	K	34.2	Very low	51	Low	182 Å²	182	75.3 Å²	75.3	79%	0.791	36%	0.364	S	S	*	.	H	α-helix	trans	-74.2	-18.1	172.1	-78.4	-179.7	171.9	178.5	0	114.3	D162 Y164	D162-K166 WeakPolarHBondContact O-CB 3.21Å; D162-K166 PolarHBondContact O-N 3.35Å; Y164-K166 PolarHBondContact O-N 2.97Å
167	G	35	Very low	53.6	Low	49 Å²	49	68.1 Å²	68.1	51%	0.505	33%	0.333	S	S	.	.	H	α-helix	trans	-92.9	-2.6	-177.9	0	0	0	0	0	113.9	N163 Y164 I165 R169	N163-G167 VanDerWaalsContact O-CA 3.28Å; N163-G167 WeakPolarHBondContact O-CA 3.46Å; N163-G167 PolarHBondContact O-N 2.89Å; Y164-G167 CarbonylContact O-C 3.57Å; Y164-G167 WeakPolarHBondContact O-CA 3.29Å; Y164-G167 PolarHBondContact O-N 3.16Å; I165-G167 VanDerWaalsContact C-N 3.31Å; G167-R169 VanDerWaalsContact C-N 3.26Å; G167-R169 PolarHBondContact O-N 3.18Å
168	M	38.8	Very low	55.7	Low	56 Å²	56	64.8 Å²	64.8	28%	0.276	32%	0.317	S	S	.	.			trans	-64.7	88.8	173.5	-80.5	177	-172.9	0	0	110.5	Y164	Y164-M168 HydrophobicContact CD1-CE 3.93Å; Y164-M168 HydrophobicContact CE1-CE 3.3Å; Y164-M168 HydrophobicContact CE2-CE 4.37Å; Y164-M168 PolarHBondContact O-N 2.96Å
169	R	46.9	Very low	58.2	Low	153 Å²	153	60.9 Å²	60.9	58%	0.577	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-58.9	159.7	-177.9	-157.8	166.2	-179	174.4	2.6	110.9	V92 G167 S171	V92-R169 HydrophobicContact CB-CG 4.5Å; V92-R169 HydrophobicContact CG1-CB 4.5Å; V92-R169 HydrophobicContact CG1-CG 3.78Å; V92-R169 HydrophobicContact CG2-CB 3.66Å; V92-R169 HydrophobicContact CG2-CG 3.84Å; G167-R169 VanDerWaalsContact C-N 3.26Å; G167-R169 PolarHBondContact O-N 3.18Å; R169-S171 PolarHBondContact O-N 3.48Å
170	T	48	Very low	61	Low	89 Å²	89	53.6 Å²	53.6	55%	0.546	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-49.7	119	-166.8	48.3	0	0	0	0	114	S172	T170-S172 PolarHBondContact O-N 2.9Å
171	S	56.8	Low	63.7	Low	30 Å²	30	47 Å²	47	21%	0.21	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-51.8	121.4	173.1	164.6	0	0	0	0	111.2	Y52 R169 S175	Y52-S171 WeakPolarHBondContact CE1-OG 3.03Å; Y52-S171 PolarHBondContact OH-OG 2.86Å; R169-S171 PolarHBondContact O-N 3.48Å; S171-S175 PolarHBondContact OG-OG 3.04Å
172	S	71.3	Confident	66.2	Low	4 Å²	4	45.6 Å²	45.6	3%	0.028	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-70.8	159.2	178.9	65.5	0	0	0	0	112.9	W91 D93 T170 T174 S175	W91-S172 VanDerWaalsContact O-CB 3.23Å; W91-S172 WeakPolarHBondContact O-CB 3.02Å; W91-S172 PolarHBondContact O-N 2.72Å; W91-S172 PolarHBondContact O-OG 3.06Å; D93-S172 WeakPolarHBondContact OD2-CA 3.31Å; D93-S172 WeakPolarHBondContact OD2-CB 3.17Å; T170-S172 PolarHBondContact O-N 2.9Å; S172-T174 VanDerWaalsContact C-N 3.27Å; S172-T174 PolarHBondContact O-N 3.47Å; S172-S175 PolarHBondContact N-OG 2.97Å; S172-S175 WeakPolarHBondContact O-CB 3.33Å; S172-S175 PolarHBondContact O-N 2.8Å; S172-S175 PolarHBondContact O-OG 3.46Å; S172-S175 PolarHBondContact OG-N 2.92Å
173	I	84.7	Confident	68.9	Low	16 Å²	16	45.6 Å²	45.6	8%	0.082	23%	0.233	C	C	.	.	H	α-helix	trans	-58.7	-42.5	173.7	-60.3	147.6	0	0	0	110.2	D93 S175 L176 F177 R249 M250 A255	D93-I173 PolarHBondContact OD2-N 3.34Å; I173-S175 PolarHBondContact O-N 2.74Å; I173-L176 WeakPolarHBondContact O-CB 3.4Å; I173-L176 PolarHBondContact O-N 3.11Å; I173-L176 VanDerWaalsContact O-N 3.08Å; I173-F177 HydrophobicContact CG2-CE2 3.91Å; I173-F177 HydrophobicContact CG2-CZ 4.13Å; I173-R249 HydrophobicContact CD1-CB 4.04Å; I173-M250 HydrophobicContact CD1-CB 4.19Å; I173-M250 WeakPolarHBondContact CD1-O 3.29Å; I173-M250 WeakPolarHBondContact CG1-O 3.42Å; I173-M250 HydrophobicContact CG2-CE 3.78Å; I173-M250 HydrophobicContact CG2-CG 4.41Å; I173-A255 HydrophobicContact CG2-CB 3.85Å
174	T	84.3	Confident	71.7	Confident	6 Å²	6	42.3 Å²	42.3	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-27.9	175.8	-37.8	0	0	0	0	112.5	S172 L176 F177 L178 I234 D237 R238 L389	S172-T174 VanDerWaalsContact C-N 3.27Å; S172-T174 PolarHBondContact O-N 3.47Å; T174-L176 VanDerWaalsContact C-N 3.27Å; T174-L176 PolarHBondContact O-N 2.95Å; T174-F177 PolarHBondContact O-N 3.19Å; T174-F177 VanDerWaalsContact O-N 3.15Å; T174-L178 HydrophobicContact CG2-CD1 3.88Å; T174-L178 HydrophobicContact CG2-CG 4.16Å; T174-L178 WeakPolarHBondContact O-CB 3.5Å; T174-L178 VanDerWaalsContact O-CG 3.31Å; T174-L178 WeakPolarHBondContact O-CG 3.31Å; T174-L178 PolarHBondContact O-N 3.49Å; T174-I234 HydrophobicContact CG2-CG1 4.34Å; T174-I234 HydrophobicContact CG2-CG2 4.23Å; T174-D237 PolarHBondContact OG1-OD2 2.99Å; T174-R238 PolarHBondContact OG1-NE 2.9Å; T174-R238 VanDerWaalsContact OG1-NE 3.16Å; T174-R238 PolarHBondContact OG1-NH2 2.95Å; T174-L389 HydrophobicContact CG2-CD1 4.2Å
175	S	84.8	Confident	74.3	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.014	21%	0.206	C	C	.	.	H	α-helix	trans	-69.6	-20.9	176.8	72.9	0	0	0	0	113.7	Y52 S171 S172 I173 F179	Y52-S175 PolarHBondContact OH-OG 2.7Å; S171-S175 PolarHBondContact OG-OG 3.04Å; S172-S175 PolarHBondContact N-OG 2.97Å; S172-S175 WeakPolarHBondContact O-CB 3.33Å; S172-S175 PolarHBondContact O-N 2.8Å; S172-S175 PolarHBondContact O-OG 3.46Å; S172-S175 PolarHBondContact OG-N 2.92Å; I173-S175 PolarHBondContact O-N 2.74Å; S175-F179 WeakPolarHBondContact O-CB 3.26Å; S175-F179 PolarHBondContact O-N 2.99Å
176	L	88.8	Confident	76.9	Confident	17 Å²	17	37.3 Å²	37.3	9%	0.089	19%	0.193	C	C	.	.	H	α-helix	trans	-70.2	-45.4	166.3	-76.8	174.3	0	0	0	111	Y52 I173 T174 F179 N180 Q252 A255 I256 L259	Y52-L176 HydrophobicContact CE1-CD2 3.78Å; Y52-L176 HydrophobicContact CE1-CG 4.3Å; Y52-L176 HydrophobicContact CE2-CD2 4.06Å; Y52-L176 VanDerWaalsContact CZ-CD2 3.48Å; Y52-L176 WeakPolarHBondContact OH-CA 3.42Å; Y52-L176 WeakPolarHBondContact OH-CD2 3.46Å; Y52-L176 WeakPolarHBondContact OH-CG 3.3Å; Y52-L176 PolarHBondContact OH-N 3.09Å; I173-L176 WeakPolarHBondContact O-CB 3.4Å; I173-L176 PolarHBondContact O-N 3.11Å; I173-L176 VanDerWaalsContact O-N 3.08Å; T174-L176 VanDerWaalsContact C-N 3.27Å; T174-L176 PolarHBondContact O-N 2.95Å; L176-F179 PolarHBondContact O-N 3.21Å; L176-N180 PolarHBondContact O-N 3.11Å; L176-Q252 HydrophobicContact CD1-CG 3.77Å; L176-A255 HydrophobicContact CD1-CB 3.76Å; L176-I256 HydrophobicContact CD1-CG1 3.96Å; L176-L259 HydrophobicContact CB-CD1 4.23Å
177	F	92.6	Very high	79.9	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-68.6	-39.4	-177.8	-56.5	-34.7	0	0	0	111.8	I173 T174 F179 N180 L181 T230 L233 I234 D237 M250 A255 L259	I173-F177 HydrophobicContact CG2-CE2 3.91Å; I173-F177 HydrophobicContact CG2-CZ 4.13Å; T174-F177 PolarHBondContact O-N 3.19Å; T174-F177 VanDerWaalsContact O-N 3.15Å; F177-F179 VanDerWaalsContact C-N 3.34Å; F177-N180 PolarHBondContact O-N 2.93Å; F177-L181 WeakPolarHBondContact O-CB 3.27Å; F177-L181 PolarHBondContact O-N 3.23Å; F177-T230 HydrophobicContact CB-CG2 4.01Å; F177-T230 WeakPolarHBondContact O-CG2 3.35Å; F177-L233 HydrophobicContact CD1-CB 4.34Å; F177-L233 HydrophobicContact CD1-CD1 4.25Å; F177-L233 HydrophobicContact CD2-CB 4.28Å; F177-L233 HydrophobicContact CE1-CB 4.2Å; F177-L233 HydrophobicContact CE1-CD1 3.89Å; F177-L233 HydrophobicContact CE2-CB 4.12Å; F177-L233 HydrophobicContact CG-CB 4.39Å; F177-L233 HydrophobicContact CZ-CB 4.08Å; F177-L233 HydrophobicContact CZ-CD1 4.37Å; F177-I234 HydrophobicContact CB-CD1 3.97Å; F177-I234 HydrophobicContact CB-CG1 3.5Å; F177-I234 VanDerWaalsContact CB-CG1 3.5Å; F177-I234 HydrophobicContact CD2-CG1 4.06Å; F177-I234 HydrophobicContact CG-CG1 4.19Å; F177-D237 HydrophobicContact CE2-CB 3.92Å; F177-M250 HydrophobicContact CE2-CE 3.91Å; F177-M250 HydrophobicContact CZ-CE 3.69Å; F177-A255 HydrophobicContact CE1-CB 4.08Å; F177-A255 HydrophobicContact CZ-CB 4.01Å; F177-L259 HydrophobicContact CD1-CD1 4.1Å; F177-L259 HydrophobicContact CD1-CD2 3.79Å; F177-L259 HydrophobicContact CD1-CG 3.87Å; F177-L259 HydrophobicContact CE1-CD1 4.47Å; F177-L259 HydrophobicContact CE1-CD2 4.27Å; F177-L259 HydrophobicContact CE1-CG 4.01Å
178	L	91.2	Very high	82.8	Confident	5 Å²	5	29.3 Å²	29.3	3%	0.026	15%	0.147	C	C	.	.	H	α-helix	trans	-67.4	-34.2	175	-67	166.2	0	0	0	112	L48 W91 T174 L181 S182 I234 L389 Y444	L48-L178 HydrophobicContact CD1-CB 4.11Å; W91-L178 HydrophobicContact CH2-CD1 4.12Å; W91-L178 HydrophobicContact CZ3-CD1 3.59Å; T174-L178 HydrophobicContact CG2-CD1 3.88Å; T174-L178 HydrophobicContact CG2-CG 4.16Å; T174-L178 WeakPolarHBondContact O-CB 3.5Å; T174-L178 VanDerWaalsContact O-CG 3.31Å; T174-L178 WeakPolarHBondContact O-CG 3.31Å; T174-L178 PolarHBondContact O-N 3.49Å; L178-L181 HydrophobicContact CD2-CD2 4.44Å; L178-S182 PolarHBondContact O-N 3.47Å; L178-S182 VanDerWaalsContact O-N 3.1Å; L178-S182 PolarHBondContact O-OG 2.95Å; L178-I234 HydrophobicContact CD2-CD1 3.99Å; L178-I234 HydrophobicContact CG-CD1 4.4Å; L178-L389 HydrophobicContact CD2-CD2 4.21Å; L178-Y444 HydrophobicContact CD2-CE1 4.18Å; L178-Y444 WeakPolarHBondContact CD2-OH 3.47Å
179	F	91.5	Very high	85.5	Confident	51 Å²	51	26.7 Å²	26.7	22%	0.224	13%	0.134	C	C	.	.	H	α-helix	trans	-64.1	-43.6	169.9	178.2	-99	0	0	0	111.8	C45 L48 R49 S175 L176 F177 S182 L183	C45-F179 HydrophobicContact CB-CD2 4.26Å; C45-F179 HydrophobicContact CB-CE2 4Å; L48-F179 HydrophobicContact CB-CB 4.23Å; L48-F179 HydrophobicContact CB-CD2 4.02Å; L48-F179 HydrophobicContact CD1-CB 3.86Å; R49-F179 HydrophobicContact CB-CE2 4.23Å; S175-F179 WeakPolarHBondContact O-CB 3.26Å; S175-F179 PolarHBondContact O-N 2.99Å; L176-F179 PolarHBondContact O-N 3.21Å; F177-F179 VanDerWaalsContact C-N 3.34Å; F179-S182 PolarHBondContact O-N 2.85Å; F179-L183 HydrophobicContact CD1-CD1 4.12Å; F179-L183 HydrophobicContact CE1-CD1 3.57Å; F179-L183 HydrophobicContact CE1-CG 4.25Å; F179-L183 HydrophobicContact CZ-CD1 3.99Å; F179-L183 HydrophobicContact CZ-CD2 4.45Å; F179-L183 HydrophobicContact CZ-CG 4.35Å; F179-L183 WeakPolarHBondContact O-CG 3.37Å; F179-L183 PolarHBondContact O-N 3.48Å; F179-L183 VanDerWaalsContact O-N 3.15Å
180	N	94.1	Very high	87.9	Confident	10 Å²	10	23.6 Å²	23.6	5%	0.053	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-41.6	177.8	-166.6	78.1	0	0	0	112.7	L176 F177 L183 A184 V226 T230 L259 W263	L176-N180 PolarHBondContact O-N 3.11Å; F177-N180 PolarHBondContact O-N 2.93Å; N180-L183 PolarHBondContact O-N 3.29Å; N180-A184 PolarHBondContact O-N 3.2Å; N180-V226 WeakPolarHBondContact ND2-CG1 3.43Å; N180-T230 HydrophobicContact CB-CG2 4.45Å; N180-T230 PolarHBondContact ND2-OG1 3.08Å; N180-L259 HydrophobicContact CB-CD1 4.01Å; N180-L259 HydrophobicContact CB-CD2 3.68Å; N180-L259 HydrophobicContact CB-CG 4.5Å; N180-L259 VanDerWaalsContact CG-CD2 3.5Å; N180-W263 PolarHBondContact OD1-NE1 3.2Å
181	L	94.5	Very high	90.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.4	-50	175.4	-178	64.8	0	0	0	111.1	F177 L178 L183 A184 D185 T230	F177-L181 WeakPolarHBondContact O-CB 3.27Å; F177-L181 PolarHBondContact O-N 3.23Å; L178-L181 HydrophobicContact CD2-CD2 4.44Å; L181-L183 PolarHBondContact O-N 3.43Å; L181-A184 PolarHBondContact O-N 3.32Å; L181-A184 VanDerWaalsContact O-N 3.07Å; L181-D185 PolarHBondContact O-N 3.45Å; L181-T230 HydrophobicContact CB-CG2 4Å
182	S	95.1	Very high	92	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.7	-24.6	177.4	-73.6	0	0	0	0	113.8	N41 V44 C45 L178 F179 I186	N41-S182 WeakPolarHBondContact OD1-CB 3.23Å; N41-S182 PolarHBondContact OD1-OG 3.49Å; V44-S182 WeakPolarHBondContact CG1-OG 3.15Å; C45-S182 WeakPolarHBondContact SG-CB 3.35Å; L178-S182 PolarHBondContact O-N 3.47Å; L178-S182 VanDerWaalsContact O-N 3.1Å; L178-S182 PolarHBondContact O-OG 2.95Å; F179-S182 PolarHBondContact O-N 2.85Å; S182-I186 WeakPolarHBondContact O-CB 3.19Å; S182-I186 VanDerWaalsContact O-CD1 3.3Å; S182-I186 WeakPolarHBondContact O-CD1 3.38Å; S182-I186 WeakPolarHBondContact O-CG1 3.32Å; S182-I186 PolarHBondContact O-N 2.92Å; S182-I186 VanDerWaalsContact O-N 3.12Å
183	L	94.5	Very high	93.2	Very high	71 Å²	71	20 Å²	20	37%	0.372	11%	0.106	S	C	.	.	H	α-helix	trans	-71.4	-40.3	170.5	-71.6	178.2	0	0	0	112.5	F179 N180 L181 I186 L187	F179-L183 HydrophobicContact CD1-CD1 4.12Å; F179-L183 HydrophobicContact CE1-CD1 3.57Å; F179-L183 HydrophobicContact CE1-CG 4.25Å; F179-L183 HydrophobicContact CZ-CD1 3.99Å; F179-L183 HydrophobicContact CZ-CD2 4.45Å; F179-L183 HydrophobicContact CZ-CG 4.35Å; F179-L183 WeakPolarHBondContact O-CG 3.37Å; F179-L183 PolarHBondContact O-N 3.48Å; F179-L183 VanDerWaalsContact O-N 3.15Å; N180-L183 PolarHBondContact O-N 3.29Å; L181-L183 PolarHBondContact O-N 3.43Å; L183-I186 PolarHBondContact O-N 2.76Å; L183-L187 PolarHBondContact O-N 2.94Å
184	A	96	Very high	93.8	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67	-41.7	175.5	0	0	0	0	0	111.8	N180 L181 I186 L187 M188 S223 V226 S227	N180-A184 PolarHBondContact O-N 3.2Å; L181-A184 PolarHBondContact O-N 3.32Å; L181-A184 VanDerWaalsContact O-N 3.07Å; A184-I186 VanDerWaalsContact C-N 3.32Å; A184-I186 PolarHBondContact O-N 2.94Å; A184-L187 PolarHBondContact O-N 2.68Å; A184-M188 PolarHBondContact O-N 3Å; A184-S223 VanDerWaalsContact CA-OG 3.29Å; A184-S223 WeakPolarHBondContact CA-OG 3.24Å; A184-S223 WeakPolarHBondContact CB-OG 3.37Å; A184-S223 PolarHBondContact O-OG 2.99Å; A184-V226 HydrophobicContact CB-CB 4.13Å; A184-V226 HydrophobicContact CB-CG1 3.86Å; A184-S227 WeakPolarHBondContact CB-OG 3.33Å
185	D	96.4	Very high	94.3	Very high	7 Å²	7	22.6 Å²	22.6	4%	0.037	12%	0.121	C	C	.	.	H	α-helix	trans	-63.4	-36.2	175.4	-66.9	-12.8	0	0	0	111.9	N41 L181 A189 T437 N440	N41-D185 WeakPolarHBondContact ND2-CB 3.28Å; L181-D185 PolarHBondContact O-N 3.45Å; D185-A189 VanDerWaalsContact O-CB 3.3Å; D185-A189 WeakPolarHBondContact O-CB 3.37Å; D185-A189 PolarHBondContact O-N 3.4Å; D185-T437 HydrophobicContact CB-CG2 4.36Å; D185-N440 PolarHBondContact OD2-ND2 3.46Å
186	I	96.4	Very high	94.7	Very high	36 Å²	36	23.1 Å²	23.1	19%	0.185	12%	0.124	C	C	.	.	H	α-helix	trans	-67	-44.1	172.3	-72.3	164.6	0	0	0	111.3	N41 S182 L183 A184 M188 A189 V190	N41-I186 HydrophobicContact CB-CD1 4.01Å; N41-I186 HydrophobicContact CB-CG1 3.71Å; S182-I186 WeakPolarHBondContact O-CB 3.19Å; S182-I186 VanDerWaalsContact O-CD1 3.3Å; S182-I186 WeakPolarHBondContact O-CD1 3.38Å; S182-I186 WeakPolarHBondContact O-CG1 3.32Å; S182-I186 PolarHBondContact O-N 2.92Å; S182-I186 VanDerWaalsContact O-N 3.12Å; L183-I186 PolarHBondContact O-N 2.76Å; A184-I186 VanDerWaalsContact C-N 3.32Å; A184-I186 PolarHBondContact O-N 2.94Å; I186-M188 VanDerWaalsContact C-N 3.33Å; I186-M188 PolarHBondContact O-N 3.05Å; I186-A189 PolarHBondContact O-N 2.96Å; I186-V190 HydrophobicContact CG2-CG2 4.06Å; I186-V190 WeakPolarHBondContact O-CB 3.26Å; I186-V190 WeakPolarHBondContact O-CG2 3.36Å; I186-V190 PolarHBondContact O-N 3.31Å
187	L	95.3	Very high	95.1	Very high	56 Å²	56	22.8 Å²	22.8	29%	0.293	12%	0.123	S	C	.	.	H	α-helix	trans	-58.9	-45.9	177.7	175.9	59.8	0	0	0	111	L183 A184 L191	L183-L187 PolarHBondContact O-N 2.94Å; A184-L187 PolarHBondContact O-N 2.68Å; L187-L191 HydrophobicContact CD1-CB 4.36Å; L187-L191 HydrophobicContact CD1-CD2 4.15Å; L187-L191 WeakPolarHBondContact O-CB 3.25Å; L187-L191 PolarHBondContact O-N 3.33Å
188	M	95.8	Very high	95.2	Very high	7 Å²	7	25 Å²	25	3%	0.034	13%	0.134	C	C	.	.	I	π-helix	trans	-57.5	-53.3	173.1	-77.3	-58.4	-58.6	0	0	111.7	A184 I186 V190 C192 I193 Q220 D434 T437	A184-M188 PolarHBondContact O-N 3Å; I186-M188 VanDerWaalsContact C-N 3.33Å; I186-M188 PolarHBondContact O-N 3.05Å; M188-V190 PolarHBondContact O-N 2.9Å; M188-C192 HydrophobicContact CE-CB 3.62Å; M188-C192 WeakPolarHBondContact O-CA 3.42Å; M188-C192 WeakPolarHBondContact O-CB 3.29Å; M188-C192 PolarHBondContact O-N 2.67Å; M188-C192 HydrophobicContact SD-CB 3.87Å; M188-C192 VanDerWaalsContact SD-SG 3.68Å; M188-I193 WeakPolarHBondContact O-CG1 3.31Å; M188-I193 PolarHBondContact O-N 3.36Å; M188-Q220 HydrophobicContact CE-CG 4.06Å; M188-Q220 HydrophobicContact SD-CB 4.41Å; M188-Q220 HydrophobicContact SD-CG 4.28Å; M188-D434 WeakPolarHBondContact CE-OD1 3.33Å; M188-T437 HydrophobicContact CB-CG2 3.89Å
189	A	97.1	Very high	95.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.138	C	C	.	.	I	π-helix	trans	-69.7	-27.8	-172.5	0	0	0	0	0	114.6	I34 A37 V38 D185 I186 I193	I34-A189 WeakPolarHBondContact CG2-O 3.27Å; A37-A189 HydrophobicContact CB-CB 3.68Å; V38-A189 HydrophobicContact CG2-CB 3.74Å; D185-A189 VanDerWaalsContact O-CB 3.3Å; D185-A189 WeakPolarHBondContact O-CB 3.37Å; D185-A189 PolarHBondContact O-N 3.4Å; I186-A189 PolarHBondContact O-N 2.96Å; A189-I193 HydrophobicContact CB-CD1 4.11Å
190	V	96.5	Very high	95.1	Very high	89 Å²	89	25.4 Å²	25.4	54%	0.539	14%	0.137	S	C	.	.	I	π-helix	trans	-89	-36.8	179.5	176.9	0	0	0	0	112.6	V38 I186 M188	V38-V190 HydrophobicContact CG1-CG2 4.49Å; V38-V190 HydrophobicContact CG2-CG2 3.65Å; I186-V190 HydrophobicContact CG2-CG2 4.06Å; I186-V190 WeakPolarHBondContact O-CB 3.26Å; I186-V190 WeakPolarHBondContact O-CG2 3.36Å; I186-V190 PolarHBondContact O-N 3.31Å; M188-V190 PolarHBondContact O-N 2.9Å
191	L	95	Very high	95.1	Very high	47 Å²	47	25 Å²	25	25%	0.246	14%	0.136	C	C	.	.	I	π-helix	trans	-106.4	-47	-173.6	-178.7	59.5	0	0	0	113.4	L187 M195 A219	L187-L191 HydrophobicContact CD1-CB 4.36Å; L187-L191 HydrophobicContact CD1-CD2 4.15Å; L187-L191 WeakPolarHBondContact O-CB 3.25Å; L187-L191 PolarHBondContact O-N 3.33Å; L191-M195 WeakPolarHBondContact O-CG 3.48Å; L191-A219 HydrophobicContact CD2-CB 3.69Å
192	C	96.7	Very high	95	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.153	C	C	.	.	I	π-helix	trans	-84.9	-52.3	-168.4	-51.9	0	0	0	0	112	M188 M195 N196 Q220	M188-C192 HydrophobicContact CE-CB 3.62Å; M188-C192 WeakPolarHBondContact O-CA 3.42Å; M188-C192 WeakPolarHBondContact O-CB 3.29Å; M188-C192 PolarHBondContact O-N 2.67Å; M188-C192 HydrophobicContact SD-CB 3.87Å; M188-C192 VanDerWaalsContact SD-SG 3.68Å; C192-M195 PolarHBondContact O-N 2.83Å; C192-N196 PolarHBondContact O-N 2.97Å; C192-N196 PolarHBondContact O-OD1 3.42Å; C192-Q220 HydrophobicContact CB-CB 4.27Å
193	I	96.7	Very high	94.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-56.8	-48.1	-177.1	-50.7	-178.5	0	0	0	112.3	F30 V33 I34 M188 A189 M195 N196 V197 D434	F30-I193 HydrophobicContact CD1-CG2 3.49Å; F30-I193 VanDerWaalsContact CD1-CG2 3.49Å; F30-I193 HydrophobicContact CE1-CG2 4Å; V33-I193 HydrophobicContact CG1-CD1 4.33Å; I34-I193 HydrophobicContact CD1-CB 4.15Å; I34-I193 HydrophobicContact CD1-CG2 3.8Å; I34-I193 HydrophobicContact CG1-CB 3.9Å; I34-I193 HydrophobicContact CG1-CD1 4.32Å; I34-I193 HydrophobicContact CG1-CG2 3.73Å; M188-I193 WeakPolarHBondContact O-CG1 3.31Å; M188-I193 PolarHBondContact O-N 3.36Å; A189-I193 HydrophobicContact CB-CD1 4.11Å; I193-M195 VanDerWaalsContact C-N 3.32Å; I193-M195 PolarHBondContact O-N 3.48Å; I193-N196 PolarHBondContact O-N 2.85Å; I193-V197 HydrophobicContact CG2-CG2 4.41Å; I193-V197 WeakPolarHBondContact O-CG2 3.33Å; I193-V197 PolarHBondContact O-N 3.34Å; I193-D434 HydrophobicContact CD1-CB 3.88Å; I193-D434 HydrophobicContact CG1-CB 3.96Å; I193-D434 WeakPolarHBondContact CG1-OD1 3.5Å; I193-D434 HydrophobicContact CG2-CB 4.35Å
194	P	96.3	Very high	94.6	Very high	36 Å²	36	33.1 Å²	33.1	23%	0.234	17%	0.17	C	C	.	.	H	α-helix	trans	-63.8	-37.9	-177.5	-20.9	33.8	0	0	0	112.6	I34 V197 I198	I34-P194 HydrophobicContact CD1-CB 4.48Å; I34-P194 HydrophobicContact CD1-CG 3.92Å; P194-V197 PolarHBondContact O-N 3.3Å; P194-I198 WeakPolarHBondContact O-CD1 3.28Å; P194-I198 VanDerWaalsContact O-CG1 3.28Å; P194-I198 WeakPolarHBondContact O-CG1 3.3Å; P194-I198 PolarHBondContact O-N 2.83Å; P194-I198 VanDerWaalsContact O-N 3.09Å
195	M	95	Very high	94.3	Very high	41 Å²	41	36.7 Å²	36.7	20%	0.202	18%	0.184	C	C	.	.	H	α-helix	trans	-71.7	-42.8	-179.7	-59.9	-59.7	175.5	0	0	111.1	L191 C192 I193 V197 I198 T199 L208 V216	L191-M195 WeakPolarHBondContact O-CG 3.48Å; C192-M195 PolarHBondContact O-N 2.83Å; I193-M195 VanDerWaalsContact C-N 3.32Å; I193-M195 PolarHBondContact O-N 3.48Å; M195-V197 VanDerWaalsContact C-N 3.29Å; M195-V197 PolarHBondContact O-N 3.19Å; M195-I198 WeakPolarHBondContact O-CB 3.39Å; M195-I198 PolarHBondContact O-N 2.84Å; M195-I198 VanDerWaalsContact O-N 3.15Å; M195-I198 HydrophobicContact SD-CD1 4.21Å; M195-T199 WeakPolarHBondContact O-CG2 3.49Å; M195-T199 PolarHBondContact O-N 3.16Å; M195-T199 PolarHBondContact O-OG1 3.32Å; M195-L208 HydrophobicContact CB-CD1 4.02Å; M195-L208 HydrophobicContact CG-CD1 4.17Å; M195-L208 HydrophobicContact SD-CD1 3.48Å; M195-L208 WeakPolarHBondContact SD-CD1 3.48Å; M195-L208 HydrophobicContact SD-CD2 3.91Å; M195-L208 HydrophobicContact SD-CG 4.35Å; M195-V216 HydrophobicContact CB-CG1 3.88Å; M195-V216 HydrophobicContact CB-CG2 4.11Å; M195-V216 HydrophobicContact CG-CG2 3.98Å
196	N	93.9	Very high	94.2	Very high	13 Å²	13	37.2 Å²	37.2	7%	0.07	19%	0.185	C	C	.	.	H	α-helix	trans	-56.9	-42	173.1	-64.6	-8.8	0	0	0	111.7	C192 I193 T199 E200 Q220 R433	C192-N196 PolarHBondContact O-N 2.97Å; C192-N196 PolarHBondContact O-OD1 3.42Å; I193-N196 PolarHBondContact O-N 2.85Å; N196-T199 PolarHBondContact O-N 2.8Å; N196-E200 VanDerWaalsContact O-CB 3.28Å; N196-E200 WeakPolarHBondContact O-CB 3.42Å; N196-E200 PolarHBondContact O-N 2.99Å; N196-Q220 PolarHBondContact ND2-OE1 3.26Å; N196-R433 PolarHBondContact ND2-NH2 3.46Å
197	V	95.7	Very high	94.1	Very high	10 Å²	10	37.9 Å²	37.9	6%	0.061	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-41.1	177.2	172.3	0	0	0	0	111.6	V27 F30 I193 P194 M195 T199 I201 I202	V27-V197 HydrophobicContact CG2-CG1 3.88Å; F30-V197 HydrophobicContact CB-CG2 3.62Å; F30-V197 HydrophobicContact CD1-CG2 3.64Å; F30-V197 HydrophobicContact CD2-CG2 3.78Å; F30-V197 HydrophobicContact CE1-CG2 4.11Å; F30-V197 HydrophobicContact CE2-CG2 4.27Å; F30-V197 HydrophobicContact CG-CG2 3.42Å; F30-V197 VanDerWaalsContact CG-CG2 3.42Å; F30-V197 HydrophobicContact CZ-CG2 4.4Å; I193-V197 HydrophobicContact CG2-CG2 4.41Å; I193-V197 WeakPolarHBondContact O-CG2 3.33Å; I193-V197 PolarHBondContact O-N 3.34Å; P194-V197 PolarHBondContact O-N 3.3Å; M195-V197 VanDerWaalsContact C-N 3.29Å; M195-V197 PolarHBondContact O-N 3.19Å; V197-T199 PolarHBondContact O-N 2.95Å; V197-I201 HydrophobicContact CG1-CD1 4.48Å; V197-I201 HydrophobicContact CG2-CD1 4.29Å; V197-I201 WeakPolarHBondContact O-CB 3.33Å; V197-I201 PolarHBondContact O-N 2.82Å; V197-I202 HydrophobicContact CG1-CD1 4.21Å; V197-I202 HydrophobicContact CG1-CG1 4.38Å; V197-I202 PolarHBondContact O-N 3.37Å
198	I	94.9	Very high	94	Very high	46 Å²	46	37.2 Å²	37.2	24%	0.236	19%	0.188	C	C	.	.	I	π-helix	trans	-59.3	-46.6	175.2	-72.2	165.4	0	0	0	110.5	P194 M195 I202 Y203 P207 L208	P194-I198 WeakPolarHBondContact O-CD1 3.28Å; P194-I198 VanDerWaalsContact O-CG1 3.28Å; P194-I198 WeakPolarHBondContact O-CG1 3.3Å; P194-I198 PolarHBondContact O-N 2.83Å; P194-I198 VanDerWaalsContact O-N 3.09Å; M195-I198 WeakPolarHBondContact O-CB 3.39Å; M195-I198 PolarHBondContact O-N 2.84Å; M195-I198 VanDerWaalsContact O-N 3.15Å; M195-I198 HydrophobicContact SD-CD1 4.21Å; I198-I202 HydrophobicContact CG1-CD1 4.39Å; I198-Y203 HydrophobicContact CG2-CD2 3.75Å; I198-Y203 HydrophobicContact CG2-CE2 4.04Å; I198-Y203 WeakPolarHBondContact O-CD2 3.17Å; I198-Y203 PolarHBondContact O-N 3.4Å; I198-P207 HydrophobicContact CG2-CG 3.9Å; I198-L208 HydrophobicContact CG2-CD2 4.46Å
199	T	92.2	Very high	93.9	Very high	17 Å²	17	38.5 Å²	38.5	10%	0.104	20%	0.203	C	C	.	.	I	π-helix	trans	-89.2	-36.9	-171.1	60.9	0	0	0	0	114.5	M195 N196 V197 L204 W206 L208	M195-T199 WeakPolarHBondContact O-CG2 3.49Å; M195-T199 PolarHBondContact O-N 3.16Å; M195-T199 PolarHBondContact O-OG1 3.32Å; N196-T199 PolarHBondContact O-N 2.8Å; V197-T199 PolarHBondContact O-N 2.95Å; T199-L204 CarbonylContact O-C 3.46Å; T199-L204 WeakPolarHBondContact O-CA 3.24Å; T199-L204 PolarHBondContact O-N 3.33Å; T199-L204 VanDerWaalsContact O-N 3.12Å; T199-W206 HydrophobicContact CG2-CD2 4.19Å; T199-W206 HydrophobicContact CG2-CE3 3.59Å; T199-W206 HydrophobicContact CG2-CH2 4.35Å; T199-W206 HydrophobicContact CG2-CZ3 3.71Å; T199-L208 HydrophobicContact CG2-CD1 3.94Å
200	E	90	Very high	93.8	Very high	47 Å²	47	42.7 Å²	42.7	22%	0.22	22%	0.223	C	C	.	.	I	π-helix	trans	-92.4	-12.8	-177.4	-58.6	-169.7	146.5	0	0	114.2	N196 L204 W426 N430	N196-E200 VanDerWaalsContact O-CB 3.28Å; N196-E200 WeakPolarHBondContact O-CB 3.42Å; N196-E200 PolarHBondContact O-N 2.99Å; E200-L204 WeakPolarHBondContact O-CD2 3.39Å; E200-W426 PolarHBondContact OE1-NE1 3.48Å; E200-N430 VanDerWaalsContact CD-ND2 3.31Å; E200-N430 PolarHBondContact OE1-ND2 2.91Å; E200-N430 PolarHBondContact OE2-ND2 3.28Å
201	I	92.3	Very high	93.8	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.015	23%	0.225	C	C	.	.	I	π-helix	trans	-131	-42.3	-172.1	-47.5	-179.4	0	0	0	113.1	I23 L26 F30 V197	I23-I201 HydrophobicContact CG2-CG2 4.42Å; L26-I201 HydrophobicContact CB-CD1 4.28Å; L26-I201 HydrophobicContact CB-CG2 3.97Å; L26-I201 HydrophobicContact CD1-CD1 4.46Å; L26-I201 HydrophobicContact CD1-CG2 3.8Å; F30-I201 HydrophobicContact CD2-CD1 3.82Å; F30-I201 HydrophobicContact CE2-CD1 3.38Å; F30-I201 HydrophobicContact CZ-CD1 4.15Å; V197-I201 HydrophobicContact CG1-CD1 4.48Å; V197-I201 HydrophobicContact CG2-CD1 4.29Å; V197-I201 WeakPolarHBondContact O-CB 3.33Å; V197-I201 PolarHBondContact O-N 2.82Å
202	I	93.1	Very high	93.8	Very high	70 Å²	70	42.9 Å²	42.9	36%	0.359	23%	0.226	S	C	.	.	I	π-helix	trans	-84.8	-53.1	-176.9	-61.2	176.2	0	0	0	111.7	V27 V197 I198	V27-I202 HydrophobicContact CG2-CD1 3.88Å; V27-I202 HydrophobicContact CG2-CG1 3.77Å; V197-I202 HydrophobicContact CG1-CD1 4.21Å; V197-I202 HydrophobicContact CG1-CG1 4.38Å; V197-I202 PolarHBondContact O-N 3.37Å; I198-I202 HydrophobicContact CG1-CD1 4.39Å
203	Y	90.9	Very high	93.8	Very high	114 Å²	114	42.9 Å²	42.9	45%	0.447	23%	0.226	S	C	.	.	I	π-helix	trans	-102.7	-31.9	-173.3	-71.1	-77.1	0	0	0	114.5	I198 W205 P207	I198-Y203 HydrophobicContact CG2-CD2 3.75Å; I198-Y203 HydrophobicContact CG2-CE2 4.04Å; I198-Y203 WeakPolarHBondContact O-CD2 3.17Å; I198-Y203 PolarHBondContact O-N 3.4Å; Y203-W205 AromaticContact CD1-CE2 3.83Å; Y203-W205 AromaticContact CD1-CZ2 3.71Å; Y203-W205 HydrophobicContact CD1-CZ2 3.71Å; Y203-W205 AromaticContact CD1-NE1 3.94Å; Y203-W205 HydrophobicContact CE1-CZ2 4.21Å; Y203-W205 HydrophobicContact CG-CZ2 4.44Å; Y203-W205 PolarHBondContact O-N 2.77Å; Y203-W205 VanDerWaalsContact O-N 3.07Å; Y203-P207 HydrophobicContact CD2-CG 3.86Å; Y203-P207 HydrophobicContact CE2-CG 4.24Å; Y203-P207 HydrophobicContact CG-CG 4.23Å
204	L	90.5	Very high	93.7	Very high	56 Å²	56	45.4 Å²	45.4	29%	0.293	24%	0.237	S	C	.	.	S	Bend	trans	66.3	-8.6	-170.3	-46.4	-179	0	0	0	115.1	L16 P17 F18 T199 E200 I423	L16-L204 HydrophobicContact CD1-CD1 4.08Å; P17-L204 HydrophobicContact CG-CD1 3.58Å; F18-L204 HydrophobicContact CD2-CD2 4.46Å; T199-L204 CarbonylContact O-C 3.46Å; T199-L204 WeakPolarHBondContact O-CA 3.24Å; T199-L204 PolarHBondContact O-N 3.33Å; T199-L204 VanDerWaalsContact O-N 3.12Å; E200-L204 WeakPolarHBondContact O-CD2 3.39Å; L204-I423 HydrophobicContact CD2-CD1 3.93Å
205	W	90.6	Very high	93.7	Very high	75 Å²	75	47.7 Å²	47.7	28%	0.284	25%	0.247	S	C	.	.	S	Bend	trans	-118.5	-176.8	168	57.6	-92.2	0	0	0	111.5	Y203 P207 E285 F287	Y203-W205 AromaticContact CD1-CE2 3.83Å; Y203-W205 AromaticContact CD1-CZ2 3.71Å; Y203-W205 HydrophobicContact CD1-CZ2 3.71Å; Y203-W205 AromaticContact CD1-NE1 3.94Å; Y203-W205 HydrophobicContact CE1-CZ2 4.21Å; Y203-W205 HydrophobicContact CG-CZ2 4.44Å; Y203-W205 PolarHBondContact O-N 2.77Å; Y203-W205 VanDerWaalsContact O-N 3.07Å; W205-P207 HydrophobicContact CE3-CB 4.14Å; W205-P207 HydrophobicContact CH2-CB 3.83Å; W205-P207 VanDerWaalsContact CZ3-CA 3.46Å; W205-P207 HydrophobicContact CZ3-CB 3.56Å; W205-P207 HydrophobicContact CZ3-CG 4.48Å; W205-P207 WeakPolarHBondContact O-CD 3.3Å; W205-E285 HydrophobicContact CB-CB 4.25Å; W205-E285 HydrophobicContact CG-CB 4.35Å; W205-E285 HydrophobicContact CG-CG 4.4Å; W205-F287 HydrophobicContact CB-CD1 4.36Å; W205-F287 HydrophobicContact CB-CE1 3.98Å; W205-F287 HydrophobicContact CB-CZ 4.33Å
206	W	93.5	Very high	93.8	Very high	19 Å²	19	45.9 Å²	45.9	7%	0.072	24%	0.237	C	C	.	.			trans	-108.2	89.1	-172.1	-170.2	-86.6	0	0	0	113.1	T199 L208 G209 L212 C213 V216 T286 C288	T199-W206 HydrophobicContact CG2-CD2 4.19Å; T199-W206 HydrophobicContact CG2-CE3 3.59Å; T199-W206 HydrophobicContact CG2-CH2 4.35Å; T199-W206 HydrophobicContact CG2-CZ3 3.71Å; W206-L208 VanDerWaalsContact C-N 3.29Å; W206-L208 HydrophobicContact CH2-CD1 4.01Å; W206-L208 HydrophobicContact CZ2-CB 3.78Å; W206-L208 HydrophobicContact CZ2-CD1 3.77Å; W206-L208 HydrophobicContact CZ2-CG 4.34Å; W206-L208 PolarHBondContact O-N 3.37Å; W206-G209 PolarHBondContact NE1-O 3.45Å; W206-L212 HydrophobicContact CZ2-CB 3.95Å; W206-L212 WeakPolarHBondContact CZ2-O 3.37Å; W206-C213 HydrophobicContact CD2-CB 4.36Å; W206-C213 VanDerWaalsContact CZ2-CA 3.43Å; W206-C213 HydrophobicContact CZ2-CB 4.12Å; W206-V216 HydrophobicContact CH2-CB 4.16Å; W206-V216 HydrophobicContact CH2-CG2 4.44Å; W206-T286 WeakPolarHBondContact CA-O 3.42Å; W206-T286 VanDerWaalsContact CB-O 3.3Å; W206-T286 WeakPolarHBondContact CB-O 3.23Å; W206-T286 PolarHBondContact N-O 3.42Å; W206-T286 PolarHBondContact O-OG1 3.21Å; W206-C288 HydrophobicContact CB-CB 4.02Å; W206-C288 HydrophobicContact CD2-CB 3.5Å; W206-C288 VanDerWaalsContact CD2-CB 3.5Å; W206-C288 HydrophobicContact CE3-CB 3.56Å; W206-C288 HydrophobicContact CG-CB 3.65Å; W206-C288 HydrophobicContact CZ3-CB 4.39Å
207	P	93.6	Very high	93.8	Very high	50 Å²	50	46.8 Å²	46.8	33%	0.325	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-6.7	178.3	29.9	-36.4	0	0	0	114.8	I198 Y203 W205 G209	I198-P207 HydrophobicContact CG2-CG 3.9Å; Y203-P207 HydrophobicContact CD2-CG 3.86Å; Y203-P207 HydrophobicContact CE2-CG 4.24Å; Y203-P207 HydrophobicContact CG-CG 4.23Å; W205-P207 HydrophobicContact CE3-CB 4.14Å; W205-P207 HydrophobicContact CH2-CB 3.83Å; W205-P207 VanDerWaalsContact CZ3-CA 3.46Å; W205-P207 HydrophobicContact CZ3-CB 3.56Å; W205-P207 HydrophobicContact CZ3-CG 4.48Å; W205-P207 WeakPolarHBondContact O-CD 3.3Å; P207-G209 PolarHBondContact O-N 3.48Å
208	L	94	Very high	93.9	Very high	41 Å²	41	48.7 Å²	48.7	22%	0.215	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	2.3	-163.7	-57.5	170.8	0	0	0	114.5	M195 I198 T199 W206 L212	M195-L208 HydrophobicContact CB-CD1 4.02Å; M195-L208 HydrophobicContact CG-CD1 4.17Å; M195-L208 HydrophobicContact SD-CD1 3.48Å; M195-L208 WeakPolarHBondContact SD-CD1 3.48Å; M195-L208 HydrophobicContact SD-CD2 3.91Å; M195-L208 HydrophobicContact SD-CG 4.35Å; I198-L208 HydrophobicContact CG2-CD2 4.46Å; T199-L208 HydrophobicContact CG2-CD1 3.94Å; W206-L208 VanDerWaalsContact C-N 3.29Å; W206-L208 HydrophobicContact CH2-CD1 4.01Å; W206-L208 HydrophobicContact CZ2-CB 3.78Å; W206-L208 HydrophobicContact CZ2-CD1 3.77Å; W206-L208 HydrophobicContact CZ2-CG 4.34Å; W206-L208 PolarHBondContact O-N 3.37Å; L208-L212 HydrophobicContact CB-CB 3.87Å; L208-L212 HydrophobicContact CB-CD1 3.86Å; L208-L212 HydrophobicContact CD2-CD1 4.43Å
209	G	94.1	Very high	94	Very high	34 Å²	34	47 Å²	47	35%	0.351	24%	0.244	S	C	.	.	H	α-helix	trans	70.5	169.5	-178.1	0	0	0	0	0	114.8	W206 P207 L212 C213	W206-G209 PolarHBondContact NE1-O 3.45Å; P207-G209 PolarHBondContact O-N 3.48Å; G209-L212 PolarHBondContact O-N 3.23Å; G209-C213 PolarHBondContact O-N 3.34Å
210	E	94.1	Very high	94.1	Very high	88 Å²	88	48.2 Å²	48.2	41%	0.411	25%	0.248	S	C	.	.	H	α-helix	trans	-61	-40.9	-174	-158.6	-176	158	0	0	115	L212 C213 K214 T279	E210-L212 VanDerWaalsContact C-N 3.29Å; E210-L212 PolarHBondContact O-N 3.09Å; E210-C213 WeakPolarHBondContact O-CB 3.21Å; E210-C213 PolarHBondContact O-N 2.91Å; E210-C213 VanDerWaalsContact O-N 3.08Å; E210-K214 PolarHBondContact O-N 3.46Å; E210-K214 VanDerWaalsContact O-N 3.1Å; E210-K214 WeakPolarHBondContact OE1-CE 3.31Å; E210-K214 IonicContact OE1-NZ 2.73Å; E210-T279 HydrophobicContact CB-CG2 4.33Å; E210-T279 WeakPolarHBondContact CB-OG1 3.44Å
211	P	96.3	Very high	94.4	Very high	90 Å²	90	46.7 Å²	46.7	58%	0.584	25%	0.245	S	C	*	.	H	α-helix	trans	-58.8	-39.9	-179	-26.8	36.2	0	0	0	112.9	K214 I215	P211-K214 PolarHBondContact O-N 3.36Å; P211-I215 WeakPolarHBondContact O-CB 3.3Å; P211-I215 WeakPolarHBondContact O-CD1 3.31Å; P211-I215 WeakPolarHBondContact O-CG1 3.33Å; P211-I215 PolarHBondContact O-N 2.88Å
212	L	95.9	Very high	94.6	Very high	51 Å²	51	46.9 Å²	46.9	27%	0.267	25%	0.246	S	C	.	.	H	α-helix	trans	-76.7	-30.1	177.2	-69.8	174.2	0	0	0	112.4	W206 L208 G209 E210 K214 I215 V216	W206-L212 HydrophobicContact CZ2-CB 3.95Å; W206-L212 WeakPolarHBondContact CZ2-O 3.37Å; L208-L212 HydrophobicContact CB-CB 3.87Å; L208-L212 HydrophobicContact CB-CD1 3.86Å; L208-L212 HydrophobicContact CD2-CD1 4.43Å; G209-L212 PolarHBondContact O-N 3.23Å; E210-L212 VanDerWaalsContact C-N 3.29Å; E210-L212 PolarHBondContact O-N 3.09Å; L212-K214 PolarHBondContact O-N 2.84Å; L212-I215 PolarHBondContact O-N 3.23Å; L212-V216 HydrophobicContact CB-CG2 4.28Å; L212-V216 HydrophobicContact CD2-CG2 4.2Å; L212-V216 WeakPolarHBondContact O-CB 3.19Å; L212-V216 WeakPolarHBondContact O-CG2 3.35Å; L212-V216 PolarHBondContact O-N 3.41Å
213	C	96	Very high	94.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.3	-34.4	171	170.3	0	0	0	0	111.4	W206 G209 E210 P217 N277 R278 T279 C288	W206-C213 HydrophobicContact CD2-CB 4.36Å; W206-C213 VanDerWaalsContact CZ2-CA 3.43Å; W206-C213 HydrophobicContact CZ2-CB 4.12Å; G209-C213 PolarHBondContact O-N 3.34Å; E210-C213 WeakPolarHBondContact O-CB 3.21Å; E210-C213 PolarHBondContact O-N 2.91Å; E210-C213 VanDerWaalsContact O-N 3.08Å; C213-P217 WeakPolarHBondContact O-CD 3.28Å; C213-P217 WeakPolarHBondContact O-CG 3.49Å; C213-N277 WeakPolarHBondContact O-CB 3.5Å; C213-R278 VanDerWaalsContact SG-C 3.55Å; C213-T279 HydrophobicContact CB-CG2 3.9Å; C213-C288 WeakPolarHBondContact CA-SG 3.17Å; C213-C288 HydrophobicContact CB-CB 3.78Å; C213-C288 WeakPolarHBondContact CB-SG 3.15Å; C213-C288 VanDerWaalsContact SG-CA 3.6Å; C213-C288 WeakPolarHBondContact SG-CB 3.43Å; C213-C288 CovalentContact SG-SG 2.03Å; C213-C288 PolarHBondContact SG-SG 3.15Å
214	K	95.8	Very high	94.9	Very high	52 Å²	52	38.6 Å²	38.6	23%	0.226	21%	0.211	C	C	.	.	H	α-helix	trans	-81	-42.2	173.1	-66.1	179.5	177.3	-61.7	0	113.2	E210 P211 L212 Y218 P274 I275 N277	E210-K214 PolarHBondContact O-N 3.46Å; E210-K214 VanDerWaalsContact O-N 3.1Å; E210-K214 WeakPolarHBondContact OE1-CE 3.31Å; E210-K214 IonicContact OE1-NZ 2.73Å; P211-K214 PolarHBondContact O-N 3.36Å; L212-K214 PolarHBondContact O-N 2.84Å; K214-Y218 WeakPolarHBondContact O-CB 3.32Å; K214-P274 HydrophobicContact CB-CB 4.06Å; K214-P274 WeakPolarHBondContact CD-O 3.45Å; K214-P274 WeakPolarHBondContact CG-O 3.47Å; K214-P274 PolarHBondContact NZ-O 2.94Å; K214-I275 PolarHBondContact NZ-O 3.01Å; K214-N277 WeakPolarHBondContact CE-O 3.4Å; K214-N277 VanDerWaalsContact CG-O 3.3Å; K214-N277 WeakPolarHBondContact CG-O 3.26Å; K214-N277 PolarHBondContact NZ-O 3.19Å
215	I	96.1	Very high	95.2	Very high	85 Å²	85	36 Å²	36	44%	0.436	20%	0.197	S	C	.	.	H	α-helix	trans	-76.7	-42.7	-171.8	-70.7	165.1	0	0	0	113.2	P211 L212 Y218 A219	P211-I215 WeakPolarHBondContact O-CB 3.3Å; P211-I215 WeakPolarHBondContact O-CD1 3.31Å; P211-I215 WeakPolarHBondContact O-CG1 3.33Å; P211-I215 PolarHBondContact O-N 2.88Å; L212-I215 PolarHBondContact O-N 3.23Å; I215-Y218 PolarHBondContact O-N 3.1Å; I215-A219 VanDerWaalsContact O-CB 3.31Å; I215-A219 WeakPolarHBondContact O-CB 3.36Å; I215-A219 PolarHBondContact O-N 2.94Å
216	V	96	Very high	95.5	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-68.6	-49.3	-171.5	174.4	0	0	0	0	112.2	M195 W206 L212 Y218 A219 Q220	M195-V216 HydrophobicContact CB-CG1 3.88Å; M195-V216 HydrophobicContact CB-CG2 4.11Å; M195-V216 HydrophobicContact CG-CG2 3.98Å; W206-V216 HydrophobicContact CH2-CB 4.16Å; W206-V216 HydrophobicContact CH2-CG2 4.44Å; L212-V216 HydrophobicContact CB-CG2 4.28Å; L212-V216 HydrophobicContact CD2-CG2 4.2Å; L212-V216 WeakPolarHBondContact O-CB 3.19Å; L212-V216 WeakPolarHBondContact O-CG2 3.35Å; L212-V216 PolarHBondContact O-N 3.41Å; V216-Y218 VanDerWaalsContact C-N 3.3Å; V216-Y218 PolarHBondContact O-N 3.36Å; V216-A219 PolarHBondContact O-N 3.46Å; V216-Q220 WeakPolarHBondContact O-CB 3.42Å; V216-Q220 PolarHBondContact O-N 3.43Å
217	P	94.8	Very high	95.6	Very high	32 Å²	32	32 Å²	32	21%	0.208	18%	0.183	C	C	.	.	H	α-helix	trans	-63.1	-36.8	176.2	-22.9	36.2	0	0	0	112.4	C213 Q220 G221 V273	C213-P217 WeakPolarHBondContact O-CD 3.28Å; C213-P217 WeakPolarHBondContact O-CG 3.49Å; P217-Q220 PolarHBondContact O-N 2.63Å; P217-G221 PolarHBondContact O-N 2.97Å; P217-V273 HydrophobicContact CB-CG1 3.66Å
218	Y	96.6	Very high	95.7	Very high	50 Å²	50	29.6 Å²	29.6	20%	0.196	17%	0.168	C	C	.	.	H	α-helix	trans	-63.6	-50.6	175.2	178.8	-111.8	0	0	0	111.9	K214 I215 V216 Q220 G221 V222 L267 P270 L271 P274	K214-Y218 WeakPolarHBondContact O-CB 3.32Å; I215-Y218 PolarHBondContact O-N 3.1Å; V216-Y218 VanDerWaalsContact C-N 3.3Å; V216-Y218 PolarHBondContact O-N 3.36Å; Y218-Q220 VanDerWaalsContact C-N 3.3Å; Y218-Q220 PolarHBondContact O-N 2.92Å; Y218-G221 PolarHBondContact O-N 3.26Å; Y218-G221 VanDerWaalsContact O-N 3.13Å; Y218-V222 HydrophobicContact CD1-CG2 4.25Å; Y218-V222 HydrophobicContact CD2-CG2 4.2Å; Y218-V222 HydrophobicContact CE1-CG2 3.89Å; Y218-V222 HydrophobicContact CE2-CG2 3.83Å; Y218-V222 HydrophobicContact CG-CG2 4.4Å; Y218-V222 VanDerWaalsContact O-CG2 3.29Å; Y218-V222 WeakPolarHBondContact O-CG2 3.28Å; Y218-V222 PolarHBondContact O-N 3.46Å; Y218-L267 WeakPolarHBondContact OH-CD2 3.15Å; Y218-L267 PolarHBondContact OH-O 3.5Å; Y218-P270 HydrophobicContact CD2-CB 3.86Å; Y218-P270 WeakPolarHBondContact CD2-O 3.45Å; Y218-P270 HydrophobicContact CE2-CB 3.95Å; Y218-L271 HydrophobicContact CE2-CD2 4.29Å; Y218-P274 HydrophobicContact CD2-CG 3.98Å; Y218-P274 HydrophobicContact CG-CG 4.16Å
219	A	96.9	Very high	95.8	Very high	11 Å²	11	29 Å²	29	9%	0.091	16%	0.164	C	C	.	.	H	α-helix	trans	-62	-37.1	178.6	0	0	0	0	0	112.4	L191 I215 V216 S223	L191-A219 HydrophobicContact CD2-CB 3.69Å; I215-A219 VanDerWaalsContact O-CB 3.31Å; I215-A219 WeakPolarHBondContact O-CB 3.36Å; I215-A219 PolarHBondContact O-N 2.94Å; V216-A219 PolarHBondContact O-N 3.46Å; A219-S223 WeakPolarHBondContact O-CB 3.39Å; A219-S223 PolarHBondContact O-N 2.88Å
220	Q	95.6	Very high	95.9	Very high	43 Å²	43	27.3 Å²	27.3	20%	0.201	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-48.4	171.6	175.7	159.3	-88.6	0	0	111.6	M188 C192 N196 V216 P217 Y218 S223 V224	M188-Q220 HydrophobicContact CE-CG 4.06Å; M188-Q220 HydrophobicContact SD-CB 4.41Å; M188-Q220 HydrophobicContact SD-CG 4.28Å; C192-Q220 HydrophobicContact CB-CB 4.27Å; N196-Q220 PolarHBondContact ND2-OE1 3.26Å; V216-Q220 WeakPolarHBondContact O-CB 3.42Å; V216-Q220 PolarHBondContact O-N 3.43Å; P217-Q220 PolarHBondContact O-N 2.63Å; Y218-Q220 VanDerWaalsContact C-N 3.3Å; Y218-Q220 PolarHBondContact O-N 2.92Å; Q220-S223 PolarHBondContact O-N 3.13Å; Q220-V224 WeakPolarHBondContact O-CB 3.19Å; Q220-V224 VanDerWaalsContact O-CG2 3.32Å; Q220-V224 WeakPolarHBondContact O-CG2 3.39Å; Q220-V224 PolarHBondContact O-N 3.41Å
221	G	95.3	Very high	95.9	Very high	15 Å²	15	23.6 Å²	23.6	16%	0.155	13%	0.13	C	C	.	.	H	α-helix	trans	-57.1	-54.8	175.3	0	0	0	0	0	112.2	P217 Y218 S223 V224 F225	P217-G221 PolarHBondContact O-N 2.97Å; Y218-G221 PolarHBondContact O-N 3.26Å; Y218-G221 VanDerWaalsContact O-N 3.13Å; G221-S223 VanDerWaalsContact C-N 3.33Å; G221-S223 PolarHBondContact O-N 3.27Å; G221-V224 PolarHBondContact O-N 3.14Å; G221-F225 VanDerWaalsContact O-CD2 3.29Å; G221-F225 WeakPolarHBondContact O-CD2 3.23Å; G221-F225 PolarHBondContact O-N 3.42Å
222	V	97	Very high	95.8	Very high	6 Å²	6	20.4 Å²	20.4	4%	0.036	11%	0.109	C	C	.	.	H	α-helix	trans	-52.4	-50.6	178.5	174.7	0	0	0	0	110.8	Y218 F225 V226 W263 A266 L267 P270	Y218-V222 HydrophobicContact CD1-CG2 4.25Å; Y218-V222 HydrophobicContact CD2-CG2 4.2Å; Y218-V222 HydrophobicContact CE1-CG2 3.89Å; Y218-V222 HydrophobicContact CE2-CG2 3.83Å; Y218-V222 HydrophobicContact CG-CG2 4.4Å; Y218-V222 VanDerWaalsContact O-CG2 3.29Å; Y218-V222 WeakPolarHBondContact O-CG2 3.28Å; Y218-V222 PolarHBondContact O-N 3.46Å; V222-F225 PolarHBondContact O-N 3.15Å; V222-V226 HydrophobicContact CG1-CG2 4.43Å; V222-V226 WeakPolarHBondContact O-CG2 3.18Å; V222-V226 PolarHBondContact O-N 3.28Å; V222-W263 HydrophobicContact CG1-CZ3 4.17Å; V222-A266 WeakPolarHBondContact CA-O 3.37Å; V222-A266 HydrophobicContact CG1-CB 4.44Å; V222-A266 WeakPolarHBondContact CG2-O 3.29Å; V222-L267 HydrophobicContact CG1-CD2 3.95Å; V222-L267 HydrophobicContact CG1-CG 4.42Å; V222-L267 HydrophobicContact CG2-CD2 4.08Å; V222-P270 HydrophobicContact CG2-CG 4.29Å
223	S	96.2	Very high	95.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-70.5	-36.2	-174.5	-146.4	0	0	0	0	113	A184 A219 Q220 G221 F225 V226 S227	A184-S223 VanDerWaalsContact CA-OG 3.29Å; A184-S223 WeakPolarHBondContact CA-OG 3.24Å; A184-S223 WeakPolarHBondContact CB-OG 3.37Å; A184-S223 PolarHBondContact O-OG 2.99Å; A219-S223 WeakPolarHBondContact O-CB 3.39Å; A219-S223 PolarHBondContact O-N 2.88Å; Q220-S223 PolarHBondContact O-N 3.13Å; G221-S223 VanDerWaalsContact C-N 3.33Å; G221-S223 PolarHBondContact O-N 3.27Å; S223-F225 PolarHBondContact O-N 2.95Å; S223-V226 PolarHBondContact O-N 2.94Å; S223-S227 PolarHBondContact O-N 2.93Å; S223-S227 PolarHBondContact O-OG 3.38Å
224	V	94.6	Very high	95.7	Very high	11 Å²	11	19 Å²	19	7%	0.067	10%	0.102	C	C	.	.	H	α-helix	trans	-61.5	-43.1	172.1	169.8	0	0	0	0	110.9	Q220 G221 S227 A228 Q342	Q220-V224 WeakPolarHBondContact O-CB 3.19Å; Q220-V224 VanDerWaalsContact O-CG2 3.32Å; Q220-V224 WeakPolarHBondContact O-CG2 3.39Å; Q220-V224 PolarHBondContact O-N 3.41Å; G221-V224 PolarHBondContact O-N 3.14Å; V224-S227 PolarHBondContact O-N 2.95Å; V224-A228 VanDerWaalsContact O-CB 3.25Å; V224-A228 WeakPolarHBondContact O-CB 3.42Å; V224-A228 PolarHBondContact O-N 3.3Å; V224-Q342 HydrophobicContact CG1-CB 4.27Å; V224-Q342 HydrophobicContact CG1-CG 4.25Å
225	F	96.5	Very high	95.5	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.009	9%	0.091	C	C	.	.	H	α-helix	trans	-63.7	-42.7	174.1	-85.7	-71.7	0	0	0	112.9	G221 V222 S223 A228 L229 A266 I269 P270 L338 L341 Q342	G221-F225 VanDerWaalsContact O-CD2 3.29Å; G221-F225 WeakPolarHBondContact O-CD2 3.23Å; G221-F225 PolarHBondContact O-N 3.42Å; V222-F225 PolarHBondContact O-N 3.15Å; S223-F225 PolarHBondContact O-N 2.95Å; F225-A228 PolarHBondContact O-N 3.38Å; F225-L229 WeakPolarHBondContact O-CB 3.35Å; F225-L229 VanDerWaalsContact O-CG 3.32Å; F225-L229 WeakPolarHBondContact O-CG 3.48Å; F225-L229 PolarHBondContact O-N 3.33Å; F225-A266 HydrophobicContact CB-CB 3.55Å; F225-I269 HydrophobicContact CD1-CD1 4.32Å; F225-I269 HydrophobicContact CE1-CD1 4.08Å; F225-I269 HydrophobicContact CE1-CG2 4.1Å; F225-I269 HydrophobicContact CE2-CB 4.33Å; F225-I269 HydrophobicContact CE2-CG2 3.76Å; F225-I269 HydrophobicContact CZ-CB 4.28Å; F225-I269 HydrophobicContact CZ-CG2 3.49Å; F225-I269 VanDerWaalsContact CZ-CG2 3.49Å; F225-P270 HydrophobicContact CD2-CG 3.8Å; F225-P270 HydrophobicContact CE2-CG 4.08Å; F225-L338 HydrophobicContact CE2-CD2 3.95Å; F225-L338 HydrophobicContact CZ-CD2 3.9Å; F225-L341 HydrophobicContact CE1-CB 3.8Å; F225-L341 HydrophobicContact CZ-CB 4.16Å; F225-Q342 HydrophobicContact CD1-CB 4.09Å; F225-Q342 HydrophobicContact CE1-CB 3.66Å; F225-Q342 HydrophobicContact CE2-CB 4.27Å; F225-Q342 HydrophobicContact CZ-CB 3.75Å
226	V	97.1	Very high	95.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.4	-47.4	176.8	175.7	0	0	0	0	110.8	N180 A184 V222 S223 T230 V262 W263 A266	N180-V226 WeakPolarHBondContact ND2-CG1 3.43Å; A184-V226 HydrophobicContact CB-CB 4.13Å; A184-V226 HydrophobicContact CB-CG1 3.86Å; V222-V226 HydrophobicContact CG1-CG2 4.43Å; V222-V226 WeakPolarHBondContact O-CG2 3.18Å; V222-V226 PolarHBondContact O-N 3.28Å; S223-V226 PolarHBondContact O-N 2.94Å; V226-T230 WeakPolarHBondContact O-CB 3.35Å; V226-T230 PolarHBondContact O-N 3.29Å; V226-T230 PolarHBondContact O-OG1 3.07Å; V226-V262 HydrophobicContact CG1-CG1 4.35Å; V226-W263 HydrophobicContact CG1-CZ2 3.98Å; V226-W263 HydrophobicContact CG2-CD2 3.89Å; V226-W263 HydrophobicContact CG2-CE3 3.79Å; V226-W263 HydrophobicContact CG2-CH2 4.08Å; V226-W263 HydrophobicContact CG2-CZ2 4.16Å; V226-W263 HydrophobicContact CG2-CZ3 3.89Å; V226-A266 HydrophobicContact CG2-CB 3.51Å
227	S	95.5	Very high	95.1	Very high	9 Å²	9	18.6 Å²	18.6	6%	0.063	9%	0.094	C	C	.	.	H	α-helix	trans	-64.8	-46.1	178	-68.2	0	0	0	0	112	A184 S223 V224 L229 T230 H231	A184-S227 WeakPolarHBondContact CB-OG 3.33Å; S223-S227 PolarHBondContact O-N 2.93Å; S223-S227 PolarHBondContact O-OG 3.38Å; V224-S227 PolarHBondContact O-N 2.95Å; S227-L229 PolarHBondContact O-N 2.98Å; S227-T230 PolarHBondContact O-N 3.24Å; S227-H231 PolarHBondContact O-CD2 2.93Å; S227-H231 PolarHBondContact O-N 2.67Å
228	A	95.4	Very high	94.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-56.3	-52.3	178.5	0	0	0	0	0	112.6	V224 F225 H231 V232 Q342 P346 Y396	V224-A228 VanDerWaalsContact O-CB 3.25Å; V224-A228 WeakPolarHBondContact O-CB 3.42Å; V224-A228 PolarHBondContact O-N 3.3Å; F225-A228 PolarHBondContact O-N 3.38Å; A228-H231 PolarHBondContact O-N 2.95Å; A228-V232 PolarHBondContact O-N 3.38Å; A228-Q342 WeakPolarHBondContact CB-O 3.45Å; A228-P346 HydrophobicContact CB-CB 4.3Å; A228-P346 HydrophobicContact CB-CG 4.18Å; A228-Y396 WeakPolarHBondContact CB-OH 3.25Å
229	L	96.2	Very high	94.5	Very high	27 Å²	27	17.1 Å²	17.1	14%	0.141	9%	0.085	C	C	.	.	H	α-helix	trans	-72.4	-29.4	-179.3	-62	174.4	0	0	0	111.9	F225 S227 V232 L233 V262 L265	F225-L229 WeakPolarHBondContact O-CB 3.35Å; F225-L229 VanDerWaalsContact O-CG 3.32Å; F225-L229 WeakPolarHBondContact O-CG 3.48Å; F225-L229 PolarHBondContact O-N 3.33Å; S227-L229 PolarHBondContact O-N 2.98Å; L229-V232 WeakPolarHBondContact O-CB 3.29Å; L229-V232 PolarHBondContact O-N 2.92Å; L229-L233 WeakPolarHBondContact O-CG 3.33Å; L229-L233 PolarHBondContact O-N 3.33Å; L229-V262 HydrophobicContact CB-CB 4.35Å; L229-V262 HydrophobicContact CB-CG1 3.79Å; L229-V262 HydrophobicContact CB-CG2 3.74Å; L229-V262 HydrophobicContact CD1-CG1 4.29Å; L229-V262 HydrophobicContact CD1-CG2 4.47Å; L229-L265 HydrophobicContact CD1-CB 4.18Å
230	T	95.8	Very high	94.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66.5	-38.6	172.5	-60.2	0	0	0	0	111.4	F177 N180 L181 V226 S227 V232 L233 I234	F177-T230 HydrophobicContact CB-CG2 4.01Å; F177-T230 WeakPolarHBondContact O-CG2 3.35Å; N180-T230 HydrophobicContact CB-CG2 4.45Å; N180-T230 PolarHBondContact ND2-OG1 3.08Å; L181-T230 HydrophobicContact CB-CG2 4Å; V226-T230 WeakPolarHBondContact O-CB 3.35Å; V226-T230 PolarHBondContact O-N 3.29Å; V226-T230 PolarHBondContact O-OG1 3.07Å; S227-T230 PolarHBondContact O-N 3.24Å; T230-V232 VanDerWaalsContact C-N 3.33Å; T230-V232 PolarHBondContact O-N 2.94Å; T230-L233 PolarHBondContact O-N 2.79Å; T230-I234 HydrophobicContact CG2-CD1 4.16Å; T230-I234 VanDerWaalsContact O-CG1 3.31Å; T230-I234 WeakPolarHBondContact O-CG1 3.29Å; T230-I234 PolarHBondContact O-N 2.8Å
231	H	94	Very high	93.6	Very high	10 Å²	10	18.1 Å²	18.1	5%	0.046	9%	0.089	C	C	.	.	H	α-helix	trans	-62.1	-38.5	172.3	-70.1	-52.4	0	0	0	112.5	S227 A228 I234 S235 I350 V392 Y396	S227-H231 PolarHBondContact O-CD2 2.93Å; S227-H231 PolarHBondContact O-N 2.67Å; A228-H231 PolarHBondContact O-N 2.95Å; H231-I234 PolarHBondContact O-N 2.85Å; H231-S235 PolarHBondContact O-N 3.38Å; H231-I350 HydrophobicContact CB-CD1 3.58Å; H231-I350 HydrophobicContact CB-CG1 4.49Å; H231-V392 WeakPolarHBondContact CE1-CG1 3.34Å; H231-Y396 AromaticContact CD2-CD2 3.69Å; H231-Y396 AromaticContact CD2-CG 3.64Å; H231-Y396 AromaticContact NE2-CD2 3.65Å; H231-Y396 AromaticContact NE2-CG 3.77Å
232	V	95.7	Very high	93.1	Very high	22 Å²	22	18.4 Å²	18.4	13%	0.133	9%	0.088	C	C	.	.	H	α-helix	trans	-61.7	-46.3	172.6	172.1	0	0	0	0	111.3	A228 L229 T230 I234 S235 W236 P346 M349 I350	A228-V232 PolarHBondContact O-N 3.38Å; L229-V232 WeakPolarHBondContact O-CB 3.29Å; L229-V232 PolarHBondContact O-N 2.92Å; T230-V232 VanDerWaalsContact C-N 3.33Å; T230-V232 PolarHBondContact O-N 2.94Å; V232-I234 VanDerWaalsContact C-N 3.29Å; V232-I234 PolarHBondContact O-N 2.88Å; V232-S235 PolarHBondContact O-N 3.43Å; V232-S235 PolarHBondContact O-OG 2.94Å; V232-W236 VanDerWaalsContact O-CB 3.23Å; V232-W236 WeakPolarHBondContact O-CB 3.41Å; V232-W236 PolarHBondContact O-N 3.38Å; V232-P346 HydrophobicContact CG2-CB 3.84Å; V232-M349 HydrophobicContact CB-CE 4.32Å; V232-M349 HydrophobicContact CG1-CE 3.63Å; V232-M349 HydrophobicContact CG1-SD 4.43Å; V232-M349 HydrophobicContact CG2-CE 3.69Å; V232-I350 HydrophobicContact CG2-CD1 4.07Å; V232-I350 HydrophobicContact CG2-CG1 4.06Å
233	L	95.1	Very high	92.6	Very high	18 Å²	18	21.7 Å²	21.7	9%	0.094	10%	0.1	C	C	.	.	H	α-helix	trans	-61.1	-38.2	176.5	-69.5	-175.5	0	0	0	112.3	F177 L229 T230 D237 L258 L259 V262	F177-L233 HydrophobicContact CD1-CB 4.34Å; F177-L233 HydrophobicContact CD1-CD1 4.25Å; F177-L233 HydrophobicContact CD2-CB 4.28Å; F177-L233 HydrophobicContact CE1-CB 4.2Å; F177-L233 HydrophobicContact CE1-CD1 3.89Å; F177-L233 HydrophobicContact CE2-CB 4.12Å; F177-L233 HydrophobicContact CG-CB 4.39Å; F177-L233 HydrophobicContact CZ-CB 4.08Å; F177-L233 HydrophobicContact CZ-CD1 4.37Å; L229-L233 WeakPolarHBondContact O-CG 3.33Å; L229-L233 PolarHBondContact O-N 3.33Å; T230-L233 PolarHBondContact O-N 2.79Å; L233-D237 WeakPolarHBondContact O-CB 3.31Å; L233-D237 PolarHBondContact O-N 3.14Å; L233-L258 HydrophobicContact CD1-CB 3.9Å; L233-L258 HydrophobicContact CD2-CB 4.06Å; L233-L258 HydrophobicContact CD2-CD1 4.12Å; L233-L258 HydrophobicContact CD2-CD2 4.34Å; L233-L258 HydrophobicContact CD2-CG 4.41Å; L233-L259 HydrophobicContact CD1-CD2 4.15Å; L233-V262 HydrophobicContact CD1-CG2 3.67Å; L233-V262 HydrophobicContact CG-CG2 4.24Å
234	I	92.7	Very high	92.1	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	12%	0.117	C	C	.	.	H	α-helix	trans	-64.5	-48.5	175.1	-70.5	167.2	0	0	0	111.2	T174 F177 L178 T230 H231 V232 R238 L389	T174-I234 HydrophobicContact CG2-CG1 4.34Å; T174-I234 HydrophobicContact CG2-CG2 4.23Å; F177-I234 HydrophobicContact CB-CD1 3.97Å; F177-I234 HydrophobicContact CB-CG1 3.5Å; F177-I234 VanDerWaalsContact CB-CG1 3.5Å; F177-I234 HydrophobicContact CD2-CG1 4.06Å; F177-I234 HydrophobicContact CG-CG1 4.19Å; L178-I234 HydrophobicContact CD2-CD1 3.99Å; L178-I234 HydrophobicContact CG-CD1 4.4Å; T230-I234 HydrophobicContact CG2-CD1 4.16Å; T230-I234 VanDerWaalsContact O-CG1 3.31Å; T230-I234 WeakPolarHBondContact O-CG1 3.29Å; T230-I234 PolarHBondContact O-N 2.8Å; H231-I234 PolarHBondContact O-N 2.85Å; V232-I234 VanDerWaalsContact C-N 3.29Å; V232-I234 PolarHBondContact O-N 2.88Å; I234-R238 VanDerWaalsContact O-CG 3.3Å; I234-R238 WeakPolarHBondContact O-CG 3.07Å; I234-R238 PolarHBondContact O-N 3.33Å; I234-R238 VanDerWaalsContact O-N 3.11Å; I234-L389 HydrophobicContact CG2-CB 4.29Å; I234-L389 HydrophobicContact CG2-CD1 4.02Å; I234-L389 HydrophobicContact CG2-CD2 4.05Å; I234-L389 HydrophobicContact CG2-CG 4.34Å
235	S	92.7	Very high	91.3	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.007	15%	0.145	C	C	.	.	H	α-helix	trans	-69.1	-36	-177.8	81.7	0	0	0	0	111.8	H231 V232 F239 T353	H231-S235 PolarHBondContact O-N 3.38Å; V232-S235 PolarHBondContact O-N 3.43Å; V232-S235 PolarHBondContact O-OG 2.94Å; S235-F239 VanDerWaalsContact O-CB 3.28Å; S235-F239 WeakPolarHBondContact O-CB 3.04Å; S235-F239 PolarHBondContact O-N 3.43Å; S235-T353 VanDerWaalsContact CB-OG1 3.24Å; S235-T353 WeakPolarHBondContact CB-OG1 3.3Å; S235-T353 PolarHBondContact OG-OG1 3.48Å
236	W	92.8	Very high	90.6	Very high	127 Å²	127	38 Å²	38	48%	0.481	19%	0.188	S	C	.	.	H	α-helix	trans	-66.7	-45.8	175.1	-177.9	-116.9	0	0	0	113.4	V232 R238 F239 I240 T353	V232-W236 VanDerWaalsContact O-CB 3.23Å; V232-W236 WeakPolarHBondContact O-CB 3.41Å; V232-W236 PolarHBondContact O-N 3.38Å; W236-R238 VanDerWaalsContact C-N 3.35Å; W236-R238 PolarHBondContact O-N 3.2Å; W236-F239 AromaticContact CE3-CD1 3.89Å; W236-F239 HydrophobicContact CE3-CD1 3.89Å; W236-F239 HydrophobicContact CE3-CE1 4.48Å; W236-F239 HydrophobicContact CH2-CE1 4.46Å; W236-F239 AromaticContact CZ3-CD1 3.75Å; W236-F239 HydrophobicContact CZ3-CD1 3.75Å; W236-F239 AromaticContact CZ3-CE1 3.89Å; W236-F239 HydrophobicContact CZ3-CE1 3.89Å; W236-F239 WeakPolarHBondContact O-CB 3.48Å; W236-F239 PolarHBondContact O-N 3.44Å; W236-I240 HydrophobicContact CD2-CD1 4.36Å; W236-I240 HydrophobicContact CG-CD1 4.49Å; W236-I240 HydrophobicContact CZ2-CD1 4.2Å; W236-I240 WeakPolarHBondContact O-CG1 3.47Å; W236-I240 PolarHBondContact O-N 3.05Å; W236-T353 HydrophobicContact CE3-CG2 4.42Å
237	D	90.6	Very high	89.7	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-58.1	-46.1	174	165.9	67.8	0	0	0	111.4	T174 F177 L233 I240 L241 M250	T174-D237 PolarHBondContact OG1-OD2 2.99Å; F177-D237 HydrophobicContact CE2-CB 3.92Å; L233-D237 WeakPolarHBondContact O-CB 3.31Å; L233-D237 PolarHBondContact O-N 3.14Å; D237-I240 PolarHBondContact O-N 3.13Å; D237-L241 WeakPolarHBondContact O-CD1 3.15Å; D237-L241 VanDerWaalsContact O-CG 3.3Å; D237-L241 WeakPolarHBondContact O-CG 3.19Å; D237-L241 PolarHBondContact O-N 2.84Å; D237-M250 HydrophobicContact CB-CE 4.11Å
238	R	88.9	Confident	88.9	Confident	13 Å²	13	49.2 Å²	49.2	5%	0.049	25%	0.248	C	C	.	.	H	α-helix	trans	-69.6	-32.5	176.7	-62.8	-62	99.1	175.7	1	112.6	D93 T174 I234 W236 L241 V242 I357 M385 L389	D93-R238 IonicContact OD1-NH1 2.95Å; D93-R238 IonicContact OD1-NH2 2.66Å; D93-R238 PolarHBondContact OD1-NH2 3.48Å; T174-R238 PolarHBondContact OG1-NE 2.9Å; T174-R238 VanDerWaalsContact OG1-NE 3.16Å; T174-R238 PolarHBondContact OG1-NH2 2.95Å; I234-R238 VanDerWaalsContact O-CG 3.3Å; I234-R238 WeakPolarHBondContact O-CG 3.07Å; I234-R238 PolarHBondContact O-N 3.33Å; I234-R238 VanDerWaalsContact O-N 3.11Å; W236-R238 VanDerWaalsContact C-N 3.35Å; W236-R238 PolarHBondContact O-N 3.2Å; R238-L241 PolarHBondContact O-N 3.5Å; R238-V242 VanDerWaalsContact O-CG2 3.31Å; R238-V242 WeakPolarHBondContact O-CG2 3.29Å; R238-V242 PolarHBondContact O-N 3.46Å; R238-V242 VanDerWaalsContact O-N 3.11Å; R238-I357 HydrophobicContact CB-CD1 4.28Å; R238-M385 VanDerWaalsContact CD-CE 3.45Å; R238-M385 PolarHBondContact NH1-SD 3.25Å; R238-L389 HydrophobicContact CG-CD1 3.73Å
239	F	89.7	Confident	88	Confident	38 Å²	38	53 Å²	53	17%	0.167	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-50.8	173.1	171.5	-97.4	0	0	0	111.3	S235 W236 L241 V242 Y243 T353 A356 I357	S235-F239 VanDerWaalsContact O-CB 3.28Å; S235-F239 WeakPolarHBondContact O-CB 3.04Å; S235-F239 PolarHBondContact O-N 3.43Å; W236-F239 AromaticContact CE3-CD1 3.89Å; W236-F239 HydrophobicContact CE3-CD1 3.89Å; W236-F239 HydrophobicContact CE3-CE1 4.48Å; W236-F239 HydrophobicContact CH2-CE1 4.46Å; W236-F239 AromaticContact CZ3-CD1 3.75Å; W236-F239 HydrophobicContact CZ3-CD1 3.75Å; W236-F239 AromaticContact CZ3-CE1 3.89Å; W236-F239 HydrophobicContact CZ3-CE1 3.89Å; W236-F239 WeakPolarHBondContact O-CB 3.48Å; W236-F239 PolarHBondContact O-N 3.44Å; F239-L241 VanDerWaalsContact C-N 3.27Å; F239-L241 PolarHBondContact O-N 3.45Å; F239-V242 PolarHBondContact O-N 3Å; F239-Y243 AromaticContact CD2-CD2 3.65Å; F239-Y243 HydrophobicContact CD2-CD2 3.65Å; F239-Y243 AromaticContact CD2-CE2 3.83Å; F239-Y243 HydrophobicContact CD2-CE2 3.83Å; F239-Y243 HydrophobicContact CD2-CG 4.38Å; F239-Y243 HydrophobicContact CE2-CD1 4.3Å; F239-Y243 AromaticContact CE2-CD2 3.45Å; F239-Y243 HydrophobicContact CE2-CD2 3.45Å; F239-Y243 VanDerWaalsContact CE2-CD2 3.45Å; F239-Y243 HydrophobicContact CE2-CE1 4.32Å; F239-Y243 AromaticContact CE2-CE2 3.49Å; F239-Y243 HydrophobicContact CE2-CE2 3.49Å; F239-Y243 VanDerWaalsContact CE2-CE2 3.49Å; F239-Y243 AromaticContact CE2-CG 3.89Å; F239-Y243 HydrophobicContact CE2-CG 3.89Å; F239-Y243 AromaticContact CE2-CZ 3.93Å; F239-Y243 HydrophobicContact CG-CD2 4.42Å; F239-Y243 HydrophobicContact CZ-CD1 4.32Å; F239-Y243 HydrophobicContact CZ-CD2 4.1Å; F239-Y243 HydrophobicContact CZ-CE2 4.4Å; F239-Y243 HydrophobicContact CZ-CG 4.06Å; F239-Y243 WeakPolarHBondContact O-CB 3.47Å; F239-Y243 PolarHBondContact O-N 3.01Å; F239-T353 HydrophobicContact CB-CG2 4.11Å; F239-T353 HydrophobicContact CD2-CG2 4.37Å; F239-T353 HydrophobicContact CG-CG2 4.19Å; F239-A356 HydrophobicContact CD2-CB 4.2Å; F239-A356 HydrophobicContact CE2-CB 3.88Å; F239-I357 HydrophobicContact CB-CD1 4.14Å; F239-I357 HydrophobicContact CB-CG1 4.35Å; F239-I357 HydrophobicContact CD2-CG1 4.41Å
240	I	89.2	Confident	87.4	Confident	46 Å²	46	53.4 Å²	53.4	24%	0.236	26%	0.264	C	S	.	.	H	α-helix	trans	-54.6	-44.7	177	-72.2	171.7	0	0	0	111	W236 D237 V242 F244	W236-I240 HydrophobicContact CD2-CD1 4.36Å; W236-I240 HydrophobicContact CG-CD1 4.49Å; W236-I240 HydrophobicContact CZ2-CD1 4.2Å; W236-I240 WeakPolarHBondContact O-CG1 3.47Å; W236-I240 PolarHBondContact O-N 3.05Å; D237-I240 PolarHBondContact O-N 3.13Å; I240-V242 VanDerWaalsContact C-N 3.35Å; I240-V242 PolarHBondContact O-N 2.91Å; I240-F244 WeakPolarHBondContact O-CA 3.4Å; I240-F244 WeakPolarHBondContact O-CB 3.35Å; I240-F244 PolarHBondContact O-N 3.45Å
241	L	84.8	Confident	87	Confident	29 Å²	29	57.1 Å²	57.1	15%	0.152	29%	0.287	C	S	.	.	H	α-helix	trans	-76.4	-18.5	-175.3	-67.6	167.4	0	0	0	114.6	D237 R238 F239 R249	D237-L241 WeakPolarHBondContact O-CD1 3.15Å; D237-L241 VanDerWaalsContact O-CG 3.3Å; D237-L241 WeakPolarHBondContact O-CG 3.19Å; D237-L241 PolarHBondContact O-N 2.84Å; R238-L241 PolarHBondContact O-N 3.5Å; F239-L241 VanDerWaalsContact C-N 3.27Å; F239-L241 PolarHBondContact O-N 3.45Å; L241-R249 HydrophobicContact CD2-CB 4.3Å; L241-R249 VanDerWaalsContact CD2-CD 3.47Å; L241-R249 HydrophobicContact CD2-CG 3.59Å
242	V	83.6	Confident	86.5	Confident	21 Å²	21	61.3 Å²	61.3	13%	0.127	31%	0.306	C	S	.	.	H	α-helix	trans	-88.4	-39.7	172.4	169.4	0	0	0	0	111.4	R238 F239 I240 I357 K360 V361	R238-V242 VanDerWaalsContact O-CG2 3.31Å; R238-V242 WeakPolarHBondContact O-CG2 3.29Å; R238-V242 PolarHBondContact O-N 3.46Å; R238-V242 VanDerWaalsContact O-N 3.11Å; F239-V242 PolarHBondContact O-N 3Å; I240-V242 VanDerWaalsContact C-N 3.35Å; I240-V242 PolarHBondContact O-N 2.91Å; V242-I357 HydrophobicContact CB-CG1 4.31Å; V242-I357 HydrophobicContact CG1-CG1 4.45Å; V242-I357 HydrophobicContact CG1-CG2 4.32Å; V242-I357 HydrophobicContact CG2-CG1 4.43Å; V242-I357 HydrophobicContact CG2-CG2 4.16Å; V242-K360 HydrophobicContact CG1-CB 4.18Å; V242-K360 HydrophobicContact CG1-CG 3.96Å; V242-V361 HydrophobicContact CG1-CG2 3.91Å
243	Y	86.5	Confident	86.1	Confident	75 Å²	75	70.7 Å²	70.7	29%	0.294	34%	0.339	S	S	.	.	H	α-helix	trans	-83.2	-34.7	-177.7	-90.1	-104.2	0	0	0	114	F239 P245 A356 K360	F239-Y243 AromaticContact CD2-CD2 3.65Å; F239-Y243 HydrophobicContact CD2-CD2 3.65Å; F239-Y243 AromaticContact CD2-CE2 3.83Å; F239-Y243 HydrophobicContact CD2-CE2 3.83Å; F239-Y243 HydrophobicContact CD2-CG 4.38Å; F239-Y243 HydrophobicContact CE2-CD1 4.3Å; F239-Y243 AromaticContact CE2-CD2 3.45Å; F239-Y243 HydrophobicContact CE2-CD2 3.45Å; F239-Y243 VanDerWaalsContact CE2-CD2 3.45Å; F239-Y243 HydrophobicContact CE2-CE1 4.32Å; F239-Y243 AromaticContact CE2-CE2 3.49Å; F239-Y243 HydrophobicContact CE2-CE2 3.49Å; F239-Y243 VanDerWaalsContact CE2-CE2 3.49Å; F239-Y243 AromaticContact CE2-CG 3.89Å; F239-Y243 HydrophobicContact CE2-CG 3.89Å; F239-Y243 AromaticContact CE2-CZ 3.93Å; F239-Y243 HydrophobicContact CG-CD2 4.42Å; F239-Y243 HydrophobicContact CZ-CD1 4.32Å; F239-Y243 HydrophobicContact CZ-CD2 4.1Å; F239-Y243 HydrophobicContact CZ-CE2 4.4Å; F239-Y243 HydrophobicContact CZ-CG 4.06Å; F239-Y243 WeakPolarHBondContact O-CB 3.47Å; F239-Y243 PolarHBondContact O-N 3.01Å; Y243-P245 VanDerWaalsContact C-CD 3.43Å; Y243-P245 WeakPolarHBondContact O-CD 3.46Å; Y243-A356 HydrophobicContact CE2-CB 4.01Å; Y243-A356 WeakPolarHBondContact OH-CB 3.38Å; Y243-A356 PolarHBondContact OH-O 3.38Å; Y243-A356 VanDerWaalsContact OH-O 3.05Å; Y243-K360 HydrophobicContact CD2-CB 4.37Å; Y243-K360 HydrophobicContact CD2-CG 4.23Å; Y243-K360 HydrophobicContact CE1-CG 4.49Å; Y243-K360 HydrophobicContact CE2-CB 3.65Å; Y243-K360 HydrophobicContact CE2-CG 3.95Å
244	F	86.3	Confident	85.9	Confident	82 Å²	82	76.2 Å²	76.2	36%	0.36	36%	0.362	S	S	.	.			trans	-124.7	62.3	-173.5	-55.2	-69.5	0	0	0	112.6	I240 L246 K247	I240-F244 WeakPolarHBondContact O-CA 3.4Å; I240-F244 WeakPolarHBondContact O-CB 3.35Å; I240-F244 PolarHBondContact O-N 3.45Å; F244-L246 PolarHBondContact O-N 2.87Å; F244-K247 HydrophobicContact CB-CB 3.92Å; F244-K247 HydrophobicContact CB-CD 3.69Å; F244-K247 HydrophobicContact CB-CG 3.83Å; F244-K247 HydrophobicContact CD1-CD 4.01Å; F244-K247 HydrophobicContact CD2-CD 4.3Å; F244-K247 HydrophobicContact CG-CD 3.75Å; F244-K247 HydrophobicContact CG-CG 4.38Å; F244-K247 PolarHBondContact O-N 2.89Å
245	P	78.7	Confident	85.9	Confident	99 Å²	99	76 Å²	76	64%	0.643	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-17.8	-175.8	26.4	-36.2	0	0	0	114.6	Y243	Y243-P245 VanDerWaalsContact C-CD 3.43Å; Y243-P245 WeakPolarHBondContact O-CD 3.46Å
246	L	80.3	Confident	85.8	Confident	174 Å²	174	79.4 Å²	79.4	91%	0.911	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-9.9	177.2	-58.5	179.1	0	0	0	114	F244	F244-L246 PolarHBondContact O-N 2.87Å
247	K	80.1	Confident	85.9	Confident	119 Å²	119	78.6 Å²	78.6	52%	0.517	38%	0.383	S	S	.	.	S	Bend	trans	-75.9	144.3	174.4	-76.2	-175.8	-174.6	168.3	0	109.6	F244 R249	F244-K247 HydrophobicContact CB-CB 3.92Å; F244-K247 HydrophobicContact CB-CD 3.69Å; F244-K247 HydrophobicContact CB-CG 3.83Å; F244-K247 HydrophobicContact CD1-CD 4.01Å; F244-K247 HydrophobicContact CD2-CD 4.3Å; F244-K247 HydrophobicContact CG-CD 3.75Å; F244-K247 HydrophobicContact CG-CG 4.38Å; F244-K247 PolarHBondContact O-N 2.89Å; K247-R249 PolarHBondContact O-N 3.47Å
248	P	77.5	Confident	86.1	Confident	125 Å²	125	81.1 Å²	81.1	81%	0.812	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-60.5	134.2	176.2	26	-34.3	0	0	0	110
249	R	77.2	Confident	86.4	Confident	80 Å²	80	81.3 Å²	81.3	30%	0.302	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-64.8	155.2	-177.8	-56.4	-161.4	177.5	166	15.1	111.3	D93 E94 I173 L241 K247 T251	D93-R249 IonicContact OD1-NH1 3.2Å; D93-R249 PolarHBondContact OD1-NH1 2.93Å; E94-R249 PolarHBondContact O-NH1 2.78Å; E94-R249 PolarHBondContact O-NH2 3.46Å; E94-R249 VanDerWaalsContact O-NH2 3.1Å; I173-R249 HydrophobicContact CD1-CB 4.04Å; L241-R249 HydrophobicContact CD2-CB 4.3Å; L241-R249 VanDerWaalsContact CD2-CD 3.47Å; L241-R249 HydrophobicContact CD2-CG 3.59Å; K247-R249 PolarHBondContact O-N 3.47Å; R249-T251 PolarHBondContact O-N 3.03Å
250	M	84.2	Confident	86.7	Confident	36 Å²	36	84.2 Å²	84.2	18%	0.177	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-55.8	125.9	174.8	173.8	151.8	57	0	0	110.4	I173 F177 D237 K254 A255 L258	I173-M250 HydrophobicContact CD1-CB 4.19Å; I173-M250 WeakPolarHBondContact CD1-O 3.29Å; I173-M250 WeakPolarHBondContact CG1-O 3.42Å; I173-M250 HydrophobicContact CG2-CE 3.78Å; I173-M250 HydrophobicContact CG2-CG 4.41Å; F177-M250 HydrophobicContact CE2-CE 3.91Å; F177-M250 HydrophobicContact CZ-CE 3.69Å; D237-M250 HydrophobicContact CB-CE 4.11Å; M250-K254 HydrophobicContact CG-CB 3.85Å; M250-K254 HydrophobicContact SD-CB 4.26Å; M250-A255 HydrophobicContact CG-CB 4.3Å; M250-A255 HydrophobicContact SD-CB 4.45Å; M250-L258 HydrophobicContact CE-CD1 4.16Å; M250-L258 HydrophobicContact SD-CD1 3.42Å; M250-L258 WeakPolarHBondContact SD-CD1 3.45Å
251	T	85.4	Confident	87.1	Confident	78 Å²	78	84.8 Å²	84.8	48%	0.479	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-73.6	150.9	179.1	62.8	0	0	0	0	110.4	R249 R253 K254 A255	R249-T251 PolarHBondContact O-N 3.03Å; T251-R253 PolarHBondContact O-N 3.23Å; T251-R253 VanDerWaalsContact O-N 3.1Å; T251-K254 WeakPolarHBondContact O-CA 3.32Å; T251-K254 WeakPolarHBondContact O-CB 3.44Å; T251-K254 PolarHBondContact O-N 3.48Å; T251-A255 PolarHBondContact O-N 2.73Å
252	Q	84	Confident	87.7	Confident	97 Å²	97	83.8 Å²	83.8	45%	0.453	42%	0.416	S	S	.	.	H	α-helix	trans	-53.6	-34.9	178.2	-162.9	-175.3	-5.6	0	0	112.3	L176 A255 I256	L176-Q252 HydrophobicContact CD1-CG 3.77Å; Q252-A255 PolarHBondContact O-N 3.29Å; Q252-I256 HydrophobicContact CG-CD1 4.17Å; Q252-I256 VanDerWaalsContact O-CG1 3.29Å; Q252-I256 WeakPolarHBondContact O-CG1 3.33Å; Q252-I256 PolarHBondContact O-N 3.07Å
253	R	88.1	Confident	88.3	Confident	220 Å²	220	86.4 Å²	86.4	83%	0.83	42%	0.424	S	S	*	.	H	α-helix	trans	-61.7	-43.3	173.4	-65.3	-175.5	-177.3	176.5	-0.2	112.9	T251 L257	T251-R253 PolarHBondContact O-N 3.23Å; T251-R253 VanDerWaalsContact O-N 3.1Å; R253-L257 WeakPolarHBondContact O-CB 3.46Å; R253-L257 PolarHBondContact O-N 2.95Å
254	K	91.4	Very high	88.8	Confident	133 Å²	133	87.7 Å²	87.7	58%	0.578	44%	0.435	S	S	*	.	H	α-helix	trans	-67.3	-40.1	176.3	-74.2	-172	179.1	-167.2	0	111.5	M250 T251 L257 L258	M250-K254 HydrophobicContact CG-CB 3.85Å; M250-K254 HydrophobicContact SD-CB 4.26Å; T251-K254 WeakPolarHBondContact O-CA 3.32Å; T251-K254 WeakPolarHBondContact O-CB 3.44Å; T251-K254 PolarHBondContact O-N 3.48Å; K254-L257 PolarHBondContact O-N 3.35Å; K254-L258 WeakPolarHBondContact O-CG 3.46Å; K254-L258 PolarHBondContact O-N 3.24Å
255	A	91	Very high	89.3	Confident	0 Å²	0	88 Å²	88	0%	0	44%	0.44	C	S	.	.	H	α-helix	trans	-63.9	-41.3	176.4	0	0	0	0	0	112.5	I173 L176 F177 M250 T251 Q252 L258 L259	I173-A255 HydrophobicContact CG2-CB 3.85Å; L176-A255 HydrophobicContact CD1-CB 3.76Å; F177-A255 HydrophobicContact CE1-CB 4.08Å; F177-A255 HydrophobicContact CZ-CB 4.01Å; M250-A255 HydrophobicContact CG-CB 4.3Å; M250-A255 HydrophobicContact SD-CB 4.45Å; T251-A255 PolarHBondContact O-N 2.73Å; Q252-A255 PolarHBondContact O-N 3.29Å; A255-L258 PolarHBondContact O-N 3.12Å; A255-L259 PolarHBondContact O-N 3.41Å
256	I	91.7	Very high	90.2	Very high	73 Å²	73	83.2 Å²	83.2	37%	0.374	41%	0.409	S	S	.	.	H	α-helix	trans	-64.6	-42.9	173.6	-68.6	165.6	0	0	0	111	L176 Q252 L258 L259 L260	L176-I256 HydrophobicContact CD1-CG1 3.96Å; Q252-I256 HydrophobicContact CG-CD1 4.17Å; Q252-I256 VanDerWaalsContact O-CG1 3.29Å; Q252-I256 WeakPolarHBondContact O-CG1 3.33Å; Q252-I256 PolarHBondContact O-N 3.07Å; I256-L258 VanDerWaalsContact C-N 3.33Å; I256-L258 PolarHBondContact O-N 2.73Å; I256-L259 PolarHBondContact O-N 2.93Å; I256-L260 HydrophobicContact CG2-CD1 4.3Å; I256-L260 WeakPolarHBondContact O-CG 3.28Å; I256-L260 PolarHBondContact O-N 3.38Å
257	L	94.2	Very high	91	Very high	110 Å²	110	78.2 Å²	78.2	58%	0.576	38%	0.383	S	S	*	.	H	α-helix	trans	-60.6	-41.4	176.1	-178.7	61.4	0	0	0	112.1	R253 K254 L260 T261	R253-L257 WeakPolarHBondContact O-CB 3.46Å; R253-L257 PolarHBondContact O-N 2.95Å; K254-L257 PolarHBondContact O-N 3.35Å; L257-L260 PolarHBondContact O-N 3.43Å; L257-T261 PolarHBondContact O-N 3Å; L257-T261 PolarHBondContact O-OG1 3.24Å
258	L	95.7	Very high	91.8	Very high	55 Å²	55	77.3 Å²	77.3	29%	0.288	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-41.3	175.2	-71.9	169.6	0	0	0	112.1	L233 M250 K254 A255 I256 L260 T261 V262	L233-L258 HydrophobicContact CD1-CB 3.9Å; L233-L258 HydrophobicContact CD2-CB 4.06Å; L233-L258 HydrophobicContact CD2-CD1 4.12Å; L233-L258 HydrophobicContact CD2-CD2 4.34Å; L233-L258 HydrophobicContact CD2-CG 4.41Å; M250-L258 HydrophobicContact CE-CD1 4.16Å; M250-L258 HydrophobicContact SD-CD1 3.42Å; M250-L258 WeakPolarHBondContact SD-CD1 3.45Å; K254-L258 WeakPolarHBondContact O-CG 3.46Å; K254-L258 PolarHBondContact O-N 3.24Å; A255-L258 PolarHBondContact O-N 3.12Å; I256-L258 VanDerWaalsContact C-N 3.33Å; I256-L258 PolarHBondContact O-N 2.73Å; L258-L260 VanDerWaalsContact C-N 3.34Å; L258-L260 PolarHBondContact O-N 2.95Å; L258-T261 WeakPolarHBondContact CA-OG1 3.37Å; L258-T261 PolarHBondContact O-N 3.44Å; L258-T261 PolarHBondContact O-OG1 3.14Å; L258-V262 WeakPolarHBondContact O-CG2 3.4Å; L258-V262 PolarHBondContact O-N 2.79Å
259	L	95.4	Very high	92.7	Very high	18 Å²	18	73.4 Å²	73.4	9%	0.094	35%	0.354	C	S	.	.	H	α-helix	trans	-62.1	-40.4	173	-75.8	179.2	0	0	0	112.3	L176 F177 N180 L233 A255 I256 T261 V262 W263	L176-L259 HydrophobicContact CB-CD1 4.23Å; F177-L259 HydrophobicContact CD1-CD1 4.1Å; F177-L259 HydrophobicContact CD1-CD2 3.79Å; F177-L259 HydrophobicContact CD1-CG 3.87Å; F177-L259 HydrophobicContact CE1-CD1 4.47Å; F177-L259 HydrophobicContact CE1-CD2 4.27Å; F177-L259 HydrophobicContact CE1-CG 4.01Å; N180-L259 HydrophobicContact CB-CD1 4.01Å; N180-L259 HydrophobicContact CB-CD2 3.68Å; N180-L259 HydrophobicContact CB-CG 4.5Å; N180-L259 VanDerWaalsContact CG-CD2 3.5Å; L233-L259 HydrophobicContact CD1-CD2 4.15Å; A255-L259 PolarHBondContact O-N 3.41Å; I256-L259 PolarHBondContact O-N 2.93Å; L259-T261 PolarHBondContact O-N 3.11Å; L259-V262 WeakPolarHBondContact O-CB 2.99Å; L259-V262 PolarHBondContact O-N 3.46Å; L259-W263 VanDerWaalsContact O-CD1 3.3Å; L259-W263 PolarHBondContact O-N 3.27Å
260	L	95.9	Very high	93.5	Very high	98 Å²	98	69.6 Å²	69.6	51%	0.513	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-41.2	174	-68.5	171.9	0	0	0	111.7	I256 L257 L258 V262 W263 L264	I256-L260 HydrophobicContact CG2-CD1 4.3Å; I256-L260 WeakPolarHBondContact O-CG 3.28Å; I256-L260 PolarHBondContact O-N 3.38Å; L257-L260 PolarHBondContact O-N 3.43Å; L258-L260 VanDerWaalsContact C-N 3.34Å; L258-L260 PolarHBondContact O-N 2.95Å; L260-V262 VanDerWaalsContact C-N 3.32Å; L260-V262 PolarHBondContact O-N 3.48Å; L260-W263 PolarHBondContact O-N 2.9Å; L260-L264 WeakPolarHBondContact O-CG 3.27Å; L260-L264 PolarHBondContact O-N 3.44Å
261	T	96.9	Very high	94	Very high	59 Å²	59	72 Å²	72	36%	0.362	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-33.5	173.7	52.8	0	0	0	0	112.9	L257 L258 L259 L264 L265	L257-T261 PolarHBondContact O-N 3Å; L257-T261 PolarHBondContact O-OG1 3.24Å; L258-T261 WeakPolarHBondContact CA-OG1 3.37Å; L258-T261 PolarHBondContact O-N 3.44Å; L258-T261 PolarHBondContact O-OG1 3.14Å; L259-T261 PolarHBondContact O-N 3.11Å; T261-L264 PolarHBondContact O-N 3.3Å; T261-L265 WeakPolarHBondContact O-CB 3.29Å; T261-L265 VanDerWaalsContact O-CG 3.29Å; T261-L265 WeakPolarHBondContact O-CG 3.39Å; T261-L265 PolarHBondContact O-N 3.43Å
262	V	97.3	Very high	94.4	Very high	8 Å²	8	69.5 Å²	69.5	5%	0.048	34%	0.339	C	S	.	.	H	α-helix	trans	-64.2	-47	173.2	164.3	0	0	0	0	111.2	V226 L229 L233 L258 L259 L260 L265 A266	V226-V262 HydrophobicContact CG1-CG1 4.35Å; L229-V262 HydrophobicContact CB-CB 4.35Å; L229-V262 HydrophobicContact CB-CG1 3.79Å; L229-V262 HydrophobicContact CB-CG2 3.74Å; L229-V262 HydrophobicContact CD1-CG1 4.29Å; L229-V262 HydrophobicContact CD1-CG2 4.47Å; L233-V262 HydrophobicContact CD1-CG2 3.67Å; L233-V262 HydrophobicContact CG-CG2 4.24Å; L258-V262 WeakPolarHBondContact O-CG2 3.4Å; L258-V262 PolarHBondContact O-N 2.79Å; L259-V262 WeakPolarHBondContact O-CB 2.99Å; L259-V262 PolarHBondContact O-N 3.46Å; L260-V262 VanDerWaalsContact C-N 3.32Å; L260-V262 PolarHBondContact O-N 3.48Å; V262-L265 PolarHBondContact O-N 2.93Å; V262-A266 WeakPolarHBondContact O-CB 3.4Å; V262-A266 PolarHBondContact O-N 3.07Å
263	W	97.1	Very high	94.8	Very high	76 Å²	76	65.4 Å²	65.4	29%	0.288	32%	0.32	S	S	.	.	H	α-helix	trans	-63.7	-40.4	176.6	-82.5	99	0	0	0	112.5	N180 V222 V226 L259 L260 A266 L267	N180-W263 PolarHBondContact OD1-NE1 3.2Å; V222-W263 HydrophobicContact CG1-CZ3 4.17Å; V226-W263 HydrophobicContact CG1-CZ2 3.98Å; V226-W263 HydrophobicContact CG2-CD2 3.89Å; V226-W263 HydrophobicContact CG2-CE3 3.79Å; V226-W263 HydrophobicContact CG2-CH2 4.08Å; V226-W263 HydrophobicContact CG2-CZ2 4.16Å; V226-W263 HydrophobicContact CG2-CZ3 3.89Å; L259-W263 VanDerWaalsContact O-CD1 3.3Å; L259-W263 PolarHBondContact O-N 3.27Å; L260-W263 PolarHBondContact O-N 2.9Å; W263-A266 PolarHBondContact O-N 3.31Å; W263-L267 WeakPolarHBondContact O-CB 3.33Å; W263-L267 WeakPolarHBondContact O-CD1 3.33Å; W263-L267 WeakPolarHBondContact O-CG 3.37Å; W263-L267 PolarHBondContact O-N 3.5Å
264	L	97.4	Very high	95.1	Very high	102 Å²	102	56.6 Å²	56.6	53%	0.534	29%	0.291	S	S	.	.	H	α-helix	trans	-62.2	-48.4	175.5	-71.9	170.7	0	0	0	111.8	L260 T261 L267 I268	L260-L264 WeakPolarHBondContact O-CG 3.27Å; L260-L264 PolarHBondContact O-N 3.44Å; T261-L264 PolarHBondContact O-N 3.3Å; L264-L267 PolarHBondContact O-N 3.27Å; L264-I268 WeakPolarHBondContact O-CB 3.32Å; L264-I268 WeakPolarHBondContact O-CD1 3.24Å; L264-I268 WeakPolarHBondContact O-CG1 3.04Å; L264-I268 PolarHBondContact O-N 3.49Å
265	L	96.8	Very high	95.2	Very high	87 Å²	87	53.8 Å²	53.8	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-43.3	177.2	-70.7	170.4	0	0	0	112	L229 T261 V262 L267 I268 I269	L229-L265 HydrophobicContact CD1-CB 4.18Å; T261-L265 WeakPolarHBondContact O-CB 3.29Å; T261-L265 VanDerWaalsContact O-CG 3.29Å; T261-L265 WeakPolarHBondContact O-CG 3.39Å; T261-L265 PolarHBondContact O-N 3.43Å; V262-L265 PolarHBondContact O-N 2.93Å; L265-L267 VanDerWaalsContact C-N 3.3Å; L265-L267 PolarHBondContact O-N 3.01Å; L265-I268 PolarHBondContact O-N 2.97Å; L265-I269 HydrophobicContact CB-CD1 4.34Å; L265-I269 WeakPolarHBondContact O-CB 3.48Å; L265-I269 VanDerWaalsContact O-CG1 3.28Å; L265-I269 WeakPolarHBondContact O-CG1 3.32Å; L265-I269 PolarHBondContact O-N 2.92Å
266	A	97.2	Very high	95.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68	-26.4	179.7	0	0	0	0	0	113.7	V222 F225 V226 V262 W263 P270	V222-A266 WeakPolarHBondContact CA-O 3.37Å; V222-A266 HydrophobicContact CG1-CB 4.44Å; V222-A266 WeakPolarHBondContact CG2-O 3.29Å; F225-A266 HydrophobicContact CB-CB 3.55Å; V226-A266 HydrophobicContact CG2-CB 3.51Å; V262-A266 WeakPolarHBondContact O-CB 3.4Å; V262-A266 PolarHBondContact O-N 3.07Å; W263-A266 PolarHBondContact O-N 3.31Å; A266-P270 WeakPolarHBondContact O-CD 3.41Å; A266-P270 VanDerWaalsContact O-CG 3.28Å; A266-P270 WeakPolarHBondContact O-CG 3.36Å
267	L	97	Very high	95.3	Very high	68 Å²	68	50.7 Å²	50.7	36%	0.356	27%	0.266	S	S	.	.	H	α-helix	trans	-80.3	-39.5	170.9	-71.3	166.1	0	0	0	111.9	Y218 V222 W263 L264 L265 L271	Y218-L267 WeakPolarHBondContact OH-CD2 3.15Å; Y218-L267 PolarHBondContact OH-O 3.5Å; V222-L267 HydrophobicContact CG1-CD2 3.95Å; V222-L267 HydrophobicContact CG1-CG 4.42Å; V222-L267 HydrophobicContact CG2-CD2 4.08Å; W263-L267 WeakPolarHBondContact O-CB 3.33Å; W263-L267 WeakPolarHBondContact O-CD1 3.33Å; W263-L267 WeakPolarHBondContact O-CG 3.37Å; W263-L267 PolarHBondContact O-N 3.5Å; L264-L267 PolarHBondContact O-N 3.27Å; L265-L267 VanDerWaalsContact C-N 3.3Å; L265-L267 PolarHBondContact O-N 3.01Å; L267-L271 WeakPolarHBondContact O-CG 3.48Å
268	I	96.6	Very high	95.3	Very high	101 Å²	101	49.9 Å²	49.9	52%	0.518	26%	0.255	S	S	.	.	H	α-helix	trans	-73.4	-45.6	-175.3	-71.4	165.9	0	0	0	112.6	L264 L265 L271	L264-I268 WeakPolarHBondContact O-CB 3.32Å; L264-I268 WeakPolarHBondContact O-CD1 3.24Å; L264-I268 WeakPolarHBondContact O-CG1 3.04Å; L264-I268 PolarHBondContact O-N 3.49Å; L265-I268 PolarHBondContact O-N 2.97Å; I268-L271 HydrophobicContact CB-CD1 4.5Å; I268-L271 WeakPolarHBondContact O-CB 3.32Å; I268-L271 VanDerWaalsContact O-CG 3.29Å; I268-L271 WeakPolarHBondContact O-CG 3.18Å; I268-L271 PolarHBondContact O-N 3.44Å
269	I	95.3	Very high	95.2	Very high	42 Å²	42	49 Å²	49	22%	0.215	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-41.5	-173	-64.8	163.7	0	0	0	112.1	F225 L265 L271 Y334 L338 L341	F225-I269 HydrophobicContact CD1-CD1 4.32Å; F225-I269 HydrophobicContact CE1-CD1 4.08Å; F225-I269 HydrophobicContact CE1-CG2 4.1Å; F225-I269 HydrophobicContact CE2-CB 4.33Å; F225-I269 HydrophobicContact CE2-CG2 3.76Å; F225-I269 HydrophobicContact CZ-CB 4.28Å; F225-I269 HydrophobicContact CZ-CG2 3.49Å; F225-I269 VanDerWaalsContact CZ-CG2 3.49Å; L265-I269 HydrophobicContact CB-CD1 4.34Å; L265-I269 WeakPolarHBondContact O-CB 3.48Å; L265-I269 VanDerWaalsContact O-CG1 3.28Å; L265-I269 WeakPolarHBondContact O-CG1 3.32Å; L265-I269 PolarHBondContact O-N 2.92Å; I269-L271 VanDerWaalsContact C-N 3.35Å; I269-L271 PolarHBondContact O-N 2.92Å; I269-Y334 PolarHBondContact O-OH 3.33Å; I269-L338 HydrophobicContact CG2-CD2 3.56Å; I269-L341 HydrophobicContact CD1-CD1 4.44Å; I269-L341 HydrophobicContact CG2-CD1 4.21Å
270	P	95.1	Very high	95.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	4.3	177.7	-16.1	34	0	0	0	116.1	Y218 V222 F225 A266 P272 V273 Y334	Y218-P270 HydrophobicContact CD2-CB 3.86Å; Y218-P270 WeakPolarHBondContact CD2-O 3.45Å; Y218-P270 HydrophobicContact CE2-CB 3.95Å; V222-P270 HydrophobicContact CG2-CG 4.29Å; F225-P270 HydrophobicContact CD2-CG 3.8Å; F225-P270 HydrophobicContact CE2-CG 4.08Å; A266-P270 WeakPolarHBondContact O-CD 3.41Å; A266-P270 VanDerWaalsContact O-CG 3.28Å; A266-P270 WeakPolarHBondContact O-CG 3.36Å; P270-P272 VanDerWaalsContact C-N 3.31Å; P270-P272 VanDerWaalsContact O-N 3.16Å; P270-V273 HydrophobicContact CB-CG2 4.26Å; P270-V273 VanDerWaalsContact O-CB 3.27Å; P270-V273 WeakPolarHBondContact O-CB 3.15Å; P270-V273 VanDerWaalsContact O-CG2 3.31Å; P270-V273 WeakPolarHBondContact O-CG2 3.29Å; P270-V273 PolarHBondContact O-N 3.15Å; P270-Y334 WeakPolarHBondContact CA-OH 3.48Å
271	L	94.2	Very high	94.9	Very high	86 Å²	86	53.1 Å²	53.1	45%	0.45	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-31	-175.1	-74.4	175.2	0	0	0	116.2	Y218 L267 I268 I269 V273 P274	Y218-L271 HydrophobicContact CE2-CD2 4.29Å; L267-L271 WeakPolarHBondContact O-CG 3.48Å; I268-L271 HydrophobicContact CB-CD1 4.5Å; I268-L271 WeakPolarHBondContact O-CB 3.32Å; I268-L271 VanDerWaalsContact O-CG 3.29Å; I268-L271 WeakPolarHBondContact O-CG 3.18Å; I268-L271 PolarHBondContact O-N 3.44Å; I269-L271 VanDerWaalsContact C-N 3.35Å; I269-L271 PolarHBondContact O-N 2.92Å; L271-V273 VanDerWaalsContact C-N 3.29Å; L271-V273 PolarHBondContact O-N 3.45Å; L271-P274 VanDerWaalsContact O-CD 3.31Å; L271-P274 WeakPolarHBondContact O-CD 3.2Å
272	P	93.3	Very high	94.5	Very high	27 Å²	27	58.4 Å²	58.4	18%	0.175	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-29.3	172.8	-27.5	37.5	0	0	0	114.4	P270 I275 V276 W292 L295 Y334	P270-P272 VanDerWaalsContact C-N 3.31Å; P270-P272 VanDerWaalsContact O-N 3.16Å; P272-I275 WeakPolarHBondContact O-CA 3.36Å; P272-I275 WeakPolarHBondContact O-CB 3.38Å; P272-I275 PolarHBondContact O-N 3.34Å; P272-V276 PolarHBondContact O-N 3.47Å; P272-W292 HydrophobicContact CB-CH2 4.06Å; P272-W292 HydrophobicContact CB-CZ3 4.37Å; P272-L295 HydrophobicContact CB-CD2 4.28Å; P272-Y334 HydrophobicContact CB-CE2 4.19Å; P272-Y334 HydrophobicContact CG-CE2 3.78Å
273	V	93.7	Very high	94	Very high	11 Å²	11	64.9 Å²	64.9	7%	0.067	32%	0.32	C	S	.	.	H	α-helix	trans	-55.1	-52.7	-173.3	180	0	0	0	0	113.4	P217 P270 L271 I275 V276 N277 Y334	P217-V273 HydrophobicContact CB-CG1 3.66Å; P270-V273 HydrophobicContact CB-CG2 4.26Å; P270-V273 VanDerWaalsContact O-CB 3.27Å; P270-V273 WeakPolarHBondContact O-CB 3.15Å; P270-V273 VanDerWaalsContact O-CG2 3.31Å; P270-V273 WeakPolarHBondContact O-CG2 3.29Å; P270-V273 PolarHBondContact O-N 3.15Å; L271-V273 VanDerWaalsContact C-N 3.29Å; L271-V273 PolarHBondContact O-N 3.45Å; V273-I275 PolarHBondContact O-N 3.47Å; V273-V276 PolarHBondContact O-N 2.84Å; V273-N277 WeakPolarHBondContact CG1-ND2 3.34Å; V273-N277 WeakPolarHBondContact O-CB 3.25Å; V273-N277 PolarHBondContact O-N 3.02Å; V273-N277 PolarHBondContact O-ND2 3.09Å; V273-Y334 HydrophobicContact CG2-CE1 4.18Å; V273-Y334 WeakPolarHBondContact CG2-OH 3.49Å
274	P	94.2	Very high	93.6	Very high	35 Å²	35	69.3 Å²	69.3	23%	0.227	35%	0.349	C	S	.	.	H	α-helix	trans	-71.5	-13.3	177.4	29.3	-37.2	0	0	0	114.1	K214 Y218 L271	K214-P274 HydrophobicContact CB-CB 4.06Å; K214-P274 WeakPolarHBondContact CD-O 3.45Å; K214-P274 WeakPolarHBondContact CG-O 3.47Å; K214-P274 PolarHBondContact NZ-O 2.94Å; Y218-P274 HydrophobicContact CD2-CG 3.98Å; Y218-P274 HydrophobicContact CG-CG 4.16Å; L271-P274 VanDerWaalsContact O-CD 3.31Å; L271-P274 WeakPolarHBondContact O-CD 3.2Å
275	I	92.4	Very high	93.2	Very high	73 Å²	73	68.5 Å²	68.5	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-77.2	-53.1	172.5	-58.1	175.4	0	0	0	108.9	K214 P272 V273 L294 L295	K214-I275 PolarHBondContact NZ-O 3.01Å; P272-I275 WeakPolarHBondContact O-CA 3.36Å; P272-I275 WeakPolarHBondContact O-CB 3.38Å; P272-I275 PolarHBondContact O-N 3.34Å; V273-I275 PolarHBondContact O-N 3.47Å; I275-L294 HydrophobicContact CG2-CB 4.42Å; I275-L294 VanDerWaalsContact O-CD1 3.31Å; I275-L294 WeakPolarHBondContact O-CD1 3.43Å; I275-L295 HydrophobicContact CD1-CD1 4.06Å; I275-L295 HydrophobicContact CG2-CD1 4.24Å
276	V	91.7	Very high	93	Very high	0 Å²	0	66 Å²	66	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-75.8	-33.6	-173.8	-56	0	0	0	0	113.7	P272 V273 R278 E290 D291 W292 L295	P272-V276 PolarHBondContact O-N 3.47Å; V273-V276 PolarHBondContact O-N 2.84Å; V276-R278 PolarHBondContact O-N 3.34Å; V276-E290 HydrophobicContact CG2-CB 4.13Å; V276-E290 HydrophobicContact CG2-CG 4.27Å; V276-D291 PolarHBondContact O-N 3.5Å; V276-W292 HydrophobicContact CB-CD2 4.36Å; V276-W292 HydrophobicContact CB-CG 4.43Å; V276-W292 HydrophobicContact CG1-CD2 3.77Å; V276-W292 HydrophobicContact CG1-CE3 3.9Å; V276-W292 HydrophobicContact CG1-CG 4.13Å; V276-W292 HydrophobicContact CG1-CH2 4.36Å; V276-W292 HydrophobicContact CG1-CZ2 4.29Å; V276-W292 HydrophobicContact CG1-CZ3 4.2Å; V276-W292 HydrophobicContact CG2-CZ2 3.97Å; V276-L295 HydrophobicContact CG1-CB 4.13Å
277	N	94	Very high	92.8	Very high	9 Å²	9	68.9 Å²	68.9	5%	0.048	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	121.7	-179.2	-83.1	-93.5	0	0	0	110.9	C213 K214 V273 I289 E290	C213-N277 WeakPolarHBondContact O-CB 3.5Å; K214-N277 WeakPolarHBondContact CE-O 3.4Å; K214-N277 VanDerWaalsContact CG-O 3.3Å; K214-N277 WeakPolarHBondContact CG-O 3.26Å; K214-N277 PolarHBondContact NZ-O 3.19Å; V273-N277 WeakPolarHBondContact CG1-ND2 3.34Å; V273-N277 WeakPolarHBondContact O-CB 3.25Å; V273-N277 PolarHBondContact O-N 3.02Å; V273-N277 PolarHBondContact O-ND2 3.09Å; N277-I289 WeakPolarHBondContact CA-O 3.47Å; N277-E290 PolarHBondContact ND2-OE1 3.12Å
278	R	93.5	Very high	92.7	Very high	92 Å²	92	67.2 Å²	67.2	35%	0.347	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.7	174.5	64.9	164	178.4	134.6	-5.3	111.9	C213 V276 V280 I289 D291 L294	C213-R278 VanDerWaalsContact SG-C 3.55Å; V276-R278 PolarHBondContact O-N 3.34Å; R278-V280 HydrophobicContact CG-CG2 4.4Å; R278-I289 HydrophobicContact CG-CG1 4.4Å; R278-I289 PolarHBondContact N-O 2.99Å; R278-I289 PolarHBondContact O-N 3.21Å; R278-D291 HydrophobicContact CG-CB 4.06Å; R278-D291 IonicContact CZ-OD2 2.94Å; R278-D291 IonicContact NE-OD2 3.52Å; R278-D291 PolarHBondContact NE-OD2 3.13Å; R278-D291 IonicContact NH2-OD2 2.66Å; R278-D291 PolarHBondContact NH2-OD2 3.44Å; R278-L294 HydrophobicContact CB-CD1 4.43Å; R278-L294 HydrophobicContact CG-CD1 4.31Å
279	T	93.9	Very high	92.4	Very high	37 Å²	37	65.8 Å²	65.8	23%	0.227	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	135.9	171.3	45	0	0	0	0	111.6	E210 C213 F287	E210-T279 HydrophobicContact CB-CG2 4.33Å; E210-T279 WeakPolarHBondContact CB-OG1 3.44Å; C213-T279 HydrophobicContact CB-CG2 3.9Å; T279-F287 CarbonylContact C-O 3.53Å; T279-F287 VanDerWaalsContact CA-O 3.28Å; T279-F287 WeakPolarHBondContact CA-O 3.42Å
280	V	92.8	Very high	92.1	Very high	48 Å²	48	67.9 Å²	67.9	29%	0.291	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.4	172.9	175.1	0	0	0	0	108.6	R278 F287 I289	R278-V280 HydrophobicContact CG-CG2 4.4Å; V280-F287 PolarHBondContact N-O 3.18Å; V280-F287 PolarHBondContact O-N 3.42Å; V280-I289 HydrophobicContact CB-CD1 4.22Å; V280-I289 HydrophobicContact CB-CG1 4.44Å; V280-I289 HydrophobicContact CG2-CD1 3.65Å; V280-I289 HydrophobicContact CG2-CG1 3.92Å
281	Q	92	Very high	91.7	Very high	155 Å²	155	69 Å²	69	72%	0.724	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	136.7	172.6	-77.3	176.8	-29.4	0	0	110.6	E285 T286	Q281-E285 WeakPolarHBondContact CA-O 3.3Å; Q281-T286 HydrophobicContact CG-CG2 3.59Å
282	R	90.1	Very high	91.3	Very high	170 Å²	170	65.1 Å²	65.1	64%	0.642	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.5	127.4	170.7	166.7	177.8	-74.1	165.6	-4.4	107	N284 E285 F287	R282-N284 VanDerWaalsContact C-N 3.3Å; R282-N284 PolarHBondContact O-N 2.93Å; R282-E285 PolarHBondContact N-O 2.97Å; R282-E285 PolarHBondContact O-N 3.02Å; R282-E285 VanDerWaalsContact O-O 3.07Å; R282-F287 HydrophobicContact CB-CD2 4.08Å; R282-F287 HydrophobicContact CB-CE2 4.06Å; R282-F287 HydrophobicContact CG-CE2 4.49Å
283	D	85.4	Confident	90.7	Very high	144 Å²	144	65.4 Å²	65.4	77%	0.77	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	45.6	170.8	-46.7	-33.5	0	0	0	113.5	E285	D283-E285 PolarHBondContact O-N 3.35Å; D283-E285 VanDerWaalsContact O-N 3.15Å
284	N	88.1	Confident	90	Very high	168 Å²	168	67.5 Å²	67.5	90%	0.898	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	-8.4	-172.2	-62.8	-37	0	0	0	117	R282	R282-N284 VanDerWaalsContact C-N 3.3Å; R282-N284 PolarHBondContact O-N 2.93Å
285	E	90.5	Very high	89.3	Confident	86 Å²	86	67.6 Å²	67.6	40%	0.402	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	150.2	174.1	-63.6	-168.5	154.4	0	0	112	W205 Q281 R282 D283 F287	W205-E285 HydrophobicContact CB-CB 4.25Å; W205-E285 HydrophobicContact CG-CB 4.35Å; W205-E285 HydrophobicContact CG-CG 4.4Å; Q281-E285 WeakPolarHBondContact CA-O 3.3Å; R282-E285 PolarHBondContact N-O 2.97Å; R282-E285 PolarHBondContact O-N 3.02Å; R282-E285 VanDerWaalsContact O-O 3.07Å; D283-E285 PolarHBondContact O-N 3.35Å; D283-E285 VanDerWaalsContact O-N 3.15Å; E285-F287 HydrophobicContact CB-CD2 4.49Å; E285-F287 HydrophobicContact CB-CE2 3.66Å; E285-F287 HydrophobicContact CB-CZ 3.88Å; E285-F287 WeakPolarHBondContact OE2-CZ 3.39Å
286	T	93	Very high	88.2	Confident	34 Å²	34	65.3 Å²	65.3	21%	0.209	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122.8	175.8	39.5	0	0	0	0	110.7	W206 Q281	W206-T286 WeakPolarHBondContact CA-O 3.42Å; W206-T286 VanDerWaalsContact CB-O 3.3Å; W206-T286 WeakPolarHBondContact CB-O 3.23Å; W206-T286 PolarHBondContact N-O 3.42Å; W206-T286 PolarHBondContact O-OG1 3.21Å; Q281-T286 HydrophobicContact CG-CG2 3.59Å
287	F	92.2	Very high	86.9	Confident	61 Å²	61	68.4 Å²	68.4	27%	0.268	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.9	176.7	-62.9	-83.8	0	0	0	110.7	W205 T279 V280 R282 E285 I289	W205-F287 HydrophobicContact CB-CD1 4.36Å; W205-F287 HydrophobicContact CB-CE1 3.98Å; W205-F287 HydrophobicContact CB-CZ 4.33Å; T279-F287 CarbonylContact C-O 3.53Å; T279-F287 VanDerWaalsContact CA-O 3.28Å; T279-F287 WeakPolarHBondContact CA-O 3.42Å; V280-F287 PolarHBondContact N-O 3.18Å; V280-F287 PolarHBondContact O-N 3.42Å; R282-F287 HydrophobicContact CB-CD2 4.08Å; R282-F287 HydrophobicContact CB-CE2 4.06Å; R282-F287 HydrophobicContact CG-CE2 4.49Å; E285-F287 HydrophobicContact CB-CD2 4.49Å; E285-F287 HydrophobicContact CB-CE2 3.66Å; E285-F287 HydrophobicContact CB-CZ 3.88Å; E285-F287 WeakPolarHBondContact OE2-CZ 3.39Å; F287-I289 HydrophobicContact CB-CG2 4.22Å
288	C	94.4	Very high	85.2	Confident	33 Å²	33	71 Å²	71	22%	0.223	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	119.5	166.5	-179.2	0	0	0	0	108	W206 C213	W206-C288 HydrophobicContact CB-CB 4.02Å; W206-C288 HydrophobicContact CD2-CB 3.5Å; W206-C288 VanDerWaalsContact CD2-CB 3.5Å; W206-C288 HydrophobicContact CE3-CB 3.56Å; W206-C288 HydrophobicContact CG-CB 3.65Å; W206-C288 HydrophobicContact CZ3-CB 4.39Å; C213-C288 WeakPolarHBondContact CA-SG 3.17Å; C213-C288 HydrophobicContact CB-CB 3.78Å; C213-C288 WeakPolarHBondContact CB-SG 3.15Å; C213-C288 VanDerWaalsContact SG-CA 3.6Å; C213-C288 WeakPolarHBondContact SG-CB 3.43Å; C213-C288 CovalentContact SG-SG 2.03Å; C213-C288 PolarHBondContact SG-SG 3.15Å
289	I	90.4	Very high	83.4	Confident	71 Å²	71	71.3 Å²	71.3	36%	0.364	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	151.5	-177.4	64.2	163.9	0	0	0	110.6	N277 R278 V280 F287 D291	N277-I289 WeakPolarHBondContact CA-O 3.47Å; R278-I289 HydrophobicContact CG-CG1 4.4Å; R278-I289 PolarHBondContact N-O 2.99Å; R278-I289 PolarHBondContact O-N 3.21Å; V280-I289 HydrophobicContact CB-CD1 4.22Å; V280-I289 HydrophobicContact CB-CG1 4.44Å; V280-I289 HydrophobicContact CG2-CD1 3.65Å; V280-I289 HydrophobicContact CG2-CG1 3.92Å; F287-I289 HydrophobicContact CB-CG2 4.22Å; I289-D291 PolarHBondContact O-N 2.72Å
290	E	89.2	Confident	81.3	Confident	85 Å²	85	74.2 Å²	74.2	40%	0.397	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	109.4	169.5	-57.5	-157.1	152.7	0	0	110.6	V276 N277 W292	V276-E290 HydrophobicContact CG2-CB 4.13Å; V276-E290 HydrophobicContact CG2-CG 4.27Å; N277-E290 PolarHBondContact ND2-OE1 3.12Å; E290-W292 PolarHBondContact OE2-NE1 2.98Å
291	D	86.7	Confident	79.2	Confident	23 Å²	23	77.5 Å²	77.5	12%	0.123	40%	0.401	C	S	.	.			trans	-102.7	92.8	171.4	-166.2	-22.3	0	0	0	110.4	V276 R278 I289 S293 L294	V276-D291 PolarHBondContact O-N 3.5Å; R278-D291 HydrophobicContact CG-CB 4.06Å; R278-D291 IonicContact CZ-OD2 2.94Å; R278-D291 IonicContact NE-OD2 3.52Å; R278-D291 PolarHBondContact NE-OD2 3.13Å; R278-D291 IonicContact NH2-OD2 2.66Å; R278-D291 PolarHBondContact NH2-OD2 3.44Å; I289-D291 PolarHBondContact O-N 2.72Å; D291-S293 PolarHBondContact O-N 3.43Å; D291-S293 VanDerWaalsContact OD1-CB 3.3Å; D291-S293 WeakPolarHBondContact OD1-CB 3.47Å; D291-S293 PolarHBondContact OD1-N 2.9Å; D291-S293 VanDerWaalsContact OD1-N 3.14Å; D291-S293 PolarHBondContact OD1-OG 2.92Å; D291-L294 HydrophobicContact CB-CD1 4.17Å; D291-L294 HydrophobicContact CB-CG 4.24Å; D291-L294 WeakPolarHBondContact O-CB 3.22Å; D291-L294 WeakPolarHBondContact O-CG 3.19Å; D291-L294 PolarHBondContact O-N 3.31Å
292	W	85.3	Confident	77.4	Confident	6 Å²	6	75.9 Å²	75.9	2%	0.023	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.5	-178.1	-78.3	80.6	0	0	0	113.6	P272 V276 E290 L294 L295 L296 N315 I330 D331 Y334	P272-W292 HydrophobicContact CB-CH2 4.06Å; P272-W292 HydrophobicContact CB-CZ3 4.37Å; V276-W292 HydrophobicContact CB-CD2 4.36Å; V276-W292 HydrophobicContact CB-CG 4.43Å; V276-W292 HydrophobicContact CG1-CD2 3.77Å; V276-W292 HydrophobicContact CG1-CE3 3.9Å; V276-W292 HydrophobicContact CG1-CG 4.13Å; V276-W292 HydrophobicContact CG1-CH2 4.36Å; V276-W292 HydrophobicContact CG1-CZ2 4.29Å; V276-W292 HydrophobicContact CG1-CZ3 4.2Å; V276-W292 HydrophobicContact CG2-CZ2 3.97Å; E290-W292 PolarHBondContact OE2-NE1 2.98Å; W292-L294 PolarHBondContact O-N 3.4Å; W292-L295 HydrophobicContact CE3-CD2 3.97Å; W292-L295 HydrophobicContact CZ3-CD2 3.63Å; W292-L295 WeakPolarHBondContact O-CB 3.17Å; W292-L295 PolarHBondContact O-N 2.81Å; W292-L296 WeakPolarHBondContact O-CD1 3.42Å; W292-L296 PolarHBondContact O-N 3.34Å; W292-N315 VanDerWaalsContact CB-OD1 3.3Å; W292-N315 WeakPolarHBondContact CB-OD1 3.37Å; W292-I330 HydrophobicContact CE3-CG2 3.78Å; W292-I330 HydrophobicContact CZ3-CG2 4.16Å; W292-D331 HydrophobicContact CD2-CB 4.1Å; W292-D331 HydrophobicContact CG-CB 3.94Å; W292-Y334 AromaticContact CH2-CD1 3.22Å; W292-Y334 HydrophobicContact CH2-CD1 3.22Å; W292-Y334 AromaticContact CH2-CD2 3.99Å; W292-Y334 HydrophobicContact CH2-CD2 3.99Å; W292-Y334 AromaticContact CH2-CE1 3.69Å; W292-Y334 HydrophobicContact CH2-CE1 3.69Å; W292-Y334 HydrophobicContact CH2-CE2 4.41Å; W292-Y334 AromaticContact CH2-CG 3.35Å; W292-Y334 HydrophobicContact CH2-CG 3.35Å; W292-Y334 AromaticContact CZ2-CD1 3.43Å; W292-Y334 HydrophobicContact CZ2-CD1 3.43Å; W292-Y334 VanDerWaalsContact CZ2-CD1 3.43Å; W292-Y334 AromaticContact CZ2-CE1 3.92Å; W292-Y334 HydrophobicContact CZ2-CE1 3.92Å; W292-Y334 AromaticContact CZ2-CG 3.99Å; W292-Y334 HydrophobicContact CZ2-CG 3.99Å; W292-Y334 HydrophobicContact CZ3-CD1 4.39Å; W292-Y334 HydrophobicContact CZ3-CG 4.15Å
293	S	80.3	Confident	74.6	Confident	33 Å²	33	73.8 Å²	73.8	23%	0.231	40%	0.398	C	S	.	.	H	α-helix	trans	-64.7	-21.8	175.5	77.6	0	0	0	0	113.2	D291 L295 L296 S297 K314 N315	D291-S293 PolarHBondContact O-N 3.43Å; D291-S293 VanDerWaalsContact OD1-CB 3.3Å; D291-S293 WeakPolarHBondContact OD1-CB 3.47Å; D291-S293 PolarHBondContact OD1-N 2.9Å; D291-S293 VanDerWaalsContact OD1-N 3.14Å; D291-S293 PolarHBondContact OD1-OG 2.92Å; S293-L295 VanDerWaalsContact C-N 3.31Å; S293-L295 PolarHBondContact O-N 2.98Å; S293-L296 PolarHBondContact O-N 2.85Å; S293-S297 WeakPolarHBondContact O-CB 3.36Å; S293-S297 PolarHBondContact O-N 3.29Å; S293-S297 PolarHBondContact O-OG 2.91Å; S293-K314 WeakPolarHBondContact CA-O 3.3Å; S293-K314 WeakPolarHBondContact CB-O 3.42Å; S293-N315 PolarHBondContact N-OD1 3.44Å; S293-N315 VanDerWaalsContact N-OD1 3.08Å
294	L	80.3	Confident	72.9	Confident	54 Å²	54	72.6 Å²	72.6	28%	0.283	39%	0.39	S	S	.	.	H	α-helix	trans	-65.2	-32.5	172.7	-61.4	175.9	0	0	0	112.8	I275 R278 D291 W292 S297 S298	I275-L294 HydrophobicContact CG2-CB 4.42Å; I275-L294 VanDerWaalsContact O-CD1 3.31Å; I275-L294 WeakPolarHBondContact O-CD1 3.43Å; R278-L294 HydrophobicContact CB-CD1 4.43Å; R278-L294 HydrophobicContact CG-CD1 4.31Å; D291-L294 HydrophobicContact CB-CD1 4.17Å; D291-L294 HydrophobicContact CB-CG 4.24Å; D291-L294 WeakPolarHBondContact O-CB 3.22Å; D291-L294 WeakPolarHBondContact O-CG 3.19Å; D291-L294 PolarHBondContact O-N 3.31Å; W292-L294 PolarHBondContact O-N 3.4Å; L294-S297 PolarHBondContact O-OG 3.46Å; L294-S298 PolarHBondContact O-N 3.03Å; L294-S298 PolarHBondContact O-OG 3.37Å
295	L	78.5	Confident	71	Confident	37 Å²	37	71.4 Å²	71.4	19%	0.194	38%	0.384	C	S	.	.	H	α-helix	trans	-75.3	-40.1	176.5	-166.6	68.8	0	0	0	110.4	P272 I275 V276 W292 S293 S298 I299	P272-L295 HydrophobicContact CB-CD2 4.28Å; I275-L295 HydrophobicContact CD1-CD1 4.06Å; I275-L295 HydrophobicContact CG2-CD1 4.24Å; V276-L295 HydrophobicContact CG1-CB 4.13Å; W292-L295 HydrophobicContact CE3-CD2 3.97Å; W292-L295 HydrophobicContact CZ3-CD2 3.63Å; W292-L295 WeakPolarHBondContact O-CB 3.17Å; W292-L295 PolarHBondContact O-N 2.81Å; S293-L295 VanDerWaalsContact C-N 3.31Å; S293-L295 PolarHBondContact O-N 2.98Å; L295-S298 WeakPolarHBondContact O-CB 3.4Å; L295-S298 PolarHBondContact O-N 2.92Å; L295-I299 WeakPolarHBondContact O-CG1 3.31Å; L295-I299 PolarHBondContact O-N 3.34Å
296	L	69.8	Low	69	Low	25 Å²	25	74.3 Å²	74.3	13%	0.131	40%	0.403	C	S	.	.	H	α-helix	trans	-73.8	-33.1	178.7	-74.9	86.3	0	0	0	112.9	W292 S293 S298 I299 K300 I313 I330	W292-L296 WeakPolarHBondContact O-CD1 3.42Å; W292-L296 PolarHBondContact O-N 3.34Å; S293-L296 PolarHBondContact O-N 2.85Å; L296-S298 VanDerWaalsContact C-N 3.27Å; L296-S298 PolarHBondContact O-N 3.49Å; L296-I299 PolarHBondContact O-N 2.87Å; L296-I299 VanDerWaalsContact O-N 3.15Å; L296-K300 WeakPolarHBondContact O-CG 3.49Å; L296-K300 PolarHBondContact O-N 2.94Å; L296-I313 HydrophobicContact CD2-CG2 3.8Å; L296-I330 HydrophobicContact CD1-CD1 3.71Å; L296-I330 HydrophobicContact CD2-CD1 3.73Å; L296-I330 HydrophobicContact CG-CD1 4.18Å
297	S	64.5	Low	66.7	Low	65 Å²	65	78.3 Å²	78.3	46%	0.455	42%	0.417	S	S	.	.	H	α-helix	trans	-63.5	-36.1	173.6	66.1	0	0	0	0	111.6	S293 L294 K300	S293-S297 WeakPolarHBondContact O-CB 3.36Å; S293-S297 PolarHBondContact O-N 3.29Å; S293-S297 PolarHBondContact O-OG 2.91Å; L294-S297 PolarHBondContact O-OG 3.46Å; S297-K300 PolarHBondContact O-N 3.13Å
298	S	57.9	Low	64.3	Low	65 Å²	65	81 Å²	81	46%	0.455	44%	0.439	S	S	.	.	H	α-helix	trans	-61	-45.4	170.6	-56	0	0	0	0	111.3	L294 L295 L296 T301	L294-S298 PolarHBondContact O-N 3.03Å; L294-S298 PolarHBondContact O-OG 3.37Å; L295-S298 WeakPolarHBondContact O-CB 3.4Å; L295-S298 PolarHBondContact O-N 2.92Å; L296-S298 VanDerWaalsContact C-N 3.27Å; L296-S298 PolarHBondContact O-N 3.49Å; S298-T301 PolarHBondContact O-N 3.33Å; S298-T301 PolarHBondContact O-OG1 2.96Å
299	I	56.6	Low	61.7	Low	97 Å²	97	86.1 Å²	86.1	50%	0.497	46%	0.464	S	S	.	.	H	α-helix	trans	-68.2	-35.2	178.5	-63.8	164.9	0	0	0	112.4	L295 L296 T301 I302	L295-I299 WeakPolarHBondContact O-CG1 3.31Å; L295-I299 PolarHBondContact O-N 3.34Å; L296-I299 PolarHBondContact O-N 2.87Å; L296-I299 VanDerWaalsContact O-N 3.15Å; I299-T301 PolarHBondContact O-N 2.94Å; I299-I302 WeakPolarHBondContact O-CB 3.2Å; I299-I302 PolarHBondContact O-N 3.07Å
300	K	49.3	Very low	59.7	Low	98 Å²	98	86 Å²	86	43%	0.426	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-17	177.9	-79.6	177.7	179.8	-177.8	0	113.7	L296 S297 I302 L310	L296-K300 WeakPolarHBondContact O-CG 3.49Å; L296-K300 PolarHBondContact O-N 2.94Å; S297-K300 PolarHBondContact O-N 3.13Å; K300-I302 VanDerWaalsContact C-N 3.26Å; K300-I302 PolarHBondContact O-N 2.92Å; K300-L310 HydrophobicContact CD-CD2 3.9Å
301	T	49.9	Very low	57.8	Low	117 Å²	117	89.4 Å²	89.4	72%	0.718	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.3	172.3	67.2	0	0	0	0	113.8	S298 I299 N303	S298-T301 PolarHBondContact O-N 3.33Å; S298-T301 PolarHBondContact O-OG1 2.96Å; I299-T301 PolarHBondContact O-N 2.94Å; T301-N303 VanDerWaalsContact C-N 3.33Å; T301-N303 PolarHBondContact O-N 2.95Å; T301-N303 VanDerWaalsContact O-N 3.13Å
302	I	52.3	Low	55.9	Low	121 Å²	121	96.8 Å²	96.8	62%	0.621	52%	0.519	S	S	*	.	S	Bend	trans	-90.5	66.2	-178.4	-47.5	178.5	0	0	0	110.3	I299 K300 I304	I299-I302 WeakPolarHBondContact O-CB 3.2Å; I299-I302 PolarHBondContact O-N 3.07Å; K300-I302 VanDerWaalsContact C-N 3.26Å; K300-I302 PolarHBondContact O-N 2.92Å; I302-I304 WeakPolarHBondContact O-CG1 3.36Å; I302-I304 PolarHBondContact O-N 3.4Å
303	N	32.9	Very low	54.2	Low	126 Å²	126	98.5 Å²	98.5	67%	0.674	53%	0.528	S	S	*	.			trans	34.3	75.7	159.2	-169	17.3	0	0	0	117.2	T301 N305	T301-N303 VanDerWaalsContact C-N 3.33Å; T301-N303 PolarHBondContact O-N 2.95Å; T301-N303 VanDerWaalsContact O-N 3.13Å; N303-N305 PolarHBondContact OD1-ND2 2.99Å; N303-N305 PolarHBondContact OD1-OD1 3.45Å
304	I	48.5	Very low	53.1	Low	119 Å²	119	104.1 Å²	104.1	61%	0.61	55%	0.548	S	S	*	.			trans	-123	78	166.3	-50	-178.1	0	0	0	109.5	I302 N306 F307	I302-I304 WeakPolarHBondContact O-CG1 3.36Å; I302-I304 PolarHBondContact O-N 3.4Å; I304-N306 PolarHBondContact O-N 3.26Å; I304-F307 HydrophobicContact CG2-CB 4.27Å
305	N	49.2	Very low	52.2	Low	143 Å²	143	104 Å²	104	77%	0.765	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	1	-178.7	-64.2	-16.7	0	0	0	114.5	N303	N303-N305 PolarHBondContact OD1-ND2 2.99Å; N303-N305 PolarHBondContact OD1-OD1 3.45Å
306	N	47.6	Very low	51.7	Low	148 Å²	148	105.7 Å²	105.7	79%	0.791	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	3.2	-174.3	-69.1	4.2	0	0	0	114.1	I304 T308	I304-N306 PolarHBondContact O-N 3.26Å; N306-T308 PolarHBondContact O-N 2.96Å
307	F	45	Very low	51.5	Low	117 Å²	117	108.1 Å²	108.1	51%	0.513	57%	0.567	S	S	.	*			trans	-96.2	77.5	-179.6	-145.2	-62.1	0	0	0	112.1	I304 L310 I313	I304-F307 HydrophobicContact CG2-CB 4.27Å; F307-L310 HydrophobicContact CB-CD1 3.99Å; F307-L310 HydrophobicContact CD1-CD1 3.85Å; F307-L310 HydrophobicContact CG-CD1 4.1Å; F307-I313 HydrophobicContact CD1-CD1 3.93Å; F307-I313 HydrophobicContact CE1-CD1 3.58Å; F307-I313 HydrophobicContact CE2-CD1 4.42Å; F307-I313 HydrophobicContact CZ-CD1 3.85Å
308	T	42	Very low	51.5	Low	117 Å²	117	109.5 Å²	109.5	72%	0.718	57%	0.572	S	S	*	*			trans	-64.4	149.6	169.2	46.3	0	0	0	0	111.5	N306	N306-T308 PolarHBondContact O-N 2.96Å
309	N	40	Very low	52	Low	142 Å²	142	109.9 Å²	109.9	76%	0.759	57%	0.569	S	S	*	*			trans	65.3	65.8	-174.9	-56.9	-13.7	0	0	0	114
310	L	48.1	Very low	52.7	Low	69 Å²	69	111.3 Å²	111.3	36%	0.361	57%	0.573	S	S	.	*			trans	-92.5	2.1	-170.3	-152	72.5	0	0	0	115.5	K300 F307 I313	K300-L310 HydrophobicContact CD-CD2 3.9Å; F307-L310 HydrophobicContact CB-CD1 3.99Å; F307-L310 HydrophobicContact CD1-CD1 3.85Å; F307-L310 HydrophobicContact CG-CD1 4.1Å; L310-I313 HydrophobicContact CD1-CD1 3.93Å
311	D	49.5	Very low	53.9	Low	155 Å²	155	110.8 Å²	110.8	83%	0.829	57%	0.574	S	S	*	*	S	Bend	trans	-83.8	-23.3	-173.3	-69.4	-51.3	0	0	0	114.8
312	Q	45.9	Very low	55.1	Low	179 Å²	179	112.3 Å²	112.3	84%	0.836	58%	0.578	S	S	*	*	S	Bend	trans	-81.7	-18.7	175.6	-70.3	-172.2	-59.6	0	0	113.2	K314	Q312-K314 VanDerWaalsContact C-N 3.29Å; Q312-K314 PolarHBondContact O-N 3.21Å
313	I	50.4	Low	56.1	Low	42 Å²	42	113.7 Å²	113.7	22%	0.215	59%	0.587	C	S	.	*			trans	-80.4	77	177.6	-42.4	179.9	0	0	0	110.2	L296 F307 L310	L296-I313 HydrophobicContact CD2-CG2 3.8Å; F307-I313 HydrophobicContact CD1-CD1 3.93Å; F307-I313 HydrophobicContact CE1-CD1 3.58Å; F307-I313 HydrophobicContact CE2-CD1 4.42Å; F307-I313 HydrophobicContact CZ-CD1 3.85Å; L310-I313 HydrophobicContact CD1-CD1 3.93Å
314	K	57.1	Low	58	Low	150 Å²	150	113.1 Å²	113.1	65%	0.652	58%	0.58	S	S	*	*	S	Bend	trans	-94.6	-51.2	168.4	-106.3	171.8	178.4	167.7	0	113	S293 Q312	S293-K314 WeakPolarHBondContact CA-O 3.3Å; S293-K314 WeakPolarHBondContact CB-O 3.42Å; Q312-K314 VanDerWaalsContact C-N 3.29Å; Q312-K314 PolarHBondContact O-N 3.21Å
315	N	62.2	Low	59	Low	52 Å²	52	111.1 Å²	111.1	28%	0.278	58%	0.575	S	S	.	*	S	Bend	trans	-138.1	5	178.5	-70.7	-29.5	0	0	0	114.8	W292 S293 I330	W292-N315 VanDerWaalsContact CB-OD1 3.3Å; W292-N315 WeakPolarHBondContact CB-OD1 3.37Å; S293-N315 PolarHBondContact N-OD1 3.44Å; S293-N315 VanDerWaalsContact N-OD1 3.08Å; N315-I330 WeakPolarHBondContact O-CG1 3.35Å; N315-I330 PolarHBondContact O-N 3.37Å; N315-I330 VanDerWaalsContact O-N 3.1Å
316	E	66.6	Low	59.9	Low	72 Å²	72	110.9 Å²	110.9	34%	0.336	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.3	142.2	-163.3	-77.9	171	-177.5	0	0	113.8	I327 Q329	E316-I327 HydrophobicContact CB-CG2 3.96Å; E316-I327 VanDerWaalsContact CD-CG2 3.47Å; E316-I327 HydrophobicContact CG-CG2 3.73Å; E316-I327 WeakPolarHBondContact OE2-CG2 3.31Å; E316-Q329 HydrophobicContact CG-CG 3.56Å; E316-Q329 PolarHBondContact OE1-NE2 2.96Å
317	I	66.8	Low	61	Low	77 Å²	77	108.9 Å²	108.9	40%	0.395	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.7	122.7	172	-57.7	177.4	0	0	0	108.2	I319 L328 I330 I333	I317-I319 HydrophobicContact CG2-CG1 4.08Å; I317-L328 PolarHBondContact N-O 3.42Å; I317-L328 PolarHBondContact O-N 2.87Å; I317-I330 HydrophobicContact CD1-CD1 3.92Å; I317-I330 HydrophobicContact CD1-CG1 3.75Å; I317-I330 HydrophobicContact CG1-CD1 3.75Å; I317-I330 HydrophobicContact CG1-CG1 3.77Å; I317-I333 HydrophobicContact CD1-CD1 4.3Å
318	T	64.8	Low	62.2	Low	93 Å²	93	106.7 Å²	106.7	57%	0.571	55%	0.546	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	118.2	173.2	42.5	0	0	0	0	110.6	I327	T318-I327 HydrophobicContact CG2-CG1 4.19Å
319	I	68.3	Low	64	Low	74 Å²	74	103.3 Å²	103.3	38%	0.379	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.7	174.5	-51.6	179.4	0	0	0	108.1	I317 I321 Y326 L328	I317-I319 HydrophobicContact CG2-CG1 4.08Å; I319-I321 HydrophobicContact CG2-CD1 4.2Å; I319-I321 HydrophobicContact CG2-CG1 3.94Å; I319-Y326 PolarHBondContact N-O 2.85Å; I319-Y326 WeakPolarHBondContact O-CB 3.33Å; I319-Y326 PolarHBondContact O-N 2.86Å; I319-L328 HydrophobicContact CD1-CD2 4.12Å
320	Q	71.4	Confident	66	Low	127 Å²	127	97.8 Å²	97.8	59%	0.593	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	123.5	173.9	-59.8	-64.8	-10.6	0	0	109.6	Q324	Q320-Q324 PolarHBondContact OE1-O 3.28Å
321	I	74.2	Confident	67.7	Low	87 Å²	87	96.3 Å²	96.3	45%	0.446	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	124.3	172.4	-52.6	177.2	0	0	0	107.4	I319 D323 Q324 Y326	I319-I321 HydrophobicContact CG2-CD1 4.2Å; I319-I321 HydrophobicContact CG2-CG1 3.94Å; I321-D323 VanDerWaalsContact C-N 3.31Å; I321-D323 PolarHBondContact O-N 3.24Å; I321-Q324 PolarHBondContact N-O 3.13Å; I321-Q324 PolarHBondContact O-N 3.41Å; I321-Y326 HydrophobicContact CB-CD2 3.91Å; I321-Y326 HydrophobicContact CB-CE2 3.81Å; I321-Y326 HydrophobicContact CD1-CD2 4.22Å; I321-Y326 HydrophobicContact CG1-CD2 4.11Å; I321-Y326 HydrophobicContact CG1-CE2 4.46Å
322	N	74.5	Confident	69.4	Low	149 Å²	149	90 Å²	90	80%	0.797	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	50.2	-178.2	-58.7	-3.7	0	0	0	112.8	Q324	N322-Q324 PolarHBondContact O-N 2.94Å; N322-Q324 VanDerWaalsContact O-N 3.1Å
323	D	73.7	Confident	71.4	Confident	150 Å²	150	84.6 Å²	84.6	80%	0.802	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	23.2	-178.1	-53.7	-48.1	0	0	0	115.1	I321	I321-D323 VanDerWaalsContact C-N 3.31Å; I321-D323 PolarHBondContact O-N 3.24Å
324	Q	72.2	Confident	73.3	Confident	114 Å²	114	83.9 Å²	83.9	53%	0.533	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130	172.4	-63.7	-63	-82.6	0	0	111.5	Q320 I321 N322 Y326	Q320-Q324 PolarHBondContact OE1-O 3.28Å; I321-Q324 PolarHBondContact N-O 3.13Å; I321-Q324 PolarHBondContact O-N 3.41Å; N322-Q324 PolarHBondContact O-N 2.94Å; N322-Q324 VanDerWaalsContact O-N 3.1Å; Q324-Y326 HydrophobicContact CB-CD2 4.48Å; Q324-Y326 HydrophobicContact CB-CE2 3.86Å; Q324-Y326 WeakPolarHBondContact O-CD2 3.4Å; Q324-Y326 PolarHBondContact O-N 3.46Å
325	P	70.3	Confident	74.9	Confident	77 Å²	77	78.2 Å²	78.2	50%	0.5	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	103.5	177.6	30.9	-33.2	0	0	0	111.3	I327	P325-I327 PolarHBondContact O-N 3.47Å
326	Y	68.2	Low	76.3	Confident	137 Å²	137	78.7 Å²	78.7	54%	0.537	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	106.8	170.2	-68.1	-89.2	0	0	0	109.8	I319 I321 Q324	I319-Y326 PolarHBondContact N-O 2.85Å; I319-Y326 WeakPolarHBondContact O-CB 3.33Å; I319-Y326 PolarHBondContact O-N 2.86Å; I321-Y326 HydrophobicContact CB-CD2 3.91Å; I321-Y326 HydrophobicContact CB-CE2 3.81Å; I321-Y326 HydrophobicContact CD1-CD2 4.22Å; I321-Y326 HydrophobicContact CG1-CD2 4.11Å; I321-Y326 HydrophobicContact CG1-CE2 4.46Å; Q324-Y326 HydrophobicContact CB-CD2 4.48Å; Q324-Y326 HydrophobicContact CB-CE2 3.86Å; Q324-Y326 WeakPolarHBondContact O-CD2 3.4Å; Q324-Y326 PolarHBondContact O-N 3.46Å
327	I	69.3	Low	77.6	Confident	107 Å²	107	79.2 Å²	79.2	55%	0.549	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	117.9	174.8	-55.2	173.5	0	0	0	108.6	E316 T318 P325	E316-I327 HydrophobicContact CB-CG2 3.96Å; E316-I327 VanDerWaalsContact CD-CG2 3.47Å; E316-I327 HydrophobicContact CG-CG2 3.73Å; E316-I327 WeakPolarHBondContact OE2-CG2 3.31Å; T318-I327 HydrophobicContact CG2-CG1 4.19Å; P325-I327 PolarHBondContact O-N 3.47Å
328	L	71	Confident	78.9	Confident	71 Å²	71	76.7 Å²	76.7	37%	0.372	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	114.6	-176.6	-170.5	62.3	0	0	0	110.7	I317 I319 I333	I317-L328 PolarHBondContact N-O 3.42Å; I317-L328 PolarHBondContact O-N 2.87Å; I319-L328 HydrophobicContact CD1-CD2 4.12Å; L328-I333 HydrophobicContact CD1-CG1 4.09Å; L328-I333 HydrophobicContact CD2-CD1 3.6Å; L328-I333 HydrophobicContact CD2-CG1 3.74Å; L328-I333 HydrophobicContact CG-CD1 3.72Å; L328-I333 HydrophobicContact CG-CG1 3.61Å
329	Q	79.1	Confident	80.3	Confident	45 Å²	45	72.6 Å²	72.6	21%	0.21	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	128	-177.2	-77.3	-177.8	-19.9	0	0	111.2	E316 D331 V332 I333	E316-Q329 HydrophobicContact CG-CG 3.56Å; E316-Q329 PolarHBondContact OE1-NE2 2.96Å; Q329-D331 WeakPolarHBondContact CB-OD1 3.48Å; Q329-D331 PolarHBondContact O-N 2.76Å; Q329-V332 HydrophobicContact CB-CB 4.31Å; Q329-V332 HydrophobicContact CB-CG2 3.81Å; Q329-V332 WeakPolarHBondContact O-CB 3.48Å; Q329-V332 PolarHBondContact O-N 3.26Å; Q329-V332 VanDerWaalsContact O-N 3.11Å; Q329-I333 PolarHBondContact O-N 2.96Å; Q329-I333 VanDerWaalsContact O-N 3.08Å
330	I	83.1	Confident	81.5	Confident	27 Å²	27	72.7 Å²	72.7	14%	0.138	37%	0.369	C	S	.	.	H	α-helix	trans	-70.2	-36.2	-165.6	-66.7	169.1	0	0	0	112.4	W292 L296 N315 I317 V332 I333 Y334	W292-I330 HydrophobicContact CE3-CG2 3.78Å; W292-I330 HydrophobicContact CZ3-CG2 4.16Å; L296-I330 HydrophobicContact CD1-CD1 3.71Å; L296-I330 HydrophobicContact CD2-CD1 3.73Å; L296-I330 HydrophobicContact CG-CD1 4.18Å; N315-I330 WeakPolarHBondContact O-CG1 3.35Å; N315-I330 PolarHBondContact O-N 3.37Å; N315-I330 VanDerWaalsContact O-N 3.1Å; I317-I330 HydrophobicContact CD1-CD1 3.92Å; I317-I330 HydrophobicContact CD1-CG1 3.75Å; I317-I330 HydrophobicContact CG1-CD1 3.75Å; I317-I330 HydrophobicContact CG1-CG1 3.77Å; I330-V332 VanDerWaalsContact C-N 3.28Å; I330-V332 PolarHBondContact O-N 3.5Å; I330-I333 PolarHBondContact O-N 2.98Å; I330-Y334 WeakPolarHBondContact O-CB 3.34Å; I330-Y334 PolarHBondContact O-N 3.35Å
331	D	83.3	Confident	82.7	Confident	38 Å²	38	69 Å²	69	20%	0.203	35%	0.353	C	S	.	.	H	α-helix	trans	-56.8	-40.1	169.9	56.4	-67.4	0	0	0	112.2	W292 Q329 T335	W292-D331 HydrophobicContact CD2-CB 4.1Å; W292-D331 HydrophobicContact CG-CB 3.94Å; Q329-D331 WeakPolarHBondContact CB-OD1 3.48Å; Q329-D331 PolarHBondContact O-N 2.76Å; D331-T335 WeakPolarHBondContact O-CB 3.32Å; D331-T335 PolarHBondContact O-N 3.27Å; D331-T335 PolarHBondContact O-OG1 2.87Å
332	V	85.4	Confident	83.6	Confident	23 Å²	23	65.7 Å²	65.7	14%	0.139	34%	0.336	C	S	.	.	H	α-helix	trans	-69.7	-44.9	177.2	-175.5	0	0	0	0	110.7	Q329 I330 Y334 T335 I336 L411	Q329-V332 HydrophobicContact CB-CB 4.31Å; Q329-V332 HydrophobicContact CB-CG2 3.81Å; Q329-V332 WeakPolarHBondContact O-CB 3.48Å; Q329-V332 PolarHBondContact O-N 3.26Å; Q329-V332 VanDerWaalsContact O-N 3.11Å; I330-V332 VanDerWaalsContact C-N 3.28Å; I330-V332 PolarHBondContact O-N 3.5Å; V332-Y334 VanDerWaalsContact C-N 3.34Å; V332-Y334 PolarHBondContact O-N 2.88Å; V332-T335 PolarHBondContact O-N 3.3Å; V332-I336 HydrophobicContact CG1-CD1 3.78Å; V332-I336 HydrophobicContact CG1-CG1 4.46Å; V332-I336 WeakPolarHBondContact O-CB 3.29Å; V332-I336 VanDerWaalsContact O-CG1 3.24Å; V332-I336 WeakPolarHBondContact O-CG1 3.25Å; V332-I336 PolarHBondContact O-N 2.96Å; V332-L411 HydrophobicContact CG1-CD1 4.04Å; V332-L411 HydrophobicContact CG1-CD2 4.12Å; V332-L411 HydrophobicContact CG2-CD2 3.94Å
333	I	87.5	Confident	84.5	Confident	65 Å²	65	59 Å²	59	33%	0.333	30%	0.3	S	S	.	.	H	α-helix	trans	-55.6	-52.8	174	-55.1	169.4	0	0	0	109.7	I317 L328 Q329 I330 T335 I336 L337	I317-I333 HydrophobicContact CD1-CD1 4.3Å; L328-I333 HydrophobicContact CD1-CG1 4.09Å; L328-I333 HydrophobicContact CD2-CD1 3.6Å; L328-I333 HydrophobicContact CD2-CG1 3.74Å; L328-I333 HydrophobicContact CG-CD1 3.72Å; L328-I333 HydrophobicContact CG-CG1 3.61Å; Q329-I333 PolarHBondContact O-N 2.96Å; Q329-I333 VanDerWaalsContact O-N 3.08Å; I330-I333 PolarHBondContact O-N 2.98Å; I333-T335 PolarHBondContact O-N 3.02Å; I333-I336 PolarHBondContact O-N 3.47Å; I333-L337 WeakPolarHBondContact O-CB 3.27Å; I333-L337 PolarHBondContact O-N 3.43Å
334	Y	90.8	Very high	85.5	Confident	26 Å²	26	56.6 Å²	56.6	10%	0.102	28%	0.282	C	S	.	.	H	α-helix	trans	-64.7	-42.8	-174.3	177.1	-101.7	0	0	0	111.6	I269 P270 P272 V273 W292 I330 V332 I336 L337 L338	I269-Y334 PolarHBondContact O-OH 3.33Å; P270-Y334 WeakPolarHBondContact CA-OH 3.48Å; P272-Y334 HydrophobicContact CB-CE2 4.19Å; P272-Y334 HydrophobicContact CG-CE2 3.78Å; V273-Y334 HydrophobicContact CG2-CE1 4.18Å; V273-Y334 WeakPolarHBondContact CG2-OH 3.49Å; W292-Y334 AromaticContact CH2-CD1 3.22Å; W292-Y334 HydrophobicContact CH2-CD1 3.22Å; W292-Y334 AromaticContact CH2-CD2 3.99Å; W292-Y334 HydrophobicContact CH2-CD2 3.99Å; W292-Y334 AromaticContact CH2-CE1 3.69Å; W292-Y334 HydrophobicContact CH2-CE1 3.69Å; W292-Y334 HydrophobicContact CH2-CE2 4.41Å; W292-Y334 AromaticContact CH2-CG 3.35Å; W292-Y334 HydrophobicContact CH2-CG 3.35Å; W292-Y334 AromaticContact CZ2-CD1 3.43Å; W292-Y334 HydrophobicContact CZ2-CD1 3.43Å; W292-Y334 VanDerWaalsContact CZ2-CD1 3.43Å; W292-Y334 AromaticContact CZ2-CE1 3.92Å; W292-Y334 HydrophobicContact CZ2-CE1 3.92Å; W292-Y334 AromaticContact CZ2-CG 3.99Å; W292-Y334 HydrophobicContact CZ2-CG 3.99Å; W292-Y334 HydrophobicContact CZ3-CD1 4.39Å; W292-Y334 HydrophobicContact CZ3-CG 4.15Å; I330-Y334 WeakPolarHBondContact O-CB 3.34Å; I330-Y334 PolarHBondContact O-N 3.35Å; V332-Y334 VanDerWaalsContact C-N 3.34Å; V332-Y334 PolarHBondContact O-N 2.88Å; Y334-I336 PolarHBondContact O-N 3.13Å; Y334-L337 WeakPolarHBondContact O-CB 3.36Å; Y334-L337 PolarHBondContact O-N 2.95Å; Y334-L338 HydrophobicContact CD1-CD1 4.06Å; Y334-L338 HydrophobicContact CD1-CG 4.12Å; Y334-L338 HydrophobicContact CE1-CD1 3.42Å; Y334-L338 VanDerWaalsContact CE1-CD1 3.42Å; Y334-L338 HydrophobicContact CE1-CD2 4.25Å; Y334-L338 HydrophobicContact CE1-CG 3.78Å; Y334-L338 HydrophobicContact CE2-CD2 4.02Å; Y334-L338 HydrophobicContact CE2-CG 4.28Å; Y334-L338 WeakPolarHBondContact O-CG 3.19Å; Y334-L338 PolarHBondContact O-N 3.4Å
335	T	90.8	Very high	86.6	Confident	32 Å²	32	55 Å²	55	20%	0.196	28%	0.277	C	S	.	.	H	α-helix	trans	-71.1	-33.1	-179.6	-50.2	0	0	0	0	112.2	D331 V332 I333 M339 Y407	D331-T335 WeakPolarHBondContact O-CB 3.32Å; D331-T335 PolarHBondContact O-N 3.27Å; D331-T335 PolarHBondContact O-OG1 2.87Å; V332-T335 PolarHBondContact O-N 3.3Å; I333-T335 PolarHBondContact O-N 3.02Å; T335-M339 VanDerWaalsContact O-CB 3.28Å; T335-M339 WeakPolarHBondContact O-CB 3.33Å; T335-M339 PolarHBondContact O-N 3Å; T335-Y407 WeakPolarHBondContact CB-OH 3.49Å; T335-Y407 HydrophobicContact CG2-CD1 4.17Å; T335-Y407 HydrophobicContact CG2-CE1 3.37Å; T335-Y407 HydrophobicContact CG2-CE2 4.27Å; T335-Y407 VanDerWaalsContact CG2-CZ 3.45Å; T335-Y407 WeakPolarHBondContact CG2-OH 3.31Å
336	I	91.8	Very high	87.8	Confident	61 Å²	61	51.3 Å²	51.3	31%	0.313	25%	0.253	S	S	.	.	H	α-helix	trans	-64.3	-42.9	169	-69.8	170.7	0	0	0	110.5	V332 I333 Y334 M339 I340	V332-I336 HydrophobicContact CG1-CD1 3.78Å; V332-I336 HydrophobicContact CG1-CG1 4.46Å; V332-I336 WeakPolarHBondContact O-CB 3.29Å; V332-I336 VanDerWaalsContact O-CG1 3.24Å; V332-I336 WeakPolarHBondContact O-CG1 3.25Å; V332-I336 PolarHBondContact O-N 2.96Å; I333-I336 PolarHBondContact O-N 3.47Å; Y334-I336 PolarHBondContact O-N 3.13Å; I336-M339 HydrophobicContact CB-CE 4.49Å; I336-M339 HydrophobicContact CG1-CE 4.24Å; I336-M339 HydrophobicContact CG2-CE 4.39Å; I336-M339 WeakPolarHBondContact O-CB 3.33Å; I336-M339 PolarHBondContact O-N 3.34Å; I336-I340 HydrophobicContact CG2-CD1 3.92Å; I336-I340 WeakPolarHBondContact O-CG1 3.47Å; I336-I340 PolarHBondContact O-N 3.32Å
337	L	93.9	Very high	89	Confident	84 Å²	84	46.5 Å²	46.5	44%	0.44	24%	0.236	S	C	.	.	H	α-helix	trans	-62.2	-46	176.2	179.6	62.8	0	0	0	111.9	I333 Y334 M339 I340 L341	I333-L337 WeakPolarHBondContact O-CB 3.27Å; I333-L337 PolarHBondContact O-N 3.43Å; Y334-L337 WeakPolarHBondContact O-CB 3.36Å; Y334-L337 PolarHBondContact O-N 2.95Å; L337-M339 VanDerWaalsContact C-N 3.33Å; L337-M339 PolarHBondContact O-N 3.23Å; L337-I340 PolarHBondContact O-N 3.01Å; L337-L341 HydrophobicContact CD1-CD1 3.86Å; L337-L341 HydrophobicContact CD1-CG 4.08Å; L337-L341 HydrophobicContact CG-CD1 3.9Å; L337-L341 HydrophobicContact CG-CG 4.45Å; L337-L341 WeakPolarHBondContact O-CB 3.42Å; L337-L341 VanDerWaalsContact O-CG 3.32Å; L337-L341 WeakPolarHBondContact O-CG 3.43Å; L337-L341 PolarHBondContact O-N 2.98Å
338	L	93.6	Very high	90.2	Very high	23 Å²	23	43.6 Å²	43.6	12%	0.12	23%	0.233	C	C	.	.	H	α-helix	trans	-58.6	-45	174	-69.5	-165.3	0	0	0	111.4	F225 I269 Y334 I340 L341 Q342	F225-L338 HydrophobicContact CE2-CD2 3.95Å; F225-L338 HydrophobicContact CZ-CD2 3.9Å; I269-L338 HydrophobicContact CG2-CD2 3.56Å; Y334-L338 HydrophobicContact CD1-CD1 4.06Å; Y334-L338 HydrophobicContact CD1-CG 4.12Å; Y334-L338 HydrophobicContact CE1-CD1 3.42Å; Y334-L338 VanDerWaalsContact CE1-CD1 3.42Å; Y334-L338 HydrophobicContact CE1-CD2 4.25Å; Y334-L338 HydrophobicContact CE1-CG 3.78Å; Y334-L338 HydrophobicContact CE2-CD2 4.02Å; Y334-L338 HydrophobicContact CE2-CG 4.28Å; Y334-L338 WeakPolarHBondContact O-CG 3.19Å; Y334-L338 PolarHBondContact O-N 3.4Å; L338-I340 VanDerWaalsContact C-N 3.34Å; L338-I340 PolarHBondContact O-N 2.96Å; L338-L341 PolarHBondContact O-N 3.37Å; L338-Q342 WeakPolarHBondContact O-CB 3.38Å; L338-Q342 WeakPolarHBondContact O-CG 3.28Å; L338-Q342 PolarHBondContact O-N 2.99Å
339	M	93.6	Very high	91.3	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.039	24%	0.235	C	C	.	.	H	α-helix	trans	-60.2	-40.7	176.4	170.9	171.1	73.2	0	0	112.7	T335 I336 L337 Y343 F344 H404 L408	T335-M339 VanDerWaalsContact O-CB 3.28Å; T335-M339 WeakPolarHBondContact O-CB 3.33Å; T335-M339 PolarHBondContact O-N 3Å; I336-M339 HydrophobicContact CB-CE 4.49Å; I336-M339 HydrophobicContact CG1-CE 4.24Å; I336-M339 HydrophobicContact CG2-CE 4.39Å; I336-M339 WeakPolarHBondContact O-CB 3.33Å; I336-M339 PolarHBondContact O-N 3.34Å; L337-M339 VanDerWaalsContact C-N 3.33Å; L337-M339 PolarHBondContact O-N 3.23Å; M339-Y343 WeakPolarHBondContact O-CB 3.09Å; M339-Y343 PolarHBondContact O-N 3.43Å; M339-F344 HydrophobicContact CE-CE2 4.12Å; M339-F344 HydrophobicContact CG-CD2 3.77Å; M339-F344 HydrophobicContact CG-CE2 3.55Å; M339-F344 PolarHBondContact O-N 3.46Å; M339-F344 HydrophobicContact SD-CE2 3.8Å; M339-H404 VanDerWaalsContact CB-CE1 3.42Å; M339-H404 WeakPolarHBondContact CB-CE1 3.27Å; M339-H404 VanDerWaalsContact CG-CE1 3.41Å; M339-H404 WeakPolarHBondContact CG-CE1 3.33Å; M339-H404 VanDerWaalsContact CG-ND1 3.27Å; M339-H404 WeakPolarHBondContact CG-ND1 3.39Å; M339-H404 HydrophobicContact SD-CB 4.16Å; M339-H404 PolarHBondContact SD-ND1 3.01Å; M339-L408 HydrophobicContact CE-CD1 3.95Å; M339-L408 HydrophobicContact CE-CD2 3.7Å; M339-L408 HydrophobicContact CE-CG 3.95Å; M339-L408 HydrophobicContact SD-CD1 3.85Å; M339-L408 HydrophobicContact SD-CD2 4.4Å; M339-L408 HydrophobicContact SD-CG 3.98Å
340	I	95	Very high	92	Very high	75 Å²	75	42.1 Å²	42.1	39%	0.385	23%	0.225	S	C	.	.	I	π-helix	trans	-63.7	-50.9	173.9	-69.1	164.6	0	0	0	110.1	I336 L337 L338 F344 L345	I336-I340 HydrophobicContact CG2-CD1 3.92Å; I336-I340 WeakPolarHBondContact O-CG1 3.47Å; I336-I340 PolarHBondContact O-N 3.32Å; L337-I340 PolarHBondContact O-N 3.01Å; L338-I340 VanDerWaalsContact C-N 3.34Å; L338-I340 PolarHBondContact O-N 2.96Å; I340-F344 PolarHBondContact O-N 3.33Å; I340-L345 VanDerWaalsContact O-CB 3.28Å; I340-L345 WeakPolarHBondContact O-CB 3.41Å; I340-L345 PolarHBondContact O-N 3.04Å
341	L	94.7	Very high	92.5	Very high	51 Å²	51	43.6 Å²	43.6	27%	0.267	24%	0.237	S	C	.	.	I	π-helix	trans	-72.8	-32.7	-172.7	-66.3	174.9	0	0	0	114.4	F225 I269 L337 L338 P346	F225-L341 HydrophobicContact CE1-CB 3.8Å; F225-L341 HydrophobicContact CZ-CB 4.16Å; I269-L341 HydrophobicContact CD1-CD1 4.44Å; I269-L341 HydrophobicContact CG2-CD1 4.21Å; L337-L341 HydrophobicContact CD1-CD1 3.86Å; L337-L341 HydrophobicContact CD1-CG 4.08Å; L337-L341 HydrophobicContact CG-CD1 3.9Å; L337-L341 HydrophobicContact CG-CG 4.45Å; L337-L341 WeakPolarHBondContact O-CB 3.42Å; L337-L341 VanDerWaalsContact O-CG 3.32Å; L337-L341 WeakPolarHBondContact O-CG 3.43Å; L337-L341 PolarHBondContact O-N 2.98Å; L338-L341 PolarHBondContact O-N 3.37Å; L341-P346 WeakPolarHBondContact O-CD 3.33Å; L341-P346 WeakPolarHBondContact O-CG 3.41Å
342	Q	93	Very high	93	Very high	16 Å²	16	43.6 Å²	43.6	8%	0.075	25%	0.247	C	C	.	.	I	π-helix	trans	-94.7	-24.3	-176.9	85.9	-166.5	-9.5	0	0	113.8	V224 F225 A228 L338 Y396 H404	V224-Q342 HydrophobicContact CG1-CB 4.27Å; V224-Q342 HydrophobicContact CG1-CG 4.25Å; F225-Q342 HydrophobicContact CD1-CB 4.09Å; F225-Q342 HydrophobicContact CE1-CB 3.66Å; F225-Q342 HydrophobicContact CE2-CB 4.27Å; F225-Q342 HydrophobicContact CZ-CB 3.75Å; A228-Q342 WeakPolarHBondContact CB-O 3.45Å; L338-Q342 WeakPolarHBondContact O-CB 3.38Å; L338-Q342 WeakPolarHBondContact O-CG 3.28Å; L338-Q342 PolarHBondContact O-N 2.99Å; Q342-Y396 PolarHBondContact O-OH 3.44Å; Q342-H404 PolarHBondContact NE2-CE1 2.9Å; Q342-H404 PolarHBondContact NE2-NE2 3.44Å; Q342-H404 VanDerWaalsContact NE2-NE2 3.12Å
343	Y	94	Very high	93.4	Very high	9 Å²	9	43.3 Å²	43.3	4%	0.035	25%	0.245	C	C	.	.	I	π-helix	trans	-122.6	-68.1	-173.3	-178.7	-109.7	0	0	0	112.6	M339 L347 G397 Q400 L401 H404	M339-Y343 WeakPolarHBondContact O-CB 3.09Å; M339-Y343 PolarHBondContact O-N 3.43Å; Y343-L347 HydrophobicContact CE1-CD2 4.3Å; Y343-L347 HydrophobicContact CE2-CD2 4Å; Y343-L347 WeakPolarHBondContact O-CB 3.26Å; Y343-L347 PolarHBondContact O-N 2.94Å; Y343-G397 WeakPolarHBondContact CE2-O 3.42Å; Y343-G397 PolarHBondContact OH-O 3.1Å; Y343-Q400 HydrophobicContact CD2-CB 3.58Å; Y343-Q400 HydrophobicContact CD2-CG 4.4Å; Y343-Q400 HydrophobicContact CE2-CB 3.6Å; Y343-L401 HydrophobicContact CE1-CD1 4.36Å; Y343-L401 WeakPolarHBondContact OH-CB 3.38Å; Y343-H404 AromaticContact CD1-CD2 3.84Å; Y343-H404 AromaticContact CG-CD2 3.67Å
344	F	94.3	Very high	93.5	Very high	99 Å²	99	41.2 Å²	41.2	43%	0.434	23%	0.233	S	C	.	.	I	π-helix	trans	-65.7	-45.5	-170.7	-71.7	-67.3	0	0	0	113.9	M339 I340 G348	M339-F344 HydrophobicContact CE-CE2 4.12Å; M339-F344 HydrophobicContact CG-CD2 3.77Å; M339-F344 HydrophobicContact CG-CE2 3.55Å; M339-F344 PolarHBondContact O-N 3.46Å; M339-F344 HydrophobicContact SD-CE2 3.8Å; I340-F344 PolarHBondContact O-N 3.33Å; F344-G348 PolarHBondContact O-N 2.86Å
345	L	95.3	Very high	93.5	Very high	80 Å²	80	45.2 Å²	45.2	42%	0.419	26%	0.255	S	S	.	.	H	α-helix	trans	-67.8	-47.9	179.4	174.9	150.6	0	0	0	111.9	I340 G348 M349	I340-L345 VanDerWaalsContact O-CB 3.28Å; I340-L345 WeakPolarHBondContact O-CB 3.41Å; I340-L345 PolarHBondContact O-N 3.04Å; L345-G348 PolarHBondContact O-N 3.42Å; L345-M349 HydrophobicContact CD2-CE 3.51Å; L345-M349 HydrophobicContact CD2-SD 4.46Å; L345-M349 HydrophobicContact CG-CE 4.33Å; L345-M349 WeakPolarHBondContact O-CG 3.29Å; L345-M349 PolarHBondContact O-N 3.36Å; L345-M349 VanDerWaalsContact O-N 3.13Å
346	P	95.3	Very high	93.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.3	-48.6	172.1	-29.3	38.4	0	0	0	112.9	A228 V232 L341 G348 M349 I350	A228-P346 HydrophobicContact CB-CB 4.3Å; A228-P346 HydrophobicContact CB-CG 4.18Å; V232-P346 HydrophobicContact CG2-CB 3.84Å; L341-P346 WeakPolarHBondContact O-CD 3.33Å; L341-P346 WeakPolarHBondContact O-CG 3.41Å; P346-G348 PolarHBondContact O-N 3.21Å; P346-M349 PolarHBondContact O-N 3.46Å; P346-I350 HydrophobicContact CB-CD1 4.43Å; P346-I350 VanDerWaalsContact O-CB 3.29Å; P346-I350 WeakPolarHBondContact O-CB 3.39Å; P346-I350 WeakPolarHBondContact O-CD1 3.26Å; P346-I350 WeakPolarHBondContact O-CG1 3.42Å; P346-I350 PolarHBondContact O-N 3.15Å
347	L	93.7	Very high	93.3	Very high	36 Å²	36	41.8 Å²	41.8	19%	0.188	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-41.5	-179.6	-176.1	67.2	0	0	0	111.7	Y343 I350 C351	Y343-L347 HydrophobicContact CE1-CD2 4.3Å; Y343-L347 HydrophobicContact CE2-CD2 4Å; Y343-L347 WeakPolarHBondContact O-CB 3.26Å; Y343-L347 PolarHBondContact O-N 2.94Å; L347-I350 PolarHBondContact O-N 3.48Å; L347-C351 VanDerWaalsContact O-CB 3.29Å; L347-C351 WeakPolarHBondContact O-CB 3.43Å; L347-C351 PolarHBondContact O-N 2.82Å; L347-C351 PolarHBondContact O-SG 3.49Å; L347-C351 VanDerWaalsContact O-SG 3.34Å
348	G	94.3	Very high	92.9	Very high	47 Å²	47	39.2 Å²	39.2	49%	0.485	23%	0.233	S	C	.	.	H	α-helix	trans	-59.2	-47.4	175.9	0	0	0	0	0	112.6	F344 L345 P346 G352	F344-G348 PolarHBondContact O-N 2.86Å; L345-G348 PolarHBondContact O-N 3.42Å; P346-G348 PolarHBondContact O-N 3.21Å; G348-G352 PolarHBondContact O-N 3.17Å
349	M	95.7	Very high	92.6	Very high	82 Å²	82	42.4 Å²	42.4	40%	0.404	25%	0.249	S	C	.	.	H	α-helix	trans	-66	-40.6	176.5	-68	-171.5	-60.5	0	0	112.5	V232 L345 P346 T353	V232-M349 HydrophobicContact CB-CE 4.32Å; V232-M349 HydrophobicContact CG1-CE 3.63Å; V232-M349 HydrophobicContact CG1-SD 4.43Å; V232-M349 HydrophobicContact CG2-CE 3.69Å; L345-M349 HydrophobicContact CD2-CE 3.51Å; L345-M349 HydrophobicContact CD2-SD 4.46Å; L345-M349 HydrophobicContact CG-CE 4.33Å; L345-M349 WeakPolarHBondContact O-CG 3.29Å; L345-M349 PolarHBondContact O-N 3.36Å; L345-M349 VanDerWaalsContact O-N 3.13Å; P346-M349 PolarHBondContact O-N 3.46Å; M349-T353 WeakPolarHBondContact O-CB 3.49Å; M349-T353 WeakPolarHBondContact O-CG2 3.44Å; M349-T353 PolarHBondContact O-N 2.83Å; M349-T353 PolarHBondContact O-OG1 3.44Å
350	I	93.6	Very high	92.2	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-63.3	-48.3	177.5	-74.4	164.7	0	0	0	110.8	H231 V232 P346 L347 T353 Y354 A393	H231-I350 HydrophobicContact CB-CD1 3.58Å; H231-I350 HydrophobicContact CB-CG1 4.49Å; V232-I350 HydrophobicContact CG2-CD1 4.07Å; V232-I350 HydrophobicContact CG2-CG1 4.06Å; P346-I350 HydrophobicContact CB-CD1 4.43Å; P346-I350 VanDerWaalsContact O-CB 3.29Å; P346-I350 WeakPolarHBondContact O-CB 3.39Å; P346-I350 WeakPolarHBondContact O-CD1 3.26Å; P346-I350 WeakPolarHBondContact O-CG1 3.42Å; P346-I350 PolarHBondContact O-N 3.15Å; L347-I350 PolarHBondContact O-N 3.48Å; I350-T353 PolarHBondContact O-OG1 3.24Å; I350-T353 VanDerWaalsContact O-OG1 3.07Å; I350-Y354 HydrophobicContact CG2-CD2 3.86Å; I350-Y354 HydrophobicContact CG2-CE2 3.96Å; I350-Y354 VanDerWaalsContact O-CD2 3.24Å; I350-Y354 WeakPolarHBondContact O-CD2 3.3Å; I350-Y354 PolarHBondContact O-N 3.05Å; I350-A393 HydrophobicContact CG2-CB 3.56Å
351	C	93	Very high	91.4	Very high	57 Å²	57	43.5 Å²	43.5	39%	0.385	25%	0.253	S	S	.	.	H	α-helix	trans	-62.5	-49.6	176.1	-74	0	0	0	0	111.3	L347 T353 Y354 I355	L347-C351 VanDerWaalsContact O-CB 3.29Å; L347-C351 WeakPolarHBondContact O-CB 3.43Å; L347-C351 PolarHBondContact O-N 2.82Å; L347-C351 PolarHBondContact O-SG 3.49Å; L347-C351 VanDerWaalsContact O-SG 3.34Å; C351-T353 PolarHBondContact O-N 3.27Å; C351-Y354 PolarHBondContact O-N 2.91Å; C351-I355 WeakPolarHBondContact O-CB 3.14Å; C351-I355 WeakPolarHBondContact O-CD1 3.48Å; C351-I355 WeakPolarHBondContact O-CG1 3.44Å; C351-I355 PolarHBondContact O-N 3.45Å
352	G	93.2	Very high	90.7	Very high	39 Å²	39	47.1 Å²	47.1	40%	0.402	27%	0.271	S	S	.	.	H	α-helix	trans	-58.1	-45.2	178.3	0	0	0	0	0	113	G348 A356	G348-G352 PolarHBondContact O-N 3.17Å; G352-A356 VanDerWaalsContact O-CB 3.29Å; G352-A356 WeakPolarHBondContact O-CB 3.49Å; G352-A356 PolarHBondContact O-N 2.86Å
353	T	93.6	Very high	89.7	Confident	17 Å²	17	53.2 Å²	53.2	10%	0.104	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-41.4	177.2	46.5	0	0	0	0	112.7	S235 W236 F239 M349 I350 C351 I357	S235-T353 VanDerWaalsContact CB-OG1 3.24Å; S235-T353 WeakPolarHBondContact CB-OG1 3.3Å; S235-T353 PolarHBondContact OG-OG1 3.48Å; W236-T353 HydrophobicContact CE3-CG2 4.42Å; F239-T353 HydrophobicContact CB-CG2 4.11Å; F239-T353 HydrophobicContact CD2-CG2 4.37Å; F239-T353 HydrophobicContact CG-CG2 4.19Å; M349-T353 WeakPolarHBondContact O-CB 3.49Å; M349-T353 WeakPolarHBondContact O-CG2 3.44Å; M349-T353 PolarHBondContact O-N 2.83Å; M349-T353 PolarHBondContact O-OG1 3.44Å; I350-T353 PolarHBondContact O-OG1 3.24Å; I350-T353 VanDerWaalsContact O-OG1 3.07Å; C351-T353 PolarHBondContact O-N 3.27Å; T353-I357 WeakPolarHBondContact O-CB 3.35Å; T353-I357 WeakPolarHBondContact O-CD1 3.45Å; T353-I357 WeakPolarHBondContact O-CG1 3.12Å; T353-I357 PolarHBondContact O-N 2.92Å
354	Y	90.5	Very high	88.4	Confident	21 Å²	21	56.3 Å²	56.3	8%	0.082	32%	0.316	C	S	.	.	H	α-helix	trans	-72.4	-34.8	176.8	-77.5	-56.2	0	0	0	114.1	I350 C351 I357 G358 V386 L389 T390 A393	I350-Y354 HydrophobicContact CG2-CD2 3.86Å; I350-Y354 HydrophobicContact CG2-CE2 3.96Å; I350-Y354 VanDerWaalsContact O-CD2 3.24Å; I350-Y354 WeakPolarHBondContact O-CD2 3.3Å; I350-Y354 PolarHBondContact O-N 3.05Å; C351-Y354 PolarHBondContact O-N 2.91Å; Y354-I357 HydrophobicContact CD1-CD1 3.98Å; Y354-I357 HydrophobicContact CE1-CD1 4.25Å; Y354-I357 PolarHBondContact O-N 3.22Å; Y354-G358 PolarHBondContact O-N 2.87Å; Y354-V386 HydrophobicContact CD1-CG1 4.43Å; Y354-L389 VanDerWaalsContact OH-CB 3.27Å; Y354-L389 WeakPolarHBondContact OH-CB 3.49Å; Y354-T390 HydrophobicContact CD1-CG2 4.47Å; Y354-T390 WeakPolarHBondContact CD1-OG1 3.4Å; Y354-T390 HydrophobicContact CD2-CG2 4.45Å; Y354-T390 WeakPolarHBondContact CE1-OG1 3.34Å; Y354-T390 HydrophobicContact CG-CG2 4.17Å; Y354-A393 HydrophobicContact CD2-CB 4.18Å; Y354-A393 HydrophobicContact CE2-CB 3.67Å
355	I	90.1	Very high	86.5	Confident	109 Å²	109	60.2 Å²	60.2	56%	0.559	34%	0.335	S	S	*	.	H	α-helix	trans	-61.8	-48.3	172.4	-70.8	164.3	0	0	0	109.7	C351 I357 G358 I359	C351-I355 WeakPolarHBondContact O-CB 3.14Å; C351-I355 WeakPolarHBondContact O-CD1 3.48Å; C351-I355 WeakPolarHBondContact O-CG1 3.44Å; C351-I355 PolarHBondContact O-N 3.45Å; I355-I357 PolarHBondContact O-N 3.17Å; I355-G358 PolarHBondContact O-N 3.34Å; I355-G358 VanDerWaalsContact O-N 3.14Å; I355-I359 HydrophobicContact CG2-CD1 3.83Å; I355-I359 WeakPolarHBondContact O-CG1 3.23Å; I355-I359 PolarHBondContact O-N 2.9Å
356	A	91.4	Very high	84.8	Confident	21 Å²	21	59 Å²	59	17%	0.174	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-48.2	175.9	0	0	0	0	0	112	F239 Y243 G352 G358 I359 K360	F239-A356 HydrophobicContact CD2-CB 4.2Å; F239-A356 HydrophobicContact CE2-CB 3.88Å; Y243-A356 HydrophobicContact CE2-CB 4.01Å; Y243-A356 WeakPolarHBondContact OH-CB 3.38Å; Y243-A356 PolarHBondContact OH-O 3.38Å; Y243-A356 VanDerWaalsContact OH-O 3.05Å; G352-A356 VanDerWaalsContact O-CB 3.29Å; G352-A356 WeakPolarHBondContact O-CB 3.49Å; G352-A356 PolarHBondContact O-N 2.86Å; A356-G358 VanDerWaalsContact C-N 3.31Å; A356-G358 PolarHBondContact O-N 2.83Å; A356-I359 PolarHBondContact O-N 3.04Å; A356-K360 VanDerWaalsContact O-CB 3.31Å; A356-K360 WeakPolarHBondContact O-CB 3.48Å; A356-K360 PolarHBondContact O-N 3.36Å
357	I	88.2	Confident	82.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-56.3	-44.9	173.7	-71.6	162.4	0	0	0	111	R238 F239 V242 T353 Y354 I355 K360 V361 V386	R238-I357 HydrophobicContact CB-CD1 4.28Å; F239-I357 HydrophobicContact CB-CD1 4.14Å; F239-I357 HydrophobicContact CB-CG1 4.35Å; F239-I357 HydrophobicContact CD2-CG1 4.41Å; V242-I357 HydrophobicContact CB-CG1 4.31Å; V242-I357 HydrophobicContact CG1-CG1 4.45Å; V242-I357 HydrophobicContact CG1-CG2 4.32Å; V242-I357 HydrophobicContact CG2-CG1 4.43Å; V242-I357 HydrophobicContact CG2-CG2 4.16Å; T353-I357 WeakPolarHBondContact O-CB 3.35Å; T353-I357 WeakPolarHBondContact O-CD1 3.45Å; T353-I357 WeakPolarHBondContact O-CG1 3.12Å; T353-I357 PolarHBondContact O-N 2.92Å; Y354-I357 HydrophobicContact CD1-CD1 3.98Å; Y354-I357 HydrophobicContact CE1-CD1 4.25Å; Y354-I357 PolarHBondContact O-N 3.22Å; I355-I357 PolarHBondContact O-N 3.17Å; I357-K360 PolarHBondContact O-N 2.96Å; I357-V361 HydrophobicContact CG2-CG2 4.19Å; I357-V361 VanDerWaalsContact O-CB 3.25Å; I357-V361 WeakPolarHBondContact O-CB 3.34Å; I357-V361 WeakPolarHBondContact O-CG2 3.42Å; I357-V361 PolarHBondContact O-N 2.87Å; I357-V386 HydrophobicContact CG2-CB 4.48Å; I357-V386 HydrophobicContact CG2-CG1 3.68Å; I357-V386 HydrophobicContact CG2-CG2 3.91Å
358	G	85.5	Confident	81.5	Confident	30 Å²	30	66.8 Å²	66.8	31%	0.309	40%	0.396	S	S	.	.	H	α-helix	trans	-59.1	-54.4	179.1	0	0	0	0	0	112.4	Y354 I355 A356 K360 V361 I362	Y354-G358 PolarHBondContact O-N 2.87Å; I355-G358 PolarHBondContact O-N 3.34Å; I355-G358 VanDerWaalsContact O-N 3.14Å; A356-G358 VanDerWaalsContact C-N 3.31Å; A356-G358 PolarHBondContact O-N 2.83Å; G358-K360 VanDerWaalsContact C-N 3.31Å; G358-K360 PolarHBondContact O-N 3.36Å; G358-V361 PolarHBondContact O-N 3.36Å; G358-I362 WeakPolarHBondContact O-CG1 3.42Å; G358-I362 PolarHBondContact O-N 3.4Å
359	I	86.8	Confident	79.8	Confident	90 Å²	90	73.1 Å²	73.1	46%	0.462	41%	0.413	S	S	.	.	H	α-helix	trans	-55.9	-47.3	176.6	-65.2	165.6	0	0	0	110.3	I355 A356 V361 I362 H363	I355-I359 HydrophobicContact CG2-CD1 3.83Å; I355-I359 WeakPolarHBondContact O-CG1 3.23Å; I355-I359 PolarHBondContact O-N 2.9Å; A356-I359 PolarHBondContact O-N 3.04Å; I359-V361 VanDerWaalsContact C-N 3.35Å; I359-V361 PolarHBondContact O-N 3.43Å; I359-I362 PolarHBondContact O-N 2.86Å; I359-H363 PolarHBondContact O-N 3.5Å; I359-H363 VanDerWaalsContact O-N 3.13Å; I359-H363 PolarHBondContact O-ND1 2.83Å
360	K	85	Confident	77.9	Confident	80 Å²	80	78.5 Å²	78.5	35%	0.348	43%	0.429	S	S	.	.	H	α-helix	trans	-65	-35.9	-179.1	-171.9	57.7	172.9	179.6	0	112.8	V242 Y243 A356 I357 G358 L364	V242-K360 HydrophobicContact CG1-CB 4.18Å; V242-K360 HydrophobicContact CG1-CG 3.96Å; Y243-K360 HydrophobicContact CD2-CB 4.37Å; Y243-K360 HydrophobicContact CD2-CG 4.23Å; Y243-K360 HydrophobicContact CE1-CG 4.49Å; Y243-K360 HydrophobicContact CE2-CB 3.65Å; Y243-K360 HydrophobicContact CE2-CG 3.95Å; A356-K360 VanDerWaalsContact O-CB 3.31Å; A356-K360 WeakPolarHBondContact O-CB 3.48Å; A356-K360 PolarHBondContact O-N 3.36Å; I357-K360 PolarHBondContact O-N 2.96Å; G358-K360 VanDerWaalsContact C-N 3.31Å; G358-K360 PolarHBondContact O-N 3.36Å; K360-L364 HydrophobicContact CD-CD1 4.27Å; K360-L364 HydrophobicContact CG-CD1 4.34Å; K360-L364 WeakPolarHBondContact O-CB 3.45Å; K360-L364 PolarHBondContact O-N 3.49Å
361	V	77.8	Confident	76.4	Confident	26 Å²	26	82.6 Å²	82.6	16%	0.158	45%	0.45	C	S	.	.	H	α-helix	trans	-79.1	-21.3	179.7	168.4	0	0	0	0	113.1	V242 I357 G358 I359 R383	V242-V361 HydrophobicContact CG1-CG2 3.91Å; I357-V361 HydrophobicContact CG2-CG2 4.19Å; I357-V361 VanDerWaalsContact O-CB 3.25Å; I357-V361 WeakPolarHBondContact O-CB 3.34Å; I357-V361 WeakPolarHBondContact O-CG2 3.42Å; I357-V361 PolarHBondContact O-N 2.87Å; G358-V361 PolarHBondContact O-N 3.36Å; I359-V361 VanDerWaalsContact C-N 3.35Å; I359-V361 PolarHBondContact O-N 3.43Å; V361-R383 HydrophobicContact CG1-CG 3.59Å; V361-R383 PolarHBondContact O-NH2 2.84Å
362	I	79.6	Confident	75.2	Confident	127 Å²	127	82.3 Å²	82.3	65%	0.651	45%	0.448	S	S	*	.	H	α-helix	trans	-72.8	-50.6	168.5	-70.4	163.8	0	0	0	109.8	G358 I359 L364	G358-I362 WeakPolarHBondContact O-CG1 3.42Å; G358-I362 PolarHBondContact O-N 3.4Å; I359-I362 PolarHBondContact O-N 2.86Å; I362-L364 PolarHBondContact O-N 2.95Å
363	H	73.5	Confident	74.2	Confident	145 Å²	145	85.8 Å²	85.8	67%	0.671	46%	0.457	S	S	*	.	S	Bend	trans	-79.8	7.7	-178.2	-62.5	87.8	0	0	0	114.4	I359 Q365	I359-H363 PolarHBondContact O-N 3.5Å; I359-H363 VanDerWaalsContact O-N 3.13Å; I359-H363 PolarHBondContact O-ND1 2.83Å; H363-Q365 PolarHBondContact O-N 3.34Å; H363-Q365 VanDerWaalsContact O-N 3.08Å
364	L	65.6	Low	73	Confident	74 Å²	74	90.8 Å²	90.8	39%	0.387	47%	0.474	S	S	.	.			trans	-82.2	89.5	-174.7	-147.3	74.8	0	0	0	112.4	K360 I362	K360-L364 HydrophobicContact CD-CD1 4.27Å; K360-L364 HydrophobicContact CG-CD1 4.34Å; K360-L364 WeakPolarHBondContact O-CB 3.45Å; K360-L364 PolarHBondContact O-N 3.49Å; I362-L364 PolarHBondContact O-N 2.95Å
365	Q	55	Low	71.9	Confident	180 Å²	180	91.7 Å²	91.7	84%	0.841	48%	0.48	S	S	*	.			trans	-70.7	133.1	151.6	-63.4	-176.7	0	0	0	108.6	H363 P367	H363-Q365 PolarHBondContact O-N 3.34Å; H363-Q365 VanDerWaalsContact O-N 3.08Å; Q365-P367 WeakPolarHBondContact O-CD 3.35Å
366	T	59.5	Low	71	Confident	56 Å²	56	90.7 Å²	90.7	34%	0.344	47%	0.473	S	S	.	.			trans	-83.8	114.6	179.2	46.4	0	0	0	0	110
367	P	55.9	Low	70	Confident	134 Å²	134	95.4 Å²	95.4	87%	0.87	49%	0.489	S	S	*	.			trans	-77.2	130.2	-179.3	31	-34	0	0	0	111.3	Q365	Q365-P367 WeakPolarHBondContact O-CD 3.35Å
368	G	62.7	Low	69	Low	64 Å²	64	97.3 Å²	97.3	66%	0.66	50%	0.499	S	S	*	.	S	Bend	trans	135.3	176.6	178	0	0	0	0	0	113.2	R370	G368-R370 PolarHBondContact O-N 3.43Å
369	E	59.5	Low	68.2	Low	181 Å²	181	97.6 Å²	97.6	85%	0.846	50%	0.495	S	S	*	.	S	Bend	trans	-61	118.1	175.6	-166.1	57.4	-128.4	0	0	110	I371	E369-I371 PolarHBondContact O-N 3.27Å
370	R	56.3	Low	67.5	Low	195 Å²	195	100.7 Å²	100.7	74%	0.736	50%	0.501	S	S	*	.			trans	-81.3	76.2	-157.2	-167.2	-169.4	-175	-161.3	5.9	113	G368 S372	G368-R370 PolarHBondContact O-N 3.43Å; R370-S372 PolarHBondContact O-N 2.93Å
371	I	62.7	Low	66.7	Low	89 Å²	89	98 Å²	98	46%	0.456	49%	0.494	S	S	.	.			trans	-73	73.7	170.9	-51	-179.1	0	0	0	109.3	E369 I373 R374 D375	E369-I371 PolarHBondContact O-N 3.27Å; I371-I373 PolarHBondContact O-N 2.72Å; I371-R374 HydrophobicContact CB-CB 4.17Å; I371-R374 HydrophobicContact CG2-CB 3.8Å; I371-R374 WeakPolarHBondContact O-CA 3.46Å; I371-R374 WeakPolarHBondContact O-CB 3.06Å; I371-R374 PolarHBondContact O-N 3.22Å; I371-D375 VanDerWaalsContact C-OD2 3.31Å; I371-D375 PolarHBondContact N-OD2 3Å; I371-D375 PolarHBondContact O-N 3.31Å
372	S	66.5	Low	66.3	Low	51 Å²	51	100.6 Å²	100.6	36%	0.357	50%	0.503	S	S	.	.	H	α-helix	trans	-46	-39.6	-169.5	65.1	0	0	0	0	114.6	R370 Q376	R370-S372 PolarHBondContact O-N 2.93Å; S372-Q376 WeakPolarHBondContact O-CB 3.48Å; S372-Q376 WeakPolarHBondContact O-CG 3.47Å; S372-Q376 PolarHBondContact O-N 3.2Å
373	I	72	Confident	66.1	Low	112 Å²	112	100.5 Å²	100.5	57%	0.574	49%	0.494	S	S	*	.	H	α-helix	trans	-67.5	-37.5	179.1	-60	174.3	0	0	0	112	I371 K377	I371-I373 PolarHBondContact O-N 2.72Å; I373-K377 HydrophobicContact CG2-CD 4.3Å; I373-K377 WeakPolarHBondContact O-CB 3.39Å; I373-K377 VanDerWaalsContact O-CD 3.3Å; I373-K377 WeakPolarHBondContact O-CD 3.34Å; I373-K377 WeakPolarHBondContact O-CG 3.5Å; I373-K377 PolarHBondContact O-N 3.21Å
374	R	68.3	Low	66.2	Low	122 Å²	122	98.7 Å²	98.7	46%	0.46	49%	0.485	S	S	.	.	H	α-helix	trans	-74.1	-49.4	178.4	-176.5	175.6	-75	179.8	-5.9	109.8	E101 I371 Q376 K377 L378	E101-R374 IonicContact OE1-CZ 3.83Å; E101-R374 IonicContact OE1-NH2 3.2Å; E101-R374 PolarHBondContact OE1-NH2 3.47Å; E101-R374 IonicContact OE2-CZ 3.48Å; E101-R374 IonicContact OE2-NH1 2.72Å; E101-R374 PolarHBondContact OE2-NH1 3.5Å; E101-R374 IonicContact OE2-NH2 3.94Å; E101-R374 PolarHBondContact OE2-NH2 3.22Å; I371-R374 HydrophobicContact CB-CB 4.17Å; I371-R374 HydrophobicContact CG2-CB 3.8Å; I371-R374 WeakPolarHBondContact O-CA 3.46Å; I371-R374 WeakPolarHBondContact O-CB 3.06Å; I371-R374 PolarHBondContact O-N 3.22Å; R374-Q376 PolarHBondContact O-N 3.26Å; R374-K377 PolarHBondContact O-N 3.41Å; R374-L378 PolarHBondContact O-N 3.1Å
375	D	68.6	Low	66.6	Low	39 Å²	39	96.6 Å²	96.6	21%	0.209	47%	0.473	C	S	.	.	H	α-helix	trans	-68.3	-38.5	-175.5	-53.3	-34.7	0	0	0	112.4	I371 L378 T379	I371-D375 VanDerWaalsContact C-OD2 3.31Å; I371-D375 PolarHBondContact N-OD2 3Å; I371-D375 PolarHBondContact O-N 3.31Å; D375-L378 PolarHBondContact O-N 2.87Å; D375-T379 VanDerWaalsContact O-CB 3.26Å; D375-T379 WeakPolarHBondContact O-CB 3.22Å; D375-T379 PolarHBondContact O-N 3.22Å; D375-T379 PolarHBondContact O-OG1 3.08Å
376	Q	70.9	Confident	67.7	Low	88 Å²	88	89 Å²	89	41%	0.411	44%	0.439	S	S	.	.	H	α-helix	trans	-66.2	-41.9	172.5	-73	-179.5	31.3	0	0	111.9	S372 R374 L378 T379 R380	S372-Q376 WeakPolarHBondContact O-CB 3.48Å; S372-Q376 WeakPolarHBondContact O-CG 3.47Å; S372-Q376 PolarHBondContact O-N 3.2Å; R374-Q376 PolarHBondContact O-N 3.26Å; Q376-L378 VanDerWaalsContact C-N 3.32Å; Q376-L378 PolarHBondContact O-N 3.31Å; Q376-T379 PolarHBondContact O-N 3.22Å; Q376-R380 WeakPolarHBondContact O-CB 3.3Å; Q376-R380 VanDerWaalsContact O-CD 3.3Å; Q376-R380 WeakPolarHBondContact O-CD 3.31Å; Q376-R380 WeakPolarHBondContact O-CG 3.39Å; Q376-R380 PolarHBondContact O-N 2.89Å
377	K	70.3	Confident	68.8	Low	121 Å²	121	93.2 Å²	93.2	53%	0.526	45%	0.453	S	S	.	.	H	α-helix	trans	-60.2	-44.9	176.6	-79.1	171	-174.5	175.2	0	110.8	I373 R374 A381	I373-K377 HydrophobicContact CG2-CD 4.3Å; I373-K377 WeakPolarHBondContact O-CB 3.39Å; I373-K377 VanDerWaalsContact O-CD 3.3Å; I373-K377 WeakPolarHBondContact O-CD 3.34Å; I373-K377 WeakPolarHBondContact O-CG 3.5Å; I373-K377 PolarHBondContact O-N 3.21Å; R374-K377 PolarHBondContact O-N 3.41Å; K377-A381 WeakPolarHBondContact O-CB 3.4Å; K377-A381 PolarHBondContact O-N 3.39Å
378	L	66.5	Low	70	Confident	40 Å²	40	87.1 Å²	87.1	21%	0.209	41%	0.412	C	S	.	.	H	α-helix	trans	-65.5	-49.5	177.7	179.4	47.2	0	0	0	112.5	M88 E94 R374 D375 Q376 R380 A381 K382	M88-L378 HydrophobicContact CE-CD1 4.27Å; E94-L378 VanDerWaalsContact CD-CD1 3.44Å; E94-L378 WeakPolarHBondContact OE1-CD1 3.17Å; E94-L378 WeakPolarHBondContact OE1-CD2 3.33Å; E94-L378 WeakPolarHBondContact OE2-CD1 3.29Å; R374-L378 PolarHBondContact O-N 3.1Å; D375-L378 PolarHBondContact O-N 2.87Å; Q376-L378 VanDerWaalsContact C-N 3.32Å; Q376-L378 PolarHBondContact O-N 3.31Å; L378-R380 VanDerWaalsContact C-N 3.29Å; L378-R380 PolarHBondContact O-N 2.96Å; L378-A381 WeakPolarHBondContact O-CB 3.41Å; L378-A381 PolarHBondContact O-N 3.28Å; L378-K382 HydrophobicContact CD1-CD 3.85Å; L378-K382 HydrophobicContact CD1-CG 4.1Å; L378-K382 HydrophobicContact CG-CD 4.16Å; L378-K382 PolarHBondContact O-N 2.74Å
379	T	69.1	Low	71	Confident	36 Å²	36	84.3 Å²	84.3	22%	0.221	38%	0.382	C	S	.	.	H	α-helix	trans	-61.8	-38.3	179.5	-57.6	0	0	0	0	111.6	D375 Q376 R383	D375-T379 VanDerWaalsContact O-CB 3.26Å; D375-T379 WeakPolarHBondContact O-CB 3.22Å; D375-T379 PolarHBondContact O-N 3.22Å; D375-T379 PolarHBondContact O-OG1 3.08Å; Q376-T379 PolarHBondContact O-N 3.22Å; T379-R383 WeakPolarHBondContact O-CB 3.49Å; T379-R383 VanDerWaalsContact O-CG 3.31Å; T379-R383 WeakPolarHBondContact O-CG 3.18Å; T379-R383 PolarHBondContact O-N 2.61Å
380	R	72.5	Confident	72.2	Confident	154 Å²	154	78 Å²	78	58%	0.581	36%	0.356	S	S	*	.	H	α-helix	trans	-64.7	-37.2	172.8	-71.1	166.2	-171.9	-169.7	4	112.3	Q376 L378 K384	Q376-R380 WeakPolarHBondContact O-CB 3.3Å; Q376-R380 VanDerWaalsContact O-CD 3.3Å; Q376-R380 WeakPolarHBondContact O-CD 3.31Å; Q376-R380 WeakPolarHBondContact O-CG 3.39Å; Q376-R380 PolarHBondContact O-N 2.89Å; L378-R380 VanDerWaalsContact C-N 3.29Å; L378-R380 PolarHBondContact O-N 2.96Å; R380-K384 WeakPolarHBondContact O-CG 3.35Å; R380-K384 PolarHBondContact O-N 2.84Å; R380-K384 VanDerWaalsContact O-N 3.15Å
381	A	67.4	Low	73.8	Confident	24 Å²	24	71.4 Å²	71.4	20%	0.198	34%	0.335	C	S	.	.	H	α-helix	trans	-68.1	-49.6	176	0	0	0	0	0	111.9	M88 K377 L378 R383 K384 M385	M88-A381 HydrophobicContact CB-CB 3.6Å; M88-A381 HydrophobicContact CG-CB 3.62Å; K377-A381 WeakPolarHBondContact O-CB 3.4Å; K377-A381 PolarHBondContact O-N 3.39Å; L378-A381 WeakPolarHBondContact O-CB 3.41Å; L378-A381 PolarHBondContact O-N 3.28Å; A381-R383 PolarHBondContact O-N 3.09Å; A381-K384 PolarHBondContact O-N 3.44Å; A381-K384 VanDerWaalsContact O-N 3.14Å; A381-M385 PolarHBondContact O-N 3.43Å
382	K	70.2	Confident	74.9	Confident	80 Å²	80	67.4 Å²	67.4	35%	0.348	32%	0.315	S	S	.	.	H	α-helix	trans	-57.6	-45.8	176.2	-76.8	172.9	173.7	157.9	0	111.5	E94 L378 K384 M385 V386	E94-K382 WeakPolarHBondContact OE2-CE 3.43Å; E94-K382 IonicContact OE2-NZ 2.76Å; E94-K382 PolarHBondContact OE2-NZ 2.92Å; L378-K382 HydrophobicContact CD1-CD 3.85Å; L378-K382 HydrophobicContact CD1-CG 4.1Å; L378-K382 HydrophobicContact CG-CD 4.16Å; L378-K382 PolarHBondContact O-N 2.74Å; K382-K384 PolarHBondContact O-N 3.25Å; K382-M385 PolarHBondContact O-N 2.92Å; K382-V386 WeakPolarHBondContact O-CG2 3.4Å; K382-V386 PolarHBondContact O-N 3.23Å
383	R	74.9	Confident	75.8	Confident	125 Å²	125	65.3 Å²	65.3	47%	0.472	30%	0.301	S	S	.	.	H	α-helix	trans	-60.1	-38.9	174.8	-76.8	176.8	178.6	-174.4	0.6	113.4	V361 T379 A381 K387	V361-R383 HydrophobicContact CG1-CG 3.59Å; V361-R383 PolarHBondContact O-NH2 2.84Å; T379-R383 WeakPolarHBondContact O-CB 3.49Å; T379-R383 VanDerWaalsContact O-CG 3.31Å; T379-R383 WeakPolarHBondContact O-CG 3.18Å; T379-R383 PolarHBondContact O-N 2.61Å; A381-R383 PolarHBondContact O-N 3.09Å; R383-K387 WeakPolarHBondContact O-CB 3.42Å; R383-K387 PolarHBondContact O-N 3.44Å
384	K	75.8	Confident	76.7	Confident	108 Å²	108	64.3 Å²	64.3	47%	0.47	30%	0.296	S	S	.	.	H	α-helix	trans	-68.1	-45.4	176.4	-77.5	177.7	179.2	-172.1	0	112.9	R380 A381 K382 K387 M388	R380-K384 WeakPolarHBondContact O-CG 3.35Å; R380-K384 PolarHBondContact O-N 2.84Å; R380-K384 VanDerWaalsContact O-N 3.15Å; A381-K384 PolarHBondContact O-N 3.44Å; A381-K384 VanDerWaalsContact O-N 3.14Å; K382-K384 PolarHBondContact O-N 3.25Å; K384-K387 PolarHBondContact O-N 2.85Å; K384-M388 PolarHBondContact O-N 3.12Å
385	M	73.8	Confident	77.8	Confident	29 Å²	29	61.2 Å²	61.2	14%	0.143	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-46.5	176.8	176.4	-156.6	70	0	0	111.1	R238 A381 K382 M388 L389	R238-M385 VanDerWaalsContact CD-CE 3.45Å; R238-M385 PolarHBondContact NH1-SD 3.25Å; A381-M385 PolarHBondContact O-N 3.43Å; K382-M385 PolarHBondContact O-N 2.92Å; M385-M388 WeakPolarHBondContact O-CB 3.35Å; M385-M388 PolarHBondContact O-N 3.47Å; M385-L389 HydrophobicContact CG-CD1 4.13Å; M385-L389 WeakPolarHBondContact O-CG 3.3Å; M385-L389 PolarHBondContact O-N 3.46Å; M385-L389 VanDerWaalsContact O-N 3.13Å
386	V	77.7	Confident	78.8	Confident	20 Å²	20	59.9 Å²	59.9	12%	0.121	28%	0.279	C	S	.	.	H	α-helix	trans	-58.4	-52	173.9	171.1	0	0	0	0	110.2	Y354 I357 K382 M388 L389 T390	Y354-V386 HydrophobicContact CD1-CG1 4.43Å; I357-V386 HydrophobicContact CG2-CB 4.48Å; I357-V386 HydrophobicContact CG2-CG1 3.68Å; I357-V386 HydrophobicContact CG2-CG2 3.91Å; K382-V386 WeakPolarHBondContact O-CG2 3.4Å; K382-V386 PolarHBondContact O-N 3.23Å; V386-M388 PolarHBondContact O-N 3.03Å; V386-L389 PolarHBondContact O-N 3.28Å; V386-L389 VanDerWaalsContact O-N 3.09Å; V386-T390 WeakPolarHBondContact O-CB 3.47Å; V386-T390 PolarHBondContact O-N 3.2Å; V386-T390 PolarHBondContact O-OG1 2.81Å
387	K	82.5	Confident	79.8	Confident	146 Å²	146	55.9 Å²	55.9	64%	0.635	26%	0.262	S	S	*	.	H	α-helix	trans	-55.1	-37.6	177.9	-178.5	171	-179.9	172.2	0	113	R383 K384 L391	R383-K387 WeakPolarHBondContact O-CB 3.42Å; R383-K387 PolarHBondContact O-N 3.44Å; K384-K387 PolarHBondContact O-N 2.85Å; K387-L391 WeakPolarHBondContact O-CB 3.3Å; K387-L391 PolarHBondContact O-N 3.23Å
388	M	82.1	Confident	80.9	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.03	26%	0.262	C	S	.	.	H	α-helix	trans	-62.8	-49.2	176.7	-166.8	176.3	95.4	0	0	111.9	K384 M385 V386 L391 V392 I443 Y444 I447 N448	K384-M388 PolarHBondContact O-N 3.12Å; M385-M388 WeakPolarHBondContact O-CB 3.35Å; M385-M388 PolarHBondContact O-N 3.47Å; V386-M388 PolarHBondContact O-N 3.03Å; M388-L391 PolarHBondContact O-N 3.42Å; M388-V392 WeakPolarHBondContact O-CG2 3.4Å; M388-V392 PolarHBondContact O-N 3.27Å; M388-V392 VanDerWaalsContact O-N 3.12Å; M388-I443 HydrophobicContact CG-CG2 3.89Å; M388-Y444 HydrophobicContact CE-CD1 3.66Å; M388-Y444 HydrophobicContact CE-CE1 4.22Å; M388-Y444 HydrophobicContact CE-CG 4.41Å; M388-Y444 HydrophobicContact CG-CD1 4.36Å; M388-Y444 HydrophobicContact SD-CD1 4.13Å; M388-I447 HydrophobicContact CB-CB 4.23Å; M388-I447 HydrophobicContact CB-CD1 4.07Å; M388-I447 HydrophobicContact CB-CG2 3.94Å; M388-I447 HydrophobicContact CG-CB 4.06Å; M388-I447 HydrophobicContact CG-CD1 4.17Å; M388-I447 HydrophobicContact CG-CG2 4.28Å; M388-I447 HydrophobicContact SD-CB 4.28Å; M388-I447 HydrophobicContact SD-CG2 4.47Å; M388-N448 HydrophobicContact SD-CB 4.07Å
389	L	83.1	Confident	82.2	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-76.5	-31.9	-175.5	-57.8	170.1	0	0	0	112	T174 L178 I234 R238 Y354 M385 V386 V392 A393	T174-L389 HydrophobicContact CG2-CD1 4.2Å; L178-L389 HydrophobicContact CD2-CD2 4.21Å; I234-L389 HydrophobicContact CG2-CB 4.29Å; I234-L389 HydrophobicContact CG2-CD1 4.02Å; I234-L389 HydrophobicContact CG2-CD2 4.05Å; I234-L389 HydrophobicContact CG2-CG 4.34Å; R238-L389 HydrophobicContact CG-CD1 3.73Å; Y354-L389 VanDerWaalsContact OH-CB 3.27Å; Y354-L389 WeakPolarHBondContact OH-CB 3.49Å; M385-L389 HydrophobicContact CG-CD1 4.13Å; M385-L389 WeakPolarHBondContact O-CG 3.3Å; M385-L389 PolarHBondContact O-N 3.46Å; M385-L389 VanDerWaalsContact O-N 3.13Å; V386-L389 PolarHBondContact O-N 3.28Å; V386-L389 VanDerWaalsContact O-N 3.09Å; L389-V392 PolarHBondContact O-N 3.35Å; L389-A393 WeakPolarHBondContact O-CB 3.21Å; L389-A393 PolarHBondContact O-N 2.95Å
390	T	84.9	Confident	83.4	Confident	49 Å²	49	51.8 Å²	51.8	30%	0.301	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-37	169.2	-52	0	0	0	0	111.9	Y354 V386 A393 L394	Y354-T390 HydrophobicContact CD1-CG2 4.47Å; Y354-T390 WeakPolarHBondContact CD1-OG1 3.4Å; Y354-T390 HydrophobicContact CD2-CG2 4.45Å; Y354-T390 WeakPolarHBondContact CE1-OG1 3.34Å; Y354-T390 HydrophobicContact CG-CG2 4.17Å; V386-T390 WeakPolarHBondContact O-CB 3.47Å; V386-T390 PolarHBondContact O-N 3.2Å; V386-T390 PolarHBondContact O-OG1 2.81Å; T390-A393 PolarHBondContact O-N 3.5Å; T390-L394 WeakPolarHBondContact O-CB 3.41Å; T390-L394 PolarHBondContact O-N 3.49Å
391	L	89.4	Confident	84.5	Confident	55 Å²	55	47.9 Å²	47.9	29%	0.288	24%	0.235	S	C	.	.	H	α-helix	trans	-67.1	-42.5	176.1	-178.5	59.4	0	0	0	111.7	K387 M388 L394 M395 I443 I447	K387-L391 WeakPolarHBondContact O-CB 3.3Å; K387-L391 PolarHBondContact O-N 3.23Å; M388-L391 PolarHBondContact O-N 3.42Å; L391-L394 PolarHBondContact O-N 3.14Å; L391-M395 HydrophobicContact CD1-CE 4.27Å; L391-M395 HydrophobicContact CD1-CG 4.4Å; L391-M395 WeakPolarHBondContact O-CG 3.44Å; L391-M395 PolarHBondContact O-N 3.08Å; L391-I443 HydrophobicContact CB-CG2 4.36Å; L391-I443 HydrophobicContact CD2-CG1 4.17Å; L391-I443 HydrophobicContact CD2-CG2 4.04Å; L391-I443 HydrophobicContact CG-CD1 4.2Å; L391-I443 HydrophobicContact CG-CG1 4.3Å; L391-I443 HydrophobicContact CG-CG2 4.31Å; L391-I447 HydrophobicContact CD2-CD1 4.03Å
392	V	86	Confident	85.8	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.03	24%	0.24	C	C	.	.	H	α-helix	trans	-54.7	-52.4	171.1	165.9	0	0	0	0	111.1	H231 M388 L389 L394 M395 Y396 N440 I443 Y444	H231-V392 WeakPolarHBondContact CE1-CG1 3.34Å; M388-V392 WeakPolarHBondContact O-CG2 3.4Å; M388-V392 PolarHBondContact O-N 3.27Å; M388-V392 VanDerWaalsContact O-N 3.12Å; L389-V392 PolarHBondContact O-N 3.35Å; V392-L394 VanDerWaalsContact C-N 3.33Å; V392-L394 PolarHBondContact O-N 2.79Å; V392-M395 PolarHBondContact O-N 2.9Å; V392-Y396 PolarHBondContact O-N 3.3Å; V392-N440 WeakPolarHBondContact CG1-OD1 3.13Å; V392-I443 HydrophobicContact CG2-CB 4.27Å; V392-I443 HydrophobicContact CG2-CD1 3.92Å; V392-I443 HydrophobicContact CG2-CG2 3.86Å; V392-Y444 HydrophobicContact CG2-CE1 3.84Å
393	A	85.5	Confident	86.9	Confident	7 Å²	7	46.7 Å²	46.7	6%	0.058	23%	0.229	C	C	.	.	H	α-helix	trans	-60.3	-39.6	179.6	0	0	0	0	0	113.3	I350 Y354 L389 T390 Y396 G397	I350-A393 HydrophobicContact CG2-CB 3.56Å; Y354-A393 HydrophobicContact CD2-CB 4.18Å; Y354-A393 HydrophobicContact CE2-CB 3.67Å; L389-A393 WeakPolarHBondContact O-CB 3.21Å; L389-A393 PolarHBondContact O-N 2.95Å; T390-A393 PolarHBondContact O-N 3.5Å; A393-Y396 PolarHBondContact O-N 3.47Å; A393-G397 PolarHBondContact O-N 2.93Å
394	L	91.1	Very high	87.7	Confident	92 Å²	92	41 Å²	41	48%	0.482	21%	0.208	S	C	.	.	H	α-helix	trans	-65.5	-42.3	176.4	-179.2	63.4	0	0	0	111.7	T390 L391 V392 G397 L398	T390-L394 WeakPolarHBondContact O-CB 3.41Å; T390-L394 PolarHBondContact O-N 3.49Å; L391-L394 PolarHBondContact O-N 3.14Å; V392-L394 VanDerWaalsContact C-N 3.33Å; V392-L394 PolarHBondContact O-N 2.79Å; L394-G397 PolarHBondContact O-N 3.31Å; L394-L398 HydrophobicContact CD1-CD1 3.89Å; L394-L398 HydrophobicContact CD1-CG 4.08Å; L394-L398 HydrophobicContact CG-CD1 3.92Å; L394-L398 HydrophobicContact CG-CG 4.44Å; L394-L398 WeakPolarHBondContact O-CB 3.27Å; L394-L398 WeakPolarHBondContact O-CG 3.28Å; L394-L398 PolarHBondContact O-N 3.08Å
395	M	91.9	Very high	88.6	Confident	57 Å²	57	39.5 Å²	39.5	28%	0.281	21%	0.208	S	C	.	.	H	α-helix	trans	-65.9	-42	176.2	-65.3	-62.2	94.9	0	0	111.6	L391 V392 G397 L398 S399 Y439 I443	L391-M395 HydrophobicContact CD1-CE 4.27Å; L391-M395 HydrophobicContact CD1-CG 4.4Å; L391-M395 WeakPolarHBondContact O-CG 3.44Å; L391-M395 PolarHBondContact O-N 3.08Å; V392-M395 PolarHBondContact O-N 2.9Å; M395-G397 PolarHBondContact O-N 3.32Å; M395-L398 HydrophobicContact CE-CD1 4Å; M395-L398 PolarHBondContact O-N 2.96Å; M395-S399 WeakPolarHBondContact O-CB 3.45Å; M395-S399 PolarHBondContact O-N 3.39Å; M395-S399 PolarHBondContact O-OG 3.46Å; M395-Y439 HydrophobicContact CB-CD2 3.93Å; M395-Y439 HydrophobicContact CG-CD2 4.34Å; M395-I443 HydrophobicContact CG-CD1 4.09Å
396	Y	89.5	Confident	89.6	Confident	10 Å²	10	39.6 Å²	39.6	4%	0.039	21%	0.209	C	C	.	.	H	α-helix	trans	-55.4	-49.9	171.3	175.4	-95.5	0	0	0	111.6	A228 H231 Q342 V392 A393 S399 Q400	A228-Y396 WeakPolarHBondContact CB-OH 3.25Å; H231-Y396 AromaticContact CD2-CD2 3.69Å; H231-Y396 AromaticContact CD2-CG 3.64Å; H231-Y396 AromaticContact NE2-CD2 3.65Å; H231-Y396 AromaticContact NE2-CG 3.77Å; Q342-Y396 PolarHBondContact O-OH 3.44Å; V392-Y396 PolarHBondContact O-N 3.3Å; A393-Y396 PolarHBondContact O-N 3.47Å; Y396-S399 PolarHBondContact O-OG 2.9Å; Y396-Q400 HydrophobicContact CD2-CG 4.38Å; Y396-Q400 HydrophobicContact CE1-CG 4.49Å; Y396-Q400 HydrophobicContact CE2-CG 3.98Å; Y396-Q400 WeakPolarHBondContact O-CG 3.24Å; Y396-Q400 PolarHBondContact O-N 2.89Å
397	G	91.5	Very high	90.2	Very high	5 Å²	5	40.7 Å²	40.7	5%	0.052	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-53.2	178.1	0	0	0	0	0	113.2	Y343 A393 L394 M395 S399 Q400 L401	Y343-G397 WeakPolarHBondContact CE2-O 3.42Å; Y343-G397 PolarHBondContact OH-O 3.1Å; A393-G397 PolarHBondContact O-N 2.93Å; L394-G397 PolarHBondContact O-N 3.31Å; M395-G397 PolarHBondContact O-N 3.32Å; G397-S399 PolarHBondContact O-N 3Å; G397-Q400 PolarHBondContact O-N 3.07Å; G397-L401 PolarHBondContact O-N 3.11Å
398	L	93.7	Very high	90.7	Very high	99 Å²	99	36.4 Å²	36.4	52%	0.518	20%	0.195	S	C	.	.	H	α-helix	trans	-67.4	-32.4	-176.9	-66.4	176	0	0	0	113.5	L394 M395 P402	L394-L398 HydrophobicContact CD1-CD1 3.89Å; L394-L398 HydrophobicContact CD1-CG 4.08Å; L394-L398 HydrophobicContact CG-CD1 3.92Å; L394-L398 HydrophobicContact CG-CG 4.44Å; L394-L398 WeakPolarHBondContact O-CB 3.27Å; L394-L398 WeakPolarHBondContact O-CG 3.28Å; L394-L398 PolarHBondContact O-N 3.08Å; M395-L398 HydrophobicContact CE-CD1 4Å; M395-L398 PolarHBondContact O-N 2.96Å; L398-P402 WeakPolarHBondContact O-CD 3.47Å
399	S	94.6	Very high	91.2	Very high	7 Å²	7	39.6 Å²	39.6	5%	0.049	21%	0.21	C	C	.	.	H	α-helix	trans	-70.3	-34.5	177.4	61.5	0	0	0	0	114	M395 Y396 G397 P402 A432 R433 S436	M395-S399 WeakPolarHBondContact O-CB 3.45Å; M395-S399 PolarHBondContact O-N 3.39Å; M395-S399 PolarHBondContact O-OG 3.46Å; Y396-S399 PolarHBondContact O-OG 2.9Å; G397-S399 PolarHBondContact O-N 3Å; S399-P402 WeakPolarHBondContact O-CD 3.38Å; S399-A432 WeakPolarHBondContact CB-O 3.5Å; S399-A432 CarbonylContact O-C 3.5Å; S399-R433 WeakPolarHBondContact O-CA 3.46Å; S399-R433 PolarHBondContact O-N 2.84Å; S399-S436 WeakPolarHBondContact OG-CB 3.38Å
400	Q	93.6	Very high	91.5	Very high	5 Å²	5	39.5 Å²	39.5	2%	0.023	21%	0.21	C	C	.	.	H	α-helix	trans	-83.1	-24.7	-178.1	-71.6	-79	10.8	0	0	113	Y343 Y396 G397 R433	Y343-Q400 HydrophobicContact CD2-CB 3.58Å; Y343-Q400 HydrophobicContact CD2-CG 4.4Å; Y343-Q400 HydrophobicContact CE2-CB 3.6Å; Y396-Q400 HydrophobicContact CD2-CG 4.38Å; Y396-Q400 HydrophobicContact CE1-CG 4.49Å; Y396-Q400 HydrophobicContact CE2-CG 3.98Å; Y396-Q400 WeakPolarHBondContact O-CG 3.24Å; Y396-Q400 PolarHBondContact O-N 2.89Å; G397-Q400 PolarHBondContact O-N 3.07Å; Q400-R433 VanDerWaalsContact OE1-CD 3.27Å
401	L	94.5	Very high	91.6	Very high	72 Å²	72	39.1 Å²	39.1	38%	0.377	21%	0.205	S	C	.	.	H	α-helix	trans	-55.2	-50.5	-176.1	-179.2	64.9	0	0	0	113.9	Y343 G397 R403 H404 T405	Y343-L401 HydrophobicContact CE1-CD1 4.36Å; Y343-L401 WeakPolarHBondContact OH-CB 3.38Å; G397-L401 PolarHBondContact O-N 3.11Å; L401-R403 VanDerWaalsContact C-N 3.32Å; L401-R403 PolarHBondContact O-N 3.49Å; L401-H404 PolarHBondContact O-N 3.19Å; L401-H404 VanDerWaalsContact O-N 3.13Å; L401-T405 PolarHBondContact O-N 2.99Å; L401-T405 PolarHBondContact O-OG1 3.45Å
402	P	95.6	Very high	91.6	Very high	45 Å²	45	42.8 Å²	42.8	29%	0.292	22%	0.224	S	C	.	.	H	α-helix	trans	-60.5	-39.6	-171.7	-24.9	35.9	0	0	0	113.2	L398 S399 T405 I406 A429 A432	L398-P402 WeakPolarHBondContact O-CD 3.47Å; S399-P402 WeakPolarHBondContact O-CD 3.38Å; P402-T405 PolarHBondContact O-N 2.93Å; P402-I406 WeakPolarHBondContact O-CB 3.48Å; P402-I406 WeakPolarHBondContact O-CG1 3.45Å; P402-I406 PolarHBondContact O-N 3.37Å; P402-A429 HydrophobicContact CB-CB 3.82Å; P402-A432 HydrophobicContact CG-CB 4.33Å
403	R	93.4	Very high	91.7	Very high	33 Å²	33	46.4 Å²	46.4	13%	0.125	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-42	179	-179	-172.7	56.6	79.1	2.8	111.3	L401 Y407 W426 A429 N430	L401-R403 VanDerWaalsContact C-N 3.32Å; L401-R403 PolarHBondContact O-N 3.49Å; R403-Y407 VanDerWaalsContact O-CB 3.3Å; R403-Y407 WeakPolarHBondContact O-CB 3.47Å; R403-Y407 PolarHBondContact O-N 2.93Å; R403-W426 HydrophobicContact CG-CH2 4.17Å; R403-W426 HydrophobicContact CG-CZ3 4.12Å; R403-A429 HydrophobicContact CB-CB 4.18Å; R403-N430 VanDerWaalsContact CD-OD1 3.29Å; R403-N430 WeakPolarHBondContact CD-OD1 3.37Å
404	H	92.5	Very high	91.8	Very high	5 Å²	5	53 Å²	53	2%	0.023	27%	0.267	C	S	.	.	H	α-helix	trans	-68.8	-38	176.4	-83	-55.3	0	0	0	112.4	M339 Q342 Y343 L401 L408	M339-H404 VanDerWaalsContact CB-CE1 3.42Å; M339-H404 WeakPolarHBondContact CB-CE1 3.27Å; M339-H404 VanDerWaalsContact CG-CE1 3.41Å; M339-H404 WeakPolarHBondContact CG-CE1 3.33Å; M339-H404 VanDerWaalsContact CG-ND1 3.27Å; M339-H404 WeakPolarHBondContact CG-ND1 3.39Å; M339-H404 HydrophobicContact SD-CB 4.16Å; M339-H404 PolarHBondContact SD-ND1 3.01Å; Q342-H404 PolarHBondContact NE2-CE1 2.9Å; Q342-H404 PolarHBondContact NE2-NE2 3.44Å; Q342-H404 VanDerWaalsContact NE2-NE2 3.12Å; Y343-H404 AromaticContact CD1-CD2 3.84Å; Y343-H404 AromaticContact CG-CD2 3.67Å; L401-H404 PolarHBondContact O-N 3.19Å; L401-H404 VanDerWaalsContact O-N 3.13Å; H404-L408 WeakPolarHBondContact O-CB 3.28Å; H404-L408 WeakPolarHBondContact O-CG 3.44Å; H404-L408 PolarHBondContact O-N 3.15Å
405	T	93.7	Very high	91.8	Very high	78 Å²	78	55.1 Å²	55.1	48%	0.479	27%	0.274	S	S	.	.	H	α-helix	trans	-65.3	-45.3	174.2	-58.6	0	0	0	0	112.4	L401 P402 L408 H409	L401-T405 PolarHBondContact O-N 2.99Å; L401-T405 PolarHBondContact O-OG1 3.45Å; P402-T405 PolarHBondContact O-N 2.93Å; T405-L408 PolarHBondContact O-N 3.16Å; T405-H409 WeakPolarHBondContact O-CB 3.32Å; T405-H409 PolarHBondContact O-N 3.26Å
406	I	93.9	Very high	91.7	Very high	30 Å²	30	53 Å²	53	15%	0.154	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-43.1	178.7	-69.9	178.3	0	0	0	111.2	P402 H409 G410 F416 W417 A425 W426 A429	P402-I406 WeakPolarHBondContact O-CB 3.48Å; P402-I406 WeakPolarHBondContact O-CG1 3.45Å; P402-I406 PolarHBondContact O-N 3.37Å; I406-H409 PolarHBondContact O-N 3.44Å; I406-G410 PolarHBondContact O-N 3.35Å; I406-F416 HydrophobicContact CG2-CE1 3.69Å; I406-F416 HydrophobicContact CG2-CZ 3.82Å; I406-W417 HydrophobicContact CG2-CH2 4.32Å; I406-A425 HydrophobicContact CD1-CB 3.77Å; I406-A425 WeakPolarHBondContact CD1-O 3.46Å; I406-W426 HydrophobicContact CG2-CE3 4Å; I406-A429 HydrophobicContact CD1-CB 3.76Å
407	Y	91.4	Very high	91.7	Very high	44 Å²	44	57.5 Å²	57.5	17%	0.173	28%	0.28	C	S	.	.	H	α-helix	trans	-61.2	-46.1	176.9	-175.6	-98.9	0	0	0	111.8	T335 R403 H409 G410 L411 W426	T335-Y407 WeakPolarHBondContact CB-OH 3.49Å; T335-Y407 HydrophobicContact CG2-CD1 4.17Å; T335-Y407 HydrophobicContact CG2-CE1 3.37Å; T335-Y407 HydrophobicContact CG2-CE2 4.27Å; T335-Y407 VanDerWaalsContact CG2-CZ 3.45Å; T335-Y407 WeakPolarHBondContact CG2-OH 3.31Å; R403-Y407 VanDerWaalsContact O-CB 3.3Å; R403-Y407 WeakPolarHBondContact O-CB 3.47Å; R403-Y407 PolarHBondContact O-N 2.93Å; Y407-H409 PolarHBondContact O-N 3.4Å; Y407-G410 PolarHBondContact O-N 3.27Å; Y407-L411 HydrophobicContact CD1-CD1 4Å; Y407-L411 HydrophobicContact CD1-CG 4.29Å; Y407-L411 HydrophobicContact CE1-CD1 3.48Å; Y407-L411 VanDerWaalsContact CE1-CD1 3.48Å; Y407-L411 HydrophobicContact CE1-CD2 4.31Å; Y407-L411 HydrophobicContact CE1-CG 3.86Å; Y407-L411 PolarHBondContact O-N 2.97Å; Y407-W426 HydrophobicContact CD2-CH2 4.45Å; Y407-W426 HydrophobicContact CD2-CZ3 4.48Å
408	L	92.2	Very high	91.5	Very high	56 Å²	56	66.1 Å²	66.1	29%	0.293	32%	0.316	S	S	.	.	H	α-helix	trans	-60.8	-41.7	174.4	-81.4	169.3	0	0	0	112.7	M339 H404 T405 G410 L411 I412	M339-L408 HydrophobicContact CE-CD1 3.95Å; M339-L408 HydrophobicContact CE-CD2 3.7Å; M339-L408 HydrophobicContact CE-CG 3.95Å; M339-L408 HydrophobicContact SD-CD1 3.85Å; M339-L408 HydrophobicContact SD-CD2 4.4Å; M339-L408 HydrophobicContact SD-CG 3.98Å; H404-L408 WeakPolarHBondContact O-CB 3.28Å; H404-L408 WeakPolarHBondContact O-CG 3.44Å; H404-L408 PolarHBondContact O-N 3.15Å; T405-L408 PolarHBondContact O-N 3.16Å; L408-G410 VanDerWaalsContact C-N 3.35Å; L408-L411 PolarHBondContact O-N 3.37Å; L408-I412 WeakPolarHBondContact O-CG1 3.5Å; L408-I412 PolarHBondContact O-N 3.45Å; L408-I412 VanDerWaalsContact O-N 3.16Å
409	H	93	Very high	91.3	Very high	73 Å²	73	65.5 Å²	65.5	34%	0.338	31%	0.31	S	S	.	.	H	α-helix	trans	-61.8	-42.9	175	178.5	-94.3	0	0	0	111.7	T405 I406 Y407 L411 I412 N413 F416	T405-H409 WeakPolarHBondContact O-CB 3.32Å; T405-H409 PolarHBondContact O-N 3.26Å; I406-H409 PolarHBondContact O-N 3.44Å; Y407-H409 PolarHBondContact O-N 3.4Å; H409-L411 VanDerWaalsContact C-N 3.33Å; H409-L411 PolarHBondContact O-N 3.09Å; H409-I412 PolarHBondContact O-N 3.07Å; H409-N413 PolarHBondContact NE2-ND2 3.48Å; H409-N413 WeakPolarHBondContact O-CB 3.49Å; H409-N413 PolarHBondContact O-N 3.4Å; H409-F416 AromaticContact CE1-CD2 3.49Å; H409-F416 VanDerWaalsContact CE1-CD2 3.49Å; H409-F416 WeakPolarHBondContact CE1-CD2 3.38Å; H409-F416 AromaticContact CE1-CG 3.77Å; H409-F416 AromaticContact ND1-CD2 3.41Å; H409-F416 WeakPolarHBondContact ND1-CD2 3.49Å; H409-F416 AromaticContact ND1-CE2 3.93Å; H409-F416 AromaticContact ND1-CG 3.47Å; H409-F416 WeakPolarHBondContact ND1-CG 3.38Å
410	G	90.3	Very high	90.8	Very high	3 Å²	3	69.7 Å²	69.7	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-70.7	-21.4	177.2	0	0	0	0	0	114.9	I406 Y407 L408 W417	I406-G410 PolarHBondContact O-N 3.35Å; Y407-G410 PolarHBondContact O-N 3.27Å; L408-G410 VanDerWaalsContact C-N 3.35Å; G410-W417 PolarHBondContact O-NE1 3.49Å; G410-W417 VanDerWaalsContact O-NE1 3.17Å
411	L	86.2	Confident	90.6	Very high	40 Å²	40	75.8 Å²	75.8	21%	0.209	36%	0.363	C	S	.	.	H	α-helix	trans	-73.4	-44.5	169.3	-77.8	179.5	0	0	0	111.9	V332 Y407 L408 H409	V332-L411 HydrophobicContact CG1-CD1 4.04Å; V332-L411 HydrophobicContact CG1-CD2 4.12Å; V332-L411 HydrophobicContact CG2-CD2 3.94Å; Y407-L411 HydrophobicContact CD1-CD1 4Å; Y407-L411 HydrophobicContact CD1-CG 4.29Å; Y407-L411 HydrophobicContact CE1-CD1 3.48Å; Y407-L411 VanDerWaalsContact CE1-CD1 3.48Å; Y407-L411 HydrophobicContact CE1-CD2 4.31Å; Y407-L411 HydrophobicContact CE1-CG 3.86Å; Y407-L411 PolarHBondContact O-N 2.97Å; L408-L411 PolarHBondContact O-N 3.37Å; H409-L411 VanDerWaalsContact C-N 3.33Å; H409-L411 PolarHBondContact O-N 3.09Å
412	I	88.5	Confident	90.4	Very high	132 Å²	132	72.7 Å²	72.7	68%	0.677	35%	0.347	S	S	*	.	H	α-helix	trans	-72.3	-51.2	-178.7	-62.8	165.5	0	0	0	110.2	L408 H409	L408-I412 WeakPolarHBondContact O-CG1 3.5Å; L408-I412 PolarHBondContact O-N 3.45Å; L408-I412 VanDerWaalsContact O-N 3.16Å; H409-I412 PolarHBondContact O-N 3.07Å
413	N	90	Very high	90.2	Very high	81 Å²	81	72.8 Å²	72.8	43%	0.433	35%	0.345	S	S	.	.			trans	-107.7	79.7	-176.3	-66.1	-28.6	0	0	0	109.7	H409 E415 F416	H409-N413 PolarHBondContact NE2-ND2 3.48Å; H409-N413 WeakPolarHBondContact O-CB 3.49Å; H409-N413 PolarHBondContact O-N 3.4Å; N413-E415 PolarHBondContact O-N 2.89Å; N413-E415 VanDerWaalsContact O-N 3.1Å; N413-F416 WeakPolarHBondContact O-CB 3.05Å; N413-F416 PolarHBondContact O-N 3.29Å
414	R	87	Confident	90.1	Very high	146 Å²	146	74.8 Å²	74.8	55%	0.551	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-55.6	-30.3	-177.7	-69.6	-174.5	175.6	-167.5	-7.4	113.8	F416 W417	R414-F416 PolarHBondContact O-N 2.81Å; R414-F416 VanDerWaalsContact O-N 3.1Å; R414-W417 PolarHBondContact O-N 2.84Å
415	E	90.1	Very high	90.2	Very high	136 Å²	136	76.1 Å²	76.1	64%	0.636	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-53.5	-25.1	171.3	-69.4	-172.1	-175.9	0	0	114.6	N413 W417 F418 K419	N413-E415 PolarHBondContact O-N 2.89Å; N413-E415 VanDerWaalsContact O-N 3.1Å; E415-W417 VanDerWaalsContact C-N 3.26Å; E415-W417 PolarHBondContact O-N 3.25Å; E415-F418 PolarHBondContact O-N 2.82Å; E415-K419 IonicContact OE2-NZ 3.07Å
416	F	90.6	Very high	90.2	Very high	12 Å²	12	74.9 Å²	74.9	5%	0.053	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-53.6	-43.8	-179.7	171.6	-107.1	0	0	0	112.1	I406 H409 N413 R414 F418 K419 Y421 S422	I406-F416 HydrophobicContact CG2-CE1 3.69Å; I406-F416 HydrophobicContact CG2-CZ 3.82Å; H409-F416 AromaticContact CE1-CD2 3.49Å; H409-F416 VanDerWaalsContact CE1-CD2 3.49Å; H409-F416 WeakPolarHBondContact CE1-CD2 3.38Å; H409-F416 AromaticContact CE1-CG 3.77Å; H409-F416 AromaticContact ND1-CD2 3.41Å; H409-F416 WeakPolarHBondContact ND1-CD2 3.49Å; H409-F416 AromaticContact ND1-CE2 3.93Å; H409-F416 AromaticContact ND1-CG 3.47Å; H409-F416 WeakPolarHBondContact ND1-CG 3.38Å; N413-F416 WeakPolarHBondContact O-CB 3.05Å; N413-F416 PolarHBondContact O-N 3.29Å; R414-F416 PolarHBondContact O-N 2.81Å; R414-F416 VanDerWaalsContact O-N 3.1Å; F416-F418 VanDerWaalsContact C-N 3.25Å; F416-F418 PolarHBondContact O-N 3.16Å; F416-K419 WeakPolarHBondContact O-CB 3.28Å; F416-K419 PolarHBondContact O-N 3Å; F416-K419 VanDerWaalsContact O-N 3.11Å; F416-Y421 HydrophobicContact CD2-CE2 4.32Å; F416-Y421 AromaticContact CE2-CE2 3.88Å; F416-Y421 HydrophobicContact CE2-CE2 3.88Å; F416-S422 VanDerWaalsContact O-CB 3.22Å; F416-S422 WeakPolarHBondContact O-CB 3.05Å; F416-S422 PolarHBondContact O-OG 3.37Å
417	W	88.6	Confident	90.2	Very high	106 Å²	106	73.6 Å²	73.6	40%	0.402	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-69.4	-19.6	-174.2	-61.9	113.7	0	0	0	114.1	I406 G410 R414 E415 K419 S422 W426	I406-W417 HydrophobicContact CG2-CH2 4.32Å; G410-W417 PolarHBondContact O-NE1 3.49Å; G410-W417 VanDerWaalsContact O-NE1 3.17Å; R414-W417 PolarHBondContact O-N 2.84Å; E415-W417 VanDerWaalsContact C-N 3.26Å; E415-W417 PolarHBondContact O-N 3.25Å; W417-K419 VanDerWaalsContact C-N 3.3Å; W417-S422 PolarHBondContact O-OG 2.9Å; W417-W426 HydrophobicContact CH2-CD2 4.35Å; W417-W426 AromaticContact CH2-CE3 3.81Å; W417-W426 HydrophobicContact CH2-CE3 3.81Å; W417-W426 HydrophobicContact CH2-CZ3 4.14Å; W417-W426 HydrophobicContact CZ3-CE3 4.35Å
418	F	88	Confident	90.3	Very high	185 Å²	185	74.3 Å²	74.3	81%	0.811	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-82.1	-7.2	175.3	-60.7	-86.4	0	0	0	113.1	E415 F416	E415-F418 PolarHBondContact O-N 2.82Å; F416-F418 VanDerWaalsContact C-N 3.25Å; F416-F418 PolarHBondContact O-N 3.16Å
419	K	88.9	Confident	90.5	Very high	86 Å²	86	71.7 Å²	71.7	37%	0.374	35%	0.348	S	S	.	.	S	Bend	trans	-94.2	127.6	-177.6	-56.8	178.9	-171.6	-178.4	0	109.5	E415 F416 W417 Y421 S422	E415-K419 IonicContact OE2-NZ 3.07Å; F416-K419 WeakPolarHBondContact O-CB 3.28Å; F416-K419 PolarHBondContact O-N 3Å; F416-K419 VanDerWaalsContact O-N 3.11Å; W417-K419 VanDerWaalsContact C-N 3.3Å; K419-Y421 HydrophobicContact CB-CD1 3.91Å; K419-Y421 HydrophobicContact CB-CE1 3.56Å; K419-Y421 HydrophobicContact CD-CE1 4Å; K419-Y421 HydrophobicContact CG-CE1 4.31Å; K419-Y421 PolarHBondContact O-N 2.95Å; K419-S422 VanDerWaalsContact O-CB 3.24Å; K419-S422 WeakPolarHBondContact O-CB 3.29Å; K419-S422 PolarHBondContact O-N 3.43Å; K419-S422 PolarHBondContact O-OG 2.9Å
420	S	85	Confident	90.5	Very high	96 Å²	96	68.4 Å²	68.4	67%	0.671	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.2	-170	-32.7	0	0	0	0	115.3
421	Y	89	Confident	90.8	Very high	133 Å²	133	71 Å²	71	52%	0.522	34%	0.343	S	S	.	.	H	α-helix	trans	-81.4	-13.9	174.2	70.7	-96	0	0	0	113.9	F416 K419 I423 K424 A425	F416-Y421 HydrophobicContact CD2-CE2 4.32Å; F416-Y421 AromaticContact CE2-CE2 3.88Å; F416-Y421 HydrophobicContact CE2-CE2 3.88Å; K419-Y421 HydrophobicContact CB-CD1 3.91Å; K419-Y421 HydrophobicContact CB-CE1 3.56Å; K419-Y421 HydrophobicContact CD-CE1 4Å; K419-Y421 HydrophobicContact CG-CE1 4.31Å; K419-Y421 PolarHBondContact O-N 2.95Å; Y421-I423 PolarHBondContact O-N 3.31Å; Y421-K424 PolarHBondContact O-N 3.23Å; Y421-A425 PolarHBondContact O-N 3.3Å
422	S	91.1	Very high	91.3	Very high	6 Å²	6	70.3 Å²	70.3	4%	0.042	34%	0.343	C	S	.	.	H	α-helix	trans	-62.2	-44.4	-177.3	61.3	0	0	0	0	112.2	F416 W417 K419 A425 W426	F416-S422 VanDerWaalsContact O-CB 3.22Å; F416-S422 WeakPolarHBondContact O-CB 3.05Å; F416-S422 PolarHBondContact O-OG 3.37Å; W417-S422 PolarHBondContact O-OG 2.9Å; K419-S422 VanDerWaalsContact O-CB 3.24Å; K419-S422 WeakPolarHBondContact O-CB 3.29Å; K419-S422 PolarHBondContact O-N 3.43Å; K419-S422 PolarHBondContact O-OG 2.9Å; S422-A425 WeakPolarHBondContact O-CB 3.46Å; S422-A425 PolarHBondContact O-N 2.84Å; S422-W426 WeakPolarHBondContact O-CB 3.3Å; S422-W426 PolarHBondContact O-N 3.44Å
423	I	90.6	Very high	91.6	Very high	48 Å²	48	64.3 Å²	64.3	25%	0.246	31%	0.312	C	S	.	.	H	α-helix	trans	-68.5	-34.2	176.3	-168.9	172.9	0	0	0	112.5	P17 F18 L204 Y421 A425 W426 A427	P17-I423 HydrophobicContact CB-CG2 3.43Å; P17-I423 VanDerWaalsContact CB-CG2 3.43Å; P17-I423 HydrophobicContact CG-CD1 4.39Å; P17-I423 HydrophobicContact CG-CG2 4.03Å; F18-I423 HydrophobicContact CE2-CD1 4.3Å; F18-I423 HydrophobicContact CE2-CG1 4.1Å; F18-I423 HydrophobicContact CE2-CG2 4.46Å; L204-I423 HydrophobicContact CD2-CD1 3.93Å; Y421-I423 PolarHBondContact O-N 3.31Å; I423-A425 VanDerWaalsContact C-N 3.34Å; I423-A425 PolarHBondContact O-N 2.03Å; I423-W426 PolarHBondContact O-N 3.44Å; I423-A427 WeakPolarHBondContact O-CB 3.37Å; I423-A427 PolarHBondContact O-N 2.96Å
424	K	91.9	Very high	91.8	Very high	75 Å²	75	60.5 Å²	60.5	33%	0.326	29%	0.292	S	S	.	.	H	α-helix	trans	-61.8	-43.1	170.1	-62.7	-159.4	174.5	-169.5	0	111.3	P17 F18 E22 Y421 A428	P17-K424 WeakPolarHBondContact O-CE 3.37Å; F18-K424 HydrophobicContact CD1-CG 4.17Å; F18-K424 HydrophobicContact CE1-CB 4.27Å; F18-K424 HydrophobicContact CE1-CD 4.45Å; F18-K424 HydrophobicContact CE1-CG 3.73Å; F18-K424 HydrophobicContact CZ-CG 4.23Å; E22-K424 IonicContact OE1-NZ 2.88Å; E22-K424 PolarHBondContact OE1-NZ 3.05Å; E22-K424 IonicContact OE2-NZ 3.94Å; E22-K424 PolarHBondContact OE2-NZ 3.07Å; Y421-K424 PolarHBondContact O-N 3.23Å; K424-A428 WeakPolarHBondContact O-CB 3.48Å; K424-A428 PolarHBondContact O-N 3.49Å
425	A	94.3	Very high	92.2	Very high	32 Å²	32	53.7 Å²	53.7	26%	0.264	27%	0.266	S	S	.	.	H	α-helix	trans	-67.7	-40	177	0	0	0	0	0	112.1	I406 Y421 S422 I423 A428 A429	I406-A425 HydrophobicContact CD1-CB 3.77Å; I406-A425 WeakPolarHBondContact CD1-O 3.46Å; Y421-A425 PolarHBondContact O-N 3.3Å; S422-A425 WeakPolarHBondContact O-CB 3.46Å; S422-A425 PolarHBondContact O-N 2.84Å; I423-A425 VanDerWaalsContact C-N 3.34Å; I423-A425 PolarHBondContact O-N 2.03Å; A425-A428 PolarHBondContact O-N 3.13Å; A425-A429 WeakPolarHBondContact O-CB 3.5Å; A425-A429 PolarHBondContact O-N 3.26Å
426	W	93.8	Very high	92.4	Very high	53 Å²	53	48.1 Å²	48.1	20%	0.201	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-50.9	174.5	-177.6	-105.7	0	0	0	112	E200 R403 I406 Y407 W417 S422 I423 A428 A429 N430	E200-W426 PolarHBondContact OE1-NE1 3.48Å; R403-W426 HydrophobicContact CG-CH2 4.17Å; R403-W426 HydrophobicContact CG-CZ3 4.12Å; I406-W426 HydrophobicContact CG2-CE3 4Å; Y407-W426 HydrophobicContact CD2-CH2 4.45Å; Y407-W426 HydrophobicContact CD2-CZ3 4.48Å; W417-W426 HydrophobicContact CH2-CD2 4.35Å; W417-W426 AromaticContact CH2-CE3 3.81Å; W417-W426 HydrophobicContact CH2-CE3 3.81Å; W417-W426 HydrophobicContact CH2-CZ3 4.14Å; W417-W426 HydrophobicContact CZ3-CE3 4.35Å; S422-W426 WeakPolarHBondContact O-CB 3.3Å; S422-W426 PolarHBondContact O-N 3.44Å; I423-W426 PolarHBondContact O-N 3.44Å; W426-A428 VanDerWaalsContact C-N 3.32Å; W426-A428 PolarHBondContact O-N 3Å; W426-A429 PolarHBondContact O-N 2.58Å; W426-A429 VanDerWaalsContact O-N 3.09Å; W426-N430 PolarHBondContact NE1-ND2 2.83Å; W426-N430 PolarHBondContact O-N 3.04Å
427	A	92.9	Very high	92.6	Very high	3 Å²	3	47.8 Å²	47.8	3%	0.025	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-39.7	176.7	0	0	0	0	0	112.2	F18 I423 A429 N430 F431	F18-A427 HydrophobicContact CZ-CB 3.8Å; I423-A427 WeakPolarHBondContact O-CB 3.37Å; I423-A427 PolarHBondContact O-N 2.96Å; A427-A429 VanDerWaalsContact C-N 3.34Å; A427-A429 PolarHBondContact O-N 2.66Å; A427-N430 PolarHBondContact O-N 2.95Å; A427-F431 VanDerWaalsContact O-CB 3.31Å; A427-F431 WeakPolarHBondContact O-CB 3.46Å; A427-F431 PolarHBondContact O-N 3.38Å
428	A	94.6	Very high	92.8	Very high	58 Å²	58	43.1 Å²	43.1	48%	0.479	23%	0.225	S	C	.	.	H	α-helix	trans	-64.5	-36.2	174.4	0	0	0	0	0	112.8	K424 A425 W426 A432	K424-A428 WeakPolarHBondContact O-CB 3.48Å; K424-A428 PolarHBondContact O-N 3.49Å; A425-A428 PolarHBondContact O-N 3.13Å; W426-A428 VanDerWaalsContact C-N 3.32Å; W426-A428 PolarHBondContact O-N 3Å; A428-A432 WeakPolarHBondContact O-CB 3.41Å; A428-A432 PolarHBondContact O-N 3.31Å
429	A	95.9	Very high	93.1	Very high	2 Å²	2	38.1 Å²	38.1	2%	0.017	20%	0.201	C	C	.	.	H	α-helix	trans	-75.2	-36.4	176.5	0	0	0	0	0	113.4	P402 R403 I406 A425 W426 A427 A432 R433	P402-A429 HydrophobicContact CB-CB 3.82Å; R403-A429 HydrophobicContact CB-CB 4.18Å; I406-A429 HydrophobicContact CD1-CB 3.76Å; A425-A429 WeakPolarHBondContact O-CB 3.5Å; A425-A429 PolarHBondContact O-N 3.26Å; W426-A429 PolarHBondContact O-N 2.58Å; W426-A429 VanDerWaalsContact O-N 3.09Å; A427-A429 VanDerWaalsContact C-N 3.34Å; A427-A429 PolarHBondContact O-N 2.66Å; A429-A432 PolarHBondContact O-N 3.48Å; A429-R433 PolarHBondContact O-N 3.1Å
430	N	94.3	Very high	93.2	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.016	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-39.7	170	-88.8	-20.2	0	0	0	111.2	E200 R403 W426 A427 A432 R433 D434	E200-N430 VanDerWaalsContact CD-ND2 3.31Å; E200-N430 PolarHBondContact OE1-ND2 2.91Å; E200-N430 PolarHBondContact OE2-ND2 3.28Å; R403-N430 VanDerWaalsContact CD-OD1 3.29Å; R403-N430 WeakPolarHBondContact CD-OD1 3.37Å; W426-N430 PolarHBondContact NE1-ND2 2.83Å; W426-N430 PolarHBondContact O-N 3.04Å; A427-N430 PolarHBondContact O-N 2.95Å; N430-A432 PolarHBondContact O-N 2.92Å; N430-R433 WeakPolarHBondContact O-CB 3.4Å; N430-R433 PolarHBondContact O-N 3.2Å; N430-R433 PolarHBondContact OD1-NH2 3.33Å; N430-D434 WeakPolarHBondContact O-CB 3.26Å; N430-D434 PolarHBondContact O-N 3.07Å
431	F	95.7	Very high	93.5	Very high	59 Å²	59	30.5 Å²	30.5	26%	0.259	16%	0.158	S	C	.	.	H	α-helix	trans	-58.6	-46.8	170.9	177.7	-103.4	0	0	0	112.6	I29 F30 V33 A427 R433 D434 S435	I29-F431 HydrophobicContact CG2-CE1 4.49Å; I29-F431 HydrophobicContact CG2-CE2 3.49Å; I29-F431 VanDerWaalsContact CG2-CE2 3.49Å; I29-F431 HydrophobicContact CG2-CZ 3.48Å; I29-F431 VanDerWaalsContact CG2-CZ 3.48Å; F30-F431 HydrophobicContact CD1-CD2 4.05Å; F30-F431 HydrophobicContact CD2-CD2 4.05Å; F30-F431 HydrophobicContact CE1-CB 4.26Å; F30-F431 AromaticContact CE1-CD2 3.83Å; F30-F431 HydrophobicContact CE1-CD2 3.83Å; F30-F431 HydrophobicContact CE2-CB 3.95Å; F30-F431 AromaticContact CE2-CD2 3.79Å; F30-F431 HydrophobicContact CE2-CD2 3.79Å; F30-F431 HydrophobicContact CE2-CG 4.3Å; F30-F431 HydrophobicContact CG-CD2 4.2Å; F30-F431 HydrophobicContact CZ-CB 3.56Å; F30-F431 AromaticContact CZ-CD2 3.71Å; F30-F431 HydrophobicContact CZ-CD2 3.71Å; F30-F431 HydrophobicContact CZ-CG 4.14Å; V33-F431 HydrophobicContact CG2-CE2 3.75Å; V33-F431 HydrophobicContact CG2-CZ 4.11Å; A427-F431 VanDerWaalsContact O-CB 3.31Å; A427-F431 WeakPolarHBondContact O-CB 3.46Å; A427-F431 PolarHBondContact O-N 3.38Å; F431-R433 VanDerWaalsContact C-N 3.29Å; F431-R433 PolarHBondContact O-N 3.39Å; F431-D434 PolarHBondContact O-N 3.38Å; F431-S435 WeakPolarHBondContact O-CB 3.45Å; F431-S435 PolarHBondContact O-N 3.19Å; F431-S435 PolarHBondContact O-OG 3.5Å
432	A	96.1	Very high	93.6	Very high	25 Å²	25	29.3 Å²	29.3	21%	0.207	16%	0.156	C	C	.	.	H	α-helix	trans	-57.6	-42.7	176.7	0	0	0	0	0	111.5	S399 P402 A428 A429 N430 S435	S399-A432 WeakPolarHBondContact CB-O 3.5Å; S399-A432 CarbonylContact O-C 3.5Å; P402-A432 HydrophobicContact CG-CB 4.33Å; A428-A432 WeakPolarHBondContact O-CB 3.41Å; A428-A432 PolarHBondContact O-N 3.31Å; A429-A432 PolarHBondContact O-N 3.48Å; N430-A432 PolarHBondContact O-N 2.92Å; A432-S435 PolarHBondContact O-OG 3.36Å
433	R	95.3	Very high	93.6	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.019	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-52.9	173.2	176.9	-176.1	60.9	64.5	9.4	112.5	N196 S399 Q400 A429 N430 F431 S435 S436	N196-R433 PolarHBondContact ND2-NH2 3.46Å; S399-R433 WeakPolarHBondContact O-CA 3.46Å; S399-R433 PolarHBondContact O-N 2.84Å; Q400-R433 VanDerWaalsContact OE1-CD 3.27Å; A429-R433 PolarHBondContact O-N 3.1Å; N430-R433 WeakPolarHBondContact O-CB 3.4Å; N430-R433 PolarHBondContact O-N 3.2Å; N430-R433 PolarHBondContact OD1-NH2 3.33Å; F431-R433 VanDerWaalsContact C-N 3.29Å; F431-R433 PolarHBondContact O-N 3.39Å; R433-S435 VanDerWaalsContact C-N 3.34Å; R433-S435 PolarHBondContact O-N 2.78Å; R433-S436 WeakPolarHBondContact O-CB 3.35Å; R433-S436 PolarHBondContact O-N 3.04Å; R433-S436 VanDerWaalsContact O-N 3.09Å; R433-S436 PolarHBondContact O-OG 3.02Å
434	D	94.7	Very high	93.4	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-68.6	-33	-170.5	-84.3	-42.3	0	0	0	112.5	F30 M188 I193 N430 F431 S436 T437	F30-D434 HydrophobicContact CE1-CB 4.11Å; M188-D434 WeakPolarHBondContact CE-OD1 3.33Å; I193-D434 HydrophobicContact CD1-CB 3.88Å; I193-D434 HydrophobicContact CG1-CB 3.96Å; I193-D434 WeakPolarHBondContact CG1-OD1 3.5Å; I193-D434 HydrophobicContact CG2-CB 4.35Å; N430-D434 WeakPolarHBondContact O-CB 3.26Å; N430-D434 PolarHBondContact O-N 3.07Å; F431-D434 PolarHBondContact O-N 3.38Å; D434-S436 PolarHBondContact O-N 3.36Å; D434-T437 WeakPolarHBondContact O-CG2 3.37Å; D434-T437 PolarHBondContact O-N 3.04Å; D434-T437 PolarHBondContact O-OG1 2.86Å
435	S	95.2	Very high	93.2	Very high	3 Å²	3	25.2 Å²	25.2	2%	0.021	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.5	172.4	58.7	0	0	0	0	114.4	F431 A432 R433 T437 C438 Y439	F431-S435 WeakPolarHBondContact O-CB 3.45Å; F431-S435 PolarHBondContact O-N 3.19Å; F431-S435 PolarHBondContact O-OG 3.5Å; A432-S435 PolarHBondContact O-OG 3.36Å; R433-S435 VanDerWaalsContact C-N 3.34Å; R433-S435 PolarHBondContact O-N 2.78Å; S435-T437 PolarHBondContact O-N 2.86Å; S435-C438 PolarHBondContact O-N 2.75Å; S435-C438 PolarHBondContact O-SG 2.76Å; S435-Y439 WeakPolarHBondContact O-CD1 3.12Å; S435-Y439 WeakPolarHBondContact O-CE1 3.45Å; S435-Y439 PolarHBondContact OG-OH 2.97Å
436	S	93.8	Very high	92.9	Very high	20 Å²	20	34.2 Å²	34.2	14%	0.14	17%	0.169	C	C	.	.	H	α-helix	trans	-57.6	-33.2	172.1	71	0	0	0	0	113.1	S399 R433 D434 C438 Y439	S399-S436 WeakPolarHBondContact OG-CB 3.38Å; R433-S436 WeakPolarHBondContact O-CB 3.35Å; R433-S436 PolarHBondContact O-N 3.04Å; R433-S436 VanDerWaalsContact O-N 3.09Å; R433-S436 PolarHBondContact O-OG 3.02Å; D434-S436 PolarHBondContact O-N 3.36Å; S436-C438 VanDerWaalsContact C-N 3.26Å; S436-C438 PolarHBondContact O-N 2.79Å; S436-Y439 PolarHBondContact O-N 3.23Å
437	T	94.6	Very high	92.3	Very high	4 Å²	4	33.5 Å²	33.5	3%	0.025	17%	0.168	C	C	.	.	H	α-helix	trans	-61.4	-29.4	-179.5	61.2	0	0	0	0	113.3	A37 N41 D185 M188 D434 S435	A37-T437 WeakPolarHBondContact CB-OG1 3.45Å; N41-T437 PolarHBondContact ND2-O 2.93Å; D185-T437 HydrophobicContact CB-CG2 4.36Å; M188-T437 HydrophobicContact CB-CG2 3.89Å; D434-T437 WeakPolarHBondContact O-CG2 3.37Å; D434-T437 PolarHBondContact O-N 3.04Å; D434-T437 PolarHBondContact O-OG1 2.86Å; S435-T437 PolarHBondContact O-N 2.86Å
438	C	94.3	Very high	91.5	Very high	9 Å²	9	33.5 Å²	33.5	6%	0.061	17%	0.168	C	C	.	.	H	α-helix	trans	-88.5	-20.4	-179	78.5	0	0	0	0	113.7	L36 A37 S435 S436 N440 F442	L36-C438 HydrophobicContact CB-CB 3.97Å; A37-C438 HydrophobicContact CB-CB 3.95Å; S435-C438 PolarHBondContact O-N 2.75Å; S435-C438 PolarHBondContact O-SG 2.76Å; S436-C438 VanDerWaalsContact C-N 3.26Å; S436-C438 PolarHBondContact O-N 2.79Å; C438-N440 VanDerWaalsContact C-N 3.35Å; C438-N440 PolarHBondContact O-N 3.12Å; C438-F442 WeakPolarHBondContact O-CD2 3.35Å
439	Y	93.5	Very high	90.7	Very high	79 Å²	79	35.8 Å²	35.8	31%	0.31	17%	0.167	S	C	.	.	H	α-helix	trans	-67.8	-32.2	-174.7	-56.7	-28.6	0	0	0	113.5	M395 S435 S436 F442 I443	M395-Y439 HydrophobicContact CB-CD2 3.93Å; M395-Y439 HydrophobicContact CG-CD2 4.34Å; S435-Y439 WeakPolarHBondContact O-CD1 3.12Å; S435-Y439 WeakPolarHBondContact O-CE1 3.45Å; S435-Y439 PolarHBondContact OG-OH 2.97Å; S436-Y439 PolarHBondContact O-N 3.23Å; Y439-F442 PolarHBondContact O-N 2.86Å; Y439-F442 VanDerWaalsContact O-N 3.13Å; Y439-I443 WeakPolarHBondContact O-CG1 3.3Å; Y439-I443 PolarHBondContact O-N 3.09Å
440	N	89.9	Confident	89.6	Confident	9 Å²	9	36.5 Å²	36.5	5%	0.048	17%	0.171	C	C	.	.	H	α-helix	trans	-52.3	-59.3	-175.1	-84.9	-36.6	0	0	0	112.7	D185 V392 C438 F442 I443 Y444	D185-N440 PolarHBondContact OD2-ND2 3.46Å; V392-N440 WeakPolarHBondContact CG1-OD1 3.13Å; C438-N440 VanDerWaalsContact C-N 3.35Å; C438-N440 PolarHBondContact O-N 3.12Å; N440-F442 VanDerWaalsContact C-N 3.32Å; N440-F442 PolarHBondContact O-N 2.78Å; N440-I443 PolarHBondContact O-N 3.48Å; N440-Y444 HydrophobicContact CB-CE2 4.15Å; N440-Y444 WeakPolarHBondContact CB-OH 3.37Å; N440-Y444 VanDerWaalsContact O-CD1 3.22Å; N440-Y444 WeakPolarHBondContact O-CD1 3.36Å; N440-Y444 WeakPolarHBondContact O-CD2 3.45Å; N440-Y444 WeakPolarHBondContact O-CE1 3.28Å; N440-Y444 PolarHBondContact O-N 2.98Å; N440-Y444 VanDerWaalsContact O-N 3.11Å; N440-Y444 PolarHBondContact OD1-OH 3.33Å
441	P	91.6	Very high	88.9	Confident	13 Å²	13	36.6 Å²	36.6	8%	0.084	17%	0.171	C	C	.	.	H	α-helix	trans	-53.8	-39	173.8	-28.2	34.1	0	0	0	115.3	V44 Y444 A445	V44-P441 HydrophobicContact CG2-CB 4.39Å; V44-P441 HydrophobicContact CG2-CG 4.2Å; P441-Y444 PolarHBondContact O-N 3.38Å; P441-A445 WeakPolarHBondContact O-CB 3.42Å; P441-A445 PolarHBondContact O-N 3.17Å
442	F	91.9	Very high	88.4	Confident	108 Å²	108	40.1 Å²	40.1	47%	0.474	18%	0.183	S	C	.	.	H	α-helix	trans	-68.6	-41.4	179.1	-71.5	-66.4	0	0	0	112.3	L36 C438 Y439 N440 Y444 A445 W446	L36-F442 HydrophobicContact CB-CE2 4.29Å; L36-F442 HydrophobicContact CD1-CE2 4.08Å; L36-F442 HydrophobicContact CD1-CZ 4.03Å; L36-F442 HydrophobicContact CD2-CZ 3.97Å; L36-F442 HydrophobicContact CG-CZ 4.41Å; C438-F442 WeakPolarHBondContact O-CD2 3.35Å; Y439-F442 PolarHBondContact O-N 2.86Å; Y439-F442 VanDerWaalsContact O-N 3.13Å; N440-F442 VanDerWaalsContact C-N 3.32Å; N440-F442 PolarHBondContact O-N 2.78Å; F442-Y444 VanDerWaalsContact C-N 3.29Å; F442-Y444 PolarHBondContact O-N 3.42Å; F442-A445 PolarHBondContact O-N 3.23Å; F442-W446 WeakPolarHBondContact O-CB 3.37Å; F442-W446 PolarHBondContact O-N 2.89Å
443	I	90.8	Very high	87.6	Confident	13 Å²	13	44.4 Å²	44.4	7%	0.067	20%	0.198	C	C	.	.	H	α-helix	trans	-62.9	-39.9	176.3	-66.2	163.2	0	0	0	110.4	M388 L391 V392 M395 Y439 N440 W446 I447	M388-I443 HydrophobicContact CG-CG2 3.89Å; L391-I443 HydrophobicContact CB-CG2 4.36Å; L391-I443 HydrophobicContact CD2-CG1 4.17Å; L391-I443 HydrophobicContact CD2-CG2 4.04Å; L391-I443 HydrophobicContact CG-CD1 4.2Å; L391-I443 HydrophobicContact CG-CG1 4.3Å; L391-I443 HydrophobicContact CG-CG2 4.31Å; V392-I443 HydrophobicContact CG2-CB 4.27Å; V392-I443 HydrophobicContact CG2-CD1 3.92Å; V392-I443 HydrophobicContact CG2-CG2 3.86Å; M395-I443 HydrophobicContact CG-CD1 4.09Å; Y439-I443 WeakPolarHBondContact O-CG1 3.3Å; Y439-I443 PolarHBondContact O-N 3.09Å; N440-I443 PolarHBondContact O-N 3.48Å; I443-W446 PolarHBondContact O-N 2.88Å; I443-I447 HydrophobicContact CG2-CD1 4.17Å; I443-I447 PolarHBondContact O-N 2.95Å; I443-I447 VanDerWaalsContact O-N 3.14Å
444	Y	86.6	Confident	86.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.7	-45.7	175.5	-51.2	-19.4	0	0	0	111	V44 L178 M388 V392 N440 P441 F442 W446 N448 F451	V44-Y444 HydrophobicContact CG1-CE2 4.21Å; V44-Y444 HydrophobicContact CG2-CD2 3.74Å; V44-Y444 HydrophobicContact CG2-CE2 3.94Å; L178-Y444 HydrophobicContact CD2-CE1 4.18Å; L178-Y444 WeakPolarHBondContact CD2-OH 3.47Å; M388-Y444 HydrophobicContact CE-CD1 3.66Å; M388-Y444 HydrophobicContact CE-CE1 4.22Å; M388-Y444 HydrophobicContact CE-CG 4.41Å; M388-Y444 HydrophobicContact CG-CD1 4.36Å; M388-Y444 HydrophobicContact SD-CD1 4.13Å; V392-Y444 HydrophobicContact CG2-CE1 3.84Å; N440-Y444 HydrophobicContact CB-CE2 4.15Å; N440-Y444 WeakPolarHBondContact CB-OH 3.37Å; N440-Y444 VanDerWaalsContact O-CD1 3.22Å; N440-Y444 WeakPolarHBondContact O-CD1 3.36Å; N440-Y444 WeakPolarHBondContact O-CD2 3.45Å; N440-Y444 WeakPolarHBondContact O-CE1 3.28Å; N440-Y444 PolarHBondContact O-N 2.98Å; N440-Y444 VanDerWaalsContact O-N 3.11Å; N440-Y444 PolarHBondContact OD1-OH 3.33Å; P441-Y444 PolarHBondContact O-N 3.38Å; F442-Y444 VanDerWaalsContact C-N 3.29Å; F442-Y444 PolarHBondContact O-N 3.42Å; Y444-W446 PolarHBondContact O-N 3.03Å; Y444-N448 WeakPolarHBondContact O-CA 3.31Å; Y444-N448 VanDerWaalsContact O-CB 3.28Å; Y444-N448 WeakPolarHBondContact O-CB 3.19Å; Y444-N448 PolarHBondContact O-N 2.88Å; Y444-F451 HydrophobicContact CD2-CZ 4.49Å
445	A	87.3	Confident	86.3	Confident	31 Å²	31	46.8 Å²	46.8	26%	0.256	21%	0.213	S	C	.	.	H	α-helix	trans	-63.2	-38.4	176.6	0	0	0	0	0	113.2	P441 F442 F451 R452	P441-A445 WeakPolarHBondContact O-CB 3.42Å; P441-A445 PolarHBondContact O-N 3.17Å; F442-A445 PolarHBondContact O-N 3.23Å; A445-F451 HydrophobicContact CB-CD1 4.31Å; A445-F451 HydrophobicContact CB-CE1 4.22Å; A445-R452 HydrophobicContact CB-CG 4.33Å; A445-R452 WeakPolarHBondContact O-CD 3.26Å; A445-R452 WeakPolarHBondContact O-CG 3.47Å
446	W	87.4	Confident	85.7	Confident	221 Å²	221	54 Å²	54	84%	0.837	24%	0.241	S	C	*	.	H	α-helix	trans	-65	-50.9	178.5	-166.1	-43.3	0	0	0	111.3	F442 I443 Y444	F442-W446 WeakPolarHBondContact O-CB 3.37Å; F442-W446 PolarHBondContact O-N 2.89Å; I443-W446 PolarHBondContact O-N 2.88Å; Y444-W446 PolarHBondContact O-N 3.03Å
447	I	81.7	Confident	85	Confident	37 Å²	37	55.8 Å²	55.8	19%	0.19	25%	0.247	C	C	.	.	H	α-helix	trans	-95.7	-36.2	-165.7	-60.4	171.1	0	0	0	112.5	M388 L391 I443 K449	M388-I447 HydrophobicContact CB-CB 4.23Å; M388-I447 HydrophobicContact CB-CD1 4.07Å; M388-I447 HydrophobicContact CB-CG2 3.94Å; M388-I447 HydrophobicContact CG-CB 4.06Å; M388-I447 HydrophobicContact CG-CD1 4.17Å; M388-I447 HydrophobicContact CG-CG2 4.28Å; M388-I447 HydrophobicContact SD-CB 4.28Å; M388-I447 HydrophobicContact SD-CG2 4.47Å; L391-I447 HydrophobicContact CD2-CD1 4.03Å; I443-I447 HydrophobicContact CG2-CD1 4.17Å; I443-I447 PolarHBondContact O-N 2.95Å; I443-I447 VanDerWaalsContact O-N 3.14Å; I447-K449 PolarHBondContact O-N 3.27Å
448	N	76.4	Confident	84.2	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	26%	0.256	C	S	.	.			trans	-90.1	102.3	-179.4	-173.1	-2.3	0	0	0	111.5	P90 W91 M388 Y444 N450 F451 R452	P90-N448 VanDerWaalsContact CD-OD1 3.3Å; P90-N448 WeakPolarHBondContact CD-OD1 3.37Å; P90-N448 HydrophobicContact CG-CB 4.21Å; W91-N448 PolarHBondContact NE1-ND2 3.46Å; M388-N448 HydrophobicContact SD-CB 4.07Å; Y444-N448 WeakPolarHBondContact O-CA 3.31Å; Y444-N448 VanDerWaalsContact O-CB 3.28Å; Y444-N448 WeakPolarHBondContact O-CB 3.19Å; Y444-N448 PolarHBondContact O-N 2.88Å; N448-N450 VanDerWaalsContact C-N 3.25Å; N448-N450 PolarHBondContact O-N 2.93Å; N448-N450 WeakPolarHBondContact OD1-CB 3.49Å; N448-N450 PolarHBondContact OD1-N 2.73Å; N448-F451 HydrophobicContact CB-CB 3.79Å; N448-F451 WeakPolarHBondContact ND2-CB 3.38Å; N448-F451 PolarHBondContact O-N 3.31Å; N448-F451 PolarHBondContact OD1-N 3.47Å; N448-R452 PolarHBondContact O-N 2.92Å
449	K	77.6	Confident	83.4	Confident	107 Å²	107	64 Å²	64	47%	0.465	28%	0.283	S	S	.	.	H	α-helix	trans	-60	-33.5	174.2	-77.5	-159.2	178.7	-171.5	0	113.1	I447 Q453	I447-K449 PolarHBondContact O-N 3.27Å; K449-Q453 PolarHBondContact O-N 3.41Å
450	N	72.6	Confident	82.6	Confident	16 Å²	16	64.2 Å²	64.2	9%	0.086	28%	0.284	C	S	.	.	H	α-helix	trans	-72.4	-48.2	-178.3	-66.4	34	0	0	0	109.4	D89 N448 R452 Q453 D454	D89-N450 VanDerWaalsContact CB-ND2 3.29Å; D89-N450 WeakPolarHBondContact CB-ND2 3.41Å; D89-N450 PolarHBondContact OD2-ND2 3.37Å; N448-N450 VanDerWaalsContact C-N 3.25Å; N448-N450 PolarHBondContact O-N 2.93Å; N448-N450 WeakPolarHBondContact OD1-CB 3.49Å; N448-N450 PolarHBondContact OD1-N 2.73Å; N450-R452 PolarHBondContact O-N 3.16Å; N450-R452 VanDerWaalsContact O-N 3.09Å; N450-Q453 CarbonylContact O-C 3.54Å; N450-Q453 VanDerWaalsContact O-CA 3.31Å; N450-Q453 WeakPolarHBondContact O-CA 3.41Å; N450-Q453 VanDerWaalsContact O-CB 3.29Å; N450-Q453 WeakPolarHBondContact O-CB 3.29Å; N450-Q453 PolarHBondContact O-N 3.32Å; N450-D454 PolarHBondContact O-N 3.11Å; N450-D454 VanDerWaalsContact O-OD2 3.07Å
451	F	79	Confident	81.8	Confident	5 Å²	5	66.4 Å²	66.4	2%	0.022	30%	0.3	C	S	.	.	H	α-helix	trans	-50.1	-40.7	173.5	-180	-107.8	0	0	0	113.1	V44 L47 W91 Y444 A445 N448 Q453 D454 V455	V44-F451 HydrophobicContact CG2-CE2 3.99Å; V44-F451 HydrophobicContact CG2-CZ 3.74Å; L47-F451 HydrophobicContact CD1-CD2 3.76Å; L47-F451 HydrophobicContact CD1-CE2 3.52Å; L47-F451 HydrophobicContact CD1-CZ 4.38Å; W91-F451 HydrophobicContact CZ2-CB 4.33Å; W91-F451 AromaticContact CZ2-CD2 3.6Å; W91-F451 HydrophobicContact CZ2-CD2 3.6Å; W91-F451 HydrophobicContact CZ2-CE2 4.24Å; W91-F451 HydrophobicContact CZ2-CG 4.26Å; Y444-F451 HydrophobicContact CD2-CZ 4.49Å; A445-F451 HydrophobicContact CB-CD1 4.31Å; A445-F451 HydrophobicContact CB-CE1 4.22Å; N448-F451 HydrophobicContact CB-CB 3.79Å; N448-F451 WeakPolarHBondContact ND2-CB 3.38Å; N448-F451 PolarHBondContact O-N 3.31Å; N448-F451 PolarHBondContact OD1-N 3.47Å; F451-Q453 PolarHBondContact O-N 3.4Å; F451-D454 VanDerWaalsContact CA-OD2 3.25Å; F451-D454 WeakPolarHBondContact CA-OD2 3.4Å; F451-D454 PolarHBondContact N-OD2 2.93Å; F451-D454 PolarHBondContact O-N 3.07Å; F451-V455 HydrophobicContact CD1-CG2 4.24Å; F451-V455 HydrophobicContact CD2-CG2 4.43Å; F451-V455 HydrophobicContact CE1-CG2 3.96Å; F451-V455 HydrophobicContact CE2-CG2 4.19Å; F451-V455 HydrophobicContact CG-CG2 4.48Å; F451-V455 HydrophobicContact CZ-CG2 3.94Å; F451-V455 VanDerWaalsContact O-CG2 3.29Å; F451-V455 WeakPolarHBondContact O-CG2 3.35Å; F451-V455 PolarHBondContact O-N 2.89Å
452	R	85.2	Confident	80.7	Confident	133 Å²	133	69.3 Å²	69.3	50%	0.502	32%	0.32	S	S	.	.	H	α-helix	trans	-64.9	-35.7	173.4	-68.8	-163.8	-60.5	-166.8	11.2	114.2	A445 N448 N450 D454 Y456	A445-R452 HydrophobicContact CB-CG 4.33Å; A445-R452 WeakPolarHBondContact O-CD 3.26Å; A445-R452 WeakPolarHBondContact O-CG 3.47Å; N448-R452 PolarHBondContact O-N 2.92Å; N450-R452 PolarHBondContact O-N 3.16Å; N450-R452 VanDerWaalsContact O-N 3.09Å; R452-D454 VanDerWaalsContact C-N 3.33Å; R452-Y456 WeakPolarHBondContact O-CB 3.35Å; R452-Y456 PolarHBondContact O-N 3.15Å
453	Q	81	Confident	79.4	Confident	115 Å²	115	70.1 Å²	70.1	54%	0.537	32%	0.323	S	S	.	.	H	α-helix	trans	-67.9	-37.3	172.1	-66.1	174.9	-15.4	0	0	110.5	K449 N450 F451 Y456 H457	K449-Q453 PolarHBondContact O-N 3.41Å; N450-Q453 CarbonylContact O-C 3.54Å; N450-Q453 VanDerWaalsContact O-CA 3.31Å; N450-Q453 WeakPolarHBondContact O-CA 3.41Å; N450-Q453 VanDerWaalsContact O-CB 3.29Å; N450-Q453 WeakPolarHBondContact O-CB 3.29Å; N450-Q453 PolarHBondContact O-N 3.32Å; F451-Q453 PolarHBondContact O-N 3.4Å; Q453-Y456 PolarHBondContact O-N 3.46Å; Q453-H457 WeakPolarHBondContact O-CB 3.49Å; Q453-H457 PolarHBondContact O-CD2 3.37Å; Q453-H457 PolarHBondContact O-N 3.22Å
454	D	79	Confident	77.9	Confident	12 Å²	12	72.4 Å²	72.4	6%	0.064	34%	0.336	C	S	.	.	H	α-helix	trans	-67.6	-45	178.6	-47.5	-37.5	0	0	0	111.7	L47 W91 Y164 N450 F451 R452 Y456 H457 L458	L47-D454 HydrophobicContact CD1-CB 4.1Å; L47-D454 HydrophobicContact CD2-CB 3.94Å; W91-D454 PolarHBondContact NE1-OD2 2.88Å; Y164-D454 WeakPolarHBondContact OH-CA 3.45Å; Y164-D454 WeakPolarHBondContact OH-CB 3.44Å; Y164-D454 VanDerWaalsContact OH-CG 3.3Å; Y164-D454 PolarHBondContact OH-OD1 3.2Å; N450-D454 PolarHBondContact O-N 3.11Å; N450-D454 VanDerWaalsContact O-OD2 3.07Å; F451-D454 VanDerWaalsContact CA-OD2 3.25Å; F451-D454 WeakPolarHBondContact CA-OD2 3.4Å; F451-D454 PolarHBondContact N-OD2 2.93Å; F451-D454 PolarHBondContact O-N 3.07Å; R452-D454 VanDerWaalsContact C-N 3.33Å; D454-Y456 PolarHBondContact O-N 3.34Å; D454-H457 PolarHBondContact O-N 3.27Å; D454-L458 WeakPolarHBondContact O-CB 3.24Å; D454-L458 PolarHBondContact O-N 3.5Å
455	V	82.7	Confident	76.5	Confident	44 Å²	44	75.8 Å²	75.8	27%	0.267	36%	0.359	S	S	.	.	H	α-helix	trans	-59.1	-44	170.6	173	0	0	0	0	111.2	I43 L47 F451 L458 F459	I43-V455 HydrophobicContact CG2-CG2 3.72Å; L47-V455 HydrophobicContact CD1-CG2 3.72Å; F451-V455 HydrophobicContact CD1-CG2 4.24Å; F451-V455 HydrophobicContact CD2-CG2 4.43Å; F451-V455 HydrophobicContact CE1-CG2 3.96Å; F451-V455 HydrophobicContact CE2-CG2 4.19Å; F451-V455 HydrophobicContact CG-CG2 4.48Å; F451-V455 HydrophobicContact CZ-CG2 3.94Å; F451-V455 VanDerWaalsContact O-CG2 3.29Å; F451-V455 WeakPolarHBondContact O-CG2 3.35Å; F451-V455 PolarHBondContact O-N 2.89Å; V455-L458 PolarHBondContact O-N 3.49Å; V455-F459 WeakPolarHBondContact O-CB 3.49Å; V455-F459 PolarHBondContact O-N 2.97Å
456	Y	83.1	Confident	74.8	Confident	155 Å²	155	77.6 Å²	77.6	61%	0.608	37%	0.369	S	S	*	.	H	α-helix	trans	-63.6	-42.1	176.8	-178.9	-93.3	0	0	0	112.2	R452 Q453 D454 F459 Y460	R452-Y456 WeakPolarHBondContact O-CB 3.35Å; R452-Y456 PolarHBondContact O-N 3.15Å; Q453-Y456 PolarHBondContact O-N 3.46Å; D454-Y456 PolarHBondContact O-N 3.34Å; Y456-F459 PolarHBondContact O-N 3.23Å; Y456-Y460 WeakPolarHBondContact O-CB 3.41Å; Y456-Y460 PolarHBondContact O-N 2.73Å
457	H	78.3	Confident	73.2	Confident	57 Å²	57	73 Å²	73	26%	0.264	36%	0.356	S	S	.	.	H	α-helix	trans	-66.2	-39.3	175.6	-83.5	-61.7	0	0	0	112.4	Y164 Q453 D454 S461	Y164-H457 HydrophobicContact CD1-CB 4.3Å; Y164-H457 HydrophobicContact CE1-CB 3.6Å; Y164-H457 AromaticContact CE1-CD2 3.89Å; Y164-H457 AromaticContact CE1-CG 3.74Å; Y164-H457 AromaticContact CE2-CD2 3.97Å; Y164-H457 AromaticContact CZ-CD2 3.76Å; Q453-H457 WeakPolarHBondContact O-CB 3.49Å; Q453-H457 PolarHBondContact O-CD2 3.37Å; Q453-H457 PolarHBondContact O-N 3.22Å; D454-H457 PolarHBondContact O-N 3.27Å; H457-S461 VanDerWaalsContact O-CB 3.23Å; H457-S461 WeakPolarHBondContact O-CB 3.47Å; H457-S461 PolarHBondContact O-N 3.49Å; H457-S461 PolarHBondContact O-OG 3.35Å
458	L	78	Confident	71.8	Confident	42 Å²	42	76.6 Å²	76.6	22%	0.22	38%	0.375	C	S	.	.	H	α-helix	trans	-62.3	-49.4	173.6	178.7	63.7	0	0	0	111.2	I43 I46 L47 F50 D454 V455 S461 C462	I43-L458 HydrophobicContact CG2-CD2 4.4Å; I46-L458 HydrophobicContact CB-CD2 4.48Å; I46-L458 HydrophobicContact CG2-CD1 3.86Å; I46-L458 HydrophobicContact CG2-CD2 3.79Å; L47-L458 HydrophobicContact CD2-CB 4.09Å; L47-L458 HydrophobicContact CD2-CD2 4.01Å; L47-L458 HydrophobicContact CG-CD2 4.15Å; F50-L458 HydrophobicContact CE2-CD1 4.12Å; D454-L458 WeakPolarHBondContact O-CB 3.24Å; D454-L458 PolarHBondContact O-N 3.5Å; V455-L458 PolarHBondContact O-N 3.49Å; L458-S461 PolarHBondContact O-N 2.82Å; L458-C462 WeakPolarHBondContact O-CB 3.22Å; L458-C462 PolarHBondContact O-N 3.3Å
459	F	78.7	Confident	70.6	Confident	145 Å²	145	87.1 Å²	87.1	64%	0.636	41%	0.414	S	S	*	.	H	α-helix	trans	-61.9	-47.9	179.4	-169	-91.4	0	0	0	111.8	V455 Y456 S461 C462 F463	V455-F459 WeakPolarHBondContact O-CB 3.49Å; V455-F459 PolarHBondContact O-N 2.97Å; Y456-F459 PolarHBondContact O-N 3.23Å; F459-S461 VanDerWaalsContact C-N 3.34Å; F459-S461 PolarHBondContact O-N 3.46Å; F459-C462 PolarHBondContact O-N 3.1Å; F459-F463 WeakPolarHBondContact O-CB 3.1Å; F459-F463 PolarHBondContact O-N 3.03Å
460	Y	76.7	Confident	69.2	Low	82 Å²	82	87.2 Å²	87.2	32%	0.322	43%	0.428	S	S	.	.	H	α-helix	trans	-61.6	-40.4	177.1	-172.4	-98.2	0	0	0	112.3	Y456 L464	Y456-Y460 WeakPolarHBondContact O-CB 3.41Å; Y456-Y460 PolarHBondContact O-N 2.73Å; Y460-L464 HydrophobicContact CD1-CD1 4.19Å; Y460-L464 HydrophobicContact CD1-CD2 4.33Å; Y460-L464 HydrophobicContact CD2-CD1 4.04Å; Y460-L464 HydrophobicContact CE1-CD1 3.83Å; Y460-L464 HydrophobicContact CE1-CD2 3.58Å; Y460-L464 HydrophobicContact CE1-CG 4.32Å; Y460-L464 HydrophobicContact CE2-CD1 3.65Å; Y460-L464 HydrophobicContact CG-CD1 4.3Å; Y460-L464 WeakPolarHBondContact O-CB 3.5Å; Y460-L464 PolarHBondContact O-N 2.85Å
461	S	72.8	Confident	67.9	Low	56 Å²	56	91.3 Å²	91.3	39%	0.392	45%	0.449	S	S	.	.	H	α-helix	trans	-68.6	-38.3	178.4	-57.7	0	0	0	0	112.4	H457 L458 F459 S465	H457-S461 VanDerWaalsContact O-CB 3.23Å; H457-S461 WeakPolarHBondContact O-CB 3.47Å; H457-S461 PolarHBondContact O-N 3.49Å; H457-S461 PolarHBondContact O-OG 3.35Å; L458-S461 PolarHBondContact O-N 2.82Å; F459-S461 VanDerWaalsContact C-N 3.34Å; F459-S461 PolarHBondContact O-N 3.46Å; S461-S465 VanDerWaalsContact O-CB 3.26Å; S461-S465 WeakPolarHBondContact O-CB 3.3Å; S461-S465 PolarHBondContact O-N 3.14Å; S461-S465 PolarHBondContact O-OG 3.01Å
462	C	68.2	Low	65.9	Low	74 Å²	74	96.1 Å²	96.1	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-65.5	-52	173.9	-170.6	0	0	0	0	110.8	L458 F459 L464 S465 C466	L458-C462 WeakPolarHBondContact O-CB 3.22Å; L458-C462 PolarHBondContact O-N 3.3Å; F459-C462 PolarHBondContact O-N 3.1Å; C462-L464 PolarHBondContact O-N 2.73Å; C462-S465 WeakPolarHBondContact O-CB 3.49Å; C462-S465 PolarHBondContact O-N 2.98Å; C462-C466 PolarHBondContact O-N 2.92Å
463	F	65.2	Low	63.8	Low	124 Å²	124	99.6 Å²	99.6	54%	0.544	50%	0.499	S	S	.	.	H	α-helix	trans	-59.3	-45.7	-179	-165.8	-91.1	0	0	0	112.2	F459 S465 C466 F467	F459-F463 WeakPolarHBondContact O-CB 3.1Å; F459-F463 PolarHBondContact O-N 3.03Å; F463-S465 VanDerWaalsContact C-N 3.33Å; F463-S465 PolarHBondContact O-N 3.1Å; F463-C466 PolarHBondContact O-N 3.44Å; F463-F467 VanDerWaalsContact O-CB 3.29Å; F463-F467 WeakPolarHBondContact O-CB 3.48Å; F463-F467 PolarHBondContact O-N 3.11Å
464	L	58.7	Low	61.8	Low	62 Å²	62	101.9 Å²	101.9	33%	0.325	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-35.3	173.2	-98.7	67.2	0	0	0	112.5	Y460 C462 N468	Y460-L464 HydrophobicContact CD1-CD1 4.19Å; Y460-L464 HydrophobicContact CD1-CD2 4.33Å; Y460-L464 HydrophobicContact CD2-CD1 4.04Å; Y460-L464 HydrophobicContact CE1-CD1 3.83Å; Y460-L464 HydrophobicContact CE1-CD2 3.58Å; Y460-L464 HydrophobicContact CE1-CG 4.32Å; Y460-L464 HydrophobicContact CE2-CD1 3.65Å; Y460-L464 HydrophobicContact CG-CD1 4.3Å; Y460-L464 WeakPolarHBondContact O-CB 3.5Å; Y460-L464 PolarHBondContact O-N 2.85Å; C462-L464 PolarHBondContact O-N 2.73Å; L464-N468 VanDerWaalsContact O-CB 3.27Å; L464-N468 WeakPolarHBondContact O-CB 3.21Å; L464-N468 PolarHBondContact O-N 2.94Å; L464-N468 PolarHBondContact O-ND2 3.11Å
465	S	56	Low	59.7	Low	70 Å²	70	106.3 Å²	106.3	49%	0.49	55%	0.546	S	S	.	.	H	α-helix	trans	-68.9	-38.3	179.6	-63.5	0	0	0	0	112.2	S461 C462 F463 R469	S461-S465 VanDerWaalsContact O-CB 3.26Å; S461-S465 WeakPolarHBondContact O-CB 3.3Å; S461-S465 PolarHBondContact O-N 3.14Å; S461-S465 PolarHBondContact O-OG 3.01Å; C462-S465 WeakPolarHBondContact O-CB 3.49Å; C462-S465 PolarHBondContact O-N 2.98Å; F463-S465 VanDerWaalsContact C-N 3.33Å; F463-S465 PolarHBondContact O-N 3.1Å; S465-R469 WeakPolarHBondContact O-CG 2.75Å; S465-R469 PolarHBondContact O-N 2.87Å
466	C	52.9	Low	57.4	Low	70 Å²	70	116.6 Å²	116.6	47%	0.473	58%	0.58	S	S	.	*	H	α-helix	trans	-68.9	-49.4	172.7	-65.2	0	0	0	0	111.2	C462 F463 N468 R469 C470	C462-C466 PolarHBondContact O-N 2.92Å; F463-C466 PolarHBondContact O-N 3.44Å; C466-N468 VanDerWaalsContact C-N 3.33Å; C466-N468 PolarHBondContact O-N 2.66Å; C466-R469 PolarHBondContact O-N 2.97Å; C466-C470 PolarHBondContact O-N 3.27Å; C466-C470 PolarHBondContact O-SG 2.88Å
467	F	52.9	Low	55.2	Low	125 Å²	125	113 Å²	113	55%	0.548	58%	0.578	S	S	.	*	H	α-helix	trans	-59.6	-40.3	-179.7	-165.1	-92.2	0	0	0	112.7	F463 R469 L471	F463-F467 VanDerWaalsContact O-CB 3.29Å; F463-F467 WeakPolarHBondContact O-CB 3.48Å; F463-F467 PolarHBondContact O-N 3.11Å; F467-R469 VanDerWaalsContact C-N 3.29Å; F467-R469 PolarHBondContact O-N 3.26Å; F467-L471 HydrophobicContact CD1-CD1 4Å; F467-L471 HydrophobicContact CE1-CD1 3.67Å; F467-L471 HydrophobicContact CZ-CD1 4.45Å; F467-L471 PolarHBondContact O-N 3.23Å
468	N	52.8	Low	53.1	Low	111 Å²	111	117.3 Å²	117.3	59%	0.594	60%	0.603	S	S	*	*	H	α-helix	trans	-75.9	-10	175.2	-72.4	-65.9	0	0	0	114.3	L464 C466	L464-N468 VanDerWaalsContact O-CB 3.27Å; L464-N468 WeakPolarHBondContact O-CB 3.21Å; L464-N468 PolarHBondContact O-N 2.94Å; L464-N468 PolarHBondContact O-ND2 3.11Å; C466-N468 VanDerWaalsContact C-N 3.33Å; C466-N468 PolarHBondContact O-N 2.66Å
469	R	52	Low	51.1	Low	224 Å²	224	125.5 Å²	125.5	85%	0.845	64%	0.637	S	S	*	*	H	α-helix	trans	-92.5	-32.4	171.3	-82.3	-174	176.2	-138	1.6	112.8	S465 C466 F467 L471	S465-R469 WeakPolarHBondContact O-CG 2.75Å; S465-R469 PolarHBondContact O-N 2.87Å; C466-R469 PolarHBondContact O-N 2.97Å; F467-R469 VanDerWaalsContact C-N 3.29Å; F467-R469 PolarHBondContact O-N 3.26Å; R469-L471 VanDerWaalsContact C-N 3.32Å
470	C	48.3	Very low	49	Very low	110 Å²	110	124.5 Å²	124.5	74%	0.743	64%	0.642	S	S	*	*	H	α-helix	trans	-80	-10.1	178.7	-61.1	0	0	0	0	114	C466 P472	C466-C470 PolarHBondContact O-N 3.27Å; C466-C470 PolarHBondContact O-SG 2.88Å; C470-P472 WeakPolarHBondContact O-CD 3.49Å
471	L	43.8	Very low	47.2	Very low	102 Å²	102	127.7 Å²	127.7	53%	0.534	67%	0.665	S	S	.	*	S	Bend	trans	-83.5	112.6	171.9	-94.2	160.7	0	0	0	110.9	F467 R469 K473	F467-L471 HydrophobicContact CD1-CD1 4Å; F467-L471 HydrophobicContact CE1-CD1 3.67Å; F467-L471 HydrophobicContact CZ-CD1 4.45Å; F467-L471 PolarHBondContact O-N 3.23Å; R469-L471 VanDerWaalsContact C-N 3.32Å; L471-K473 PolarHBondContact O-N 2.74Å
472	P	37.4	Very low	45.5	Very low	105 Å²	105	133.6 Å²	133.6	68%	0.682	69%	0.691	S	S	*	*			trans	-65.4	136.1	176.8	27.1	-33.9	0	0	0	110.7	C470 L474	C470-P472 WeakPolarHBondContact O-CD 3.49Å; P472-L474 PolarHBondContact O-N 3.43Å
473	K	42.2	Very low	43.9	Very low	207 Å²	207	137.7 Å²	137.7	90%	0.9	71%	0.708	S	S	*	*			trans	-72.4	87.4	176.7	-68.1	177.7	-176.5	169.5	0	110.2	L471 S475	L471-K473 PolarHBondContact O-N 2.74Å; K473-S475 PolarHBondContact O-N 3.42Å
474	L	38.8	Very low	42.5	Very low	163 Å²	163	137.1 Å²	137.1	85%	0.853	72%	0.716	S	S	*	*			trans	-58.8	138	172.5	-131.3	74.7	0	0	0	110.4	P472	P472-L474 PolarHBondContact O-N 3.43Å
475	S	35.1	Very low	41.2	Very low	105 Å²	105	145.9 Å²	145.9	73%	0.734	75%	0.745	S	S	*	*			trans	-42.4	130.2	-161	-171.8	0	0	0	0	116.3	K473 S477	K473-S475 PolarHBondContact O-N 3.42Å; S475-S477 WeakPolarHBondContact OG-CB 3.49Å
476	R	33.6	Very low	40.2	Very low	259 Å²	259	148.4 Å²	148.4	98%	0.977	76%	0.763	S	S	*	*			trans	-107.7	81.6	163	-171.7	-174.7	-170.7	-174.9	3.2	108.7
477	S	36.7	Very low	39.4	Very low	80 Å²	80	152.2 Å²	152.2	56%	0.559	78%	0.778	S	S	*	*			trans	-132.2	140.2	-177.8	-170.3	0	0	0	0	112.5	S475	S475-S477 WeakPolarHBondContact OG-CB 3.49Å
478	N	34.4	Very low	38.6	Very low	147 Å²	147	154.1 Å²	154.1	79%	0.786	79%	0.794	S	S	*	*			trans	46.7	97.5	160.6	-61.8	-10	0	0	0	119.2
479	K	35.1	Very low	37.6	Very low	214 Å²	214	158.5 Å²	158.5	93%	0.93	81%	0.808	S	S	*	*				-168.1	108.3	111.2	-104	167.9	-177	179.6	0	112.2
480	T	36.4	Very low	36.7	Very low	124 Å²	124	158 Å²	158	76%	0.761	81%	0.812	S	S	*	*			trans	-117	158.8	158.2	40.1	0	0	0	0	108.3
481	N	37.6	Very low	35.9	Very low	149 Å²	149	161.5 Å²	161.5	80%	0.797	82%	0.815	S	S	*	*			trans	66	91	172.2	-50.3	-9.7	0	0	0	115.9
482	L	38.6	Very low	35.3	Very low	180 Å²	180	164.6 Å²	164.6	94%	0.942	83%	0.83	S	S	*	*				-175.9	146.6	117.1	-94.9	158	0	0	0	110.9
483	L	33.8	Very low	35.1	Very low	161 Å²	161	166.9 Å²	166.9	84%	0.843	83%	0.831	S	S	*	*			trans	-106	174.9	178.6	-79.2	164.5	0	0	0	109.3
484	P	34.7	Very low	34.7	Very low	111 Å²	111	163.1 Å²	163.1	72%	0.721	83%	0.825	S	S	*	*			cis	-130.6	-175.5	-2.7	26.2	-2.1	0	0	0	115
485	R	32.1	Very low	34.4	Very low	247 Å²	247	160.4 Å²	160.4	93%	0.932	82%	0.817	S	S	*	*			trans	3.9	121.8	154.4	-73.9	171.9	151.6	166.9	-8.8	118.9
486	S	35.5	Very low	34.3	Very low	123 Å²	123	162.5 Å²	162.5	86%	0.86	82%	0.819	S	S	*	*				-157.6	163.4	114.9	-163.6	0	0	0	0	111.2
487	N	35.2	Very low	34.2	Very low	149 Å²	149	157.2 Å²	157.2	80%	0.797	81%	0.808	S	S	*	*			trans	-89.9	130	-178.4	-70.9	-43.3	0	0	0	111.8
488	N	37.1	Very low	33.8	Very low	166 Å²	166	163.5 Å²	163.5	89%	0.888	82%	0.82	S	S	*	*				-164	153.5	123.7	-111.1	-41.2	0	0	0	113.9
489	K	32.2	Very low	33.7	Very low	203 Å²	203	165.2 Å²	165.2	88%	0.883	83%	0.825	S	S	*	*			trans	-92.3	126.8	-177.4	-60.9	169.7	-176.1	168	0	111
490	K	32.3	Very low	33.6	Very low	213 Å²	213	160.6 Å²	160.6	93%	0.926	82%	0.815	S	S	*	*			trans	-147.1	132.6	148.8	-105.4	171.1	-175	178.8	0	109.2
491	K	30.8	Very low	33.3	Very low	184 Å²	184	163.9 Å²	163.9	80%	0.8	82%	0.822	S	S	*	*			trans	-84.1	146.2	178.4	-68.1	178.8	177.6	178.6	0	109.9
492	I	32.2	Very low	33.1	Very low	166 Å²	166	162.7 Å²	162.7	85%	0.851	82%	0.822	S	S	*	*			trans	-123.9	131.9	154.8	-63.4	180	0	0	0	106.9
493	H	32.3	Very low	32.8	Very low	154 Å²	154	159.8 Å²	159.8	71%	0.713	82%	0.817	S	S	*	*			trans	-100.5	140.4	179.9	-105	-109.9	0	0	0	110.2
494	V	34.5	Very low	32.6	Very low	127 Å²	127	158.2 Å²	158.2	77%	0.77	81%	0.814	S	S	*	*			trans	-134.1	126.5	158.8	-176.3	0	0	0	0	107
495	P	33.3	Very low	32.3	Very low	106 Å²	106	160 Å²	160	69%	0.688	82%	0.817	S	S	*	*			trans	-82.1	146.5	-170.9	32	-35	0	0	0	112.8
496	I	31.8	Very low	32.2	Very low	149 Å²	149	157.6 Å²	157.6	76%	0.764	82%	0.816	S	S	*	*			trans	-110	103.2	164.2	-63.8	174.3	0	0	0	107.6	R498	I496-R498 PolarHBondContact O-N 2.82Å
497	I	32.5	Very low	31.9	Very low	148 Å²	148	155.4 Å²	155.4	76%	0.759	81%	0.813	S	S	*	*			trans	-63.8	133.3	173.2	-62	173.6	0	0	0	108.6
498	R	27.9	Very low	31.7	Very low	213 Å²	213	153.6 Å²	153.6	80%	0.804	81%	0.812	S	S	*	*			trans	-126.4	94.4	178.6	-176.1	-166.2	-63.3	-177.7	2.7	109.1	I496 T500	I496-R498 PolarHBondContact O-N 2.82Å; R498-T500 PolarHBondContact O-N 3.01Å
499	M	31.6	Very low	31.3	Very low	183 Å²	183	150.3 Å²	150.3	90%	0.901	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-66.3	123	168.5	-75.5	179.1	168.1	0	0	109.9
500	T	32.6	Very low	31.1	Very low	116 Å²	116	147.8 Å²	147.8	71%	0.712	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-98.5	128.6	171.2	43.5	0	0	0	0	109.3	R498	R498-T500 PolarHBondContact O-N 3.01Å
501	Q	31.4	Very low	30.9	Very low	193 Å²	193	143.6 Å²	143.6	90%	0.902	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-68.5	134.3	161.5	-71.4	-178.6	-54.5	0	0	108.9
502	P	32.2	Very low	30.4	Very low	124 Å²	124	142.2 Å²	142.2	81%	0.805	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.7	133.4	175.2	31.3	-32.8	0	0	0	110.7
503	S	31.9	Very low	30.2	Very low	119 Å²	119	143 Å²	143	83%	0.832	80%	0.796	S	S	*	*			trans	-110.1	114.2	162.8	56.8	0	0	0	0	108.5
504	V	30.5	Very low	29.7	Very low	129 Å²	129	144.3 Å²	144.3	78%	0.782	80%	0.799	S	S	*	*			trans	-71.6	139.2	177.1	176.8	0	0	0	0	110.3
505	N	27.8	Very low	29.1	Very low	148 Å²	148	146.3 Å²	146.3	79%	0.791	80%	0.798	S	S	*	*			trans	178.4	116.1	145.2	-97.2	-5.3	0	0	0	110.4
506	E	30.8	Very low	28.6	Very low	196 Å²	196	148.9 Å²	148.9	92%	0.916	80%	0.801	S	S	*	*				170.4	136.9	115.7	-94	177.2	-176.9	0	0	112
507	G	30	Very low	28.1	Very low	77 Å²	77	152.7 Å²	152.7	79%	0.794	81%	0.806	S	S	*	*			trans	79.3	140.7	171.4	0	0	0	0	0	117
508	S	30	Very low	27.6	Very low	111 Å²	111	150.1 Å²	150.1	78%	0.776	80%	0.801	S	S	*	*			cis	-164	147	-17.7	56	0	0	0	0	111.7
509	S	29.4	Very low	27.5	Very low	98 Å²	98	148.8 Å²	148.8	69%	0.685	80%	0.803	S	S	*	*			trans	69.5	111.3	151.3	-61.6	0	0	0	0	121.8
510	N	27.2	Very low	27.2	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	79%	0.789	S	S	*	*				88.9	162.6	126.2	-59.7	-6	0	0	0	121.5
511	S	27.4	Very low	27	Very low	124 Å²	124	144.5 Å²	144.5	87%	0.867	79%	0.791	S	S	*	*			trans	82.4	100.5	170.3	-56	0	0	0	0	117.8
512	I	22.3	Very low	27	Very low	155 Å²	155	141 Å²	141	80%	0.795	78%	0.783	S	S	*	*			trans	-72.2	138.3	156.1	-63.4	156.7	0	0	0	108
513	H	26.3	Very low	26.9	Very low	184 Å²	184	140 Å²	140	85%	0.852	78%	0.775	S	S	*	*			trans	-172.8	178.4	134.5	-114.8	-98.1	0	0	0	112.8
514	F	21.5	Very low	27.1	Very low	180 Å²	180	142 Å²	142	79%	0.789	77%	0.771	S	S	*	*			trans	-101.2	168.8	-165.3	-107.2	-97.8	0	0	0	114.6
515	F	22.5	Very low	27.3	Very low	170 Å²	170	141.1 Å²	141.1	75%	0.746	76%	0.762	S	S	*	*			trans	92.4	144	146.2	-108.7	-90.6	0	0	0	122.8
516	Q	22.7	Very low	27.7	Very low	159 Å²	159	141.6 Å²	141.6	74%	0.743	76%	0.759	S	S	*	*			trans	22.7	117.9	166.9	-84.1	166.7	-39.1	0	0	125.4
517	R	21	Very low	27.8	Very low	230 Å²	230	138.8 Å²	138.8	87%	0.868	75%	0.75	S	S	*	*				40.2	143	112.4	-148.8	179.4	-166.4	177.4	4.2	122.2
518	S	23.6	Very low	28.1	Very low	94 Å²	94	142.8 Å²	142.8	66%	0.657	75%	0.748	S	S	*	*			trans	83.5	126.9	152.5	24.2	0	0	0	0	121.3
519	H	25.1	Very low	28.4	Very low	184 Å²	184	143 Å²	143	85%	0.852	74%	0.74	S	S	*	*			trans	39.4	142.6	135.5	-63.7	-69	0	0	0	121.1
520	S	26	Very low	28.8	Very low	87 Å²	87	146 Å²	146	61%	0.608	74%	0.743	S	S	*	*			cis	-166.4	-175.5	4.1	50.5	0	0	0	0	111.2
521	T	27.3	Very low	29	Very low	122 Å²	122	146.1 Å²	146.1	75%	0.748	74%	0.743	S	S	*	*			trans	66.7	149.8	153.8	41.4	0	0	0	0	117.1
522	T	31.3	Very low	29.4	Very low	121 Å²	121	147.3 Å²	147.3	74%	0.742	74%	0.739	S	S	*	*			cis	-146.9	-169.5	-1.8	-1.1	0	0	0	0	107.2
523	T	31.5	Very low	30.1	Very low	102 Å²	102	145.3 Å²	145.3	63%	0.626	73%	0.734	S	S	*	*			cis	-157.7	169.1	13.6	-21.2	0	0	0	0	109.7
524	H	34.2	Very low	30.7	Very low	160 Å²	160	144.1 Å²	144.1	74%	0.741	73%	0.734	S	S	*	*			trans	68.8	139.6	162	-60.8	-58.9	0	0	0	118.3
525	N	35.5	Very low	31.4	Very low	112 Å²	112	146.1 Å²	146.1	60%	0.599	74%	0.736	S	S	*	*			cis	-154.5	160.9	-6.6	-130	26.1	0	0	0	111.9
526	E	36.1	Very low	32.2	Very low	157 Å²	157	144.9 Å²	144.9	73%	0.734	74%	0.738	S	S	*	*			trans	65.6	142.1	155.8	-72.5	156.1	-144.8	0	0	119.3
527	L	32.5	Very low	33	Very low	137 Å²	137	142.5 Å²	142.5	72%	0.717	73%	0.734	S	S	*	*			cis	-167.3	142.5	-21.9	-151.4	69.7	0	0	0	109.3
528	H	36.3	Very low	34.2	Very low	162 Å²	162	138.8 Å²	138.8	75%	0.75	73%	0.731	S	S	*	*			trans	61.7	150.8	166.5	-75	-65	0	0	0	119
529	D	36.8	Very low	35.5	Very low	115 Å²	115	143 Å²	143	62%	0.615	77%	0.772	S	S	*	*			cis	-165.5	179.3	-20.7	-150.3	-44.8	0	0	0	110.1
530	Q	38.2	Very low	36	Very low	162 Å²	162	140.9 Å²	140.9	76%	0.757	77%	0.768	S	S	*	*			trans	70.7	102.4	159.7	-61	-63	-70.6	0	0	119.3
531	L	30.2	Very low	36.5	Very low	152 Å²	152	143.7 Å²	143.7	80%	0.796	78%	0.776	S	S	*	*			trans	-79.9	136.8	149	-72.9	154.7	0	0	0	109.6
532	N	35.9	Very low	37	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	78%	0.778	S	S	*	*				172	141.7	117.4	-92.2	-36.9	0	0	0	115.7
533	V	37.5	Very low	37.4	Very low	113 Å²	113	146.4 Å²	146.4	69%	0.685	78%	0.78	S	S	*	*			trans	36.3	112.3	135.3	-174.1	0	0	0	0	118.8
534	N	38.9	Very low	37.7	Very low	159 Å²	159	149.1 Å²	149.1	85%	0.85	79%	0.789	S	S	*	*				-160.6	160.5	109.9	-109.2	-46.3	0	0	0	114.3
535	R	37.1	Very low	38	Very low	222 Å²	222	148.4 Å²	148.4	84%	0.838	79%	0.792	S	S	*	*			trans	-95.7	157.7	168.2	-70.4	176	173.7	161.1	-3.9	110.1
536	N	38.7	Very low	38.1	Very low	145 Å²	145	151 Å²	151	78%	0.775	81%	0.806	S	S	*	*			trans	172.2	111.6	136.3	-84.3	-2.7	0	0	0	105.9
537	T	38.8	Very low	38.3	Very low	108 Å²	108	150.5 Å²	150.5	66%	0.663	81%	0.812	S	S	*	*				60.4	119.3	83.8	69.4	0	0	0	0	113.2
538	D	46.5	Very low	38.8	Very low	152 Å²	152	151.7 Å²	151.7	81%	0.813	82%	0.82	S	S	*	*				179.1	160.3	108.7	-81	-5.5	0	0	0	110.3
539	A	50.5	Low	39	Very low	182 Å²	182	150.7 Å²	150.7	100%	1.504	83%	0.826	S	S	*	*			trans	66.9	0	-174.4	0	0	0	0	0	116.4

Retrieved 539 of 539 residues in 94.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).