A0A077ZAQ4_TRITR Loading...

Vacuolar membrane protein pep3

AlphaFold DB , UniProt , Accession A0A077ZAQ4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 482 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.4	Very low	41.1	Very low	215 Å²	215	124.5 Å²	124.5	100%	1.059	64%	0.635	S	S	*	*				0	27.9	0	-101.7	-177	-104.2	0	0	110.2
2	D	45.6	Very low	42	Very low	126 Å²	126	116.5 Å²	116.5	67%	0.674	60%	0.602	S	S	*	*			trans	-106.2	-21.5	-153.1	-57.4	-70.1	0	0	0	113.7	Q6	D2-Q6 PolarHBondContact O-N 2.86Å
3	N	40.7	Very low	43.7	Very low	134 Å²	134	112.1 Å²	112.1	72%	0.717	59%	0.587	S	S	*	*	H	α-helix	trans	-76	-24.3	179	-70.2	-2.3	0	0	0	113.5	S7	N3-S7 PolarHBondContact O-N 2.83Å; N3-S7 PolarHBondContact O-OG 3.15Å; N3-S7 VanDerWaalsContact O-OG 3.14Å
4	C	42.8	Very low	45.4	Very low	92 Å²	92	106.2 Å²	106.2	62%	0.622	57%	0.567	S	S	*	*	H	α-helix	trans	-78.2	-28.6	178.7	-153.7	0	0	0	0	112.1	S7 S8	C4-S7 PolarHBondContact O-OG 3.48Å; C4-S7 VanDerWaalsContact O-OG 3.12Å; C4-S8 WeakPolarHBondContact O-CB 3.47Å; C4-S8 PolarHBondContact O-N 3.16Å; C4-S8 PolarHBondContact O-OG 3.48Å
5	F	42.7	Very low	47.2	Very low	99 Å²	99	103.5 Å²	103.5	43%	0.434	57%	0.566	S	S	.	*	H	α-helix	trans	-75.8	-40.7	178.1	-149	-93.3	0	0	0	111.1	S8 L9	F5-S8 PolarHBondContact O-N 3.05Å; F5-L9 HydrophobicContact CD1-CD1 3.61Å; F5-L9 HydrophobicContact CD1-CG 4.41Å; F5-L9 HydrophobicContact CE1-CD1 3.88Å; F5-L9 HydrophobicContact CE1-CG 4.48Å; F5-L9 WeakPolarHBondContact O-CB 3.38Å; F5-L9 WeakPolarHBondContact O-CD1 3.27Å; F5-L9 PolarHBondContact O-N 3.09Å
6	Q	39.3	Very low	48.9	Very low	131 Å²	131	103.8 Å²	103.8	61%	0.612	56%	0.562	S	S	*	*	H	α-helix	trans	-64.3	-41.7	175	-102.1	179.1	-17.4	0	0	113.1	D2 L9 L10	D2-Q6 PolarHBondContact O-N 2.86Å; Q6-L9 PolarHBondContact O-N 3.48Å; Q6-L10 PolarHBondContact O-N 3.39Å
7	S	38.3	Very low	50.5	Low	59 Å²	59	99.8 Å²	99.8	41%	0.413	54%	0.54	S	S	.	.	H	α-helix	trans	-70.2	-33.2	178.5	60.2	0	0	0	0	112.8	N3 C4	N3-S7 PolarHBondContact O-N 2.83Å; N3-S7 PolarHBondContact O-OG 3.15Å; N3-S7 VanDerWaalsContact O-OG 3.14Å; C4-S7 PolarHBondContact O-OG 3.48Å; C4-S7 VanDerWaalsContact O-OG 3.12Å
8	S	40.2	Very low	52.2	Low	55 Å²	55	95.4 Å²	95.4	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-70.9	-38.7	174.8	-57.3	0	0	0	0	111.8	C4 F5 L10 R11 A12	C4-S8 WeakPolarHBondContact O-CB 3.47Å; C4-S8 PolarHBondContact O-N 3.16Å; C4-S8 PolarHBondContact O-OG 3.48Å; F5-S8 PolarHBondContact O-N 3.05Å; S8-L10 VanDerWaalsContact C-N 3.28Å; S8-L10 PolarHBondContact O-N 3.47Å; S8-R11 PolarHBondContact O-N 3.22Å; S8-A12 VanDerWaalsContact O-CB 3.25Å; S8-A12 WeakPolarHBondContact O-CB 3.44Å; S8-A12 PolarHBondContact O-N 3.35Å
9	L	40.9	Very low	53.7	Low	82 Å²	82	97 Å²	97	43%	0.429	51%	0.514	S	S	.	.	H	α-helix	trans	-60.5	-33.8	175.1	-91.8	157.3	0	0	0	113.5	F5 Q6 L17	F5-L9 HydrophobicContact CD1-CD1 3.61Å; F5-L9 HydrophobicContact CD1-CG 4.41Å; F5-L9 HydrophobicContact CE1-CD1 3.88Å; F5-L9 HydrophobicContact CE1-CG 4.48Å; F5-L9 WeakPolarHBondContact O-CB 3.38Å; F5-L9 WeakPolarHBondContact O-CD1 3.27Å; F5-L9 PolarHBondContact O-N 3.09Å; Q6-L9 PolarHBondContact O-N 3.48Å; L9-L17 HydrophobicContact CD2-CD1 3.33Å; L9-L17 HydrophobicContact CG-CD1 4.45Å
10	L	40.6	Very low	55	Low	153 Å²	153	95.6 Å²	95.6	80%	0.801	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-13.5	-178.8	-75.7	162.4	0	0	0	114.1	Q6 S8	Q6-L10 PolarHBondContact O-N 3.39Å; S8-L10 VanDerWaalsContact C-N 3.28Å; S8-L10 PolarHBondContact O-N 3.47Å
11	R	40.6	Very low	56.3	Low	224 Å²	224	92 Å²	92	85%	0.845	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-10.7	179.9	-68.2	-173.2	-169.3	178.2	3.5	114.3	S8 S13	S8-R11 PolarHBondContact O-N 3.22Å; R11-S13 PolarHBondContact O-N 3.05Å
12	A	52.4	Low	58.3	Low	28 Å²	28	84.2 Å²	84.2	23%	0.231	45%	0.448	C	S	.	.			trans	-65	131.1	-176.8	0	0	0	0	0	111	S8 E16 L17	S8-A12 VanDerWaalsContact O-CB 3.25Å; S8-A12 WeakPolarHBondContact O-CB 3.44Å; S8-A12 PolarHBondContact O-N 3.35Å; A12-E16 WeakPolarHBondContact CA-OE2 2.95Å; A12-E16 HydrophobicContact CB-CB 4.06Å; A12-L17 HydrophobicContact CB-CB 4.35Å
13	S	63.3	Low	60.1	Low	59 Å²	59	85.6 Å²	85.6	41%	0.413	44%	0.444	S	S	.	.			trans	-59.9	154.2	162.6	62	0	0	0	0	110.1	R11 A15 E16 L17	R11-S13 PolarHBondContact O-N 3.05Å; S13-A15 PolarHBondContact O-N 3.47Å; S13-A15 VanDerWaalsContact O-N 3.08Å; S13-E16 PolarHBondContact N-OE2 3.13Å; S13-E16 PolarHBondContact O-N 3Å; S13-E16 VanDerWaalsContact OG-CG 3.27Å; S13-E16 WeakPolarHBondContact OG-CG 2.75Å; S13-E16 PolarHBondContact OG-N 2.84Å; S13-E16 PolarHBondContact OG-OE2 2.9Å; S13-L17 PolarHBondContact O-N 3.46Å
14	G	67.7	Low	62.1	Low	30 Å²	30	83.5 Å²	83.5	31%	0.309	43%	0.429	S	S	.	.	H	α-helix	trans	-51.4	-36.6	179.1	0	0	0	0	0	113.1	L17 K18	G14-L17 PolarHBondContact O-N 2.94Å; G14-K18 VanDerWaalsContact O-CG 3.3Å; G14-K18 WeakPolarHBondContact O-CG 3.31Å; G14-K18 PolarHBondContact O-N 3.36Å
15	A	72.6	Confident	63.9	Low	66 Å²	66	79.1 Å²	79.1	55%	0.545	40%	0.399	S	S	.	.	H	α-helix	trans	-66.8	-43.3	176.5	0	0	0	0	0	113.6	S13 L17 K18 Y19	S13-A15 PolarHBondContact O-N 3.47Å; S13-A15 VanDerWaalsContact O-N 3.08Å; A15-L17 VanDerWaalsContact C-N 3.33Å; A15-K18 PolarHBondContact O-N 3.41Å; A15-Y19 PolarHBondContact O-N 3.3Å
16	E	74.5	Confident	65.8	Low	107 Å²	107	79.1 Å²	79.1	50%	0.5	40%	0.403	S	S	.	.	H	α-helix	trans	-65.9	-39.4	177.1	-72	164.4	150	0	0	111.1	A12 S13 Y19 L20	A12-E16 WeakPolarHBondContact CA-OE2 2.95Å; A12-E16 HydrophobicContact CB-CB 4.06Å; S13-E16 PolarHBondContact N-OE2 3.13Å; S13-E16 PolarHBondContact O-N 3Å; S13-E16 VanDerWaalsContact OG-CG 3.27Å; S13-E16 WeakPolarHBondContact OG-CG 2.75Å; S13-E16 PolarHBondContact OG-N 2.84Å; S13-E16 PolarHBondContact OG-OE2 2.9Å; E16-Y19 PolarHBondContact O-N 3.01Å; E16-L20 WeakPolarHBondContact O-CB 3.39Å; E16-L20 VanDerWaalsContact O-CG 3.27Å; E16-L20 WeakPolarHBondContact O-CG 3.49Å; E16-L20 PolarHBondContact O-N 3.29Å
17	L	76.1	Confident	67.8	Low	37 Å²	37	77.1 Å²	77.1	19%	0.194	40%	0.404	C	S	.	.	H	α-helix	trans	-63.9	-45.1	176.6	-172.1	68.8	0	0	0	111.3	L9 A12 S13 G14 A15 L20 L21 I46	L9-L17 HydrophobicContact CD2-CD1 3.33Å; L9-L17 HydrophobicContact CG-CD1 4.45Å; A12-L17 HydrophobicContact CB-CB 4.35Å; S13-L17 PolarHBondContact O-N 3.46Å; G14-L17 PolarHBondContact O-N 2.94Å; A15-L17 VanDerWaalsContact C-N 3.33Å; L17-L20 PolarHBondContact O-N 3.17Å; L17-L21 HydrophobicContact CG-CD1 4.12Å; L17-L21 WeakPolarHBondContact O-CB 3.42Å; L17-L21 VanDerWaalsContact O-CG 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.28Å; L17-L21 PolarHBondContact O-N 3.36Å; L17-I46 HydrophobicContact CB-CD1 4.29Å; L17-I46 HydrophobicContact CD2-CD1 3.33Å; L17-I46 HydrophobicContact CD2-CG1 3.85Å; L17-I46 HydrophobicContact CG-CD1 3.63Å
18	K	80.5	Confident	69.7	Low	20 Å²	20	75.9 Å²	75.9	9%	0.087	39%	0.392	C	S	.	.	H	α-helix	trans	-57	-50.8	174.6	-75.4	178.6	-170.5	-168.9	0	111.4	G14 A15 L20 L21 E22 L43 I46 D47 E50 V81	G14-K18 VanDerWaalsContact O-CG 3.3Å; G14-K18 WeakPolarHBondContact O-CG 3.31Å; G14-K18 PolarHBondContact O-N 3.36Å; A15-K18 PolarHBondContact O-N 3.41Å; K18-L20 VanDerWaalsContact C-N 3.33Å; K18-L20 PolarHBondContact O-N 2.83Å; K18-L21 PolarHBondContact O-N 3.2Å; K18-L21 VanDerWaalsContact O-N 3.16Å; K18-E22 WeakPolarHBondContact O-CG 3.44Å; K18-E22 PolarHBondContact O-N 2.62Å; K18-L43 HydrophobicContact CB-CD2 4.45Å; K18-L43 HydrophobicContact CG-CD2 4.5Å; K18-I46 HydrophobicContact CD-CG2 4.24Å; K18-I46 HydrophobicContact CG-CB 4.35Å; K18-I46 HydrophobicContact CG-CD1 4.37Å; K18-I46 HydrophobicContact CG-CG2 3.89Å; K18-D47 WeakPolarHBondContact CE-OD1 3.42Å; K18-D47 IonicContact NZ-OD1 3.09Å; K18-D47 PolarHBondContact NZ-OD1 3.48Å; K18-E50 VanDerWaalsContact CE-CD 3.44Å; K18-E50 WeakPolarHBondContact CE-OE1 3.44Å; K18-E50 WeakPolarHBondContact CE-OE2 3.31Å; K18-E50 IonicContact NZ-OE1 3.9Å; K18-E50 PolarHBondContact NZ-OE1 3.38Å; K18-E50 IonicContact NZ-OE2 2.64Å; K18-E50 PolarHBondContact NZ-OE2 3.23Å; K18-V81 HydrophobicContact CD-CG2 4.13Å
19	Y	81.4	Confident	71.3	Confident	126 Å²	126	80.4 Å²	80.4	49%	0.494	41%	0.408	S	S	.	.	H	α-helix	trans	-60.3	-42	179.8	179.4	-108.7	0	0	0	112.5	A15 E16 R23	A15-Y19 PolarHBondContact O-N 3.3Å; E16-Y19 PolarHBondContact O-N 3.01Å; Y19-R23 HydrophobicContact CE1-CG 4.47Å; Y19-R23 HydrophobicContact CE2-CG 4.26Å; Y19-R23 VanDerWaalsContact CZ-CD 3.48Å; Y19-R23 WeakPolarHBondContact O-CG 3.46Å; Y19-R23 PolarHBondContact O-N 3.16Å
20	L	80.1	Confident	72.6	Confident	68 Å²	68	80.5 Å²	80.5	36%	0.356	42%	0.42	S	S	.	.	H	α-helix	trans	-63.8	-41.3	176	-75.4	171.5	0	0	0	112.2	E16 L17 K18 K24	E16-L20 WeakPolarHBondContact O-CB 3.39Å; E16-L20 VanDerWaalsContact O-CG 3.27Å; E16-L20 WeakPolarHBondContact O-CG 3.49Å; E16-L20 PolarHBondContact O-N 3.29Å; L17-L20 PolarHBondContact O-N 3.17Å; K18-L20 VanDerWaalsContact C-N 3.33Å; K18-L20 PolarHBondContact O-N 2.83Å; L20-K24 VanDerWaalsContact O-CB 3.31Å; L20-K24 WeakPolarHBondContact O-CB 3.45Å; L20-K24 PolarHBondContact O-N 2.92Å
21	L	80.8	Confident	73.9	Confident	22 Å²	22	80.4 Å²	80.4	12%	0.115	42%	0.421	C	S	.	.	H	α-helix	trans	-69.9	-41.5	179.1	-71.5	173.2	0	0	0	112.1	L17 K18 K24 L25 L39 A42 L43 I46	L17-L21 HydrophobicContact CG-CD1 4.12Å; L17-L21 WeakPolarHBondContact O-CB 3.42Å; L17-L21 VanDerWaalsContact O-CG 3.25Å; L17-L21 WeakPolarHBondContact O-CG 3.28Å; L17-L21 PolarHBondContact O-N 3.36Å; K18-L21 PolarHBondContact O-N 3.2Å; K18-L21 VanDerWaalsContact O-N 3.16Å; L21-K24 PolarHBondContact O-N 3.06Å; L21-L25 WeakPolarHBondContact O-CB 3.39Å; L21-L25 PolarHBondContact O-N 2.61Å; L21-L39 HydrophobicContact CD2-CD2 3.59Å; L21-A42 HydrophobicContact CD1-CB 3.92Å; L21-A42 HydrophobicContact CD2-CB 4.44Å; L21-L43 HydrophobicContact CB-CD2 3.5Å; L21-L43 VanDerWaalsContact CB-CD2 3.5Å; L21-L43 HydrophobicContact CB-CG 3.9Å; L21-L43 HydrophobicContact CD1-CD2 4.01Å; L21-L43 HydrophobicContact CD1-CG 4.3Å; L21-L43 HydrophobicContact CG-CD2 4.43Å; L21-I46 HydrophobicContact CD1-CD1 3.36Å
22	E	83.7	Confident	75.6	Confident	51 Å²	51	75.1 Å²	75.1	24%	0.238	40%	0.404	C	S	.	.	H	α-helix	trans	-57.7	-51.9	173.1	-75.4	-180	127.5	0	0	110.9	K18 K24 L25 D26 L43 V81	K18-E22 WeakPolarHBondContact O-CG 3.44Å; K18-E22 PolarHBondContact O-N 2.62Å; E22-K24 PolarHBondContact O-N 3.32Å; E22-L25 WeakPolarHBondContact O-CB 3.3Å; E22-L25 PolarHBondContact O-N 3.43Å; E22-L25 VanDerWaalsContact O-N 3.11Å; E22-D26 PolarHBondContact O-N 3.28Å; E22-L43 HydrophobicContact CG-CD1 4.42Å; E22-L43 HydrophobicContact CG-CD2 4.26Å; E22-V81 HydrophobicContact CG-CG1 3.53Å; E22-V81 WeakPolarHBondContact OE1-CG1 3.46Å
23	R	83.5	Confident	76.9	Confident	155 Å²	155	78.1 Å²	78.1	59%	0.585	42%	0.421	S	S	*	.	H	α-helix	trans	-60.8	-37.2	178.1	-72.4	-169.2	76.8	172.6	8	112.3	Y19 D26 S27	Y19-R23 HydrophobicContact CE1-CG 4.47Å; Y19-R23 HydrophobicContact CE2-CG 4.26Å; Y19-R23 VanDerWaalsContact CZ-CD 3.48Å; Y19-R23 WeakPolarHBondContact O-CG 3.46Å; Y19-R23 PolarHBondContact O-N 3.16Å; R23-D26 PolarHBondContact O-N 2.66Å; R23-S27 VanDerWaalsContact O-CB 3.31Å; R23-S27 WeakPolarHBondContact O-CB 3.45Å; R23-S27 PolarHBondContact O-N 3.01Å; R23-S27 PolarHBondContact O-OG 3.08Å
24	K	81.7	Confident	77.7	Confident	90 Å²	90	80.2 Å²	80.2	39%	0.391	43%	0.431	S	S	.	.	H	α-helix	trans	-65.8	-43.5	176.8	-167.1	169.9	-179	175.1	0	110.8	L20 L21 E22 S27 L28 L39	L20-K24 VanDerWaalsContact O-CB 3.31Å; L20-K24 WeakPolarHBondContact O-CB 3.45Å; L20-K24 PolarHBondContact O-N 2.92Å; L21-K24 PolarHBondContact O-N 3.06Å; E22-K24 PolarHBondContact O-N 3.32Å; K24-S27 WeakPolarHBondContact CA-OG 3.16Å; K24-S27 PolarHBondContact O-N 3.04Å; K24-S27 PolarHBondContact O-OG 2.98Å; K24-L28 WeakPolarHBondContact O-CG 3.44Å; K24-L28 PolarHBondContact O-N 2.98Å; K24-L28 VanDerWaalsContact O-N 3.09Å; K24-L39 HydrophobicContact CB-CD1 4.16Å; K24-L39 HydrophobicContact CD-CD1 4.33Å; K24-L39 HydrophobicContact CD-CD2 4.03Å; K24-L39 HydrophobicContact CG-CD1 3.91Å; K24-L39 HydrophobicContact CG-CD2 4.45Å
25	L	81.1	Confident	78.1	Confident	0 Å²	0	81 Å²	81	0%	0	43%	0.432	C	S	.	.	H	α-helix	trans	-63	-41	176.9	-172	73.2	0	0	0	111.8	L21 E22 S27 L28 E36 L39 L43 N85 R87 A88	L21-L25 WeakPolarHBondContact O-CB 3.39Å; L21-L25 PolarHBondContact O-N 2.61Å; E22-L25 WeakPolarHBondContact O-CB 3.3Å; E22-L25 PolarHBondContact O-N 3.43Å; E22-L25 VanDerWaalsContact O-N 3.11Å; L25-S27 VanDerWaalsContact C-N 3.35Å; L25-L28 HydrophobicContact CD1-CD1 4.41Å; L25-L28 PolarHBondContact O-N 3.15Å; L25-E36 HydrophobicContact CD1-CB 4.22Å; L25-E36 HydrophobicContact CD1-CG 4.28Å; L25-L39 HydrophobicContact CB-CD1 4.17Å; L25-L39 HydrophobicContact CD1-CB 3.94Å; L25-L39 HydrophobicContact CD1-CD1 4.14Å; L25-L43 HydrophobicContact CD2-CD1 4.22Å; L25-N85 HydrophobicContact CD2-CB 4.34Å; L25-N85 WeakPolarHBondContact CD2-OD1 3.08Å; L25-R87 HydrophobicContact CD1-CB 4.49Å; L25-R87 HydrophobicContact CD2-CB 4.14Å; L25-R87 HydrophobicContact CG-CB 4.17Å; L25-R87 PolarHBondContact O-NH1 3.48Å; L25-A88 HydrophobicContact CD2-CB 3.59Å
26	D	82.6	Confident	78.5	Confident	98 Å²	98	79.3 Å²	79.3	52%	0.524	41%	0.413	S	S	.	.	H	α-helix	trans	-68.5	-35.3	176.7	-65.8	-19.9	0	0	0	111.8	E22 R23 L28 N85 R87	E22-D26 PolarHBondContact O-N 3.28Å; R23-D26 PolarHBondContact O-N 2.66Å; D26-L28 VanDerWaalsContact C-N 3.32Å; D26-L28 PolarHBondContact O-N 3.48Å; D26-N85 PolarHBondContact OD1-ND2 3.29Å; D26-R87 PolarHBondContact O-NH1 3.02Å
27	S	81.7	Confident	78.9	Confident	90 Å²	90	74.8 Å²	74.8	63%	0.629	39%	0.394	S	S	*	.	H	α-helix	trans	-76.6	-12.8	177.6	73.7	0	0	0	0	114.8	R23 K24 L25 Q29	R23-S27 VanDerWaalsContact O-CB 3.31Å; R23-S27 WeakPolarHBondContact O-CB 3.45Å; R23-S27 PolarHBondContact O-N 3.01Å; R23-S27 PolarHBondContact O-OG 3.08Å; K24-S27 WeakPolarHBondContact CA-OG 3.16Å; K24-S27 PolarHBondContact O-N 3.04Å; K24-S27 PolarHBondContact O-OG 2.98Å; L25-S27 VanDerWaalsContact C-N 3.35Å; S27-Q29 PolarHBondContact O-N 3.42Å
28	L	78.1	Confident	79	Confident	32 Å²	32	78.6 Å²	78.6	17%	0.168	41%	0.414	C	S	.	.	S	Bend	trans	-67.5	131.9	-178.6	-85	179.2	0	0	0	111.1	K24 L25 D26 E36 L39 R87	K24-L28 WeakPolarHBondContact O-CG 3.44Å; K24-L28 PolarHBondContact O-N 2.98Å; K24-L28 VanDerWaalsContact O-N 3.09Å; L25-L28 HydrophobicContact CD1-CD1 4.41Å; L25-L28 PolarHBondContact O-N 3.15Å; D26-L28 VanDerWaalsContact C-N 3.32Å; D26-L28 PolarHBondContact O-N 3.48Å; L28-E36 HydrophobicContact CD1-CG 3.85Å; L28-L39 HydrophobicContact CD1-CD1 3.42Å; L28-L39 VanDerWaalsContact CD1-CD1 3.42Å; L28-L39 HydrophobicContact CD1-CG 4.47Å; L28-L39 HydrophobicContact CG-CD1 4.14Å; L28-R87 PolarHBondContact O-NH1 3Å; L28-R87 PolarHBondContact O-NH2 2.93Å
29	Q	73.8	Confident	79	Confident	151 Å²	151	78.5 Å²	78.5	71%	0.706	41%	0.414	S	S	*	.			trans	-60.8	139.7	167.3	-67.7	178.1	-16.2	0	0	110	S27 N31	S27-Q29 PolarHBondContact O-N 3.42Å; Q29-N31 PolarHBondContact O-N 2.95Å
30	A	68.6	Low	79.2	Confident	84 Å²	84	72.5 Å²	72.5	69%	0.694	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	3.8	-172.4	0	0	0	0	0	116.4
31	N	68.1	Low	79.3	Confident	151 Å²	151	70.8 Å²	70.8	81%	0.807	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	23.4	-174.9	-81.2	-8.2	0	0	0	113.6	Q29	Q29-N31 PolarHBondContact O-N 2.95Å
32	K	75.9	Confident	79.1	Confident	112 Å²	112	71.3 Å²	71.3	49%	0.487	39%	0.388	S	S	.	.			trans	-129.7	69.8	179.5	-66.1	-170.5	179.4	-178.1	0	112.4	T34 S35 E36	K32-T34 VanDerWaalsContact C-N 3.28Å; K32-T34 PolarHBondContact O-N 3.35Å; K32-S35 PolarHBondContact O-N 3.46Å; K32-E36 PolarHBondContact O-N 3.21Å
33	P	78.7	Confident	79.1	Confident	92 Å²	92	68.9 Å²	68.9	60%	0.597	38%	0.377	S	S	*	.	H	α-helix	trans	-59.4	-36.9	-175.6	24.5	-34.5	0	0	0	112.7	S35 E36 A37	P33-S35 PolarHBondContact O-N 3.28Å; P33-E36 PolarHBondContact O-N 3.17Å; P33-A37 WeakPolarHBondContact O-CB 3.18Å; P33-A37 PolarHBondContact O-N 3.16Å
34	T	80.6	Confident	79.2	Confident	103 Å²	103	61.5 Å²	61.5	63%	0.632	35%	0.349	S	S	*	.	H	α-helix	trans	-63.7	-40.8	176.7	-44.3	0	0	0	0	112.3	K32 L38	K32-T34 VanDerWaalsContact C-N 3.28Å; K32-T34 PolarHBondContact O-N 3.35Å; T34-L38 HydrophobicContact CG2-CD1 4.41Å; T34-L38 VanDerWaalsContact O-CG 3.28Å; T34-L38 WeakPolarHBondContact O-CG 3.25Å; T34-L38 PolarHBondContact O-N 3.13Å
35	S	76.3	Confident	79.1	Confident	46 Å²	46	65 Å²	65	32%	0.322	36%	0.359	S	S	.	.	H	α-helix	trans	-69.9	-39	178.4	-57.7	0	0	0	0	111.3	K32 P33 L38 L39	K32-S35 PolarHBondContact O-N 3.46Å; P33-S35 PolarHBondContact O-N 3.28Å; S35-L38 PolarHBondContact O-N 2.85Å; S35-L39 WeakPolarHBondContact O-CG 3.44Å; S35-L39 PolarHBondContact O-N 3.33Å
36	E	81.5	Confident	79	Confident	31 Å²	31	65.9 Å²	65.9	15%	0.145	36%	0.364	C	S	.	.	H	α-helix	trans	-61.6	-47.2	173.9	-69	177.5	-159	0	0	111.4	L25 L28 K32 P33 L38 L39 A40 R87	L25-E36 HydrophobicContact CD1-CB 4.22Å; L25-E36 HydrophobicContact CD1-CG 4.28Å; L28-E36 HydrophobicContact CD1-CG 3.85Å; K32-E36 PolarHBondContact O-N 3.21Å; P33-E36 PolarHBondContact O-N 3.17Å; E36-L38 PolarHBondContact O-N 3.14Å; E36-L39 PolarHBondContact O-N 3.09Å; E36-A40 VanDerWaalsContact O-CB 3.29Å; E36-A40 WeakPolarHBondContact O-CB 3.47Å; E36-A40 PolarHBondContact O-N 3.35Å; E36-R87 IonicContact OE1-CZ 3.2Å; E36-R87 IonicContact OE1-NE 2.61Å; E36-R87 IonicContact OE1-NH2 3.69Å; E36-R87 PolarHBondContact OE1-NH2 3.32Å; E36-R87 IonicContact OE2-NE 2.62Å
37	A	82.2	Confident	79	Confident	12 Å²	12	61.7 Å²	61.7	10%	0.099	34%	0.341	C	S	.	.	H	α-helix	trans	-58.5	-47.1	176.1	0	0	0	0	0	112.1	P33 L39 A40 F41 L95	P33-A37 WeakPolarHBondContact O-CB 3.18Å; P33-A37 PolarHBondContact O-N 3.16Å; A37-L39 VanDerWaalsContact C-N 3.35Å; A37-L39 PolarHBondContact O-N 3.38Å; A37-A40 PolarHBondContact O-N 2.94Å; A37-F41 WeakPolarHBondContact O-CB 3.4Å; A37-F41 WeakPolarHBondContact O-CD2 3.3Å; A37-F41 PolarHBondContact O-N 3.43Å; A37-L95 HydrophobicContact CB-CD1 3.57Å
38	L	78.9	Confident	78.9	Confident	117 Å²	117	57.4 Å²	57.4	61%	0.613	31%	0.311	S	S	*	.	H	α-helix	trans	-61.4	-41.9	178.8	-73.9	171	0	0	0	112.4	T34 S35 E36 A42	T34-L38 HydrophobicContact CG2-CD1 4.41Å; T34-L38 VanDerWaalsContact O-CG 3.28Å; T34-L38 WeakPolarHBondContact O-CG 3.25Å; T34-L38 PolarHBondContact O-N 3.13Å; S35-L38 PolarHBondContact O-N 2.85Å; E36-L38 PolarHBondContact O-N 3.14Å; L38-A42 WeakPolarHBondContact O-CB 3.35Å; L38-A42 PolarHBondContact O-N 2.86Å
39	L	80.7	Confident	78.8	Confident	17 Å²	17	58.3 Å²	58.3	9%	0.089	32%	0.321	C	S	.	.	H	α-helix	trans	-68.2	-39.3	176	-68	-179.7	0	0	0	111.6	L21 K24 L25 L28 S35 E36 A37 A42 L43	L21-L39 HydrophobicContact CD2-CD2 3.59Å; K24-L39 HydrophobicContact CB-CD1 4.16Å; K24-L39 HydrophobicContact CD-CD1 4.33Å; K24-L39 HydrophobicContact CD-CD2 4.03Å; K24-L39 HydrophobicContact CG-CD1 3.91Å; K24-L39 HydrophobicContact CG-CD2 4.45Å; L25-L39 HydrophobicContact CB-CD1 4.17Å; L25-L39 HydrophobicContact CD1-CB 3.94Å; L25-L39 HydrophobicContact CD1-CD1 4.14Å; L28-L39 HydrophobicContact CD1-CD1 3.42Å; L28-L39 VanDerWaalsContact CD1-CD1 3.42Å; L28-L39 HydrophobicContact CD1-CG 4.47Å; L28-L39 HydrophobicContact CG-CD1 4.14Å; S35-L39 WeakPolarHBondContact O-CG 3.44Å; S35-L39 PolarHBondContact O-N 3.33Å; E36-L39 PolarHBondContact O-N 3.09Å; A37-L39 VanDerWaalsContact C-N 3.35Å; A37-L39 PolarHBondContact O-N 3.38Å; L39-A42 PolarHBondContact O-N 3.16Å; L39-L43 WeakPolarHBondContact O-CG 3.03Å; L39-L43 PolarHBondContact O-N 2.73Å
40	A	84.2	Confident	78.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.8	-45	177.1	0	0	0	0	0	111.8	E36 A37 A42 L43 L44 A88 A91 L92	E36-A40 VanDerWaalsContact O-CB 3.29Å; E36-A40 WeakPolarHBondContact O-CB 3.47Å; E36-A40 PolarHBondContact O-N 3.35Å; A37-A40 PolarHBondContact O-N 2.94Å; A40-A42 VanDerWaalsContact C-N 3.34Å; A40-A42 PolarHBondContact O-N 2.95Å; A40-L43 PolarHBondContact O-N 3.12Å; A40-L44 WeakPolarHBondContact O-CB 3.41Å; A40-L44 PolarHBondContact O-N 3.14Å; A40-A88 HydrophobicContact CB-CB 3.79Å; A40-A91 HydrophobicContact CB-CB 4.01Å; A40-L92 HydrophobicContact CB-CD2 4.21Å; A40-L92 HydrophobicContact CB-CG 4.02Å
41	F	82.1	Confident	79.3	Confident	32 Å²	32	50 Å²	50	14%	0.14	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-36.7	173.6	-82.5	-63.5	0	0	0	112.5	A37 L44 R45 L92 L95 M102	A37-F41 WeakPolarHBondContact O-CB 3.4Å; A37-F41 WeakPolarHBondContact O-CD2 3.3Å; A37-F41 PolarHBondContact O-N 3.43Å; F41-L44 PolarHBondContact O-N 3.43Å; F41-R45 VanDerWaalsContact O-CB 3.25Å; F41-R45 WeakPolarHBondContact O-CB 3.25Å; F41-R45 PolarHBondContact O-N 2.93Å; F41-L92 HydrophobicContact CD1-CD2 3.85Å; F41-L92 HydrophobicContact CE1-CD2 3.87Å; F41-L92 HydrophobicContact CG-CD2 4.23Å; F41-L92 HydrophobicContact CZ-CD2 4.22Å; F41-L95 HydrophobicContact CE2-CB 4.17Å; F41-L95 HydrophobicContact CE2-CD1 3.69Å; F41-L95 HydrophobicContact CZ-CB 4.08Å; F41-L95 HydrophobicContact CZ-CD1 4.43Å; F41-M102 HydrophobicContact CB-CE 4.12Å; F41-M102 HydrophobicContact CD1-CE 3.31Å; F41-M102 HydrophobicContact CD1-SD 3.74Å; F41-M102 HydrophobicContact CE1-CE 4.03Å; F41-M102 HydrophobicContact CE1-SD 4.44Å; F41-M102 HydrophobicContact CG-CE 4.04Å
42	A	77.4	Confident	79.4	Confident	34 Å²	34	47.9 Å²	47.9	28%	0.281	25%	0.248	S	C	.	.	H	α-helix	trans	-63.6	-45.7	174.2	0	0	0	0	0	111.3	L21 L38 L39 A40 R45 I46	L21-A42 HydrophobicContact CD1-CB 3.92Å; L21-A42 HydrophobicContact CD2-CB 4.44Å; L38-A42 WeakPolarHBondContact O-CB 3.35Å; L38-A42 PolarHBondContact O-N 2.86Å; L39-A42 PolarHBondContact O-N 3.16Å; A40-A42 VanDerWaalsContact C-N 3.34Å; A40-A42 PolarHBondContact O-N 2.95Å; A42-R45 PolarHBondContact O-N 2.88Å; A42-I46 WeakPolarHBondContact O-CD1 3.27Å; A42-I46 VanDerWaalsContact O-CG1 3.25Å; A42-I46 WeakPolarHBondContact O-CG1 3.43Å; A42-I46 PolarHBondContact O-N 3.28Å
43	L	83.3	Confident	79.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.7	-48.9	174.5	-75.4	172.7	0	0	0	111.5	K18 L21 E22 L25 L39 A40 R45 I46 D47 V81 A82 A88	K18-L43 HydrophobicContact CB-CD2 4.45Å; K18-L43 HydrophobicContact CG-CD2 4.5Å; L21-L43 HydrophobicContact CB-CD2 3.5Å; L21-L43 VanDerWaalsContact CB-CD2 3.5Å; L21-L43 HydrophobicContact CB-CG 3.9Å; L21-L43 HydrophobicContact CD1-CD2 4.01Å; L21-L43 HydrophobicContact CD1-CG 4.3Å; L21-L43 HydrophobicContact CG-CD2 4.43Å; E22-L43 HydrophobicContact CG-CD1 4.42Å; E22-L43 HydrophobicContact CG-CD2 4.26Å; L25-L43 HydrophobicContact CD2-CD1 4.22Å; L39-L43 WeakPolarHBondContact O-CG 3.03Å; L39-L43 PolarHBondContact O-N 2.73Å; A40-L43 PolarHBondContact O-N 3.12Å; L43-R45 VanDerWaalsContact C-N 3.33Å; L43-R45 PolarHBondContact O-N 3.11Å; L43-I46 PolarHBondContact O-N 2.98Å; L43-D47 PolarHBondContact O-N 3.04Å; L43-V81 HydrophobicContact CD2-CG1 4.01Å; L43-A82 HydrophobicContact CB-CB 3.95Å; L43-A88 HydrophobicContact CD1-CB 4.33Å
44	L	85.3	Confident	79	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-44.3	178.9	179.1	60.5	0	0	0	111.4	A40 F41 I46 D47 L48 F80 A82 F83 L92 T99 M102	A40-L44 WeakPolarHBondContact O-CB 3.41Å; A40-L44 PolarHBondContact O-N 3.14Å; F41-L44 PolarHBondContact O-N 3.43Å; L44-I46 VanDerWaalsContact C-N 3.32Å; L44-I46 PolarHBondContact O-N 3.26Å; L44-D47 PolarHBondContact O-N 3.4Å; L44-L48 HydrophobicContact CD1-CD1 3.94Å; L44-L48 HydrophobicContact CD1-CG 3.97Å; L44-L48 HydrophobicContact CD2-CD1 4.38Å; L44-L48 HydrophobicContact CG-CD1 3.74Å; L44-L48 HydrophobicContact CG-CG 4.23Å; L44-L48 WeakPolarHBondContact O-CB 3.37Å; L44-L48 VanDerWaalsContact O-CG 3.25Å; L44-L48 WeakPolarHBondContact O-CG 3.42Å; L44-L48 PolarHBondContact O-N 2.79Å; L44-F80 HydrophobicContact CD1-CD1 4.35Å; L44-A82 HydrophobicContact CB-CB 4Å; L44-A82 HydrophobicContact CD1-CB 4.45Å; L44-F83 HydrophobicContact CD1-CE2 3.69Å; L44-F83 HydrophobicContact CD1-CZ 4.34Å; L44-L92 HydrophobicContact CB-CD1 4.28Å; L44-L92 HydrophobicContact CB-CD2 4.43Å; L44-L92 HydrophobicContact CD2-CD1 4.2Å; L44-L92 HydrophobicContact CD2-CD2 3.86Å; L44-T99 HydrophobicContact CD2-CG2 3.87Å; L44-M102 HydrophobicContact CB-SD 4.38Å; L44-M102 HydrophobicContact CD2-CG 4.46Å; L44-M102 HydrophobicContact CD2-SD 3.88Å; L44-M102 HydrophobicContact CG-SD 4.06Å
45	R	80.1	Confident	78.4	Confident	163 Å²	163	44.8 Å²	44.8	62%	0.615	22%	0.217	S	C	*	.	H	α-helix	trans	-59.7	-42.3	177.9	-169.5	-179.3	176.3	159.9	-1.7	111.7	F41 A42 L43 S49 M102 Y106	F41-R45 VanDerWaalsContact O-CB 3.25Å; F41-R45 WeakPolarHBondContact O-CB 3.25Å; F41-R45 PolarHBondContact O-N 2.93Å; A42-R45 PolarHBondContact O-N 2.88Å; L43-R45 VanDerWaalsContact C-N 3.33Å; L43-R45 PolarHBondContact O-N 3.11Å; R45-S49 VanDerWaalsContact O-CB 3.29Å; R45-S49 WeakPolarHBondContact O-CB 3.31Å; R45-S49 PolarHBondContact O-N 3.28Å; R45-S49 PolarHBondContact O-OG 3.47Å; R45-M102 HydrophobicContact CB-SD 4.39Å; R45-Y106 VanDerWaalsContact CG-OH 3.24Å; R45-Y106 WeakPolarHBondContact CG-OH 3.33Å
46	I	78.6	Confident	78	Confident	19 Å²	19	47.3 Å²	47.3	10%	0.097	23%	0.226	C	C	.	.	H	α-helix	trans	-66.7	-47.1	177.8	-58.5	157	0	0	0	110	L17 K18 L21 A42 L43 L44 L48 S49 E50	L17-I46 HydrophobicContact CB-CD1 4.29Å; L17-I46 HydrophobicContact CD2-CD1 3.33Å; L17-I46 HydrophobicContact CD2-CG1 3.85Å; L17-I46 HydrophobicContact CG-CD1 3.63Å; K18-I46 HydrophobicContact CD-CG2 4.24Å; K18-I46 HydrophobicContact CG-CB 4.35Å; K18-I46 HydrophobicContact CG-CD1 4.37Å; K18-I46 HydrophobicContact CG-CG2 3.89Å; L21-I46 HydrophobicContact CD1-CD1 3.36Å; A42-I46 WeakPolarHBondContact O-CD1 3.27Å; A42-I46 VanDerWaalsContact O-CG1 3.25Å; A42-I46 WeakPolarHBondContact O-CG1 3.43Å; A42-I46 PolarHBondContact O-N 3.28Å; L43-I46 PolarHBondContact O-N 2.98Å; L44-I46 VanDerWaalsContact C-N 3.32Å; L44-I46 PolarHBondContact O-N 3.26Å; I46-L48 VanDerWaalsContact C-N 3.33Å; I46-L48 PolarHBondContact O-N 2.97Å; I46-S49 WeakPolarHBondContact CA-OG 3.48Å; I46-S49 PolarHBondContact O-N 3.48Å; I46-S49 PolarHBondContact O-OG 3.46Å; I46-E50 PolarHBondContact O-N 2.94Å
47	D	83	Confident	77.4	Confident	9 Å²	9	49.2 Å²	49.2	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-58.3	-45.1	178	-74.3	-37.4	0	0	0	111.9	K18 L43 L44 E50 M51 F80 V81 A82	K18-D47 WeakPolarHBondContact CE-OD1 3.42Å; K18-D47 IonicContact NZ-OD1 3.09Å; K18-D47 PolarHBondContact NZ-OD1 3.48Å; L43-D47 PolarHBondContact O-N 3.04Å; L44-D47 PolarHBondContact O-N 3.4Å; D47-E50 PolarHBondContact O-N 2.95Å; D47-M51 WeakPolarHBondContact O-CB 3.39Å; D47-M51 PolarHBondContact O-N 2.91Å; D47-F80 HydrophobicContact CB-CB 4.29Å; D47-F80 HydrophobicContact CB-CD1 3.22Å; D47-F80 HydrophobicContact CB-CE1 3.71Å; D47-F80 HydrophobicContact CB-CG 4.07Å; D47-V81 PolarHBondContact OD1-N 3.23Å; D47-V81 PolarHBondContact OD2-N 2.97Å; D47-A82 PolarHBondContact OD2-N 3.1Å
48	L	80.2	Confident	76.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.7	-40.8	176.7	-72.1	172.2	0	0	0	112	L44 I46 M51 R52 F80 M102 I103 Y106 L111	L44-L48 HydrophobicContact CD1-CD1 3.94Å; L44-L48 HydrophobicContact CD1-CG 3.97Å; L44-L48 HydrophobicContact CD2-CD1 4.38Å; L44-L48 HydrophobicContact CG-CD1 3.74Å; L44-L48 HydrophobicContact CG-CG 4.23Å; L44-L48 WeakPolarHBondContact O-CB 3.37Å; L44-L48 VanDerWaalsContact O-CG 3.25Å; L44-L48 WeakPolarHBondContact O-CG 3.42Å; L44-L48 PolarHBondContact O-N 2.79Å; I46-L48 VanDerWaalsContact C-N 3.33Å; I46-L48 PolarHBondContact O-N 2.97Å; L48-M51 HydrophobicContact CD2-CE 3.98Å; L48-M51 PolarHBondContact O-N 3.36Å; L48-R52 WeakPolarHBondContact O-CB 3.36Å; L48-R52 PolarHBondContact O-N 2.85Å; L48-F80 HydrophobicContact CD2-CE1 3.94Å; L48-F80 HydrophobicContact CG-CE1 4.3Å; L48-M102 HydrophobicContact CD1-CG 3.93Å; L48-M102 HydrophobicContact CD1-SD 4.42Å; L48-I103 HydrophobicContact CD1-CG1 4.46Å; L48-Y106 HydrophobicContact CB-CD1 3.72Å; L48-Y106 HydrophobicContact CB-CD2 3.82Å; L48-Y106 HydrophobicContact CB-CE1 3.78Å; L48-Y106 HydrophobicContact CB-CE2 3.88Å; L48-Y106 HydrophobicContact CB-CG 3.74Å; L48-Y106 HydrophobicContact CD1-CD2 3.6Å; L48-Y106 HydrophobicContact CD1-CE2 3.82Å; L48-Y106 HydrophobicContact CD1-CG 4.21Å; L48-Y106 HydrophobicContact CD2-CG 4.45Å; L48-Y106 HydrophobicContact CG-CD2 4.21Å; L48-Y106 HydrophobicContact CG-CE2 4.49Å; L48-Y106 HydrophobicContact CG-CG 4.36Å; L48-L111 HydrophobicContact CD2-CD2 3.34Å
49	S	74.7	Confident	76.3	Confident	52 Å²	52	48.2 Å²	48.2	36%	0.364	23%	0.233	S	C	.	.	H	α-helix	trans	-65.1	-40.6	177.3	75.3	0	0	0	0	112.7	R45 I46 R52 R53	R45-S49 VanDerWaalsContact O-CB 3.29Å; R45-S49 WeakPolarHBondContact O-CB 3.31Å; R45-S49 PolarHBondContact O-N 3.28Å; R45-S49 PolarHBondContact O-OG 3.47Å; I46-S49 WeakPolarHBondContact CA-OG 3.48Å; I46-S49 PolarHBondContact O-N 3.48Å; I46-S49 PolarHBondContact O-OG 3.46Å; S49-R52 PolarHBondContact O-N 3.34Å; S49-R53 WeakPolarHBondContact O-CB 3.36Å; S49-R53 PolarHBondContact O-N 3.33Å
50	E	76.9	Confident	75.5	Confident	52 Å²	52	54.5 Å²	54.5	24%	0.243	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-42.1	176.7	-78.5	-177.6	-166.6	0	0	111.3	K18 I46 D47 R53 L54	K18-E50 VanDerWaalsContact CE-CD 3.44Å; K18-E50 WeakPolarHBondContact CE-OE1 3.44Å; K18-E50 WeakPolarHBondContact CE-OE2 3.31Å; K18-E50 IonicContact NZ-OE1 3.9Å; K18-E50 PolarHBondContact NZ-OE1 3.38Å; K18-E50 IonicContact NZ-OE2 2.64Å; K18-E50 PolarHBondContact NZ-OE2 3.23Å; I46-E50 PolarHBondContact O-N 2.94Å; D47-E50 PolarHBondContact O-N 2.95Å; E50-R53 PolarHBondContact O-N 2.95Å; E50-L54 VanDerWaalsContact O-CG 3.3Å; E50-L54 WeakPolarHBondContact O-CG 3.43Å; E50-L54 PolarHBondContact O-N 2.98Å
51	M	76.7	Confident	74.8	Confident	8 Å²	8	59.5 Å²	59.5	4%	0.039	28%	0.278	C	S	.	.	H	α-helix	trans	-58.9	-48.3	174.7	176.5	-81.7	-75.4	0	0	110.6	D47 L48 R53 L54 Q55 Y75 F80 D108 L111	D47-M51 WeakPolarHBondContact O-CB 3.39Å; D47-M51 PolarHBondContact O-N 2.91Å; L48-M51 HydrophobicContact CD2-CE 3.98Å; L48-M51 PolarHBondContact O-N 3.36Å; M51-R53 PolarHBondContact O-N 2.69Å; M51-L54 PolarHBondContact O-N 2.83Å; M51-Q55 WeakPolarHBondContact O-CG 3.44Å; M51-Q55 PolarHBondContact O-N 3.49Å; M51-Q55 HydrophobicContact SD-CG 3.96Å; M51-Q55 PolarHBondContact SD-NE2 3.49Å; M51-Q55 PolarHBondContact SD-OE1 2.93Å; M51-Q55 VanDerWaalsContact SD-OE1 3.36Å; M51-Y75 HydrophobicContact CG-CD1 4.18Å; M51-Y75 HydrophobicContact CG-CD2 4.4Å; M51-Y75 HydrophobicContact CG-CE1 3.98Å; M51-Y75 HydrophobicContact CG-CE2 4.24Å; M51-Y75 HydrophobicContact CG-CG 4.4Å; M51-F80 HydrophobicContact CB-CZ 4.29Å; M51-F80 HydrophobicContact CG-CZ 4.31Å; M51-D108 HydrophobicContact CE-CB 3.73Å; M51-L111 HydrophobicContact CE-CD2 4.18Å
52	R	71.3	Confident	74	Confident	107 Å²	107	59.2 Å²	59.2	40%	0.404	28%	0.278	S	S	.	.	H	α-helix	trans	-61.3	-42.7	177.8	-174.8	64.3	178.6	-169.1	2.2	111.9	L48 S49 L54 Q55 L56 Y106	L48-R52 WeakPolarHBondContact O-CB 3.36Å; L48-R52 PolarHBondContact O-N 2.85Å; S49-R52 PolarHBondContact O-N 3.34Å; R52-L54 PolarHBondContact O-N 3.21Å; R52-Q55 PolarHBondContact O-N 3.31Å; R52-L56 HydrophobicContact CG-CD1 4.18Å; R52-L56 WeakPolarHBondContact O-CG 3.36Å; R52-L56 PolarHBondContact O-N 3.43Å; R52-Y106 HydrophobicContact CB-CD1 4.25Å; R52-Y106 PolarHBondContact NH1-O 2.88Å
53	R	71.8	Confident	73.4	Confident	125 Å²	125	65 Å²	65	47%	0.472	30%	0.299	S	S	.	.	H	α-helix	trans	-58.9	-46.9	174.7	-174.7	-174.9	64.1	84.6	2.7	111.4	S49 E50 M51 Q55 L56 E57	S49-R53 WeakPolarHBondContact O-CB 3.36Å; S49-R53 PolarHBondContact O-N 3.33Å; E50-R53 PolarHBondContact O-N 2.95Å; M51-R53 PolarHBondContact O-N 2.69Å; R53-Q55 PolarHBondContact O-N 2.88Å; R53-L56 PolarHBondContact O-N 3.34Å; R53-E57 IonicContact CZ-OE1 2.8Å; R53-E57 IonicContact NH1-OE1 3.49Å; R53-E57 PolarHBondContact NH1-OE1 2.9Å; R53-E57 IonicContact NH1-OE2 3.38Å; R53-E57 PolarHBondContact NH1-OE2 3.44Å; R53-E57 WeakPolarHBondContact O-CB 3.46Å; R53-E57 WeakPolarHBondContact O-CG 3.46Å; R53-E57 PolarHBondContact O-N 2.94Å
54	L	72.4	Confident	72.7	Confident	69 Å²	69	71 Å²	71	36%	0.361	33%	0.327	S	S	.	.	H	α-helix	trans	-64.7	-38.3	178.3	-70.9	172.2	0	0	0	112.3	E50 M51 R52 N58	E50-L54 VanDerWaalsContact O-CG 3.3Å; E50-L54 WeakPolarHBondContact O-CG 3.43Å; E50-L54 PolarHBondContact O-N 2.98Å; M51-L54 PolarHBondContact O-N 2.83Å; R52-L54 PolarHBondContact O-N 3.21Å; L54-N58 VanDerWaalsContact O-CB 3.31Å; L54-N58 WeakPolarHBondContact O-CB 3.25Å; L54-N58 PolarHBondContact O-N 2.97Å; L54-N58 PolarHBondContact O-ND2 2.73Å; L54-N58 VanDerWaalsContact O-ND2 3.13Å
55	Q	69.6	Low	72	Confident	48 Å²	48	76.8 Å²	76.8	22%	0.224	36%	0.357	C	S	.	.	H	α-helix	trans	-62.5	-46.3	174.4	-75.6	-179.5	-16.5	0	0	111.4	M51 R52 R53 N58 A59 Y75 D108	M51-Q55 WeakPolarHBondContact O-CG 3.44Å; M51-Q55 PolarHBondContact O-N 3.49Å; M51-Q55 HydrophobicContact SD-CG 3.96Å; M51-Q55 PolarHBondContact SD-NE2 3.49Å; M51-Q55 PolarHBondContact SD-OE1 2.93Å; M51-Q55 VanDerWaalsContact SD-OE1 3.36Å; R52-Q55 PolarHBondContact O-N 3.31Å; R53-Q55 PolarHBondContact O-N 2.88Å; Q55-N58 PolarHBondContact O-N 3.42Å; Q55-A59 WeakPolarHBondContact O-CB 3.43Å; Q55-A59 PolarHBondContact O-N 2.97Å; Q55-Y75 HydrophobicContact CG-CE2 4.39Å; Q55-D108 PolarHBondContact NE2-OD2 3.19Å
56	L	68.3	Low	70.8	Confident	99 Å²	99	72.5 Å²	72.5	52%	0.518	36%	0.364	S	S	.	.	H	α-helix	trans	-64.8	-43.2	177.3	-69.9	170.4	0	0	0	112.1	R52 R53 N58 A59 W60	R52-L56 HydrophobicContact CG-CD1 4.18Å; R52-L56 WeakPolarHBondContact O-CG 3.36Å; R52-L56 PolarHBondContact O-N 3.43Å; R53-L56 PolarHBondContact O-N 3.34Å; L56-N58 VanDerWaalsContact C-N 3.33Å; L56-N58 PolarHBondContact O-N 3.41Å; L56-A59 PolarHBondContact O-N 3.22Å; L56-W60 WeakPolarHBondContact O-CB 3.31Å; L56-W60 PolarHBondContact O-N 2.85Å
57	E	68.9	Low	69.9	Low	71 Å²	71	76.6 Å²	76.6	33%	0.332	39%	0.385	S	S	.	.	H	α-helix	trans	-62.2	-40.4	175.4	-78.3	176.8	-171.6	0	0	112.1	R53 K61	R53-E57 IonicContact CZ-OE1 2.8Å; R53-E57 IonicContact NH1-OE1 3.49Å; R53-E57 PolarHBondContact NH1-OE1 2.9Å; R53-E57 IonicContact NH1-OE2 3.38Å; R53-E57 PolarHBondContact NH1-OE2 3.44Å; R53-E57 WeakPolarHBondContact O-CB 3.46Å; R53-E57 WeakPolarHBondContact O-CG 3.46Å; R53-E57 PolarHBondContact O-N 2.94Å; E57-K61 WeakPolarHBondContact O-CB 3.41Å; E57-K61 VanDerWaalsContact O-CG 3.28Å; E57-K61 WeakPolarHBondContact O-CG 3.47Å; E57-K61 PolarHBondContact O-N 3.41Å
58	N	68.5	Low	68.5	Low	72 Å²	72	80.5 Å²	80.5	39%	0.385	42%	0.419	S	S	.	.	H	α-helix	trans	-68.3	-44.9	175.8	-73.8	-27.9	0	0	0	111.2	L54 Q55 L56 W60 K61 N62	L54-N58 VanDerWaalsContact O-CB 3.31Å; L54-N58 WeakPolarHBondContact O-CB 3.25Å; L54-N58 PolarHBondContact O-N 2.97Å; L54-N58 PolarHBondContact O-ND2 2.73Å; L54-N58 VanDerWaalsContact O-ND2 3.13Å; Q55-N58 PolarHBondContact O-N 3.42Å; L56-N58 VanDerWaalsContact C-N 3.33Å; L56-N58 PolarHBondContact O-N 3.41Å; N58-W60 VanDerWaalsContact C-N 3.3Å; N58-W60 PolarHBondContact O-N 2.94Å; N58-K61 PolarHBondContact O-N 3.37Å; N58-N62 WeakPolarHBondContact O-CB 3.42Å; N58-N62 PolarHBondContact O-N 2.96Å; N58-N62 PolarHBondContact O-ND2 3.21Å
59	A	68	Low	67.3	Low	35 Å²	35	86.5 Å²	86.5	29%	0.289	45%	0.451	S	S	.	.	H	α-helix	trans	-57.1	-45.8	176.5	0	0	0	0	0	111.1	Q55 L56 N62 Q63	Q55-A59 WeakPolarHBondContact O-CB 3.43Å; Q55-A59 PolarHBondContact O-N 2.97Å; L56-A59 PolarHBondContact O-N 3.22Å; A59-N62 PolarHBondContact O-N 3.27Å; A59-Q63 WeakPolarHBondContact O-CB 3.16Å; A59-Q63 PolarHBondContact O-N 3.4Å
60	W	63.9	Low	66.1	Low	150 Å²	150	87.8 Å²	87.8	57%	0.568	46%	0.458	S	S	*	.	H	α-helix	trans	-63.2	-45.3	177.4	-173.2	79.8	0	0	0	112.8	L56 N58 N62 Q63 Q64	L56-W60 WeakPolarHBondContact O-CB 3.31Å; L56-W60 PolarHBondContact O-N 2.85Å; N58-W60 VanDerWaalsContact C-N 3.3Å; N58-W60 PolarHBondContact O-N 2.94Å; W60-N62 PolarHBondContact O-N 3.07Å; W60-Q63 PolarHBondContact O-N 3.31Å; W60-Q64 PolarHBondContact O-N 3.45Å
61	K	70.5	Confident	64.9	Low	105 Å²	105	93.9 Å²	93.9	46%	0.457	49%	0.486	S	S	.	.	H	α-helix	trans	-62.1	-41.4	175.8	-76.1	174.1	-177.9	172.8	0	112.5	E57 N58 Q64 L65	E57-K61 WeakPolarHBondContact O-CB 3.41Å; E57-K61 VanDerWaalsContact O-CG 3.28Å; E57-K61 WeakPolarHBondContact O-CG 3.47Å; E57-K61 PolarHBondContact O-N 3.41Å; N58-K61 PolarHBondContact O-N 3.37Å; K61-Q64 PolarHBondContact O-N 3.01Å; K61-L65 WeakPolarHBondContact O-CB 3.43Å; K61-L65 WeakPolarHBondContact O-CD1 3.45Å; K61-L65 WeakPolarHBondContact O-CG 3.36Å; K61-L65 PolarHBondContact O-N 2.94Å; K61-L65 VanDerWaalsContact O-N 3.09Å
62	N	64.6	Low	63.7	Low	25 Å²	25	96.5 Å²	96.5	13%	0.134	51%	0.505	C	S	.	.	H	α-helix	trans	-69.2	-38.4	179.6	-66.5	-38.9	0	0	0	111.6	N58 A59 W60 Q64 L65 G66 L67 P70	N58-N62 WeakPolarHBondContact O-CB 3.42Å; N58-N62 PolarHBondContact O-N 2.96Å; N58-N62 PolarHBondContact O-ND2 3.21Å; A59-N62 PolarHBondContact O-N 3.27Å; W60-N62 PolarHBondContact O-N 3.07Å; N62-Q64 VanDerWaalsContact C-N 3.34Å; N62-Q64 PolarHBondContact O-N 2.85Å; N62-L65 PolarHBondContact O-N 3.46Å; N62-G66 PolarHBondContact O-N 3.33Å; N62-L67 PolarHBondContact O-N 3.45Å; N62-L67 VanDerWaalsContact O-N 3.16Å; N62-P70 WeakPolarHBondContact ND2-CD 3.32Å
63	Q	65.6	Low	62.9	Low	156 Å²	156	99.2 Å²	99.2	73%	0.729	52%	0.52	S	S	*	.	H	α-helix	trans	-61.5	-41.5	173.9	-169.7	177.6	11.2	0	0	111.6	A59 W60 L65 G66	A59-Q63 WeakPolarHBondContact O-CB 3.16Å; A59-Q63 PolarHBondContact O-N 3.4Å; W60-Q63 PolarHBondContact O-N 3.31Å; Q63-L65 VanDerWaalsContact C-N 3.34Å; Q63-L65 PolarHBondContact O-N 2.9Å; Q63-G66 PolarHBondContact O-N 2.9Å
64	Q	68.6	Low	62.2	Low	127 Å²	127	98.9 Å²	98.9	59%	0.593	53%	0.527	S	S	*	.	H	α-helix	trans	-65.6	-34.6	175.1	-75.9	-171	-22.2	0	0	113.5	W60 K61 N62	W60-Q64 PolarHBondContact O-N 3.45Å; K61-Q64 PolarHBondContact O-N 3.01Å; N62-Q64 VanDerWaalsContact C-N 3.34Å; N62-Q64 PolarHBondContact O-N 2.85Å
65	L	71.1	Confident	61.9	Low	120 Å²	120	97.5 Å²	97.5	63%	0.628	52%	0.518	S	S	*	.	H	α-helix	trans	-87.9	-3.5	-177.1	-70.6	164	0	0	0	113.4	K61 N62 Q63 L67	K61-L65 WeakPolarHBondContact O-CB 3.43Å; K61-L65 WeakPolarHBondContact O-CD1 3.45Å; K61-L65 WeakPolarHBondContact O-CG 3.36Å; K61-L65 PolarHBondContact O-N 2.94Å; K61-L65 VanDerWaalsContact O-N 3.09Å; N62-L65 PolarHBondContact O-N 3.46Å; Q63-L65 VanDerWaalsContact C-N 3.34Å; Q63-L65 PolarHBondContact O-N 2.9Å; L65-L67 HydrophobicContact CB-CB 4.4Å; L65-L67 HydrophobicContact CB-CD1 3.73Å; L65-L67 HydrophobicContact CB-CG 3.89Å; L65-L67 HydrophobicContact CD1-CD1 4.07Å; L65-L67 HydrophobicContact CG-CD1 4.47Å; L65-L67 PolarHBondContact O-N 3.31Å; L65-L67 VanDerWaalsContact O-N 3.15Å
66	G	53.7	Low	62.2	Low	73 Å²	73	97.3 Å²	97.3	75%	0.753	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	19.3	-174.1	0	0	0	0	0	113.3	N62 Q63	N62-G66 PolarHBondContact O-N 3.33Å; Q63-G66 PolarHBondContact O-N 2.9Å
67	L	59.3	Low	62.7	Low	105 Å²	105	93.1 Å²	93.1	55%	0.55	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-87.2	135.8	180	-69.1	169.3	0	0	0	108.7	N62 L65 L69	N62-L67 PolarHBondContact O-N 3.45Å; N62-L67 VanDerWaalsContact O-N 3.16Å; L65-L67 HydrophobicContact CB-CB 4.4Å; L65-L67 HydrophobicContact CB-CD1 3.73Å; L65-L67 HydrophobicContact CB-CG 3.89Å; L65-L67 HydrophobicContact CD1-CD1 4.07Å; L65-L67 HydrophobicContact CG-CD1 4.47Å; L65-L67 PolarHBondContact O-N 3.31Å; L65-L67 VanDerWaalsContact O-N 3.15Å; L67-L69 PolarHBondContact O-N 2.88Å
68	A	55.2	Low	63.2	Low	92 Å²	92	94.8 Å²	94.8	76%	0.76	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-51.9	134.2	172.1	0	0	0	0	0	109.5	P70	A68-P70 VanDerWaalsContact O-N 3.11Å
69	L	54	Low	63.8	Low	126 Å²	126	97.1 Å²	97.1	66%	0.66	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-51.4	123.8	177.4	-95.4	88.5	0	0	0	108.5	L67 Q71	L67-L69 PolarHBondContact O-N 2.88Å; L69-Q71 PolarHBondContact O-N 3.3Å
70	P	50.3	Low	64.5	Low	79 Å²	79	95.8 Å²	95.8	51%	0.513	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-59.5	129.7	171.7	24.1	-28.3	0	0	0	107.2	N62 A68 S72	N62-P70 WeakPolarHBondContact ND2-CD 3.32Å; A68-P70 VanDerWaalsContact O-N 3.11Å; P70-S72 PolarHBondContact O-N 3.21Å
71	Q	50	Low	65.5	Low	180 Å²	180	89.7 Å²	89.7	84%	0.841	49%	0.485	S	S	*	.			trans	-45.6	134.7	169.6	-67.7	176.1	-10.2	0	0	108.5	L69 K73	L69-Q71 PolarHBondContact O-N 3.3Å; Q71-K73 PolarHBondContact O-N 3.38Å
72	S	52.1	Low	66	Low	62 Å²	62	84.7 Å²	84.7	43%	0.434	46%	0.463	S	S	.	.			trans	-41.1	115.7	-179.1	49.3	0	0	0	0	109.3	P70 N74 D110	P70-S72 PolarHBondContact O-N 3.21Å; S72-N74 PolarHBondContact O-N 3.23Å; S72-D110 PolarHBondContact OG-OD2 2.85Å
73	K	55.1	Low	67	Low	165 Å²	165	83.8 Å²	83.8	72%	0.717	46%	0.458	S	S	*	.			trans	-61.4	114.2	171.1	-81.8	-176.5	177.7	176.6	0	106	Q71 Y75	Q71-K73 PolarHBondContact O-N 3.38Å; K73-Y75 WeakPolarHBondContact O-CD2 3.32Å; K73-Y75 WeakPolarHBondContact O-CE2 3.43Å; K73-Y75 PolarHBondContact O-N 2.99Å
74	N	57.2	Low	68	Low	118 Å²	118	82.6 Å²	82.6	63%	0.631	45%	0.45	S	S	*	.			trans	-40.3	104.9	174.7	-76.2	-13.4	0	0	0	110.4	S72 S76 K79	S72-N74 PolarHBondContact O-N 3.23Å; N74-S76 PolarHBondContact O-N 2.97Å; N74-S76 VanDerWaalsContact O-N 3.17Å; N74-K79 PolarHBondContact O-NZ 2.78Å
75	Y	64.9	Low	68.7	Low	39 Å²	39	77.5 Å²	77.5	15%	0.153	43%	0.427	C	S	.	.			trans	-81.9	94.8	176	-75.8	-79.4	0	0	0	106.8	M51 Q55 K73 N114	M51-Y75 HydrophobicContact CG-CD1 4.18Å; M51-Y75 HydrophobicContact CG-CD2 4.4Å; M51-Y75 HydrophobicContact CG-CE1 3.98Å; M51-Y75 HydrophobicContact CG-CE2 4.24Å; M51-Y75 HydrophobicContact CG-CG 4.4Å; Q55-Y75 HydrophobicContact CG-CE2 4.39Å; K73-Y75 WeakPolarHBondContact O-CD2 3.32Å; K73-Y75 WeakPolarHBondContact O-CE2 3.43Å; K73-Y75 PolarHBondContact O-N 2.99Å; Y75-N114 PolarHBondContact O-ND2 2.9Å
76	S	76.3	Confident	69.4	Low	44 Å²	44	78.1 Å²	78.1	31%	0.308	43%	0.431	S	S	.	.			trans	-65.8	139.3	167.6	170.9	0	0	0	0	109.4	N74 D78 K79	N74-S76 PolarHBondContact O-N 2.97Å; N74-S76 VanDerWaalsContact O-N 3.17Å; S76-D78 PolarHBondContact O-N 2.84Å; S76-D78 VanDerWaalsContact O-N 3.15Å; S76-D78 PolarHBondContact OG-N 3.37Å; S76-D78 VanDerWaalsContact OG-N 3.16Å; S76-D78 PolarHBondContact OG-OD2 3.09Å; S76-K79 WeakPolarHBondContact O-CB 3.27Å; S76-K79 PolarHBondContact O-N 2.65Å
77	L	79.4	Confident	70.9	Confident	11 Å²	11	77.5 Å²	77.5	6%	0.058	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-52.8	-31.9	172.2	-62.9	170.1	0	0	0	111.5	K79 F80 F83 L111 N114 Y115 S118	L77-K79 PolarHBondContact O-N 2.91Å; L77-F80 WeakPolarHBondContact O-CB 3.33Å; L77-F80 PolarHBondContact O-N 2.86Å; L77-F83 HydrophobicContact CB-CB 4.14Å; L77-F83 HydrophobicContact CB-CD2 4.17Å; L77-F83 HydrophobicContact CB-CG 4.04Å; L77-F83 HydrophobicContact CD2-CD2 3.81Å; L77-F83 HydrophobicContact CD2-CE1 4.34Å; L77-F83 HydrophobicContact CD2-CE2 3.6Å; L77-F83 HydrophobicContact CD2-CG 4.27Å; L77-F83 HydrophobicContact CD2-CZ 3.9Å; L77-F83 WeakPolarHBondContact O-CB 3.41Å; L77-L111 HydrophobicContact CD2-CD1 3.64Å; L77-N114 HydrophobicContact CG-CB 4.3Å; L77-Y115 HydrophobicContact CD2-CD2 4.45Å; L77-S118 VanDerWaalsContact CD1-OG 3.31Å; L77-S118 WeakPolarHBondContact CD1-OG 3.47Å
78	D	78.3	Confident	72	Confident	107 Å²	107	72.5 Å²	72.5	57%	0.572	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-63.7	-11.9	-179.1	-58.9	-37.9	0	0	0	113.5	S76 K84	S76-D78 PolarHBondContact O-N 2.84Å; S76-D78 VanDerWaalsContact O-N 3.15Å; S76-D78 PolarHBondContact OG-N 3.37Å; S76-D78 VanDerWaalsContact OG-N 3.16Å; S76-D78 PolarHBondContact OG-OD2 3.09Å; D78-K84 WeakPolarHBondContact O-CE 3.42Å; D78-K84 WeakPolarHBondContact O-CG 3.24Å
79	K	81.4	Confident	73.6	Confident	121 Å²	121	71.6 Å²	71.6	53%	0.526	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-80.3	-26.2	173.5	-66.4	177.5	-179.3	166.7	0	112.4	N74 S76 L77	N74-K79 PolarHBondContact O-NZ 2.78Å; S76-K79 WeakPolarHBondContact O-CB 3.27Å; S76-K79 PolarHBondContact O-N 2.65Å; L77-K79 PolarHBondContact O-N 2.91Å
80	F	84.2	Confident	75.1	Confident	7 Å²	7	68.7 Å²	68.7	3%	0.031	35%	0.353	C	S	.	.	S	Bend	trans	-79.8	130.5	-176.3	-72.3	-115.1	0	0	0	109.5	L44 D47 L48 M51 L77 A82 F83 K84 L111	L44-F80 HydrophobicContact CD1-CD1 4.35Å; D47-F80 HydrophobicContact CB-CB 4.29Å; D47-F80 HydrophobicContact CB-CD1 3.22Å; D47-F80 HydrophobicContact CB-CE1 3.71Å; D47-F80 HydrophobicContact CB-CG 4.07Å; L48-F80 HydrophobicContact CD2-CE1 3.94Å; L48-F80 HydrophobicContact CG-CE1 4.3Å; M51-F80 HydrophobicContact CB-CZ 4.29Å; M51-F80 HydrophobicContact CG-CZ 4.31Å; L77-F80 WeakPolarHBondContact O-CB 3.33Å; L77-F80 PolarHBondContact O-N 2.86Å; F80-A82 PolarHBondContact O-N 3.36Å; F80-F83 HydrophobicContact CB-CB 4.46Å; F80-F83 HydrophobicContact CB-CD2 3.77Å; F80-F83 HydrophobicContact CG-CD2 4.3Å; F80-F83 PolarHBondContact O-N 3.48Å; F80-F83 VanDerWaalsContact O-N 3.14Å; F80-K84 WeakPolarHBondContact O-CG 3.29Å; F80-K84 PolarHBondContact O-N 2.86Å; F80-K84 VanDerWaalsContact O-N 3.09Å; F80-L111 HydrophobicContact CD2-CD1 4.29Å; F80-L111 HydrophobicContact CE1-CD2 3.94Å; F80-L111 HydrophobicContact CE2-CD1 3.68Å; F80-L111 HydrophobicContact CE2-CD2 4.27Å; F80-L111 HydrophobicContact CZ-CD1 3.88Å; F80-L111 HydrophobicContact CZ-CD2 3.59Å; F80-L111 HydrophobicContact CZ-CG 4.41Å
81	V	82.8	Confident	76.7	Confident	22 Å²	22	65.7 Å²	65.7	13%	0.133	34%	0.335	C	S	.	.	H	α-helix	trans	-57.6	-40.4	176.4	164.4	0	0	0	0	110.6	K18 E22 L43 D47 F83 K84 N85	K18-V81 HydrophobicContact CD-CG2 4.13Å; E22-V81 HydrophobicContact CG-CG1 3.53Å; E22-V81 WeakPolarHBondContact OE1-CG1 3.46Å; L43-V81 HydrophobicContact CD2-CG1 4.01Å; D47-V81 PolarHBondContact OD1-N 3.23Å; D47-V81 PolarHBondContact OD2-N 2.97Å; V81-F83 PolarHBondContact O-N 3.13Å; V81-K84 PolarHBondContact O-N 2.9Å; V81-K84 VanDerWaalsContact O-N 3.13Å; V81-N85 PolarHBondContact O-N 3.28Å; V81-N85 VanDerWaalsContact O-N 3.16Å
82	A	82.2	Confident	78.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.1	-32.1	178.8	0	0	0	0	0	113.6	L43 L44 D47 F80 A88 K89 L92	L43-A82 HydrophobicContact CB-CB 3.95Å; L44-A82 HydrophobicContact CB-CB 4Å; L44-A82 HydrophobicContact CD1-CB 4.45Å; D47-A82 PolarHBondContact OD2-N 3.1Å; F80-A82 PolarHBondContact O-N 3.36Å; A82-A88 WeakPolarHBondContact O-CB 3.37Å; A82-K89 PolarHBondContact O-N 2.89Å; A82-L92 HydrophobicContact CB-CD1 4.02Å
83	F	85	Confident	80.1	Confident	5 Å²	5	56.8 Å²	56.8	2%	0.022	29%	0.286	C	S	.	.	H	α-helix	trans	-97.2	-14.2	180	-69.5	-75.2	0	0	0	113.6	L44 L77 F80 V81 K89 L92 F93 Y115	L44-F83 HydrophobicContact CD1-CE2 3.69Å; L44-F83 HydrophobicContact CD1-CZ 4.34Å; L77-F83 HydrophobicContact CB-CB 4.14Å; L77-F83 HydrophobicContact CB-CD2 4.17Å; L77-F83 HydrophobicContact CB-CG 4.04Å; L77-F83 HydrophobicContact CD2-CD2 3.81Å; L77-F83 HydrophobicContact CD2-CE1 4.34Å; L77-F83 HydrophobicContact CD2-CE2 3.6Å; L77-F83 HydrophobicContact CD2-CG 4.27Å; L77-F83 HydrophobicContact CD2-CZ 3.9Å; L77-F83 WeakPolarHBondContact O-CB 3.41Å; F80-F83 HydrophobicContact CB-CB 4.46Å; F80-F83 HydrophobicContact CB-CD2 3.77Å; F80-F83 HydrophobicContact CG-CD2 4.3Å; F80-F83 PolarHBondContact O-N 3.48Å; F80-F83 VanDerWaalsContact O-N 3.14Å; V81-F83 PolarHBondContact O-N 3.13Å; F83-K89 HydrophobicContact CD1-CG 4.32Å; F83-L92 HydrophobicContact CE1-CD1 4.04Å; F83-L92 HydrophobicContact CE2-CD1 4.45Å; F83-L92 HydrophobicContact CZ-CD1 3.99Å; F83-F93 HydrophobicContact CE1-CZ 4.39Å; F83-Y115 AromaticContact CE1-CD2 3.74Å; F83-Y115 HydrophobicContact CE1-CD2 3.74Å; F83-Y115 AromaticContact CE1-CE2 3.76Å; F83-Y115 HydrophobicContact CE1-CE2 3.76Å; F83-Y115 AromaticContact CZ-CD2 3.53Å; F83-Y115 HydrophobicContact CZ-CD2 3.53Å; F83-Y115 AromaticContact CZ-CE2 3.79Å; F83-Y115 HydrophobicContact CZ-CE2 3.79Å
84	K	86.8	Confident	81.5	Confident	131 Å²	131	52 Å²	52	57%	0.57	28%	0.283	S	S	*	.	H	α-helix	trans	-75	-36.6	169.6	-72.6	179.5	-176.1	178.9	0	112.4	D78 F80 V81 N86	D78-K84 WeakPolarHBondContact O-CE 3.42Å; D78-K84 WeakPolarHBondContact O-CG 3.24Å; F80-K84 WeakPolarHBondContact O-CG 3.29Å; F80-K84 PolarHBondContact O-N 2.86Å; F80-K84 VanDerWaalsContact O-N 3.09Å; V81-K84 PolarHBondContact O-N 2.9Å; V81-K84 VanDerWaalsContact O-N 3.13Å; K84-N86 PolarHBondContact O-N 3.5Å
85	N	84.5	Confident	82.9	Confident	20 Å²	20	49.9 Å²	49.9	11%	0.107	27%	0.271	C	S	.	.	S	Bend	trans	-78.6	118.5	177.4	-172.5	-57.3	0	0	0	110.2	L25 D26 V81 R87 A88 K89	L25-N85 HydrophobicContact CD2-CB 4.34Å; L25-N85 WeakPolarHBondContact CD2-OD1 3.08Å; D26-N85 PolarHBondContact OD1-ND2 3.29Å; V81-N85 PolarHBondContact O-N 3.28Å; V81-N85 VanDerWaalsContact O-N 3.16Å; N85-R87 VanDerWaalsContact C-N 3.27Å; N85-R87 PolarHBondContact O-N 2.91Å; N85-R87 WeakPolarHBondContact OD1-CB 3.25Å; N85-R87 PolarHBondContact OD1-N 3.08Å; N85-A88 HydrophobicContact CB-CB 4.15Å; N85-A88 PolarHBondContact O-N 3.22Å; N85-A88 PolarHBondContact OD1-N 3.26Å; N85-K89 VanDerWaalsContact O-CB 3.32Å; N85-K89 WeakPolarHBondContact O-CB 3.25Å; N85-K89 PolarHBondContact O-N 3.27Å
86	N	85.2	Confident	83.9	Confident	133 Å²	133	49.9 Å²	49.9	71%	0.711	27%	0.274	S	S	*	.	H	α-helix	trans	-58.6	-34.4	-176.2	-72.4	-31.9	0	0	0	113.7	K84 A90	K84-N86 PolarHBondContact O-N 3.5Å; N86-A90 VanDerWaalsContact O-CB 3.32Å; N86-A90 WeakPolarHBondContact O-CB 3.46Å; N86-A90 PolarHBondContact O-N 2.87Å
87	R	84.9	Confident	84.2	Confident	60 Å²	60	51.6 Å²	51.6	23%	0.226	29%	0.286	C	S	.	.	H	α-helix	trans	-72.3	-44.1	178.8	-65.1	-178.1	75.9	169.3	8.1	111.2	L25 D26 L28 E36 N85 A90 A91	L25-R87 HydrophobicContact CD1-CB 4.49Å; L25-R87 HydrophobicContact CD2-CB 4.14Å; L25-R87 HydrophobicContact CG-CB 4.17Å; L25-R87 PolarHBondContact O-NH1 3.48Å; D26-R87 PolarHBondContact O-NH1 3.02Å; L28-R87 PolarHBondContact O-NH1 3Å; L28-R87 PolarHBondContact O-NH2 2.93Å; E36-R87 IonicContact OE1-CZ 3.2Å; E36-R87 IonicContact OE1-NE 2.61Å; E36-R87 IonicContact OE1-NH2 3.69Å; E36-R87 PolarHBondContact OE1-NH2 3.32Å; E36-R87 IonicContact OE2-NE 2.62Å; N85-R87 VanDerWaalsContact C-N 3.27Å; N85-R87 PolarHBondContact O-N 2.91Å; N85-R87 WeakPolarHBondContact OD1-CB 3.25Å; N85-R87 PolarHBondContact OD1-N 3.08Å; R87-A90 PolarHBondContact O-N 3.42Å; R87-A91 WeakPolarHBondContact O-CB 3.37Å; R87-A91 PolarHBondContact O-N 3.39Å
88	A	83.3	Confident	84.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.6	-46.5	176.8	0	0	0	0	0	110.6	L25 A40 L43 A82 N85 A90 A91 L92	L25-A88 HydrophobicContact CD2-CB 3.59Å; A40-A88 HydrophobicContact CB-CB 3.79Å; L43-A88 HydrophobicContact CD1-CB 4.33Å; A82-A88 WeakPolarHBondContact O-CB 3.37Å; N85-A88 HydrophobicContact CB-CB 4.15Å; N85-A88 PolarHBondContact O-N 3.22Å; N85-A88 PolarHBondContact OD1-N 3.26Å; A88-A90 VanDerWaalsContact C-N 3.34Å; A88-A90 PolarHBondContact O-N 3.4Å; A88-A91 PolarHBondContact O-N 3.45Å; A88-L92 VanDerWaalsContact O-CG 3.32Å; A88-L92 WeakPolarHBondContact O-CG 3.36Å; A88-L92 PolarHBondContact O-N 3.48Å
89	K	87	Confident	84.8	Confident	73 Å²	73	48.5 Å²	48.5	32%	0.317	27%	0.274	S	S	.	.	H	α-helix	trans	-53.6	-49.9	174.8	-174.5	176.4	-172.2	167.7	0	111.5	A82 F83 N85 A91 L92 F93	A82-K89 PolarHBondContact O-N 2.89Å; F83-K89 HydrophobicContact CD1-CG 4.32Å; N85-K89 VanDerWaalsContact O-CB 3.32Å; N85-K89 WeakPolarHBondContact O-CB 3.25Å; N85-K89 PolarHBondContact O-N 3.27Å; K89-A91 PolarHBondContact O-N 2.9Å; K89-L92 PolarHBondContact O-N 3.36Å; K89-F93 HydrophobicContact CD-CE2 4.11Å; K89-F93 HydrophobicContact CG-CD2 3.7Å; K89-F93 HydrophobicContact CG-CE2 3.43Å; K89-F93 VanDerWaalsContact CG-CE2 3.43Å; K89-F93 WeakPolarHBondContact O-CD2 3.25Å; K89-F93 PolarHBondContact O-N 3.47Å
90	A	85.5	Confident	85	Confident	65 Å²	65	42.8 Å²	42.8	54%	0.537	25%	0.249	S	C	.	.	H	α-helix	trans	-62.5	-41.8	178.5	0	0	0	0	0	112.7	N86 R87 A88 G94	N86-A90 VanDerWaalsContact O-CB 3.32Å; N86-A90 WeakPolarHBondContact O-CB 3.46Å; N86-A90 PolarHBondContact O-N 2.87Å; R87-A90 PolarHBondContact O-N 3.42Å; A88-A90 VanDerWaalsContact C-N 3.34Å; A88-A90 PolarHBondContact O-N 3.4Å; A90-G94 PolarHBondContact O-N 2.69Å
91	A	85.7	Confident	85	Confident	16 Å²	16	48.9 Å²	48.9	13%	0.132	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-40.9	177.7	0	0	0	0	0	112.5	A40 R87 A88 K89 G94 L95	A40-A91 HydrophobicContact CB-CB 4.01Å; R87-A91 WeakPolarHBondContact O-CB 3.37Å; R87-A91 PolarHBondContact O-N 3.39Å; A88-A91 PolarHBondContact O-N 3.45Å; K89-A91 PolarHBondContact O-N 2.9Å; A91-G94 PolarHBondContact O-N 3.36Å; A91-L95 PolarHBondContact O-N 2.81Å
92	L	86.1	Confident	84.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.5	-44	177.9	-70.5	173.1	0	0	0	112.2	A40 F41 L44 A82 F83 A88 K89 G94 L95 T99 Y115	A40-L92 HydrophobicContact CB-CD2 4.21Å; A40-L92 HydrophobicContact CB-CG 4.02Å; F41-L92 HydrophobicContact CD1-CD2 3.85Å; F41-L92 HydrophobicContact CE1-CD2 3.87Å; F41-L92 HydrophobicContact CG-CD2 4.23Å; F41-L92 HydrophobicContact CZ-CD2 4.22Å; L44-L92 HydrophobicContact CB-CD1 4.28Å; L44-L92 HydrophobicContact CB-CD2 4.43Å; L44-L92 HydrophobicContact CD2-CD1 4.2Å; L44-L92 HydrophobicContact CD2-CD2 3.86Å; A82-L92 HydrophobicContact CB-CD1 4.02Å; F83-L92 HydrophobicContact CE1-CD1 4.04Å; F83-L92 HydrophobicContact CE2-CD1 4.45Å; F83-L92 HydrophobicContact CZ-CD1 3.99Å; A88-L92 VanDerWaalsContact O-CG 3.32Å; A88-L92 WeakPolarHBondContact O-CG 3.36Å; A88-L92 PolarHBondContact O-N 3.48Å; K89-L92 PolarHBondContact O-N 3.36Å; L92-G94 VanDerWaalsContact C-N 3.3Å; L92-G94 PolarHBondContact O-N 3.12Å; L92-L95 CarbonylContact O-C 3.26Å; L92-L95 VanDerWaalsContact O-C 3.29Å; L92-L95 PolarHBondContact O-N 3.5Å; L92-T99 HydrophobicContact CB-CG2 4.25Å; L92-T99 HydrophobicContact CD2-CG2 4.23Å; L92-T99 PolarHBondContact O-OG1 3.11Å; L92-Y115 PolarHBondContact O-OH 3.43Å
93	F	86.3	Confident	84.9	Confident	56 Å²	56	49.9 Å²	49.9	25%	0.246	28%	0.281	C	S	.	.	H	α-helix	trans	-67.3	-31.2	174.5	-75.5	-57.8	0	0	0	112.7	F83 K89 L95 Y115	F83-F93 HydrophobicContact CE1-CZ 4.39Å; K89-F93 HydrophobicContact CD-CE2 4.11Å; K89-F93 HydrophobicContact CG-CD2 3.7Å; K89-F93 HydrophobicContact CG-CE2 3.43Å; K89-F93 VanDerWaalsContact CG-CE2 3.43Å; K89-F93 WeakPolarHBondContact O-CD2 3.25Å; K89-F93 PolarHBondContact O-N 3.47Å; F93-L95 PolarHBondContact O-N 3.29Å; F93-Y115 HydrophobicContact CD1-CE2 4.03Å; F93-Y115 HydrophobicContact CE1-CD2 4.21Å; F93-Y115 AromaticContact CE1-CE2 3.69Å; F93-Y115 HydrophobicContact CE1-CE2 3.69Å; F93-Y115 HydrophobicContact CZ-CE2 4.36Å
94	G	84.4	Confident	84.8	Confident	64 Å²	64	53.7 Å²	53.7	66%	0.66	30%	0.297	S	S	*	.	H	α-helix	trans	-65.7	-23.6	172.7	0	0	0	0	0	113.7	A90 A91 L92	A90-G94 PolarHBondContact O-N 2.69Å; A91-G94 PolarHBondContact O-N 3.36Å; L92-G94 VanDerWaalsContact C-N 3.3Å; L92-G94 PolarHBondContact O-N 3.12Å
95	L	86.1	Confident	84.2	Confident	74 Å²	74	51.5 Å²	51.5	39%	0.387	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	52.2	179.3	-64.8	173.1	0	0	0	110.9	A37 F41 A91 L92 F93 S97 S98 T99	A37-L95 HydrophobicContact CB-CD1 3.57Å; F41-L95 HydrophobicContact CE2-CB 4.17Å; F41-L95 HydrophobicContact CE2-CD1 3.69Å; F41-L95 HydrophobicContact CZ-CB 4.08Å; F41-L95 HydrophobicContact CZ-CD1 4.43Å; A91-L95 PolarHBondContact O-N 2.81Å; L92-L95 CarbonylContact O-C 3.26Å; L92-L95 VanDerWaalsContact O-C 3.29Å; L92-L95 PolarHBondContact O-N 3.5Å; F93-L95 PolarHBondContact O-N 3.29Å; L95-S97 PolarHBondContact O-N 2.95Å; L95-S98 PolarHBondContact O-N 2.9Å; L95-T99 PolarHBondContact O-N 3.19Å; L95-T99 PolarHBondContact O-OG1 3.48Å; L95-T99 VanDerWaalsContact O-OG1 3.09Å
96	N	85.7	Confident	83.6	Confident	39 Å²	39	53 Å²	53	21%	0.209	31%	0.308	C	S	.	.	H	α-helix	trans	-52.6	-49.3	-169.2	-170.3	39.2	0	0	0	113.6	S98 T99 I100 Y115 D121	N96-S98 PolarHBondContact O-N 3.48Å; N96-T99 PolarHBondContact O-N 3.03Å; N96-I100 WeakPolarHBondContact O-CB 3.41Å; N96-I100 VanDerWaalsContact O-CG1 3.22Å; N96-I100 WeakPolarHBondContact O-CG1 3.13Å; N96-I100 PolarHBondContact O-N 2.85Å; N96-Y115 WeakPolarHBondContact OD1-CE1 3.18Å; N96-Y115 PolarHBondContact OD1-OH 3.39Å; N96-D121 PolarHBondContact ND2-OD2 3.49Å
97	S	83.3	Confident	82.8	Confident	79 Å²	79	49 Å²	49	55%	0.552	30%	0.3	S	S	*	.	H	α-helix	trans	-59.8	-46.4	-178.7	56	0	0	0	0	113	L95 T99 I100 E101	L95-S97 PolarHBondContact O-N 2.95Å; S97-T99 VanDerWaalsContact C-N 3.34Å; S97-T99 PolarHBondContact O-N 3.4Å; S97-I100 PolarHBondContact O-N 3.22Å; S97-E101 WeakPolarHBondContact O-CG 3.32Å; S97-E101 PolarHBondContact O-N 3.42Å
98	S	85.9	Confident	82.3	Confident	54 Å²	54	46.6 Å²	46.6	38%	0.378	29%	0.291	S	S	.	.	H	α-helix	trans	-68.1	-34.3	178.6	-59.6	0	0	0	0	112.5	L95 N96 M102	L95-S98 PolarHBondContact O-N 2.9Å; N96-S98 PolarHBondContact O-N 3.48Å; S98-M102 WeakPolarHBondContact O-CB 3.29Å; S98-M102 PolarHBondContact O-N 3.31Å
99	T	85.6	Confident	82.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.1	-43.6	174.6	-56.4	0	0	0	0	111.3	L44 L92 L95 N96 S97 M102 I103 Y115	L44-T99 HydrophobicContact CD2-CG2 3.87Å; L92-T99 HydrophobicContact CB-CG2 4.25Å; L92-T99 HydrophobicContact CD2-CG2 4.23Å; L92-T99 PolarHBondContact O-OG1 3.11Å; L95-T99 PolarHBondContact O-N 3.19Å; L95-T99 PolarHBondContact O-OG1 3.48Å; L95-T99 VanDerWaalsContact O-OG1 3.09Å; N96-T99 PolarHBondContact O-N 3.03Å; S97-T99 VanDerWaalsContact C-N 3.34Å; S97-T99 PolarHBondContact O-N 3.4Å; T99-M102 PolarHBondContact O-N 3.05Å; T99-I103 HydrophobicContact CG2-CD1 4.08Å; T99-I103 WeakPolarHBondContact O-CG1 3.17Å; T99-I103 PolarHBondContact O-N 3.46Å; T99-Y115 WeakPolarHBondContact CB-OH 3.48Å; T99-Y115 HydrophobicContact CG2-CD2 4.19Å; T99-Y115 HydrophobicContact CG2-CE1 4.13Å; T99-Y115 HydrophobicContact CG2-CE2 3.44Å; T99-Y115 VanDerWaalsContact CG2-CE2 3.44Å; T99-Y115 VanDerWaalsContact CG2-CZ 3.42Å
100	I	84.5	Confident	81.7	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-50.5	174.5	-72.2	168.2	0	0	0	110.7	N96 S97 M102 I103 K104 L112 Y115 L116 E124	N96-I100 WeakPolarHBondContact O-CB 3.41Å; N96-I100 VanDerWaalsContact O-CG1 3.22Å; N96-I100 WeakPolarHBondContact O-CG1 3.13Å; N96-I100 PolarHBondContact O-N 2.85Å; S97-I100 PolarHBondContact O-N 3.22Å; I100-M102 VanDerWaalsContact C-N 3.27Å; I100-M102 PolarHBondContact O-N 2.85Å; I100-I103 PolarHBondContact O-N 3.01Å; I100-K104 HydrophobicContact CG2-CD 3.83Å; I100-K104 HydrophobicContact CG2-CG 4.36Å; I100-K104 VanDerWaalsContact CG2-NZ 3.29Å; I100-K104 WeakPolarHBondContact O-CB 3.43Å; I100-K104 WeakPolarHBondContact O-CG 3.34Å; I100-K104 PolarHBondContact O-N 2.89Å; I100-L112 HydrophobicContact CG2-CD1 4.25Å; I100-Y115 HydrophobicContact CD1-CE1 4.38Å; I100-Y115 HydrophobicContact CG1-CD1 4.04Å; I100-Y115 HydrophobicContact CG1-CE1 3.63Å; I100-L116 HydrophobicContact CD1-CD2 3.55Å; I100-L116 HydrophobicContact CG1-CD2 3.88Å; I100-E124 WeakPolarHBondContact CG2-OE2 3.47Å
101	E	83.6	Confident	81.7	Confident	134 Å²	134	43.3 Å²	43.3	63%	0.626	27%	0.269	S	S	*	.	H	α-helix	trans	-57.9	-41.5	177.4	-75.9	-177.3	171.1	0	0	111.7	S97 K104 A105	S97-E101 WeakPolarHBondContact O-CG 3.32Å; S97-E101 PolarHBondContact O-N 3.42Å; E101-K104 PolarHBondContact O-N 3.37Å; E101-A105 PolarHBondContact O-N 3.07Å
102	M	79.2	Confident	81.6	Confident	44 Å²	44	43 Å²	43	22%	0.217	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-46.2	177	-174.4	172.1	-66.5	0	0	111.7	F41 L44 R45 L48 S98 T99 I100 A105 Y106	F41-M102 HydrophobicContact CB-CE 4.12Å; F41-M102 HydrophobicContact CD1-CE 3.31Å; F41-M102 HydrophobicContact CD1-SD 3.74Å; F41-M102 HydrophobicContact CE1-CE 4.03Å; F41-M102 HydrophobicContact CE1-SD 4.44Å; F41-M102 HydrophobicContact CG-CE 4.04Å; L44-M102 HydrophobicContact CB-SD 4.38Å; L44-M102 HydrophobicContact CD2-CG 4.46Å; L44-M102 HydrophobicContact CD2-SD 3.88Å; L44-M102 HydrophobicContact CG-SD 4.06Å; R45-M102 HydrophobicContact CB-SD 4.39Å; L48-M102 HydrophobicContact CD1-CG 3.93Å; L48-M102 HydrophobicContact CD1-SD 4.42Å; S98-M102 WeakPolarHBondContact O-CB 3.29Å; S98-M102 PolarHBondContact O-N 3.31Å; T99-M102 PolarHBondContact O-N 3.05Å; I100-M102 VanDerWaalsContact C-N 3.27Å; I100-M102 PolarHBondContact O-N 2.85Å; M102-A105 WeakPolarHBondContact O-CB 3.32Å; M102-A105 PolarHBondContact O-N 3.33Å; M102-Y106 HydrophobicContact CG-CE2 4.4Å; M102-Y106 VanDerWaalsContact O-CD2 3.3Å; M102-Y106 WeakPolarHBondContact O-CD2 3.31Å
103	I	83.7	Confident	81.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.6	-43.4	178.5	-64.8	168.1	0	0	0	110.5	L48 T99 I100 A105 Y106 G107 L111 L112 Y115	L48-I103 HydrophobicContact CD1-CG1 4.46Å; T99-I103 HydrophobicContact CG2-CD1 4.08Å; T99-I103 WeakPolarHBondContact O-CG1 3.17Å; T99-I103 PolarHBondContact O-N 3.46Å; I100-I103 PolarHBondContact O-N 3.01Å; I103-A105 VanDerWaalsContact C-N 3.25Å; I103-A105 PolarHBondContact O-N 3.45Å; I103-Y106 PolarHBondContact O-N 2.95Å; I103-Y106 VanDerWaalsContact O-N 3.07Å; I103-G107 PolarHBondContact O-N 3.31Å; I103-L111 HydrophobicContact CG2-CD2 4.2Å; I103-L111 HydrophobicContact CG2-CG 4.22Å; I103-L112 HydrophobicContact CB-CD1 4.31Å; I103-L112 HydrophobicContact CG2-CB 3.88Å; I103-L112 HydrophobicContact CG2-CD1 4.1Å; I103-Y115 HydrophobicContact CD1-CD1 3.98Å; I103-Y115 HydrophobicContact CD1-CD2 3.81Å; I103-Y115 HydrophobicContact CD1-CE2 4.48Å; I103-Y115 HydrophobicContact CD1-CG 3.52Å
104	K	82.9	Confident	81.5	Confident	84 Å²	84	43 Å²	43	37%	0.365	27%	0.268	S	S	.	.	H	α-helix	trans	-54.4	-41.2	175.1	-77.3	175.3	-178.4	165.7	0	111.6	I100 E101 Y106 G107 L112 E124	I100-K104 HydrophobicContact CG2-CD 3.83Å; I100-K104 HydrophobicContact CG2-CG 4.36Å; I100-K104 VanDerWaalsContact CG2-NZ 3.29Å; I100-K104 WeakPolarHBondContact O-CB 3.43Å; I100-K104 WeakPolarHBondContact O-CG 3.34Å; I100-K104 PolarHBondContact O-N 2.89Å; E101-K104 PolarHBondContact O-N 3.37Å; K104-Y106 PolarHBondContact O-N 3.04Å; K104-G107 PolarHBondContact O-N 3.27Å; K104-L112 HydrophobicContact CD-CD2 4.49Å; K104-L112 HydrophobicContact CG-CD1 4.35Å; K104-L112 HydrophobicContact CG-CD2 3.68Å; K104-E124 IonicContact NZ-OE1 3.97Å; K104-E124 PolarHBondContact NZ-OE1 2.96Å; K104-E124 IonicContact NZ-OE2 2.65Å; K104-E124 PolarHBondContact NZ-OE2 2.88Å
105	A	75.8	Confident	81.6	Confident	86 Å²	86	40 Å²	40	71%	0.711	24%	0.236	S	C	*	.	H	α-helix	trans	-62.4	-23.4	179.6	0	0	0	0	0	114.4	E101 M102 I103	E101-A105 PolarHBondContact O-N 3.07Å; M102-A105 WeakPolarHBondContact O-CB 3.32Å; M102-A105 PolarHBondContact O-N 3.33Å; I103-A105 VanDerWaalsContact C-N 3.25Å; I103-A105 PolarHBondContact O-N 3.45Å
106	Y	71.8	Confident	81.5	Confident	50 Å²	50	36.4 Å²	36.4	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-92.3	-9.7	175.4	-73.9	-98.9	0	0	0	113.4	R45 L48 R52 M102 I103 K104 D108	R45-Y106 VanDerWaalsContact CG-OH 3.24Å; R45-Y106 WeakPolarHBondContact CG-OH 3.33Å; L48-Y106 HydrophobicContact CB-CD1 3.72Å; L48-Y106 HydrophobicContact CB-CD2 3.82Å; L48-Y106 HydrophobicContact CB-CE1 3.78Å; L48-Y106 HydrophobicContact CB-CE2 3.88Å; L48-Y106 HydrophobicContact CB-CG 3.74Å; L48-Y106 HydrophobicContact CD1-CD2 3.6Å; L48-Y106 HydrophobicContact CD1-CE2 3.82Å; L48-Y106 HydrophobicContact CD1-CG 4.21Å; L48-Y106 HydrophobicContact CD2-CG 4.45Å; L48-Y106 HydrophobicContact CG-CD2 4.21Å; L48-Y106 HydrophobicContact CG-CE2 4.49Å; L48-Y106 HydrophobicContact CG-CG 4.36Å; R52-Y106 HydrophobicContact CB-CD1 4.25Å; R52-Y106 PolarHBondContact NH1-O 2.88Å; M102-Y106 HydrophobicContact CG-CE2 4.4Å; M102-Y106 VanDerWaalsContact O-CD2 3.3Å; M102-Y106 WeakPolarHBondContact O-CD2 3.31Å; I103-Y106 PolarHBondContact O-N 2.95Å; I103-Y106 VanDerWaalsContact O-N 3.07Å; K104-Y106 PolarHBondContact O-N 3.04Å; Y106-D108 PolarHBondContact O-N 3.11Å
107	G	67.9	Low	81.5	Confident	51 Å²	51	40.5 Å²	40.5	53%	0.526	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	16.7	169.5	0	0	0	0	0	116.2	I103 K104	I103-G107 PolarHBondContact O-N 3.31Å; K104-G107 PolarHBondContact O-N 3.27Å
108	D	73.8	Confident	81.6	Confident	9 Å²	9	39.9 Å²	39.9	5%	0.048	23%	0.231	C	C	.	.			trans	-93.2	104.9	176.8	-165.6	-44.2	0	0	0	111.2	M51 Q55 Y106 D110 L111 L112	M51-D108 HydrophobicContact CE-CB 3.73Å; Q55-D108 PolarHBondContact NE2-OD2 3.19Å; Y106-D108 PolarHBondContact O-N 3.11Å; D108-D110 PolarHBondContact OD1-N 3.11Å; D108-D110 VanDerWaalsContact OD1-N 3.13Å; D108-L111 HydrophobicContact CB-CB 3.95Å; D108-L111 PolarHBondContact OD1-N 3.21Å; D108-L112 WeakPolarHBondContact O-CB 3.48Å; D108-L112 PolarHBondContact O-N 2.96Å; D108-L112 VanDerWaalsContact O-N 3.1Å
109	V	78.6	Confident	81.5	Confident	40 Å²	40	38.7 Å²	38.7	24%	0.242	22%	0.223	C	C	.	.	H	α-helix	trans	-69.9	-39.5	-176.3	179.9	0	0	0	0	111.8	L111 L112 L113 F132	V109-L111 VanDerWaalsContact C-N 3.35Å; V109-L112 PolarHBondContact O-N 3.39Å; V109-L113 HydrophobicContact CG1-CD1 4.02Å; V109-L113 HydrophobicContact CG1-CG 4.35Å; V109-L113 VanDerWaalsContact O-CG 3.27Å; V109-L113 WeakPolarHBondContact O-CG 3.39Å; V109-L113 PolarHBondContact O-N 2.93Å; V109-F132 HydrophobicContact CB-CE1 4.28Å; V109-F132 HydrophobicContact CB-CE2 4.3Å; V109-F132 HydrophobicContact CB-CZ 4.09Å; V109-F132 HydrophobicContact CG1-CD1 3.9Å; V109-F132 HydrophobicContact CG1-CD2 3.44Å; V109-F132 VanDerWaalsContact CG1-CD2 3.44Å; V109-F132 HydrophobicContact CG1-CE1 3.83Å; V109-F132 HydrophobicContact CG1-CE2 3.39Å; V109-F132 HydrophobicContact CG1-CG 3.72Å; V109-F132 HydrophobicContact CG1-CZ 3.6Å; V109-F132 HydrophobicContact CG2-CD1 4.41Å; V109-F132 HydrophobicContact CG2-CE1 3.58Å; V109-F132 HydrophobicContact CG2-CE2 3.9Å; V109-F132 HydrophobicContact CG2-CZ 3.28Å
110	D	80.5	Confident	81.4	Confident	28 Å²	28	47.8 Å²	47.8	15%	0.15	26%	0.258	C	S	.	.	H	α-helix	trans	-69.7	-38.5	-177.9	-67.8	-44.2	0	0	0	110.5	S72 D108 L113 N114 K134	S72-D110 PolarHBondContact OG-OD2 2.85Å; D108-D110 PolarHBondContact OD1-N 3.11Å; D108-D110 VanDerWaalsContact OD1-N 3.13Å; D110-L113 PolarHBondContact O-N 3.38Å; D110-N114 WeakPolarHBondContact O-CB 3.3Å; D110-N114 PolarHBondContact O-N 2.8Å; D110-N114 PolarHBondContact O-ND2 3.19Å; D110-K134 IonicContact OD1-NZ 3.32Å; D110-K134 PolarHBondContact OD1-NZ 3.36Å
111	L	83.6	Confident	81.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.6	-43.3	172.1	-175.4	64.6	0	0	0	111.8	L48 M51 L77 F80 I103 D108 V109 N114 Y115	L48-L111 HydrophobicContact CD2-CD2 3.34Å; M51-L111 HydrophobicContact CE-CD2 4.18Å; L77-L111 HydrophobicContact CD2-CD1 3.64Å; F80-L111 HydrophobicContact CD2-CD1 4.29Å; F80-L111 HydrophobicContact CE1-CD2 3.94Å; F80-L111 HydrophobicContact CE2-CD1 3.68Å; F80-L111 HydrophobicContact CE2-CD2 4.27Å; F80-L111 HydrophobicContact CZ-CD1 3.88Å; F80-L111 HydrophobicContact CZ-CD2 3.59Å; F80-L111 HydrophobicContact CZ-CG 4.41Å; I103-L111 HydrophobicContact CG2-CD2 4.2Å; I103-L111 HydrophobicContact CG2-CG 4.22Å; D108-L111 HydrophobicContact CB-CB 3.95Å; D108-L111 PolarHBondContact OD1-N 3.21Å; V109-L111 VanDerWaalsContact C-N 3.35Å; L111-N114 PolarHBondContact O-N 3.35Å; L111-Y115 WeakPolarHBondContact O-CB 3.36Å; L111-Y115 PolarHBondContact O-N 3.32Å
112	L	84.9	Confident	81.2	Confident	9 Å²	9	45.7 Å²	45.7	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-44.4	177.7	-178.3	60.2	0	0	0	111.6	I100 I103 K104 D108 V109 Y115 L116 L128	I100-L112 HydrophobicContact CG2-CD1 4.25Å; I103-L112 HydrophobicContact CB-CD1 4.31Å; I103-L112 HydrophobicContact CG2-CB 3.88Å; I103-L112 HydrophobicContact CG2-CD1 4.1Å; K104-L112 HydrophobicContact CD-CD2 4.49Å; K104-L112 HydrophobicContact CG-CD1 4.35Å; K104-L112 HydrophobicContact CG-CD2 3.68Å; D108-L112 WeakPolarHBondContact O-CB 3.48Å; D108-L112 PolarHBondContact O-N 2.96Å; D108-L112 VanDerWaalsContact O-N 3.1Å; V109-L112 PolarHBondContact O-N 3.39Å; L112-Y115 PolarHBondContact O-N 3.28Å; L112-L116 HydrophobicContact CD1-CD1 4.1Å; L112-L116 HydrophobicContact CD1-CG 4.18Å; L112-L116 HydrophobicContact CG-CD1 3.94Å; L112-L116 HydrophobicContact CG-CG 4.44Å; L112-L116 WeakPolarHBondContact O-CB 3.44Å; L112-L116 VanDerWaalsContact O-CG 3.25Å; L112-L116 WeakPolarHBondContact O-CG 3.25Å; L112-L116 PolarHBondContact O-N 2.76Å; L112-L128 HydrophobicContact CD2-CD1 3.59Å; L112-L128 HydrophobicContact CD2-CD2 4.42Å; L112-L128 HydrophobicContact CG-CD1 4.01Å
113	L	84.3	Confident	81.3	Confident	11 Å²	11	46.4 Å²	46.4	6%	0.058	25%	0.252	C	S	.	.	H	α-helix	trans	-61.8	-45.6	176.4	-71	169.8	0	0	0	111.7	V109 D110 Y115 L116 E117 L125 L128 Q129 K134	V109-L113 HydrophobicContact CG1-CD1 4.02Å; V109-L113 HydrophobicContact CG1-CG 4.35Å; V109-L113 VanDerWaalsContact O-CG 3.27Å; V109-L113 WeakPolarHBondContact O-CG 3.39Å; V109-L113 PolarHBondContact O-N 2.93Å; D110-L113 PolarHBondContact O-N 3.38Å; L113-Y115 VanDerWaalsContact C-N 3.29Å; L113-Y115 PolarHBondContact O-N 3.42Å; L113-L116 PolarHBondContact O-N 3.01Å; L113-E117 WeakPolarHBondContact O-CB 3.5Å; L113-E117 PolarHBondContact O-N 3.27Å; L113-L125 HydrophobicContact CD2-CD1 3.64Å; L113-L128 HydrophobicContact CD2-CB 4.03Å; L113-Q129 HydrophobicContact CD2-CG 3.84Å; L113-K134 HydrophobicContact CD1-CD 3.82Å
114	N	84.6	Confident	81.1	Confident	46 Å²	46	49.2 Å²	49.2	25%	0.246	27%	0.265	C	S	.	.	H	α-helix	trans	-61.3	-39.3	176.3	-69.8	-23	0	0	0	111.8	Y75 L77 D110 L111 S118	Y75-N114 PolarHBondContact O-ND2 2.9Å; L77-N114 HydrophobicContact CG-CB 4.3Å; D110-N114 WeakPolarHBondContact O-CB 3.3Å; D110-N114 PolarHBondContact O-N 2.8Å; D110-N114 PolarHBondContact O-ND2 3.19Å; L111-N114 PolarHBondContact O-N 3.35Å; N114-S118 WeakPolarHBondContact O-CB 3.47Å; N114-S118 PolarHBondContact O-N 3.23Å; N114-S118 VanDerWaalsContact O-N 3.11Å; N114-S118 PolarHBondContact O-OG 2.89Å
115	Y	87	Confident	81.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.9	-49.2	175.7	178.1	-93.9	0	0	0	111.9	L77 F83 L92 F93 N96 T99 I100 I103 L111 L112 L113 E117 S118 S119	L77-Y115 HydrophobicContact CD2-CD2 4.45Å; F83-Y115 AromaticContact CE1-CD2 3.74Å; F83-Y115 HydrophobicContact CE1-CD2 3.74Å; F83-Y115 AromaticContact CE1-CE2 3.76Å; F83-Y115 HydrophobicContact CE1-CE2 3.76Å; F83-Y115 AromaticContact CZ-CD2 3.53Å; F83-Y115 HydrophobicContact CZ-CD2 3.53Å; F83-Y115 AromaticContact CZ-CE2 3.79Å; F83-Y115 HydrophobicContact CZ-CE2 3.79Å; L92-Y115 PolarHBondContact O-OH 3.43Å; F93-Y115 HydrophobicContact CD1-CE2 4.03Å; F93-Y115 HydrophobicContact CE1-CD2 4.21Å; F93-Y115 AromaticContact CE1-CE2 3.69Å; F93-Y115 HydrophobicContact CE1-CE2 3.69Å; F93-Y115 HydrophobicContact CZ-CE2 4.36Å; N96-Y115 WeakPolarHBondContact OD1-CE1 3.18Å; N96-Y115 PolarHBondContact OD1-OH 3.39Å; T99-Y115 WeakPolarHBondContact CB-OH 3.48Å; T99-Y115 HydrophobicContact CG2-CD2 4.19Å; T99-Y115 HydrophobicContact CG2-CE1 4.13Å; T99-Y115 HydrophobicContact CG2-CE2 3.44Å; T99-Y115 VanDerWaalsContact CG2-CE2 3.44Å; T99-Y115 VanDerWaalsContact CG2-CZ 3.42Å; I100-Y115 HydrophobicContact CD1-CE1 4.38Å; I100-Y115 HydrophobicContact CG1-CD1 4.04Å; I100-Y115 HydrophobicContact CG1-CE1 3.63Å; I103-Y115 HydrophobicContact CD1-CD1 3.98Å; I103-Y115 HydrophobicContact CD1-CD2 3.81Å; I103-Y115 HydrophobicContact CD1-CE2 4.48Å; I103-Y115 HydrophobicContact CD1-CG 3.52Å; L111-Y115 WeakPolarHBondContact O-CB 3.36Å; L111-Y115 PolarHBondContact O-N 3.32Å; L112-Y115 PolarHBondContact O-N 3.28Å; L113-Y115 VanDerWaalsContact C-N 3.29Å; L113-Y115 PolarHBondContact O-N 3.42Å; Y115-E117 PolarHBondContact O-N 3.29Å; Y115-S118 CarbonylContact O-C 3.57Å; Y115-S118 WeakPolarHBondContact O-CB 3.34Å; Y115-S118 PolarHBondContact O-N 3.35Å; Y115-S118 VanDerWaalsContact O-N 3.12Å; Y115-S119 PolarHBondContact O-N 3.32Å; Y115-S119 PolarHBondContact O-OG 3.02Å
116	L	85.3	Confident	81.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.2	-37.4	-179.4	-69.5	170.4	0	0	0	112.5	I100 L112 L113 S118 S119 R120 D121 E124 L125 L128	I100-L116 HydrophobicContact CD1-CD2 3.55Å; I100-L116 HydrophobicContact CG1-CD2 3.88Å; L112-L116 HydrophobicContact CD1-CD1 4.1Å; L112-L116 HydrophobicContact CD1-CG 4.18Å; L112-L116 HydrophobicContact CG-CD1 3.94Å; L112-L116 HydrophobicContact CG-CG 4.44Å; L112-L116 WeakPolarHBondContact O-CB 3.44Å; L112-L116 VanDerWaalsContact O-CG 3.25Å; L112-L116 WeakPolarHBondContact O-CG 3.25Å; L112-L116 PolarHBondContact O-N 2.76Å; L113-L116 PolarHBondContact O-N 3.01Å; L116-S118 VanDerWaalsContact C-N 3.3Å; L116-S118 PolarHBondContact O-N 2.92Å; L116-S119 WeakPolarHBondContact CA-OG 3.3Å; L116-S119 PolarHBondContact O-N 3.2Å; L116-S119 PolarHBondContact O-OG 3.07Å; L116-R120 PolarHBondContact O-N 3.29Å; L116-D121 HydrophobicContact CD2-CB 3.92Å; L116-D121 PolarHBondContact O-N 3Å; L116-E124 HydrophobicContact CD1-CB 4.08Å; L116-E124 HydrophobicContact CD2-CB 3.97Å; L116-L125 HydrophobicContact CB-CB 4.01Å; L116-L125 HydrophobicContact CB-CD1 3.98Å; L116-L125 HydrophobicContact CB-CG 4.46Å; L116-L128 HydrophobicContact CD1-CD1 3.34Å
117	E	85.4	Confident	82	Confident	124 Å²	124	40 Å²	40	58%	0.579	21%	0.213	S	C	*	.	H	α-helix	trans	-62	-40.4	172.2	-172.4	175.5	-173.5	0	0	111.3	L113 Y115 R120 L125	L113-E117 WeakPolarHBondContact O-CB 3.5Å; L113-E117 PolarHBondContact O-N 3.27Å; Y115-E117 PolarHBondContact O-N 3.29Å; E117-R120 PolarHBondContact O-N 3.38Å; E117-L125 HydrophobicContact CB-CD2 4.25Å
118	S	84.9	Confident	82.6	Confident	66 Å²	66	38.5 Å²	38.5	46%	0.462	19%	0.193	S	C	.	.	H	α-helix	trans	-73.7	-35.9	178.6	-60.1	0	0	0	0	113.4	L77 N114 Y115 L116 R120	L77-S118 VanDerWaalsContact CD1-OG 3.31Å; L77-S118 WeakPolarHBondContact CD1-OG 3.47Å; N114-S118 WeakPolarHBondContact O-CB 3.47Å; N114-S118 PolarHBondContact O-N 3.23Å; N114-S118 VanDerWaalsContact O-N 3.11Å; N114-S118 PolarHBondContact O-OG 2.89Å; Y115-S118 CarbonylContact O-C 3.57Å; Y115-S118 WeakPolarHBondContact O-CB 3.34Å; Y115-S118 PolarHBondContact O-N 3.35Å; Y115-S118 VanDerWaalsContact O-N 3.12Å; L116-S118 VanDerWaalsContact C-N 3.3Å; L116-S118 PolarHBondContact O-N 2.92Å; S118-R120 PolarHBondContact O-N 3.49Å
119	S	84.2	Confident	83.1	Confident	30 Å²	30	38.8 Å²	38.8	21%	0.21	19%	0.194	C	C	.	.	H	α-helix	trans	-77.2	-12.1	177.1	67.8	0	0	0	0	112.8	Y115 L116 D121	Y115-S119 PolarHBondContact O-N 3.32Å; Y115-S119 PolarHBondContact O-OG 3.02Å; L116-S119 WeakPolarHBondContact CA-OG 3.3Å; L116-S119 PolarHBondContact O-N 3.2Å; L116-S119 PolarHBondContact O-OG 3.07Å; S119-D121 PolarHBondContact O-N 3.31Å; S119-D121 WeakPolarHBondContact OG-CB 3.22Å; S119-D121 PolarHBondContact OG-N 2.89Å
120	R	82.1	Confident	83.2	Confident	191 Å²	191	37 Å²	37	72%	0.721	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	28	-171.9	-57.4	-178.7	173.4	-177.9	-2.2	113	L116 E117 S118 F122	L116-R120 PolarHBondContact O-N 3.29Å; E117-R120 PolarHBondContact O-N 3.38Å; S118-R120 PolarHBondContact O-N 3.49Å; R120-F122 VanDerWaalsContact C-N 3.26Å; R120-F122 HydrophobicContact CB-CE2 4.06Å; R120-F122 HydrophobicContact CB-CZ 4.02Å; R120-F122 HydrophobicContact CG-CZ 4.32Å; R120-F122 WeakPolarHBondContact O-CD2 3.36Å; R120-F122 PolarHBondContact O-N 2.82Å
121	D	81.9	Confident	83.3	Confident	36 Å²	36	40.6 Å²	40.6	19%	0.193	20%	0.199	C	C	.	.			trans	-82.8	78	172.6	-165.6	-20.9	0	0	0	109.8	N96 L116 S119 L123 L125	N96-D121 PolarHBondContact ND2-OD2 3.49Å; L116-D121 HydrophobicContact CD2-CB 3.92Å; L116-D121 PolarHBondContact O-N 3Å; S119-D121 PolarHBondContact O-N 3.31Å; S119-D121 WeakPolarHBondContact OG-CB 3.22Å; S119-D121 PolarHBondContact OG-N 2.89Å; D121-L123 PolarHBondContact O-N 3.2Å; D121-L125 WeakPolarHBondContact O-CB 3.32Å; D121-L125 PolarHBondContact O-N 2.9Å
122	F	82.4	Confident	83.1	Confident	54 Å²	54	45.5 Å²	45.5	24%	0.237	22%	0.221	C	C	.	.	H	α-helix	trans	-67.3	-22.9	-175.4	-60.9	-55.9	0	0	0	113.2	R120 L125 V126 T141 I150	R120-F122 VanDerWaalsContact C-N 3.26Å; R120-F122 HydrophobicContact CB-CE2 4.06Å; R120-F122 HydrophobicContact CB-CZ 4.02Å; R120-F122 HydrophobicContact CG-CZ 4.32Å; R120-F122 WeakPolarHBondContact O-CD2 3.36Å; R120-F122 PolarHBondContact O-N 2.82Å; F122-L125 HydrophobicContact CD1-CD2 4.36Å; F122-V126 WeakPolarHBondContact O-CB 3.39Å; F122-V126 VanDerWaalsContact O-CG2 3.26Å; F122-V126 WeakPolarHBondContact O-CG2 3.41Å; F122-V126 PolarHBondContact O-N 2.83Å; F122-T141 HydrophobicContact CB-CG2 4.29Å; F122-T141 HydrophobicContact CD1-CG2 3.5Å; F122-T141 HydrophobicContact CE1-CG2 4.25Å; F122-T141 HydrophobicContact CG-CG2 4.28Å; F122-I150 HydrophobicContact CB-CD1 3.49Å; F122-I150 VanDerWaalsContact CB-CD1 3.49Å; F122-I150 HydrophobicContact CD2-CD1 4.44Å; F122-I150 HydrophobicContact CG-CD1 4.42Å
123	L	81.8	Confident	82.8	Confident	59 Å²	59	46.7 Å²	46.7	31%	0.309	24%	0.235	S	C	.	.	H	α-helix	trans	-68.7	-52.5	-176.8	179.9	66.2	0	0	0	111.3	D121 S127 I150 N153	D121-L123 PolarHBondContact O-N 3.2Å; L123-S127 PolarHBondContact O-N 3.45Å; L123-S127 PolarHBondContact O-OG 2.94Å; L123-I150 HydrophobicContact CB-CG1 4.37Å; L123-I150 HydrophobicContact CD1-CG1 4.37Å; L123-N153 HydrophobicContact CD1-CB 3.69Å; L123-N153 WeakPolarHBondContact CD1-ND2 3.45Å
124	E	79.7	Confident	82.7	Confident	59 Å²	59	50 Å²	50	28%	0.276	25%	0.249	S	C	.	.	H	α-helix	trans	-70.6	-36.4	175.2	-71.7	-155.1	-178.9	0	0	111.5	I100 K104 L116 V126 S127 L128	I100-E124 WeakPolarHBondContact CG2-OE2 3.47Å; K104-E124 IonicContact NZ-OE1 3.97Å; K104-E124 PolarHBondContact NZ-OE1 2.96Å; K104-E124 IonicContact NZ-OE2 2.65Å; K104-E124 PolarHBondContact NZ-OE2 2.88Å; L116-E124 HydrophobicContact CD1-CB 4.08Å; L116-E124 HydrophobicContact CD2-CB 3.97Å; E124-V126 PolarHBondContact O-N 3.38Å; E124-S127 PolarHBondContact O-N 3.22Å; E124-L128 WeakPolarHBondContact O-CB 3.44Å; E124-L128 WeakPolarHBondContact O-CG 3.39Å; E124-L128 PolarHBondContact O-N 3.36Å
125	L	84.8	Confident	82.6	Confident	3 Å²	3	51 Å²	51	2%	0.016	25%	0.25	C	S	.	.	H	α-helix	trans	-59.1	-50.1	-179	-178.7	57.8	0	0	0	112.1	L113 L116 E117 D121 F122 L128 Q129 T141	L113-L125 HydrophobicContact CD2-CD1 3.64Å; L116-L125 HydrophobicContact CB-CB 4.01Å; L116-L125 HydrophobicContact CB-CD1 3.98Å; L116-L125 HydrophobicContact CB-CG 4.46Å; E117-L125 HydrophobicContact CB-CD2 4.25Å; D121-L125 WeakPolarHBondContact O-CB 3.32Å; D121-L125 PolarHBondContact O-N 2.9Å; F122-L125 HydrophobicContact CD1-CD2 4.36Å; L125-L128 PolarHBondContact O-N 3.28Å; L125-Q129 HydrophobicContact CD1-CG 4.02Å; L125-Q129 HydrophobicContact CG-CG 4.34Å; L125-Q129 WeakPolarHBondContact O-CB 3.22Å; L125-Q129 WeakPolarHBondContact O-CG 3.42Å; L125-Q129 PolarHBondContact O-N 3.44Å; L125-T141 HydrophobicContact CD2-CG2 3.7Å; L125-T141 HydrophobicContact CG-CG2 4.16Å
126	V	82.7	Confident	82.4	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-64.7	-43.6	-178.6	172.1	0	0	0	0	110.5	F122 E124 L128 Q129 I130 A138 T141 L142 I150 A154	F122-V126 WeakPolarHBondContact O-CB 3.39Å; F122-V126 VanDerWaalsContact O-CG2 3.26Å; F122-V126 WeakPolarHBondContact O-CG2 3.41Å; F122-V126 PolarHBondContact O-N 2.83Å; E124-V126 PolarHBondContact O-N 3.38Å; V126-L128 VanDerWaalsContact C-N 3.33Å; V126-L128 PolarHBondContact O-N 2.86Å; V126-Q129 PolarHBondContact O-N 3.2Å; V126-I130 HydrophobicContact CG1-CD1 3.68Å; V126-I130 HydrophobicContact CG1-CG1 4.3Å; V126-I130 VanDerWaalsContact O-CG1 3.25Å; V126-I130 WeakPolarHBondContact O-CG1 3.19Å; V126-I130 PolarHBondContact O-N 3.47Å; V126-A138 HydrophobicContact CG1-CB 4.49Å; V126-T141 HydrophobicContact CG2-CG2 3.57Å; V126-L142 HydrophobicContact CG1-CD1 3.97Å; V126-L142 HydrophobicContact CG1-CD2 4.02Å; V126-L142 HydrophobicContact CG1-CG 3.95Å; V126-L142 HydrophobicContact CG2-CD2 4.02Å; V126-L142 HydrophobicContact CG2-CG 3.88Å; V126-I150 HydrophobicContact CB-CG2 4.34Å; V126-I150 HydrophobicContact CG2-CG2 3.98Å; V126-A154 HydrophobicContact CG1-CB 3.59Å
127	S	81.5	Confident	82.3	Confident	22 Å²	22	58.4 Å²	58.4	15%	0.154	30%	0.295	C	S	.	.	H	α-helix	trans	-57.9	-46.2	177.8	-57.5	0	0	0	0	111.4	L123 E124 I130 Q131	L123-S127 PolarHBondContact O-N 3.45Å; L123-S127 PolarHBondContact O-OG 2.94Å; E124-S127 PolarHBondContact O-N 3.22Å; S127-I130 PolarHBondContact O-N 3.27Å; S127-Q131 VanDerWaalsContact O-CG 3.28Å; S127-Q131 WeakPolarHBondContact O-CG 3.32Å; S127-Q131 PolarHBondContact O-N 2.94Å
128	L	81.7	Confident	82.1	Confident	21 Å²	21	52.5 Å²	52.5	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-68.7	-42.8	176.7	-73.8	163.7	0	0	0	112.4	L112 L113 L116 E124 L125 V126 I130 Q131 F132	L112-L128 HydrophobicContact CD2-CD1 3.59Å; L112-L128 HydrophobicContact CD2-CD2 4.42Å; L112-L128 HydrophobicContact CG-CD1 4.01Å; L113-L128 HydrophobicContact CD2-CB 4.03Å; L116-L128 HydrophobicContact CD1-CD1 3.34Å; E124-L128 WeakPolarHBondContact O-CB 3.44Å; E124-L128 WeakPolarHBondContact O-CG 3.39Å; E124-L128 PolarHBondContact O-N 3.36Å; L125-L128 PolarHBondContact O-N 3.28Å; V126-L128 VanDerWaalsContact C-N 3.33Å; V126-L128 PolarHBondContact O-N 2.86Å; L128-I130 VanDerWaalsContact C-N 3.26Å; L128-I130 PolarHBondContact O-N 3Å; L128-Q131 PolarHBondContact O-N 3.27Å; L128-F132 HydrophobicContact CB-CD2 4.46Å; L128-F132 HydrophobicContact CD2-CD2 4.32Å; L128-F132 HydrophobicContact CD2-CE2 3.83Å; L128-F132 WeakPolarHBondContact O-CB 3.46Å; L128-F132 VanDerWaalsContact O-CD2 3.25Å; L128-F132 WeakPolarHBondContact O-CD2 3.46Å; L128-F132 PolarHBondContact O-N 3.16Å
129	Q	83	Confident	81.9	Confident	14 Å²	14	51.5 Å²	51.5	7%	0.065	25%	0.254	C	S	.	.	H	α-helix	trans	-58.3	-39.6	176.4	-75.3	171.9	-22.8	0	0	111.5	L113 L125 V126 G133 K134 A137 A138 T141	L113-Q129 HydrophobicContact CD2-CG 3.84Å; L125-Q129 HydrophobicContact CD1-CG 4.02Å; L125-Q129 HydrophobicContact CG-CG 4.34Å; L125-Q129 WeakPolarHBondContact O-CB 3.22Å; L125-Q129 WeakPolarHBondContact O-CG 3.42Å; L125-Q129 PolarHBondContact O-N 3.44Å; V126-Q129 PolarHBondContact O-N 3.2Å; Q129-G133 PolarHBondContact O-N 3.32Å; Q129-K134 HydrophobicContact CB-CB 4.33Å; Q129-K134 WeakPolarHBondContact O-CA 3.38Å; Q129-K134 PolarHBondContact O-N 3.19Å; Q129-A137 HydrophobicContact CG-CB 4.46Å; Q129-A138 HydrophobicContact CB-CB 3.9Å; Q129-T141 PolarHBondContact NE2-OG1 3.03Å; Q129-T141 PolarHBondContact OE1-OG1 3.38Å
130	I	82	Confident	81.9	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-67.6	-46.9	175.2	-65.2	168.5	0	0	0	110.9	V126 S127 L128 F132 G133 Y135 A138 A154 H157 L165	V126-I130 HydrophobicContact CG1-CD1 3.68Å; V126-I130 HydrophobicContact CG1-CG1 4.3Å; V126-I130 VanDerWaalsContact O-CG1 3.25Å; V126-I130 WeakPolarHBondContact O-CG1 3.19Å; V126-I130 PolarHBondContact O-N 3.47Å; S127-I130 PolarHBondContact O-N 3.27Å; L128-I130 VanDerWaalsContact C-N 3.26Å; L128-I130 PolarHBondContact O-N 3Å; I130-F132 VanDerWaalsContact C-N 3.3Å; I130-F132 PolarHBondContact O-N 3.14Å; I130-G133 PolarHBondContact O-N 3.19Å; I130-Y135 WeakPolarHBondContact O-CE1 3.43Å; I130-A138 HydrophobicContact CG1-CB 3.99Å; I130-A154 HydrophobicContact CD1-CB 4Å; I130-H157 HydrophobicContact CB-CB 4.37Å; I130-H157 HydrophobicContact CD1-CB 4.19Å; I130-H157 HydrophobicContact CG2-CB 3.76Å; I130-H157 WeakPolarHBondContact CG2-O 3.22Å; I130-L165 HydrophobicContact CD1-CD2 4.14Å; I130-L165 HydrophobicContact CG1-CD2 3.9Å
131	Q	81	Confident	81.8	Confident	103 Å²	103	46.2 Å²	46.2	48%	0.481	24%	0.235	S	C	.	.	H	α-helix	trans	-59.6	-38.2	178.7	-74.9	174.1	1.8	0	0	112.9	S127 L128 G133	S127-Q131 VanDerWaalsContact O-CG 3.28Å; S127-Q131 WeakPolarHBondContact O-CG 3.32Å; S127-Q131 PolarHBondContact O-N 2.94Å; L128-Q131 PolarHBondContact O-N 3.27Å; Q131-G133 VanDerWaalsContact C-N 3.34Å
132	F	79.3	Confident	81.7	Confident	102 Å²	102	45.3 Å²	45.3	45%	0.447	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	13.3	-179.6	-73.4	-74.4	0	0	0	114.4	V109 L128 I130 K134	V109-F132 HydrophobicContact CB-CE1 4.28Å; V109-F132 HydrophobicContact CB-CE2 4.3Å; V109-F132 HydrophobicContact CB-CZ 4.09Å; V109-F132 HydrophobicContact CG1-CD1 3.9Å; V109-F132 HydrophobicContact CG1-CD2 3.44Å; V109-F132 VanDerWaalsContact CG1-CD2 3.44Å; V109-F132 HydrophobicContact CG1-CE1 3.83Å; V109-F132 HydrophobicContact CG1-CE2 3.39Å; V109-F132 HydrophobicContact CG1-CG 3.72Å; V109-F132 HydrophobicContact CG1-CZ 3.6Å; V109-F132 HydrophobicContact CG2-CD1 4.41Å; V109-F132 HydrophobicContact CG2-CE1 3.58Å; V109-F132 HydrophobicContact CG2-CE2 3.9Å; V109-F132 HydrophobicContact CG2-CZ 3.28Å; L128-F132 HydrophobicContact CB-CD2 4.46Å; L128-F132 HydrophobicContact CD2-CD2 4.32Å; L128-F132 HydrophobicContact CD2-CE2 3.83Å; L128-F132 WeakPolarHBondContact O-CB 3.46Å; L128-F132 VanDerWaalsContact O-CD2 3.25Å; L128-F132 WeakPolarHBondContact O-CD2 3.46Å; L128-F132 PolarHBondContact O-N 3.16Å; I130-F132 VanDerWaalsContact C-N 3.3Å; I130-F132 PolarHBondContact O-N 3.14Å; F132-K134 VanDerWaalsContact C-N 3.27Å; F132-K134 PolarHBondContact O-N 3.17Å
133	G	80.3	Confident	81.6	Confident	34 Å²	34	48.8 Å²	48.8	35%	0.351	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	9.8	174.2	0	0	0	0	0	115.9	Q129 I130 Q131 Y135	Q129-G133 PolarHBondContact O-N 3.32Å; I130-G133 PolarHBondContact O-N 3.19Å; Q131-G133 VanDerWaalsContact C-N 3.34Å; G133-Y135 VanDerWaalsContact C-N 3.28Å; G133-Y135 VanDerWaalsContact CA-CZ 3.45Å; G133-Y135 WeakPolarHBondContact CA-OH 3.48Å; G133-Y135 PolarHBondContact O-N 3.06Å; G133-Y135 VanDerWaalsContact O-N 3.11Å
134	K	82.1	Confident	81.5	Confident	82 Å²	82	52.2 Å²	52.2	36%	0.357	26%	0.263	S	S	.	.			trans	-87	57.9	-179.3	-60.8	-175.8	-178.2	179.8	0	110.9	D110 L113 Q129 F132 D136 A137 A138	D110-K134 IonicContact OD1-NZ 3.32Å; D110-K134 PolarHBondContact OD1-NZ 3.36Å; L113-K134 HydrophobicContact CD1-CD 3.82Å; Q129-K134 HydrophobicContact CB-CB 4.33Å; Q129-K134 WeakPolarHBondContact O-CA 3.38Å; Q129-K134 PolarHBondContact O-N 3.19Å; F132-K134 VanDerWaalsContact C-N 3.27Å; F132-K134 PolarHBondContact O-N 3.17Å; K134-D136 PolarHBondContact O-N 3.44Å; K134-A137 HydrophobicContact CB-CB 4.24Å; K134-A137 PolarHBondContact O-N 3.46Å; K134-A138 PolarHBondContact O-N 2.9Å
135	Y	81.7	Confident	81.1	Confident	67 Å²	67	49.8 Å²	49.8	26%	0.263	25%	0.252	S	S	.	.	H	α-helix	trans	-65.2	-36.6	-171	-48	-51.4	0	0	0	114.8	I130 G133 A137 A138 R139 V161 D162 L165	I130-Y135 WeakPolarHBondContact O-CE1 3.43Å; G133-Y135 VanDerWaalsContact C-N 3.28Å; G133-Y135 VanDerWaalsContact CA-CZ 3.45Å; G133-Y135 WeakPolarHBondContact CA-OH 3.48Å; G133-Y135 PolarHBondContact O-N 3.06Å; G133-Y135 VanDerWaalsContact O-N 3.11Å; Y135-A137 VanDerWaalsContact C-N 3.33Å; Y135-A138 WeakPolarHBondContact O-CB 3.28Å; Y135-A138 PolarHBondContact O-N 3.03Å; Y135-R139 PolarHBondContact O-N 2.83Å; Y135-V161 HydrophobicContact CD1-CG1 4.15Å; Y135-V161 HydrophobicContact CE1-CB 4.29Å; Y135-V161 HydrophobicContact CE1-CG1 3.11Å; Y135-V161 HydrophobicContact CE2-CG1 4.16Å; Y135-V161 WeakPolarHBondContact OH-CG1 3.44Å; Y135-D162 HydrophobicContact CD1-CB 4.28Å; Y135-D162 HydrophobicContact CD2-CB 3.81Å; Y135-D162 HydrophobicContact CE2-CB 4.18Å; Y135-D162 HydrophobicContact CG-CB 3.88Å; Y135-L165 HydrophobicContact CD1-CD2 4.24Å
136	D	82.2	Confident	80.3	Confident	114 Å²	114	59.3 Å²	59.3	61%	0.61	29%	0.294	S	S	*	.	H	α-helix	trans	-66.7	-39.8	178	-69.9	-40.8	0	0	0	110.8	K134 R139 E140	K134-D136 PolarHBondContact O-N 3.44Å; D136-R139 PolarHBondContact O-N 3.24Å; D136-R139 IonicContact OD1-NH1 2.68Å; D136-E140 PolarHBondContact O-N 3.48Å; D136-E140 VanDerWaalsContact O-N 3.08Å
137	A	83	Confident	80	Confident	41 Å²	41	61.7 Å²	61.7	34%	0.339	31%	0.31	S	S	.	.	H	α-helix	trans	-63.7	-44	173	0	0	0	0	0	111.2	Q129 K134 Y135 R139 E140 T141	Q129-A137 HydrophobicContact CG-CB 4.46Å; K134-A137 HydrophobicContact CB-CB 4.24Å; K134-A137 PolarHBondContact O-N 3.46Å; Y135-A137 VanDerWaalsContact C-N 3.33Å; A137-R139 VanDerWaalsContact C-N 3.3Å; A137-R139 PolarHBondContact O-N 3.44Å; A137-E140 PolarHBondContact O-N 3.03Å; A137-T141 PolarHBondContact O-N 3.5Å; A137-T141 PolarHBondContact O-OG1 3.31Å
138	A	82.8	Confident	79.6	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-55.8	-44.1	173.9	0	0	0	0	0	112	V126 Q129 I130 K134 Y135 E140 T141 L142 L165	V126-A138 HydrophobicContact CG1-CB 4.49Å; Q129-A138 HydrophobicContact CB-CB 3.9Å; I130-A138 HydrophobicContact CG1-CB 3.99Å; K134-A138 PolarHBondContact O-N 2.9Å; Y135-A138 WeakPolarHBondContact O-CB 3.28Å; Y135-A138 PolarHBondContact O-N 3.03Å; A138-E140 PolarHBondContact O-N 3.4Å; A138-T141 PolarHBondContact O-N 3.39Å; A138-L142 VanDerWaalsContact O-CB 3.3Å; A138-L142 WeakPolarHBondContact O-CB 3.38Å; A138-L142 WeakPolarHBondContact O-CD1 3.31Å; A138-L142 WeakPolarHBondContact O-CG 3.24Å; A138-L142 PolarHBondContact O-N 2.91Å; A138-L165 HydrophobicContact CB-CD1 4.48Å
139	R	80.4	Confident	79.3	Confident	44 Å²	44	68.5 Å²	68.5	17%	0.166	34%	0.339	C	S	.	.	H	α-helix	trans	-63.5	-41.9	178.5	-168.5	-177.7	-64.9	135.3	16.3	112.1	Y135 D136 A137 L142 K143 D162 L165 S168	Y135-R139 PolarHBondContact O-N 2.83Å; D136-R139 PolarHBondContact O-N 3.24Å; D136-R139 IonicContact OD1-NH1 2.68Å; A137-R139 VanDerWaalsContact C-N 3.3Å; A137-R139 PolarHBondContact O-N 3.44Å; R139-L142 PolarHBondContact O-N 3.48Å; R139-K143 WeakPolarHBondContact O-CG 3.32Å; R139-K143 PolarHBondContact O-N 3.35Å; R139-D162 IonicContact NH2-OD2 2.77Å; R139-L165 HydrophobicContact CB-CD1 4.08Å; R139-L165 VanDerWaalsContact NH2-N 3.14Å; R139-S168 PolarHBondContact NE-OG 3.29Å
140	E	83.5	Confident	79.1	Confident	99 Å²	99	68.6 Å²	68.6	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-68	-42.6	176.6	-65.1	-49.8	124	0	0	111.8	D136 A137 A138 L142 K143 L144	D136-E140 PolarHBondContact O-N 3.48Å; D136-E140 VanDerWaalsContact O-N 3.08Å; A137-E140 PolarHBondContact O-N 3.03Å; A138-E140 PolarHBondContact O-N 3.4Å; E140-L142 VanDerWaalsContact C-N 3.3Å; E140-L142 PolarHBondContact O-N 2.9Å; E140-K143 PolarHBondContact O-N 3.24Å; E140-K143 IonicContact OE1-NZ 3.57Å; E140-K143 PolarHBondContact OE1-NZ 3.05Å; E140-K143 IonicContact OE2-NZ 2.66Å; E140-L144 WeakPolarHBondContact O-CG 3.33Å; E140-L144 PolarHBondContact O-N 3.09Å; E140-L144 VanDerWaalsContact O-N 3.14Å
141	T	80.7	Confident	78.7	Confident	12 Å²	12	69 Å²	69	7%	0.074	34%	0.342	C	S	.	.	H	α-helix	trans	-56.8	-45.7	173.3	-52.5	0	0	0	0	111.2	F122 L125 V126 Q129 A137 A138 K143 L144 S145	F122-T141 HydrophobicContact CB-CG2 4.29Å; F122-T141 HydrophobicContact CD1-CG2 3.5Å; F122-T141 HydrophobicContact CE1-CG2 4.25Å; F122-T141 HydrophobicContact CG-CG2 4.28Å; L125-T141 HydrophobicContact CD2-CG2 3.7Å; L125-T141 HydrophobicContact CG-CG2 4.16Å; V126-T141 HydrophobicContact CG2-CG2 3.57Å; Q129-T141 PolarHBondContact NE2-OG1 3.03Å; Q129-T141 PolarHBondContact OE1-OG1 3.38Å; A137-T141 PolarHBondContact O-N 3.5Å; A137-T141 PolarHBondContact O-OG1 3.31Å; A138-T141 PolarHBondContact O-N 3.39Å; T141-K143 VanDerWaalsContact C-N 3.35Å; T141-K143 PolarHBondContact O-N 3.47Å; T141-L144 WeakPolarHBondContact O-CB 3.45Å; T141-L144 PolarHBondContact O-N 3.17Å; T141-L144 VanDerWaalsContact O-N 3.16Å; T141-S145 PolarHBondContact O-N 3.37Å; T141-S145 PolarHBondContact O-OG 3.23Å
142	L	79.8	Confident	78.4	Confident	16 Å²	16	64.8 Å²	64.8	8%	0.084	32%	0.323	C	S	.	.	H	α-helix	trans	-65.4	-34	179	-76.5	163.6	0	0	0	113.2	V126 A138 R139 E140 L144 S145 I150 L151 A154 L165 L169	V126-L142 HydrophobicContact CG1-CD1 3.97Å; V126-L142 HydrophobicContact CG1-CD2 4.02Å; V126-L142 HydrophobicContact CG1-CG 3.95Å; V126-L142 HydrophobicContact CG2-CD2 4.02Å; V126-L142 HydrophobicContact CG2-CG 3.88Å; A138-L142 VanDerWaalsContact O-CB 3.3Å; A138-L142 WeakPolarHBondContact O-CB 3.38Å; A138-L142 WeakPolarHBondContact O-CD1 3.31Å; A138-L142 WeakPolarHBondContact O-CG 3.24Å; A138-L142 PolarHBondContact O-N 2.91Å; R139-L142 PolarHBondContact O-N 3.48Å; E140-L142 VanDerWaalsContact C-N 3.3Å; E140-L142 PolarHBondContact O-N 2.9Å; L142-L144 VanDerWaalsContact C-N 3.32Å; L142-S145 CarbonylContact O-C 3.57Å; L142-S145 PolarHBondContact O-N 3.33Å; L142-I150 HydrophobicContact CD2-CG2 3.76Å; L142-L151 HydrophobicContact CD2-CD2 3.96Å; L142-A154 HydrophobicContact CD1-CB 4.42Å; L142-A154 HydrophobicContact CD2-CB 4.17Å; L142-L165 HydrophobicContact CD1-CD1 4.16Å; L142-L169 HydrophobicContact CD1-CD1 4.34Å; L142-L169 HydrophobicContact CD1-CD2 3.51Å; L142-L169 HydrophobicContact CD1-CG 4.24Å; L142-L169 HydrophobicContact CD2-CD2 4.28Å; L142-L169 HydrophobicContact CG-CD2 4.38Å
143	K	79.9	Confident	78.2	Confident	128 Å²	128	63.1 Å²	63.1	56%	0.557	32%	0.319	S	S	*	.	H	α-helix	trans	-66.6	-35.2	173.3	-75.1	170.2	-179	172.4	0	112.1	R139 E140 T141	R139-K143 WeakPolarHBondContact O-CG 3.32Å; R139-K143 PolarHBondContact O-N 3.35Å; E140-K143 PolarHBondContact O-N 3.24Å; E140-K143 IonicContact OE1-NZ 3.57Å; E140-K143 PolarHBondContact OE1-NZ 3.05Å; E140-K143 IonicContact OE2-NZ 2.66Å; T141-K143 VanDerWaalsContact C-N 3.35Å; T141-K143 PolarHBondContact O-N 3.47Å
144	L	78.7	Confident	77.9	Confident	131 Å²	131	61.6 Å²	61.6	69%	0.686	30%	0.302	S	S	*	.	H	α-helix	trans	-72.7	-40.6	177.1	-65.6	170.2	0	0	0	111.1	E140 T141 L142 K146	E140-L144 WeakPolarHBondContact O-CG 3.33Å; E140-L144 PolarHBondContact O-N 3.09Å; E140-L144 VanDerWaalsContact O-N 3.14Å; T141-L144 WeakPolarHBondContact O-CB 3.45Å; T141-L144 PolarHBondContact O-N 3.17Å; T141-L144 VanDerWaalsContact O-N 3.16Å; L142-L144 VanDerWaalsContact C-N 3.32Å; L144-K146 PolarHBondContact O-N 3.49Å
145	S	71.8	Confident	77.6	Confident	7 Å²	7	57.7 Å²	57.7	5%	0.049	29%	0.286	C	S	.	.			trans	-86.1	95.6	179.7	72	0	0	0	0	111.4	T141 L142 S147	T141-S145 PolarHBondContact O-N 3.37Å; T141-S145 PolarHBondContact O-OG 3.23Å; L142-S145 CarbonylContact O-C 3.57Å; L142-S145 PolarHBondContact O-N 3.33Å; S145-S147 PolarHBondContact O-N 3.49Å
146	K	69.1	Low	77.1	Confident	204 Å²	204	56.5 Å²	56.5	89%	0.887	29%	0.286	S	S	*	.			trans	-71.5	16	174.3	-62.2	-177	179.4	179.4	0	114.3	L144	L144-K146 PolarHBondContact O-N 3.49Å
147	S	74.8	Confident	76.6	Confident	50 Å²	50	54.5 Å²	54.5	35%	0.35	27%	0.273	S	S	.	.			trans	-85.8	129	-176.4	-172	0	0	0	0	111.2	S145 E149 I150 L151	S145-S147 PolarHBondContact O-N 3.49Å; S147-E149 VanDerWaalsContact C-N 3.27Å; S147-E149 PolarHBondContact O-N 2.97Å; S147-E149 PolarHBondContact OG-N 3.02Å; S147-I150 PolarHBondContact O-N 3.44Å; S147-L151 PolarHBondContact O-N 3Å
148	Q	73.7	Confident	76	Confident	64 Å²	64	52.6 Å²	52.6	30%	0.299	26%	0.257	S	S	.	.	H	α-helix	trans	-63.1	-34.2	175	-168.4	65.4	33.3	0	0	112.1	I150 L151 N152 N172	Q148-I150 VanDerWaalsContact C-N 3.32Å; Q148-I150 PolarHBondContact O-N 3.41Å; Q148-L151 WeakPolarHBondContact O-CB 2.87Å; Q148-L151 PolarHBondContact O-N 3.08Å; Q148-N152 PolarHBondContact NE2-OD1 3.38Å; Q148-N152 WeakPolarHBondContact O-CB 3.37Å; Q148-N152 PolarHBondContact O-N 2.72Å; Q148-N152 PolarHBondContact O-OD1 3.5Å; Q148-N172 PolarHBondContact NE2-O 3.46Å; Q148-N172 VanDerWaalsContact NE2-O 3.11Å; Q148-N172 PolarHBondContact OE1-O 2.93Å
149	E	76.2	Confident	75.3	Confident	122 Å²	122	53.7 Å²	53.7	57%	0.57	26%	0.263	S	S	*	.	H	α-helix	trans	-63.1	-38.9	-178.8	-174.5	179.2	-174.2	0	0	112.1	S147 N152 N153	S147-E149 VanDerWaalsContact C-N 3.27Å; S147-E149 PolarHBondContact O-N 2.97Å; S147-E149 PolarHBondContact OG-N 3.02Å; E149-N152 PolarHBondContact O-N 3.33Å; E149-N153 PolarHBondContact O-N 2.99Å; E149-N153 PolarHBondContact O-ND2 3Å
150	I	77.5	Confident	74.6	Confident	17 Å²	17	56.1 Å²	56.1	9%	0.087	28%	0.279	C	S	.	.	H	α-helix	trans	-69.2	-40.7	178	-60.7	167.3	0	0	0	109.8	F122 L123 V126 L142 S147 Q148 N153 A154	F122-I150 HydrophobicContact CB-CD1 3.49Å; F122-I150 VanDerWaalsContact CB-CD1 3.49Å; F122-I150 HydrophobicContact CD2-CD1 4.44Å; F122-I150 HydrophobicContact CG-CD1 4.42Å; L123-I150 HydrophobicContact CB-CG1 4.37Å; L123-I150 HydrophobicContact CD1-CG1 4.37Å; V126-I150 HydrophobicContact CB-CG2 4.34Å; V126-I150 HydrophobicContact CG2-CG2 3.98Å; L142-I150 HydrophobicContact CD2-CG2 3.76Å; S147-I150 PolarHBondContact O-N 3.44Å; Q148-I150 VanDerWaalsContact C-N 3.32Å; Q148-I150 PolarHBondContact O-N 3.41Å; I150-N153 PolarHBondContact O-N 3.34Å; I150-A154 VanDerWaalsContact O-CB 3.24Å; I150-A154 WeakPolarHBondContact O-CB 3.41Å; I150-A154 PolarHBondContact O-N 3.46Å
151	L	75.1	Confident	73.9	Confident	13 Å²	13	54.5 Å²	54.5	7%	0.068	28%	0.275	C	S	.	.	H	α-helix	trans	-61.3	-47.3	175	-70	165.8	0	0	0	111.1	L142 S147 Q148 N153 A154 V155 L169 N172	L142-L151 HydrophobicContact CD2-CD2 3.96Å; S147-L151 PolarHBondContact O-N 3Å; Q148-L151 WeakPolarHBondContact O-CB 2.87Å; Q148-L151 PolarHBondContact O-N 3.08Å; L151-N153 VanDerWaalsContact C-N 3.31Å; L151-N153 PolarHBondContact O-N 3.29Å; L151-A154 PolarHBondContact O-N 3.16Å; L151-V155 WeakPolarHBondContact O-CG2 3.28Å; L151-V155 PolarHBondContact O-N 2.92Å; L151-L169 HydrophobicContact CD2-CD2 3.43Å; L151-L169 VanDerWaalsContact CD2-CD2 3.43Å; L151-N172 HydrophobicContact CD1-CB 3.63Å; L151-N172 HydrophobicContact CD2-CB 4.42Å
152	N	72.8	Confident	73.4	Confident	14 Å²	14	55.7 Å²	55.7	8%	0.075	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-39.1	-178.8	-69.7	-1	0	0	0	112	Q148 E149 P156 S176 E178 C179	Q148-N152 PolarHBondContact NE2-OD1 3.38Å; Q148-N152 WeakPolarHBondContact O-CB 3.37Å; Q148-N152 PolarHBondContact O-N 2.72Å; Q148-N152 PolarHBondContact O-OD1 3.5Å; E149-N152 PolarHBondContact O-N 3.33Å; N152-P156 WeakPolarHBondContact O-CD 3.36Å; N152-S176 PolarHBondContact ND2-OG 3.2Å; N152-S176 WeakPolarHBondContact OD1-CB 3.2Å; N152-E178 PolarHBondContact ND2-OE2 2.95Å; N152-C179 PolarHBondContact OD1-SG 2.75Å
153	N	75.9	Confident	72.9	Confident	67 Å²	67	60.5 Å²	60.5	36%	0.358	30%	0.301	S	S	.	.	H	α-helix	trans	-75.1	-32.8	176.3	-74.3	-50.2	0	0	0	113.1	L123 E149 I150 L151 P156 H157	L123-N153 HydrophobicContact CD1-CB 3.69Å; L123-N153 WeakPolarHBondContact CD1-ND2 3.45Å; E149-N153 PolarHBondContact O-N 2.99Å; E149-N153 PolarHBondContact O-ND2 3Å; I150-N153 PolarHBondContact O-N 3.34Å; L151-N153 VanDerWaalsContact C-N 3.31Å; L151-N153 PolarHBondContact O-N 3.29Å; N153-P156 WeakPolarHBondContact O-CD 3.46Å; N153-H157 PolarHBondContact O-CD2 3.1Å
154	A	74.6	Confident	72.6	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-71.7	-33.1	178.7	0	0	0	0	0	113.1	V126 I130 L142 I150 L151 H157 A158	V126-A154 HydrophobicContact CG1-CB 3.59Å; I130-A154 HydrophobicContact CD1-CB 4Å; L142-A154 HydrophobicContact CD1-CB 4.42Å; L142-A154 HydrophobicContact CD2-CB 4.17Å; I150-A154 VanDerWaalsContact O-CB 3.24Å; I150-A154 WeakPolarHBondContact O-CB 3.41Å; I150-A154 PolarHBondContact O-N 3.46Å; L151-A154 PolarHBondContact O-N 3.16Å; A154-H157 PolarHBondContact O-N 3.1Å; A154-A158 WeakPolarHBondContact O-CB 3.37Å; A154-A158 PolarHBondContact O-N 3.42Å
155	V	75.1	Confident	72.3	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-58.9	-53.1	-175.3	167.5	0	0	0	0	112.6	L151 H157 A158 I159 L169 A173	L151-V155 WeakPolarHBondContact O-CG2 3.28Å; L151-V155 PolarHBondContact O-N 2.92Å; V155-H157 PolarHBondContact O-N 3.26Å; V155-H157 VanDerWaalsContact O-N 3.13Å; V155-A158 PolarHBondContact O-N 3.41Å; V155-I159 HydrophobicContact CG1-CD1 4.44Å; V155-I159 HydrophobicContact CG1-CG1 4.45Å; V155-I159 VanDerWaalsContact O-CG1 3.29Å; V155-I159 WeakPolarHBondContact O-CG1 3.25Å; V155-I159 PolarHBondContact O-N 3.43Å; V155-I159 VanDerWaalsContact O-N 3.13Å; V155-L169 HydrophobicContact CG2-CB 4.43Å; V155-A173 HydrophobicContact CG2-CB 3.46Å; V155-A173 VanDerWaalsContact CG2-CB 3.46Å
156	P	71.6	Confident	72.4	Confident	41 Å²	41	55.5 Å²	55.5	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-49.3	-40.5	175.9	-26.3	29.8	0	0	0	113.4	N152 N153	N152-P156 WeakPolarHBondContact O-CD 3.36Å; N153-P156 WeakPolarHBondContact O-CD 3.46Å
157	H	71.3	Confident	72.4	Confident	73 Å²	73	48.8 Å²	48.8	34%	0.338	25%	0.25	S	C	.	.	H	α-helix	trans	-76.6	-28	179.7	-59.4	-53.8	0	0	0	113	I130 N153 A154 V155 V161	I130-H157 HydrophobicContact CB-CB 4.37Å; I130-H157 HydrophobicContact CD1-CB 4.19Å; I130-H157 HydrophobicContact CG2-CB 3.76Å; I130-H157 WeakPolarHBondContact CG2-O 3.22Å; N153-H157 PolarHBondContact O-CD2 3.1Å; A154-H157 PolarHBondContact O-N 3.1Å; V155-H157 PolarHBondContact O-N 3.26Å; V155-H157 VanDerWaalsContact O-N 3.13Å; H157-V161 WeakPolarHBondContact O-CG2 3.26Å
158	A	71.8	Confident	72.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-81.5	-23.9	-178.6	0	0	0	0	0	113.9	A154 V155 D160 V161 L165 L169	A154-A158 WeakPolarHBondContact O-CB 3.37Å; A154-A158 PolarHBondContact O-N 3.42Å; V155-A158 PolarHBondContact O-N 3.41Å; A158-D160 VanDerWaalsContact C-N 3.26Å; A158-D160 PolarHBondContact O-N 3.02Å; A158-V161 PolarHBondContact O-N 3.03Å; A158-L165 HydrophobicContact CB-CD2 3.91Å; A158-L165 HydrophobicContact CB-CG 4.23Å; A158-L169 HydrophobicContact CB-CD1 3.59Å
159	I	67.8	Low	72.2	Confident	24 Å²	24	45.7 Å²	45.7	12%	0.123	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-42	-176.1	-68.8	159.7	0	0	0	112.1	V155 L166 S182 I186	V155-I159 HydrophobicContact CG1-CD1 4.44Å; V155-I159 HydrophobicContact CG1-CG1 4.45Å; V155-I159 VanDerWaalsContact O-CG1 3.29Å; V155-I159 WeakPolarHBondContact O-CG1 3.25Å; V155-I159 PolarHBondContact O-N 3.43Å; V155-I159 VanDerWaalsContact O-N 3.13Å; I159-L166 HydrophobicContact CG1-CD1 4.48Å; I159-S182 WeakPolarHBondContact CD1-O 3.19Å; I159-I186 HydrophobicContact CB-CG1 4.13Å; I159-I186 HydrophobicContact CD1-CG1 4.28Å; I159-I186 HydrophobicContact CG1-CD1 3.93Å; I159-I186 HydrophobicContact CG1-CG1 3.63Å; I159-I186 HydrophobicContact CG2-CG1 3.57Å
160	D	65.6	Low	72	Confident	95 Å²	95	40 Å²	40	51%	0.508	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	1.2	-169.1	-69.8	-26.8	0	0	0	113.8	A158 R189	A158-D160 VanDerWaalsContact C-N 3.26Å; A158-D160 PolarHBondContact O-N 3.02Å; D160-R189 VanDerWaalsContact CB-NH1 3.34Å; D160-R189 IonicContact OD1-CZ 3.78Å; D160-R189 IonicContact OD1-NE 2.86Å; D160-R189 IonicContact OD1-NH1 3.68Å; D160-R189 PolarHBondContact OD1-NH1 3Å
161	V	67.7	Low	71.5	Confident	64 Å²	64	41.5 Å²	41.5	39%	0.388	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.5	-61.8	-153.1	-170.6	0	0	0	0	114.1	Y135 H157 A158	Y135-V161 HydrophobicContact CD1-CG1 4.15Å; Y135-V161 HydrophobicContact CE1-CB 4.29Å; Y135-V161 HydrophobicContact CE1-CG1 3.11Å; Y135-V161 HydrophobicContact CE2-CG1 4.16Å; Y135-V161 WeakPolarHBondContact OH-CG1 3.44Å; H157-V161 WeakPolarHBondContact O-CG2 3.26Å; A158-V161 PolarHBondContact O-N 3.03Å
162	D	70.2	Confident	71.2	Confident	38 Å²	38	44.9 Å²	44.9	20%	0.203	24%	0.238	C	C	.	.			trans	-137.7	120.3	-178.6	178.4	49.2	0	0	0	112.9	Y135 R139 K164 L165 L166	Y135-D162 HydrophobicContact CD1-CB 4.28Å; Y135-D162 HydrophobicContact CD2-CB 3.81Å; Y135-D162 HydrophobicContact CE2-CB 4.18Å; Y135-D162 HydrophobicContact CG-CB 3.88Å; R139-D162 IonicContact NH2-OD2 2.77Å; D162-K164 VanDerWaalsContact C-N 3.28Å; D162-K164 PolarHBondContact O-N 3.41Å; D162-K164 WeakPolarHBondContact OD2-CB 3.39Å; D162-K164 PolarHBondContact OD2-N 2.67Å; D162-L165 HydrophobicContact CB-CB 4Å; D162-L165 PolarHBondContact O-N 3.49Å; D162-L165 WeakPolarHBondContact OD2-CB 3.16Å; D162-L165 PolarHBondContact OD2-N 3.5Å; D162-L166 WeakPolarHBondContact O-CB 3.47Å; D162-L166 PolarHBondContact O-N 2.96Å
163	K	69.5	Low	71	Confident	116 Å²	116	44.2 Å²	44.2	50%	0.504	23%	0.234	S	C	.	.	H	α-helix	trans	-62.4	-34	179.8	-69.8	-165.1	175.3	-144.9	0	112.4	T167 E190 Q192	K163-T167 WeakPolarHBondContact O-CB 3.43Å; K163-T167 PolarHBondContact O-N 3.39Å; K163-T167 PolarHBondContact O-OG1 2.96Å; K163-E190 WeakPolarHBondContact CE-OE1 3.19Å; K163-E190 IonicContact NZ-OE1 2.7Å; K163-E190 PolarHBondContact NZ-OE1 3.04Å; K163-Q192 VanDerWaalsContact NZ-OE1 3.12Å
164	K	73.8	Confident	70.4	Confident	149 Å²	149	41.2 Å²	41.2	65%	0.648	22%	0.218	S	C	*	.	H	α-helix	trans	-71	-43.7	-179.5	-63.7	179.1	179.6	174.4	0	110.7	D162 T167 S168	D162-K164 VanDerWaalsContact C-N 3.28Å; D162-K164 PolarHBondContact O-N 3.41Å; D162-K164 WeakPolarHBondContact OD2-CB 3.39Å; D162-K164 PolarHBondContact OD2-N 2.67Å; K164-T167 PolarHBondContact O-N 2.73Å; K164-S168 PolarHBondContact O-N 3.24Å; K164-S168 VanDerWaalsContact O-N 3.1Å; K164-S168 PolarHBondContact O-OG 3.04Å
165	L	72.9	Confident	69.9	Low	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.6	-48.9	174.3	-177.3	63.6	0	0	0	110.4	I130 Y135 A138 R139 L142 A158 D162 T167 S168 L169	I130-L165 HydrophobicContact CD1-CD2 4.14Å; I130-L165 HydrophobicContact CG1-CD2 3.9Å; Y135-L165 HydrophobicContact CD1-CD2 4.24Å; A138-L165 HydrophobicContact CB-CD1 4.48Å; R139-L165 HydrophobicContact CB-CD1 4.08Å; R139-L165 VanDerWaalsContact NH2-N 3.14Å; L142-L165 HydrophobicContact CD1-CD1 4.16Å; A158-L165 HydrophobicContact CB-CD2 3.91Å; A158-L165 HydrophobicContact CB-CG 4.23Å; D162-L165 HydrophobicContact CB-CB 4Å; D162-L165 PolarHBondContact O-N 3.49Å; D162-L165 WeakPolarHBondContact OD2-CB 3.16Å; D162-L165 PolarHBondContact OD2-N 3.5Å; L165-T167 PolarHBondContact O-N 3.38Å; L165-S168 PolarHBondContact O-N 2.96Å; L165-S168 VanDerWaalsContact O-N 3.1Å; L165-S168 PolarHBondContact O-OG 3.03Å; L165-L169 HydrophobicContact CD1-CD1 4.24Å; L165-L169 HydrophobicContact CD1-CG 4.46Å; L165-L169 HydrophobicContact CG-CD1 3.91Å; L165-L169 WeakPolarHBondContact O-CG 3.38Å; L165-L169 PolarHBondContact O-N 3.39Å
166	L	72.5	Confident	69.6	Low	12 Å²	12	46.4 Å²	46.4	6%	0.063	25%	0.246	C	C	.	.	H	α-helix	trans	-58	-46.8	177.8	-173.2	65.2	0	0	0	112	I159 D162 S168 L169 I170 I186	I159-L166 HydrophobicContact CG1-CD1 4.48Å; D162-L166 WeakPolarHBondContact O-CB 3.47Å; D162-L166 PolarHBondContact O-N 2.96Å; L166-S168 PolarHBondContact O-N 3.39Å; L166-L169 PolarHBondContact O-N 3.18Å; L166-I170 HydrophobicContact CD1-CD1 4.39Å; L166-I170 HydrophobicContact CD1-CG1 4.28Å; L166-I170 HydrophobicContact CD2-CD1 4.41Å; L166-I170 HydrophobicContact CG-CD1 3.8Å; L166-I170 HydrophobicContact CG-CG1 4.19Å; L166-I170 WeakPolarHBondContact O-CG1 3.39Å; L166-I170 PolarHBondContact O-N 3.4Å; L166-I186 HydrophobicContact CD1-CD1 3.8Å; L166-I186 HydrophobicContact CD2-CD1 4.01Å; L166-I186 HydrophobicContact CD2-CG1 4.33Å; L166-I186 HydrophobicContact CD2-CG2 4.25Å; L166-I186 HydrophobicContact CG-CD1 4.38Å
167	T	69.7	Low	69.3	Low	63 Å²	63	47 Å²	47	39%	0.387	25%	0.251	S	S	.	.	H	α-helix	trans	-59.5	-34.8	177.4	-56.6	0	0	0	0	112.3	K163 K164 L165 P171 L199	K163-T167 WeakPolarHBondContact O-CB 3.43Å; K163-T167 PolarHBondContact O-N 3.39Å; K163-T167 PolarHBondContact O-OG1 2.96Å; K164-T167 PolarHBondContact O-N 2.73Å; L165-T167 PolarHBondContact O-N 3.38Å; T167-P171 WeakPolarHBondContact O-CD 3.32Å; T167-L199 HydrophobicContact CG2-CD2 3.95Å
168	S	72.1	Confident	69.1	Low	46 Å²	46	50.3 Å²	50.3	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-76.3	-24.8	176	65.7	0	0	0	0	114.2	R139 K164 L165 L166	R139-S168 PolarHBondContact NE-OG 3.29Å; K164-S168 PolarHBondContact O-N 3.24Å; K164-S168 VanDerWaalsContact O-N 3.1Å; K164-S168 PolarHBondContact O-OG 3.04Å; L165-S168 PolarHBondContact O-N 2.96Å; L165-S168 VanDerWaalsContact O-N 3.1Å; L165-S168 PolarHBondContact O-OG 3.03Å; L166-S168 PolarHBondContact O-N 3.39Å
169	L	73.4	Confident	68.8	Low	3 Å²	3	50.3 Å²	50.3	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-86.4	-40.5	-177.7	-79.1	175.2	0	0	0	112.9	L142 L151 V155 A158 L165 L166 P171 N172 A173	L142-L169 HydrophobicContact CD1-CD1 4.34Å; L142-L169 HydrophobicContact CD1-CD2 3.51Å; L142-L169 HydrophobicContact CD1-CG 4.24Å; L142-L169 HydrophobicContact CD2-CD2 4.28Å; L142-L169 HydrophobicContact CG-CD2 4.38Å; L151-L169 HydrophobicContact CD2-CD2 3.43Å; L151-L169 VanDerWaalsContact CD2-CD2 3.43Å; V155-L169 HydrophobicContact CG2-CB 4.43Å; A158-L169 HydrophobicContact CB-CD1 3.59Å; L165-L169 HydrophobicContact CD1-CD1 4.24Å; L165-L169 HydrophobicContact CD1-CG 4.46Å; L165-L169 HydrophobicContact CG-CD1 3.91Å; L165-L169 WeakPolarHBondContact O-CG 3.38Å; L165-L169 PolarHBondContact O-N 3.39Å; L166-L169 PolarHBondContact O-N 3.18Å; L169-P171 VanDerWaalsContact C-CD 3.45Å; L169-N172 PolarHBondContact O-N 3.13Å; L169-N172 VanDerWaalsContact O-N 3.11Å; L169-A173 WeakPolarHBondContact O-CB 3.2Å; L169-A173 PolarHBondContact O-N 3.37Å
170	I	70.7	Confident	68.8	Low	4 Å²	4	50.3 Å²	50.3	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-44.8	-50.9	-175.4	-79.8	165.9	0	0	0	112.7	L166 N172 A173 I174 F183 L199 I200	L166-I170 HydrophobicContact CD1-CD1 4.39Å; L166-I170 HydrophobicContact CD1-CG1 4.28Å; L166-I170 HydrophobicContact CD2-CD1 4.41Å; L166-I170 HydrophobicContact CG-CD1 3.8Å; L166-I170 HydrophobicContact CG-CG1 4.19Å; L166-I170 WeakPolarHBondContact O-CG1 3.39Å; L166-I170 PolarHBondContact O-N 3.4Å; I170-N172 VanDerWaalsContact C-N 3.27Å; I170-N172 PolarHBondContact O-N 3.32Å; I170-A173 PolarHBondContact O-N 3.28Å; I170-I174 HydrophobicContact CB-CD1 4.49Å; I170-I174 HydrophobicContact CG2-CD1 3.35Å; I170-I174 HydrophobicContact CG2-CG1 4.19Å; I170-I174 WeakPolarHBondContact O-CD1 3.41Å; I170-I174 WeakPolarHBondContact O-CG1 3.26Å; I170-I174 PolarHBondContact O-N 2.91Å; I170-I174 VanDerWaalsContact O-N 3.1Å; I170-F183 HydrophobicContact CG1-CE1 3.91Å; I170-L199 HydrophobicContact CD1-CB 4.33Å; I170-I200 HydrophobicContact CG2-CG1 4.41Å
171	P	67.8	Low	68.9	Low	47 Å²	47	48.3 Å²	48.3	31%	0.305	26%	0.264	S	S	.	.	H	α-helix	trans	-60	-33.6	-175.5	-22.1	31	0	0	0	114.9	T167 L169	T167-P171 WeakPolarHBondContact O-CD 3.32Å; L169-P171 VanDerWaalsContact C-CD 3.45Å
172	N	68.4	Low	68.9	Low	85 Å²	85	45.8 Å²	45.8	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-91.7	-32	-178	-59.7	-39.1	0	0	0	111.7	Q148 L151 L169 I170	Q148-N172 PolarHBondContact NE2-O 3.46Å; Q148-N172 VanDerWaalsContact NE2-O 3.11Å; Q148-N172 PolarHBondContact OE1-O 2.93Å; L151-N172 HydrophobicContact CD1-CB 3.63Å; L151-N172 HydrophobicContact CD2-CB 4.42Å; L169-N172 PolarHBondContact O-N 3.13Å; L169-N172 VanDerWaalsContact O-N 3.11Å; I170-N172 VanDerWaalsContact C-N 3.27Å; I170-N172 PolarHBondContact O-N 3.32Å
173	A	67.7	Low	68.8	Low	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-76.3	-31.3	-177.7	0	0	0	0	0	113.8	V155 L169 I170 L175 S176 F183	V155-A173 HydrophobicContact CG2-CB 3.46Å; V155-A173 VanDerWaalsContact CG2-CB 3.46Å; L169-A173 WeakPolarHBondContact O-CB 3.2Å; L169-A173 PolarHBondContact O-N 3.37Å; I170-A173 PolarHBondContact O-N 3.28Å; A173-L175 PolarHBondContact O-N 2.78Å; A173-L175 VanDerWaalsContact O-N 3.15Å; A173-S176 PolarHBondContact O-N 3.22Å; A173-S176 VanDerWaalsContact O-N 3.13Å; A173-F183 HydrophobicContact CB-CE2 4.43Å; A173-F183 HydrophobicContact CB-CZ 3.78Å
174	I	64.5	Low	68.6	Low	4 Å²	4	41.5 Å²	41.5	2%	0.021	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.2	-179.3	-64.4	160.8	0	0	0	112.4	I170 S176 F183 I200 L204 I214	I170-I174 HydrophobicContact CB-CD1 4.49Å; I170-I174 HydrophobicContact CG2-CD1 3.35Å; I170-I174 HydrophobicContact CG2-CG1 4.19Å; I170-I174 WeakPolarHBondContact O-CD1 3.41Å; I170-I174 WeakPolarHBondContact O-CG1 3.26Å; I170-I174 PolarHBondContact O-N 2.91Å; I170-I174 VanDerWaalsContact O-N 3.1Å; I174-S176 PolarHBondContact O-N 3.03Å; I174-S176 VanDerWaalsContact O-N 3.11Å; I174-F183 HydrophobicContact CB-CE2 4.23Å; I174-F183 HydrophobicContact CB-CZ 4.42Å; I174-F183 HydrophobicContact CG1-CD2 4.28Å; I174-F183 HydrophobicContact CG1-CE1 4.03Å; I174-F183 HydrophobicContact CG1-CE2 3.61Å; I174-F183 HydrophobicContact CG1-CZ 3.5Å; I174-F183 VanDerWaalsContact CG1-CZ 3.5Å; I174-I200 HydrophobicContact CD1-CB 4.01Å; I174-I200 HydrophobicContact CD1-CG1 4.06Å; I174-I200 HydrophobicContact CD1-CG2 3.77Å; I174-I200 HydrophobicContact CG1-CG2 4.49Å; I174-L204 HydrophobicContact CB-CD2 4.25Å; I174-L204 HydrophobicContact CD1-CG 4.37Å; I174-L204 HydrophobicContact CG2-CD1 4.16Å; I174-L204 HydrophobicContact CG2-CD2 3.31Å; I174-L204 HydrophobicContact CG2-CG 3.82Å; I174-I214 HydrophobicContact CG2-CG2 4.4Å; I174-I214 VanDerWaalsContact O-CD1 3.24Å; I174-I214 WeakPolarHBondContact O-CD1 3.25Å
175	L	64.2	Low	68.2	Low	95 Å²	95	38.1 Å²	38.1	50%	0.497	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-12	177.9	-59.8	175.1	0	0	0	113.4	A173 F207	A173-L175 PolarHBondContact O-N 2.78Å; A173-L175 VanDerWaalsContact O-N 3.15Å; L175-F207 HydrophobicContact CD2-CB 4.25Å
176	S	67.8	Low	67.8	Low	15 Å²	15	38.3 Å²	38.3	11%	0.105	21%	0.212	C	C	.	.	S	Bend	trans	-108.8	127.4	176.2	-176.8	0	0	0	0	111.3	N152 A173 I174 E178 C179	N152-S176 PolarHBondContact ND2-OG 3.2Å; N152-S176 WeakPolarHBondContact OD1-CB 3.2Å; A173-S176 PolarHBondContact O-N 3.22Å; A173-S176 VanDerWaalsContact O-N 3.13Å; I174-S176 PolarHBondContact O-N 3.03Å; I174-S176 VanDerWaalsContact O-N 3.11Å; S176-E178 PolarHBondContact O-N 3.46Å; S176-E178 PolarHBondContact OG-N 3.29Å; S176-C179 PolarHBondContact O-N 2.85Å
177	S	66.1	Low	67.3	Low	54 Å²	54	38.4 Å²	38.4	38%	0.378	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-59.9	-22.8	173.8	55.3	0	0	0	0	113.2	C179 L180	S177-C179 PolarHBondContact O-N 2.96Å; S177-L180 WeakPolarHBondContact O-CB 3.27Å; S177-L180 VanDerWaalsContact O-CG 3.22Å; S177-L180 WeakPolarHBondContact O-CG 3Å; S177-L180 PolarHBondContact O-N 3.33Å
178	E	66.4	Low	67.1	Low	142 Å²	142	40.8 Å²	40.8	66%	0.664	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-63.9	-26.2	178.6	-61.5	177.2	-180	0	0	112.7	N152 S176	N152-E178 PolarHBondContact ND2-OE2 2.95Å; S176-E178 PolarHBondContact O-N 3.46Å; S176-E178 PolarHBondContact OG-N 3.29Å
179	C	66.8	Low	66.5	Low	1 Å²	1	46.6 Å²	46.6	1%	0.007	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-86.9	-4.8	-179.7	-70.3	0	0	0	0	113.7	N152 S176 S177 A181 S182 F183	N152-C179 PolarHBondContact OD1-SG 2.75Å; S176-C179 PolarHBondContact O-N 2.85Å; S177-C179 PolarHBondContact O-N 2.96Å; C179-A181 VanDerWaalsContact C-N 3.33Å; C179-A181 PolarHBondContact O-N 3.09Å; C179-S182 WeakPolarHBondContact O-CA 3.09Å; C179-S182 VanDerWaalsContact O-CB 3.26Å; C179-S182 WeakPolarHBondContact O-CB 3.3Å; C179-S182 PolarHBondContact O-N 3.43Å; C179-S182 VanDerWaalsContact O-N 3.11Å; C179-F183 HydrophobicContact CB-CD2 3.8Å; C179-F183 HydrophobicContact CB-CE2 3.28Å; C179-F183 HydrophobicContact CB-CZ 4.06Å; C179-F183 WeakPolarHBondContact O-CD2 3.42Å; C179-F183 PolarHBondContact O-N 2.06Å
180	L	67.4	Low	65.7	Low	23 Å²	23	48.5 Å²	48.5	12%	0.12	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-40.7	-174.6	-65.1	173.6	0	0	0	112.4	S177 S182 F183 Y184 L213 I214 F217	S177-L180 WeakPolarHBondContact O-CB 3.27Å; S177-L180 VanDerWaalsContact O-CG 3.22Å; S177-L180 WeakPolarHBondContact O-CG 3Å; S177-L180 PolarHBondContact O-N 3.33Å; L180-S182 VanDerWaalsContact C-N 3.32Å; L180-S182 PolarHBondContact O-N 3.18Å; L180-F183 PolarHBondContact O-N 3.19Å; L180-Y184 WeakPolarHBondContact O-CB 3.21Å; L180-Y184 PolarHBondContact O-N 3.3Å; L180-L213 HydrophobicContact CD1-CB 4.27Å; L180-I214 HydrophobicContact CD2-CG1 4.4Å; L180-F217 HydrophobicContact CB-CD2 4.4Å; L180-F217 HydrophobicContact CB-CG 4.45Å; L180-F217 HydrophobicContact CD1-CB 4.41Å; L180-F217 HydrophobicContact CD2-CB 4Å; L180-F217 HydrophobicContact CD2-CD1 3.46Å; L180-F217 VanDerWaalsContact CD2-CD1 3.46Å; L180-F217 HydrophobicContact CD2-CD2 4.49Å; L180-F217 HydrophobicContact CD2-CE1 3.96Å; L180-F217 HydrophobicContact CD2-CG 3.74Å; L180-F217 WeakPolarHBondContact O-CZ 3.5Å
181	A	67.6	Low	65	Low	53 Å²	53	58.6 Å²	58.6	44%	0.438	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-38.7	177.2	0	0	0	0	0	112.1	C179 Y184 R185	C179-A181 VanDerWaalsContact C-N 3.33Å; C179-A181 PolarHBondContact O-N 3.09Å; A181-Y184 WeakPolarHBondContact O-CB 3.24Å; A181-Y184 PolarHBondContact O-N 3.27Å; A181-R185 PolarHBondContact O-N 2.94Å
182	S	66.7	Low	64.4	Low	11 Å²	11	60.8 Å²	60.8	8%	0.077	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-45.3	173.2	-78.6	0	0	0	0	111.8	I159 C179 L180 Y184 R185 I186	I159-S182 WeakPolarHBondContact CD1-O 3.19Å; C179-S182 WeakPolarHBondContact O-CA 3.09Å; C179-S182 VanDerWaalsContact O-CB 3.26Å; C179-S182 WeakPolarHBondContact O-CB 3.3Å; C179-S182 PolarHBondContact O-N 3.43Å; C179-S182 VanDerWaalsContact O-N 3.11Å; L180-S182 VanDerWaalsContact C-N 3.32Å; L180-S182 PolarHBondContact O-N 3.18Å; S182-Y184 VanDerWaalsContact C-N 3.31Å; S182-Y184 PolarHBondContact O-N 3.45Å; S182-R185 WeakPolarHBondContact O-CB 3.2Å; S182-R185 PolarHBondContact O-N 2.8Å; S182-I186 PolarHBondContact O-N 3.32Å
183	F	68.1	Low	64	Low	2 Å²	2	60.2 Å²	60.2	1%	0.009	29%	0.29	C	S	.	.	H	α-helix	trans	-64.6	-36.2	176.3	-68.4	-59.1	0	0	0	113	I170 A173 I174 C179 L180 R185 I186 L187 I200 F217	I170-F183 HydrophobicContact CG1-CE1 3.91Å; A173-F183 HydrophobicContact CB-CE2 4.43Å; A173-F183 HydrophobicContact CB-CZ 3.78Å; I174-F183 HydrophobicContact CB-CE2 4.23Å; I174-F183 HydrophobicContact CB-CZ 4.42Å; I174-F183 HydrophobicContact CG1-CD2 4.28Å; I174-F183 HydrophobicContact CG1-CE1 4.03Å; I174-F183 HydrophobicContact CG1-CE2 3.61Å; I174-F183 HydrophobicContact CG1-CZ 3.5Å; I174-F183 VanDerWaalsContact CG1-CZ 3.5Å; C179-F183 HydrophobicContact CB-CD2 3.8Å; C179-F183 HydrophobicContact CB-CE2 3.28Å; C179-F183 HydrophobicContact CB-CZ 4.06Å; C179-F183 WeakPolarHBondContact O-CD2 3.42Å; C179-F183 PolarHBondContact O-N 2.06Å; L180-F183 PolarHBondContact O-N 3.19Å; F183-R185 VanDerWaalsContact C-N 3.26Å; F183-R185 PolarHBondContact O-N 2.93Å; F183-I186 HydrophobicContact CD1-CD1 3.71Å; F183-I186 HydrophobicContact CE1-CD1 4.28Å; F183-I186 WeakPolarHBondContact O-CB 3.48Å; F183-I186 PolarHBondContact O-N 3.21Å; F183-L187 PolarHBondContact O-N 2.89Å; F183-I200 HydrophobicContact CB-CD1 4.5Å; F183-I200 HydrophobicContact CD1-CD1 4.43Å; F183-F217 HydrophobicContact CB-CE1 3.93Å; F183-F217 HydrophobicContact CB-CZ 3.92Å
184	Y	66	Low	63.5	Low	62 Å²	62	62.8 Å²	62.8	24%	0.243	30%	0.304	C	S	.	.	H	α-helix	trans	-60.1	-38.4	175.4	-173.3	-108.7	0	0	0	111.8	L180 A181 S182 L187 L188 F217 L221 K224	L180-Y184 WeakPolarHBondContact O-CB 3.21Å; L180-Y184 PolarHBondContact O-N 3.3Å; A181-Y184 WeakPolarHBondContact O-CB 3.24Å; A181-Y184 PolarHBondContact O-N 3.27Å; S182-Y184 VanDerWaalsContact C-N 3.31Å; S182-Y184 PolarHBondContact O-N 3.45Å; Y184-L187 PolarHBondContact O-N 3.15Å; Y184-L188 HydrophobicContact CD1-CD1 3.81Å; Y184-L188 HydrophobicContact CD1-CG 4.32Å; Y184-L188 HydrophobicContact CE1-CD1 3.35Å; Y184-L188 HydrophobicContact CE1-CD2 4.4Å; Y184-L188 HydrophobicContact CE1-CG 3.93Å; Y184-L188 PolarHBondContact O-N 3.04Å; Y184-F217 HydrophobicContact CD2-CE2 4.05Å; Y184-F217 HydrophobicContact CG-CE2 4.36Å; Y184-L221 HydrophobicContact CD2-CD2 3.86Å; Y184-L221 HydrophobicContact CE2-CD2 4.39Å; Y184-K224 HydrophobicContact CE2-CD 4.35Å; Y184-K224 PolarHBondContact OH-NZ 3.13Å
185	R	65.6	Low	63.4	Low	78 Å²	78	66.9 Å²	66.9	29%	0.294	33%	0.326	S	S	.	.	H	α-helix	trans	-65.2	-40.7	176.3	-73.5	178.1	169.5	-144.5	-12.7	113.6	A181 S182 F183 L187 L188 R189 H381	A181-R185 PolarHBondContact O-N 2.94Å; S182-R185 WeakPolarHBondContact O-CB 3.2Å; S182-R185 PolarHBondContact O-N 2.8Å; F183-R185 VanDerWaalsContact C-N 3.26Å; F183-R185 PolarHBondContact O-N 2.93Å; R185-L187 PolarHBondContact O-N 3.13Å; R185-L188 PolarHBondContact O-N 3.48Å; R185-R189 WeakPolarHBondContact O-CB 3.35Å; R185-R189 PolarHBondContact O-N 2.61Å; R185-R189 VanDerWaalsContact O-N 3.1Å; R185-H381 PolarHBondContact NH1-ND1 2.94Å; R185-H381 VanDerWaalsContact NH2-CB 3.32Å; R185-H381 PolarHBondContact NH2-ND1 3.44Å; R185-H381 PolarHBondContact NH2-O 2.97Å
186	I	65.5	Low	63.2	Low	5 Å²	5	62.5 Å²	62.5	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-55.2	-45.6	175.5	-61.3	163.8	0	0	0	109.3	I159 L166 S182 F183 R189 E190	I159-I186 HydrophobicContact CB-CG1 4.13Å; I159-I186 HydrophobicContact CD1-CG1 4.28Å; I159-I186 HydrophobicContact CG1-CD1 3.93Å; I159-I186 HydrophobicContact CG1-CG1 3.63Å; I159-I186 HydrophobicContact CG2-CG1 3.57Å; L166-I186 HydrophobicContact CD1-CD1 3.8Å; L166-I186 HydrophobicContact CD2-CD1 4.01Å; L166-I186 HydrophobicContact CD2-CG1 4.33Å; L166-I186 HydrophobicContact CD2-CG2 4.25Å; L166-I186 HydrophobicContact CG-CD1 4.38Å; S182-I186 PolarHBondContact O-N 3.32Å; F183-I186 HydrophobicContact CD1-CD1 3.71Å; F183-I186 HydrophobicContact CE1-CD1 4.28Å; F183-I186 WeakPolarHBondContact O-CB 3.48Å; F183-I186 PolarHBondContact O-N 3.21Å; I186-R189 PolarHBondContact O-N 3.42Å; I186-E190 PolarHBondContact O-N 2.94Å
187	L	61.8	Low	63	Low	13 Å²	13	62 Å²	62	7%	0.068	30%	0.299	C	S	.	.	H	α-helix	trans	-71.8	-32.2	-176.2	-68.9	166.1	0	0	0	113.3	F183 Y184 R185 R189 E193 L197 I200 L221	F183-L187 PolarHBondContact O-N 2.89Å; Y184-L187 PolarHBondContact O-N 3.15Å; R185-L187 PolarHBondContact O-N 3.13Å; L187-R189 VanDerWaalsContact C-N 3.33Å; L187-E193 WeakPolarHBondContact CD2-O 3.43Å; L187-L197 HydrophobicContact CD1-CD2 4.46Å; L187-L197 HydrophobicContact CD1-CG 4.28Å; L187-L197 HydrophobicContact CD2-CD1 4.25Å; L187-L197 HydrophobicContact CD2-CG 3.79Å; L187-I200 HydrophobicContact CD1-CD1 4.08Å; L187-L221 HydrophobicContact CB-CD2 4.46Å; L187-L221 HydrophobicContact CD1-CB 4.34Å; L187-L221 HydrophobicContact CD1-CD1 3.17Å; L187-L221 HydrophobicContact CD1-CD2 3.3Å; L187-L221 HydrophobicContact CD1-CG 3.72Å; L187-L221 HydrophobicContact CG-CD2 4.49Å
188	L	63.6	Low	62.9	Low	114 Å²	114	60.7 Å²	60.7	60%	0.597	29%	0.294	S	S	*	.	H	α-helix	trans	-69.5	-30.2	172.4	-73.8	177.3	0	0	0	113	Y184 R185	Y184-L188 HydrophobicContact CD1-CD1 3.81Å; Y184-L188 HydrophobicContact CD1-CG 4.32Å; Y184-L188 HydrophobicContact CE1-CD1 3.35Å; Y184-L188 HydrophobicContact CE1-CD2 4.4Å; Y184-L188 HydrophobicContact CE1-CG 3.93Å; Y184-L188 PolarHBondContact O-N 3.04Å; R185-L188 PolarHBondContact O-N 3.48Å
189	R	61.4	Low	62.7	Low	167 Å²	167	57 Å²	57	63%	0.63	28%	0.278	S	S	*	.	H	α-helix	trans	-89.4	-33.1	-172.1	-157	177.1	-171.5	-150.6	-2.5	112.6	D160 R185 I186 L187	D160-R189 VanDerWaalsContact CB-NH1 3.34Å; D160-R189 IonicContact OD1-CZ 3.78Å; D160-R189 IonicContact OD1-NE 2.86Å; D160-R189 IonicContact OD1-NH1 3.68Å; D160-R189 PolarHBondContact OD1-NH1 3Å; R185-R189 WeakPolarHBondContact O-CB 3.35Å; R185-R189 PolarHBondContact O-N 2.61Å; R185-R189 VanDerWaalsContact O-N 3.1Å; I186-R189 PolarHBondContact O-N 3.42Å; L187-R189 VanDerWaalsContact C-N 3.33Å
190	E	56.5	Low	62.6	Low	43 Å²	43	57.1 Å²	57.1	20%	0.201	28%	0.279	C	S	.	.			trans	-89.5	118.4	-177.7	-66.1	-161.9	130	0	0	111.6	K163 I186 Q192 E193 S196	K163-E190 WeakPolarHBondContact CE-OE1 3.19Å; K163-E190 IonicContact NZ-OE1 2.7Å; K163-E190 PolarHBondContact NZ-OE1 3.04Å; I186-E190 PolarHBondContact O-N 2.94Å; E190-Q192 HydrophobicContact CB-CB 4.37Å; E190-Q192 PolarHBondContact O-N 2.97Å; E190-E193 PolarHBondContact O-N 3.32Å; E190-S196 PolarHBondContact OE2-OG 3.12Å
191	K	54.5	Low	62.4	Low	216 Å²	216	56.9 Å²	56.9	94%	0.939	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	0.3	159.5	-69.5	-177.6	176.6	179.8	0	113.6
192	Q	56	Low	62.3	Low	93 Å²	93	57.1 Å²	57.1	44%	0.435	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	42.3	176.6	-62.5	-174.3	-44.2	0	0	110.9	K163 E190 L194 D195 S196	K163-Q192 VanDerWaalsContact NZ-OE1 3.12Å; E190-Q192 HydrophobicContact CB-CB 4.37Å; E190-Q192 PolarHBondContact O-N 2.97Å; Q192-L194 PolarHBondContact O-N 3.39Å; Q192-D195 HydrophobicContact CB-CB 4.26Å; Q192-D195 PolarHBondContact O-N 3.19Å; Q192-S196 PolarHBondContact O-N 3.11Å; Q192-S196 PolarHBondContact O-OG 3.1Å
193	E	61.1	Low	62	Low	74 Å²	74	58.6 Å²	58.6	35%	0.346	30%	0.296	S	S	.	.	H	α-helix	trans	-43.2	-37.6	179.7	-61.5	176.6	174.8	0	0	113.2	L187 E190 L197 I225	L187-E193 WeakPolarHBondContact CD2-O 3.43Å; E190-E193 PolarHBondContact O-N 3.32Å; E193-L197 VanDerWaalsContact O-CB 3.26Å; E193-L197 WeakPolarHBondContact O-CB 3.27Å; E193-L197 WeakPolarHBondContact O-CG 3.49Å; E193-L197 PolarHBondContact O-N 3.2Å; E193-I225 HydrophobicContact CB-CG1 4.49Å
194	L	56.6	Low	61.6	Low	54 Å²	54	58.8 Å²	58.8	28%	0.283	30%	0.298	S	S	.	.	H	α-helix	trans	-75.4	-28.9	-177.7	-72.6	167.1	0	0	0	114.6	Q192 G198 I225 T231	Q192-L194 PolarHBondContact O-N 3.39Å; L194-G198 PolarHBondContact O-N 3Å; L194-I225 HydrophobicContact CD2-CD1 4.03Å; L194-I225 HydrophobicContact CD2-CG2 4.1Å; L194-I225 HydrophobicContact CG-CG2 4.4Å; L194-T231 HydrophobicContact CD2-CG2 4.3Å
195	D	61.4	Low	61.2	Low	90 Å²	90	58.1 Å²	58.1	48%	0.481	31%	0.31	S	S	.	.	H	α-helix	trans	-79	-43.6	179.4	-70.2	-22.1	0	0	0	109.5	Q192 L197 G198 L199	Q192-D195 HydrophobicContact CB-CB 4.26Å; Q192-D195 PolarHBondContact O-N 3.19Å; D195-L197 VanDerWaalsContact C-N 3.33Å; D195-L197 PolarHBondContact O-N 3.38Å; D195-G198 PolarHBondContact O-N 2.86Å; D195-L199 WeakPolarHBondContact O-CB 3.44Å; D195-L199 VanDerWaalsContact O-CG 3.29Å; D195-L199 WeakPolarHBondContact O-CG 3.2Å; D195-L199 PolarHBondContact O-N 3.44Å
196	S	60.6	Low	60.5	Low	3 Å²	3	62.6 Å²	62.6	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-65	-38.4	174.5	-9.2	0	0	0	0	110.7	E190 Q192 L199 I200	E190-S196 PolarHBondContact OE2-OG 3.12Å; Q192-S196 PolarHBondContact O-N 3.11Å; Q192-S196 PolarHBondContact O-OG 3.1Å; S196-L199 PolarHBondContact O-N 3.42Å; S196-I200 WeakPolarHBondContact O-CB 3.46Å; S196-I200 WeakPolarHBondContact O-CD1 3.36Å; S196-I200 WeakPolarHBondContact O-CG1 3.28Å; S196-I200 PolarHBondContact O-N 3.46Å
197	L	64.1	Low	59.9	Low	4 Å²	4	69.2 Å²	69.2	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-68.8	-36	170.4	-88.8	164.3	0	0	0	113.8	L187 E193 D195 L199 I200 T201 L221 Y222 I225	L187-L197 HydrophobicContact CD1-CD2 4.46Å; L187-L197 HydrophobicContact CD1-CG 4.28Å; L187-L197 HydrophobicContact CD2-CD1 4.25Å; L187-L197 HydrophobicContact CD2-CG 3.79Å; E193-L197 VanDerWaalsContact O-CB 3.26Å; E193-L197 WeakPolarHBondContact O-CB 3.27Å; E193-L197 WeakPolarHBondContact O-CG 3.49Å; E193-L197 PolarHBondContact O-N 3.2Å; D195-L197 VanDerWaalsContact C-N 3.33Å; D195-L197 PolarHBondContact O-N 3.38Å; L197-L199 VanDerWaalsContact C-N 3.31Å; L197-I200 PolarHBondContact O-N 3.06Å; L197-T201 VanDerWaalsContact O-CB 3.3Å; L197-T201 WeakPolarHBondContact O-CB 3.39Å; L197-T201 VanDerWaalsContact O-CG2 3.3Å; L197-T201 WeakPolarHBondContact O-CG2 3.38Å; L197-T201 PolarHBondContact O-N 3.39Å; L197-T201 PolarHBondContact O-OG1 3.38Å; L197-L221 HydrophobicContact CD1-CB 4.41Å; L197-L221 HydrophobicContact CD2-CB 3.95Å; L197-L221 HydrophobicContact CD2-CD1 3.86Å; L197-Y222 HydrophobicContact CD2-CD2 4.3Å; L197-Y222 HydrophobicContact CD2-CE2 4.05Å; L197-I225 HydrophobicContact CD1-CD1 3.01Å; L197-I225 HydrophobicContact CD1-CG1 3.73Å; L197-I225 HydrophobicContact CG-CD1 4.44Å
198	G	63.5	Low	59.5	Low	26 Å²	26	68.6 Å²	68.6	27%	0.268	36%	0.357	S	S	.	.	H	α-helix	trans	-62.2	-41.1	173.2	0	0	0	0	0	111.7	L194 D195 T201 G202	L194-G198 PolarHBondContact O-N 3Å; D195-G198 PolarHBondContact O-N 2.86Å; G198-T201 PolarHBondContact O-OG1 3.11Å; G198-G202 WeakPolarHBondContact O-CA 3.16Å; G198-G202 PolarHBondContact O-N 3.21Å
199	L	63.1	Low	59.1	Low	65 Å²	65	68.1 Å²	68.1	34%	0.34	35%	0.347	S	S	.	.	H	α-helix	trans	-64.8	-47	173.7	-73	168.7	0	0	0	111.2	T167 I170 D195 S196 L197 S203	T167-L199 HydrophobicContact CG2-CD2 3.95Å; I170-L199 HydrophobicContact CD1-CB 4.33Å; D195-L199 WeakPolarHBondContact O-CB 3.44Å; D195-L199 VanDerWaalsContact O-CG 3.29Å; D195-L199 WeakPolarHBondContact O-CG 3.2Å; D195-L199 PolarHBondContact O-N 3.44Å; S196-L199 PolarHBondContact O-N 3.42Å; L197-L199 VanDerWaalsContact C-N 3.31Å; L199-S203 WeakPolarHBondContact O-CB 3.39Å; L199-S203 PolarHBondContact O-N 2.93Å; L199-S203 PolarHBondContact O-OG 2.95Å
200	I	64.1	Low	59	Low	3 Å²	3	69.6 Å²	69.6	2%	0.015	35%	0.353	C	S	.	.	H	α-helix	trans	-61.4	-52.6	178.2	-69.3	162.5	0	0	0	110.2	I170 I174 F183 L187 S196 L197 S203 L204 L218	I170-I200 HydrophobicContact CG2-CG1 4.41Å; I174-I200 HydrophobicContact CD1-CB 4.01Å; I174-I200 HydrophobicContact CD1-CG1 4.06Å; I174-I200 HydrophobicContact CD1-CG2 3.77Å; I174-I200 HydrophobicContact CG1-CG2 4.49Å; F183-I200 HydrophobicContact CB-CD1 4.5Å; F183-I200 HydrophobicContact CD1-CD1 4.43Å; L187-I200 HydrophobicContact CD1-CD1 4.08Å; S196-I200 WeakPolarHBondContact O-CB 3.46Å; S196-I200 WeakPolarHBondContact O-CD1 3.36Å; S196-I200 WeakPolarHBondContact O-CG1 3.28Å; S196-I200 PolarHBondContact O-N 3.46Å; L197-I200 PolarHBondContact O-N 3.06Å; I200-S203 PolarHBondContact O-N 3.04Å; I200-L204 HydrophobicContact CG2-CD1 3.82Å; I200-L204 WeakPolarHBondContact O-CB 3.48Å; I200-L204 WeakPolarHBondContact O-CD1 3.46Å; I200-L204 WeakPolarHBondContact O-CG 3.29Å; I200-L204 PolarHBondContact O-N 3.39Å; I200-L218 HydrophobicContact CG2-CD2 3.78Å
201	T	63.7	Low	59.4	Low	19 Å²	19	70.1 Å²	70.1	12%	0.117	36%	0.357	C	S	.	.	H	α-helix	trans	-69.6	-35.7	-177.4	56.1	0	0	0	0	113.9	L197 G198 L218 Y222 A238	L197-T201 VanDerWaalsContact O-CB 3.3Å; L197-T201 WeakPolarHBondContact O-CB 3.39Å; L197-T201 VanDerWaalsContact O-CG2 3.3Å; L197-T201 WeakPolarHBondContact O-CG2 3.38Å; L197-T201 PolarHBondContact O-N 3.39Å; L197-T201 PolarHBondContact O-OG1 3.38Å; G198-T201 PolarHBondContact O-OG1 3.11Å; T201-L218 HydrophobicContact CG2-CD2 4.25Å; T201-Y222 HydrophobicContact CG2-CE2 3.68Å; T201-Y222 WeakPolarHBondContact CG2-OH 2.97Å; T201-A238 HydrophobicContact CG2-CB 4.02Å
202	G	64	Low	60.2	Low	58 Å²	58	65 Å²	65	60%	0.598	33%	0.331	S	S	*	.	H	α-helix	trans	-68.1	-38	174.8	0	0	0	0	0	112.5	G198	G198-G202 WeakPolarHBondContact O-CA 3.16Å; G198-G202 PolarHBondContact O-N 3.21Å
203	S	61.2	Low	60.8	Low	42 Å²	42	64.5 Å²	64.5	29%	0.294	33%	0.332	S	S	.	.	H	α-helix	trans	-75	-27.6	179.4	-53.8	0	0	0	0	112.9	L199 I200 G205	L199-S203 WeakPolarHBondContact O-CB 3.39Å; L199-S203 PolarHBondContact O-N 2.93Å; L199-S203 PolarHBondContact O-OG 2.95Å; I200-S203 PolarHBondContact O-N 3.04Å; S203-G205 VanDerWaalsContact C-N 3.27Å; S203-G205 PolarHBondContact O-N 3.27Å
204	L	60.1	Low	61.1	Low	6 Å²	6	61.4 Å²	61.4	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-66.8	-25.8	179.6	-88.5	169.4	0	0	0	114	I174 I200 F207 A208 I214 L218	I174-L204 HydrophobicContact CB-CD2 4.25Å; I174-L204 HydrophobicContact CD1-CG 4.37Å; I174-L204 HydrophobicContact CG2-CD1 4.16Å; I174-L204 HydrophobicContact CG2-CD2 3.31Å; I174-L204 HydrophobicContact CG2-CG 3.82Å; I200-L204 HydrophobicContact CG2-CD1 3.82Å; I200-L204 WeakPolarHBondContact O-CB 3.48Å; I200-L204 WeakPolarHBondContact O-CD1 3.46Å; I200-L204 WeakPolarHBondContact O-CG 3.29Å; I200-L204 PolarHBondContact O-N 3.39Å; L204-F207 WeakPolarHBondContact O-CA 3.46Å; L204-F207 PolarHBondContact O-N 3.42Å; L204-A208 HydrophobicContact CB-CB 3.74Å; L204-A208 HydrophobicContact CD1-CB 4.06Å; L204-A208 HydrophobicContact CD2-CB 3.77Å; L204-A208 HydrophobicContact CG-CB 4.06Å; L204-A208 PolarHBondContact O-N 3.47Å; L204-A208 VanDerWaalsContact O-N 3.17Å; L204-I214 HydrophobicContact CD1-CG2 4.49Å; L204-I214 HydrophobicContact CD2-CG2 4.29Å; L204-L218 HydrophobicContact CD1-CD1 3.59Å; L204-L218 HydrophobicContact CD1-CD2 3.92Å; L204-L218 HydrophobicContact CD1-CG 4.29Å
205	G	56.6	Low	61.8	Low	48 Å²	48	58.8 Å²	58.8	50%	0.495	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	38	-141	173	0	0	0	0	0	114.6	S203 F207	S203-G205 VanDerWaalsContact C-N 3.27Å; S203-G205 PolarHBondContact O-N 3.27Å; G205-F207 PolarHBondContact O-N 3.41Å
206	K	51.9	Low	62.2	Low	172 Å²	172	54.7 Å²	54.7	75%	0.748	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-75.9	36	173.3	-58.3	-180	-179.8	179.6	0	112.4	W209	K206-W209 HydrophobicContact CB-CZ2 4Å; K206-W209 WeakPolarHBondContact O-CZ2 3.43Å; K206-W209 PolarHBondContact O-NE1 2.93Å
207	F	52.5	Low	62.7	Low	143 Å²	143	55.9 Å²	55.9	63%	0.627	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-131	-21.8	179.6	-68.4	-77.4	0	0	0	114	L175 L204 G205 W209	L175-F207 HydrophobicContact CD2-CB 4.25Å; L204-F207 WeakPolarHBondContact O-CA 3.46Å; L204-F207 PolarHBondContact O-N 3.42Å; G205-F207 PolarHBondContact O-N 3.41Å; F207-W209 VanDerWaalsContact C-CD1 3.42Å; F207-W209 VanDerWaalsContact C-N 3.26Å; F207-W209 PolarHBondContact O-N 2.88Å
208	A	52.6	Low	63	Low	1 Å²	1	55.8 Å²	55.8	1%	0.008	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-58.2	-30.6	175.9	0	0	0	0	0	115.6	L204 R210 L239	L204-A208 HydrophobicContact CB-CB 3.74Å; L204-A208 HydrophobicContact CD1-CB 4.06Å; L204-A208 HydrophobicContact CD2-CB 3.77Å; L204-A208 HydrophobicContact CG-CB 4.06Å; L204-A208 PolarHBondContact O-N 3.47Å; L204-A208 VanDerWaalsContact O-N 3.17Å; A208-R210 PolarHBondContact O-N 3.09Å; A208-L239 HydrophobicContact CB-CD2 4.09Å
209	W	55.4	Low	63.4	Low	104 Å²	104	54.7 Å²	54.7	39%	0.394	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-59.4	-11.6	-177.3	50.3	-4.9	0	0	0	116.7	K206 F207 Q215 L243	K206-W209 HydrophobicContact CB-CZ2 4Å; K206-W209 WeakPolarHBondContact O-CZ2 3.43Å; K206-W209 PolarHBondContact O-NE1 2.93Å; F207-W209 VanDerWaalsContact C-CD1 3.42Å; F207-W209 VanDerWaalsContact C-N 3.26Å; F207-W209 PolarHBondContact O-N 2.88Å; W209-Q215 PolarHBondContact O-NE2 3.37Å; W209-Q215 VanDerWaalsContact O-NE2 3.11Å; W209-L243 VanDerWaalsContact O-CD1 3.27Å; W209-L243 WeakPolarHBondContact O-CD1 3.49Å
210	R	59.3	Low	63.7	Low	197 Å²	197	53.7 Å²	53.7	74%	0.743	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-99.8	-24.3	-171.4	-68.2	-173.4	-179	179.4	-0.8	115.9	A208	A208-R210 PolarHBondContact O-N 3.09Å
211	D	65.9	Low	64	Low	54 Å²	54	53.9 Å²	53.9	29%	0.289	27%	0.274	S	S	.	.			trans	-107.9	114.2	-174.7	-166	-32.7	0	0	0	111.7	L213 I214 Q215	D211-L213 VanDerWaalsContact C-N 3.28Å; D211-L213 PolarHBondContact O-N 2.87Å; D211-L213 WeakPolarHBondContact OD1-CB 3.36Å; D211-L213 PolarHBondContact OD1-N 3.46Å; D211-I214 HydrophobicContact CB-CB 4.13Å; D211-I214 HydrophobicContact CB-CD1 3.73Å; D211-I214 HydrophobicContact CB-CG1 3.81Å; D211-I214 PolarHBondContact O-N 3.26Å; D211-Q215 WeakPolarHBondContact O-CG 3.22Å; D211-Q215 PolarHBondContact O-N 2.99Å
212	R	71.3	Confident	64.2	Low	108 Å²	108	53.2 Å²	53.2	41%	0.408	27%	0.269	S	S	.	.	H	α-helix	trans	-51.6	-42.8	176.5	171.2	178.7	153.5	154.6	19.6	112.4	Q215 N216 D245	R212-Q215 PolarHBondContact O-N 3.48Å; R212-N216 VanDerWaalsContact O-CB 3.26Å; R212-N216 WeakPolarHBondContact O-CB 3.41Å; R212-N216 PolarHBondContact O-N 2.86Å; R212-N216 PolarHBondContact O-ND2 3.31Å; R212-D245 VanDerWaalsContact CD-OD1 3.3Å; R212-D245 WeakPolarHBondContact CD-OD1 3.25Å; R212-D245 IonicContact CZ-OD1 3.72Å; R212-D245 IonicContact CZ-OD2 3.54Å; R212-D245 IonicContact NE-OD1 2.87Å; R212-D245 PolarHBondContact NE-OD1 3.25Å; R212-D245 IonicContact NE-OD2 2.64Å; R212-D245 PolarHBondContact NE-OD2 3.17Å; R212-D245 IonicContact NH1-OD1 3.67Å; R212-D245 IonicContact NH2-OD1 3.34Å; R212-D245 PolarHBondContact NH2-OD1 2.99Å; R212-D245 IonicContact NH2-OD2 2.75Å; R212-D245 PolarHBondContact NH2-OD2 2.91Å
213	L	67.7	Low	64.5	Low	84 Å²	84	50.9 Å²	50.9	44%	0.44	24%	0.244	S	C	.	.	H	α-helix	trans	-68.7	-38	-177.8	-66.8	174.1	0	0	0	111.8	L180 D211 N216 F217	L180-L213 HydrophobicContact CD1-CB 4.27Å; D211-L213 VanDerWaalsContact C-N 3.28Å; D211-L213 PolarHBondContact O-N 2.87Å; D211-L213 WeakPolarHBondContact OD1-CB 3.36Å; D211-L213 PolarHBondContact OD1-N 3.46Å; L213-N216 WeakPolarHBondContact O-CB 3.29Å; L213-F217 VanDerWaalsContact O-CB 3.26Å; L213-F217 WeakPolarHBondContact O-CB 3.3Å; L213-F217 PolarHBondContact O-N 3.21Å
214	I	67.2	Low	64.8	Low	8 Å²	8	54.7 Å²	54.7	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-67.4	-43.6	176.3	-59.7	179.7	0	0	0	109.9	I174 L180 L204 D211 F217 L218	I174-I214 HydrophobicContact CG2-CG2 4.4Å; I174-I214 VanDerWaalsContact O-CD1 3.24Å; I174-I214 WeakPolarHBondContact O-CD1 3.25Å; L180-I214 HydrophobicContact CD2-CG1 4.4Å; L204-I214 HydrophobicContact CD1-CG2 4.49Å; L204-I214 HydrophobicContact CD2-CG2 4.29Å; D211-I214 HydrophobicContact CB-CB 4.13Å; D211-I214 HydrophobicContact CB-CD1 3.73Å; D211-I214 HydrophobicContact CB-CG1 3.81Å; D211-I214 PolarHBondContact O-N 3.26Å; I214-F217 PolarHBondContact O-N 3.03Å; I214-L218 HydrophobicContact CG2-CD1 3.98Å; I214-L218 HydrophobicContact CG2-CG 4.38Å; I214-L218 WeakPolarHBondContact O-CB 3.43Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 3.25Å
215	Q	70.6	Confident	65.1	Low	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-46.8	177.4	-62.3	-157.5	18.3	0	0	112	W209 D211 R212 F217 L218 I219 L239 L241 F244	W209-Q215 PolarHBondContact O-NE2 3.37Å; W209-Q215 VanDerWaalsContact O-NE2 3.11Å; D211-Q215 WeakPolarHBondContact O-CG 3.22Å; D211-Q215 PolarHBondContact O-N 2.99Å; R212-Q215 PolarHBondContact O-N 3.48Å; Q215-F217 PolarHBondContact O-N 3.21Å; Q215-L218 PolarHBondContact O-N 3.01Å; Q215-I219 VanDerWaalsContact O-CG1 3.24Å; Q215-I219 WeakPolarHBondContact O-CG1 3.18Å; Q215-I219 PolarHBondContact O-N 2.94Å; Q215-L239 HydrophobicContact CB-CD1 4.28Å; Q215-L239 HydrophobicContact CB-CD2 4.4Å; Q215-L239 HydrophobicContact CG-CD1 4.43Å; Q215-L239 HydrophobicContact CG-CD2 3.71Å; Q215-L241 PolarHBondContact NE2-O 3.26Å; Q215-L241 PolarHBondContact OE1-O 2.87Å; Q215-F244 HydrophobicContact CB-CB 4.06Å
216	N	71.8	Confident	65.3	Low	4 Å²	4	55.3 Å²	55.3	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-52.5	-52.1	173.1	-84.4	-2.3	0	0	0	112.1	R212 L213 L218 I219 S220 F244 D245 Q248	R212-N216 VanDerWaalsContact O-CB 3.26Å; R212-N216 WeakPolarHBondContact O-CB 3.41Å; R212-N216 PolarHBondContact O-N 2.86Å; R212-N216 PolarHBondContact O-ND2 3.31Å; L213-N216 WeakPolarHBondContact O-CB 3.29Å; N216-L218 PolarHBondContact O-N 3.33Å; N216-I219 PolarHBondContact O-N 3.19Å; N216-S220 PolarHBondContact O-N 2.64Å; N216-S220 PolarHBondContact O-OG 2.64Å; N216-S220 VanDerWaalsContact O-OG 3.13Å; N216-F244 WeakPolarHBondContact OD1-CA 3.44Å; N216-F244 VanDerWaalsContact OD1-CB 3.27Å; N216-F244 WeakPolarHBondContact OD1-CB 3.44Å; N216-D245 PolarHBondContact ND2-OD2 3.11Å; N216-D245 PolarHBondContact OD1-N 3.13Å; N216-Q248 VanDerWaalsContact CG-OE1 3.24Å; N216-Q248 PolarHBondContact ND2-NE2 2.74Å; N216-Q248 PolarHBondContact ND2-OE1 2.59Å
217	F	69.8	Low	65.6	Low	28 Å²	28	54 Å²	54	12%	0.123	25%	0.253	C	S	.	.	H	α-helix	trans	-58	-49.5	177.6	176.9	-111.6	0	0	0	111.5	L180 F183 Y184 L213 I214 Q215 I219 S220 L221	L180-F217 HydrophobicContact CB-CD2 4.4Å; L180-F217 HydrophobicContact CB-CG 4.45Å; L180-F217 HydrophobicContact CD1-CB 4.41Å; L180-F217 HydrophobicContact CD2-CB 4Å; L180-F217 HydrophobicContact CD2-CD1 3.46Å; L180-F217 VanDerWaalsContact CD2-CD1 3.46Å; L180-F217 HydrophobicContact CD2-CD2 4.49Å; L180-F217 HydrophobicContact CD2-CE1 3.96Å; L180-F217 HydrophobicContact CD2-CG 3.74Å; L180-F217 WeakPolarHBondContact O-CZ 3.5Å; F183-F217 HydrophobicContact CB-CE1 3.93Å; F183-F217 HydrophobicContact CB-CZ 3.92Å; Y184-F217 HydrophobicContact CD2-CE2 4.05Å; Y184-F217 HydrophobicContact CG-CE2 4.36Å; L213-F217 VanDerWaalsContact O-CB 3.26Å; L213-F217 WeakPolarHBondContact O-CB 3.3Å; L213-F217 PolarHBondContact O-N 3.21Å; I214-F217 PolarHBondContact O-N 3.03Å; Q215-F217 PolarHBondContact O-N 3.21Å; F217-I219 VanDerWaalsContact C-N 3.32Å; F217-I219 PolarHBondContact O-N 2.75Å; F217-S220 WeakPolarHBondContact O-CB 3.17Å; F217-S220 PolarHBondContact O-N 3.06Å; F217-L221 HydrophobicContact CD1-CD1 3.66Å; F217-L221 HydrophobicContact CD1-CG 4.25Å; F217-L221 HydrophobicContact CD2-CG 4.35Å; F217-L221 HydrophobicContact CE1-CD1 3.2Å; F217-L221 HydrophobicContact CE1-CD2 4.48Å; F217-L221 HydrophobicContact CE1-CG 3.99Å; F217-L221 HydrophobicContact CE2-CD1 4.14Å; F217-L221 HydrophobicContact CE2-CD2 3.93Å; F217-L221 HydrophobicContact CE2-CG 4.03Å; F217-L221 HydrophobicContact CG-CD1 4.34Å; F217-L221 HydrophobicContact CG-CG 4.46Å; F217-L221 HydrophobicContact CZ-CD1 3.47Å; F217-L221 VanDerWaalsContact CZ-CD1 3.47Å; F217-L221 HydrophobicContact CZ-CD2 3.87Å; F217-L221 HydrophobicContact CZ-CG 3.86Å; F217-L221 VanDerWaalsContact O-CG 3.28Å; F217-L221 WeakPolarHBondContact O-CG 3.47Å; F217-L221 PolarHBondContact O-N 3.34Å
218	L	69.9	Low	65.8	Low	1 Å²	1	48.4 Å²	48.4	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-57.5	-45.5	177.3	-70.8	167	0	0	0	111.4	I200 T201 L204 I214 Q215 N216 S220 L221 Y222 L239	I200-L218 HydrophobicContact CG2-CD2 3.78Å; T201-L218 HydrophobicContact CG2-CD2 4.25Å; L204-L218 HydrophobicContact CD1-CD1 3.59Å; L204-L218 HydrophobicContact CD1-CD2 3.92Å; L204-L218 HydrophobicContact CD1-CG 4.29Å; I214-L218 HydrophobicContact CG2-CD1 3.98Å; I214-L218 HydrophobicContact CG2-CG 4.38Å; I214-L218 WeakPolarHBondContact O-CB 3.43Å; I214-L218 WeakPolarHBondContact O-CG 3.3Å; I214-L218 PolarHBondContact O-N 3.25Å; Q215-L218 PolarHBondContact O-N 3.01Å; N216-L218 PolarHBondContact O-N 3.33Å; L218-S220 VanDerWaalsContact C-N 3.35Å; L218-S220 PolarHBondContact O-N 3.25Å; L218-L221 WeakPolarHBondContact O-CB 3.3Å; L218-L221 PolarHBondContact O-N 2.91Å; L218-L221 VanDerWaalsContact O-N 3.14Å; L218-Y222 VanDerWaalsContact O-CD2 3.26Å; L218-Y222 WeakPolarHBondContact O-CD2 3Å; L218-Y222 PolarHBondContact O-N 2.82Å; L218-L239 HydrophobicContact CB-CD1 4.45Å; L218-L239 HydrophobicContact CD1-CD1 4.44Å; L218-L239 HydrophobicContact CD1-CD2 4.17Å; L218-L239 HydrophobicContact CD1-CG 4.5Å
219	I	72.4	Confident	66	Low	3 Å²	3	54.2 Å²	54.2	2%	0.015	27%	0.272	C	S	.	.	H	α-helix	trans	-60.5	-46.2	177.7	-68.4	165.6	0	0	0	110.7	Q215 N216 F217 L221 Y222 A223 L239 F244 V249 I252 W267	Q215-I219 VanDerWaalsContact O-CG1 3.24Å; Q215-I219 WeakPolarHBondContact O-CG1 3.18Å; Q215-I219 PolarHBondContact O-N 2.94Å; N216-I219 PolarHBondContact O-N 3.19Å; F217-I219 VanDerWaalsContact C-N 3.32Å; F217-I219 PolarHBondContact O-N 2.75Å; I219-L221 VanDerWaalsContact C-N 3.27Å; I219-L221 PolarHBondContact O-N 2.84Å; I219-Y222 PolarHBondContact O-N 3.17Å; I219-A223 WeakPolarHBondContact O-CB 3.4Å; I219-A223 PolarHBondContact O-N 2.84Å; I219-L239 HydrophobicContact CG1-CD1 4.35Å; I219-F244 HydrophobicContact CD1-CB 3.54Å; I219-F244 HydrophobicContact CD1-CD1 3.31Å; I219-F244 HydrophobicContact CD1-CD2 4.05Å; I219-F244 HydrophobicContact CD1-CE1 3.93Å; I219-F244 HydrophobicContact CD1-CG 3.37Å; I219-V249 HydrophobicContact CD1-CG2 4.48Å; I219-V249 HydrophobicContact CG2-CG2 4.27Å; I219-I252 HydrophobicContact CG2-CD1 3.55Å; I219-W267 HydrophobicContact CD1-CH2 3.78Å; I219-W267 HydrophobicContact CD1-CZ3 3.97Å; I219-W267 HydrophobicContact CG1-CH2 3.8Å; I219-W267 HydrophobicContact CG1-CZ3 4.32Å
220	S	70.6	Confident	66.2	Low	44 Å²	44	50.7 Å²	50.7	31%	0.308	27%	0.266	S	S	.	.	H	α-helix	trans	-60.1	-37.1	175.2	-58.7	0	0	0	0	112.4	N216 F217 L218 K224	N216-S220 PolarHBondContact O-N 2.64Å; N216-S220 PolarHBondContact O-OG 2.64Å; N216-S220 VanDerWaalsContact O-OG 3.13Å; F217-S220 WeakPolarHBondContact O-CB 3.17Å; F217-S220 PolarHBondContact O-N 3.06Å; L218-S220 VanDerWaalsContact C-N 3.35Å; L218-S220 PolarHBondContact O-N 3.25Å; S220-K224 PolarHBondContact O-N 3.32Å
221	L	68.9	Low	66.4	Low	8 Å²	8	41.7 Å²	41.7	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-67.7	-47.6	175.8	-67.9	178.4	0	0	0	112	Y184 L187 L197 F217 L218 I219 A223 K224 I225	Y184-L221 HydrophobicContact CD2-CD2 3.86Å; Y184-L221 HydrophobicContact CE2-CD2 4.39Å; L187-L221 HydrophobicContact CB-CD2 4.46Å; L187-L221 HydrophobicContact CD1-CB 4.34Å; L187-L221 HydrophobicContact CD1-CD1 3.17Å; L187-L221 HydrophobicContact CD1-CD2 3.3Å; L187-L221 HydrophobicContact CD1-CG 3.72Å; L187-L221 HydrophobicContact CG-CD2 4.49Å; L197-L221 HydrophobicContact CD1-CB 4.41Å; L197-L221 HydrophobicContact CD2-CB 3.95Å; L197-L221 HydrophobicContact CD2-CD1 3.86Å; F217-L221 HydrophobicContact CD1-CD1 3.66Å; F217-L221 HydrophobicContact CD1-CG 4.25Å; F217-L221 HydrophobicContact CD2-CG 4.35Å; F217-L221 HydrophobicContact CE1-CD1 3.2Å; F217-L221 HydrophobicContact CE1-CD2 4.48Å; F217-L221 HydrophobicContact CE1-CG 3.99Å; F217-L221 HydrophobicContact CE2-CD1 4.14Å; F217-L221 HydrophobicContact CE2-CD2 3.93Å; F217-L221 HydrophobicContact CE2-CG 4.03Å; F217-L221 HydrophobicContact CG-CD1 4.34Å; F217-L221 HydrophobicContact CG-CG 4.46Å; F217-L221 HydrophobicContact CZ-CD1 3.47Å; F217-L221 VanDerWaalsContact CZ-CD1 3.47Å; F217-L221 HydrophobicContact CZ-CD2 3.87Å; F217-L221 HydrophobicContact CZ-CG 3.86Å; F217-L221 VanDerWaalsContact O-CG 3.28Å; F217-L221 WeakPolarHBondContact O-CG 3.47Å; F217-L221 PolarHBondContact O-N 3.34Å; L218-L221 WeakPolarHBondContact O-CB 3.3Å; L218-L221 PolarHBondContact O-N 2.91Å; L218-L221 VanDerWaalsContact O-N 3.14Å; I219-L221 VanDerWaalsContact C-N 3.27Å; I219-L221 PolarHBondContact O-N 2.84Å; L221-A223 PolarHBondContact O-N 3.47Å; L221-K224 PolarHBondContact O-N 3.04Å; L221-K224 VanDerWaalsContact O-N 3.15Å; L221-I225 PolarHBondContact O-N 3.19Å
222	Y	68.6	Low	66.4	Low	5 Å²	5	40.2 Å²	40.2	2%	0.02	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-31.7	177.5	-88.2	-85.3	0	0	0	112.4	L197 T201 L218 I219 K224 I225 T231 R234 L235	L197-Y222 HydrophobicContact CD2-CD2 4.3Å; L197-Y222 HydrophobicContact CD2-CE2 4.05Å; T201-Y222 HydrophobicContact CG2-CE2 3.68Å; T201-Y222 WeakPolarHBondContact CG2-OH 2.97Å; L218-Y222 VanDerWaalsContact O-CD2 3.26Å; L218-Y222 WeakPolarHBondContact O-CD2 3Å; L218-Y222 PolarHBondContact O-N 2.82Å; I219-Y222 PolarHBondContact O-N 3.17Å; Y222-K224 VanDerWaalsContact C-N 3.33Å; Y222-I225 HydrophobicContact CD1-CD1 4.28Å; Y222-T231 HydrophobicContact CD1-CG2 3.97Å; Y222-T231 HydrophobicContact CE1-CG2 4.33Å; Y222-T231 WeakPolarHBondContact CE1-O 3.26Å; Y222-R234 HydrophobicContact CE1-CB 4.19Å; Y222-R234 WeakPolarHBondContact OH-CB 3.46Å; Y222-L235 HydrophobicContact CD1-CB 4.08Å; Y222-L235 HydrophobicContact CD2-CB 4.35Å; Y222-L235 HydrophobicContact CD2-CD1 3.61Å; Y222-L235 HydrophobicContact CD2-CG 4.38Å; Y222-L235 HydrophobicContact CE1-CB 4.04Å; Y222-L235 HydrophobicContact CE2-CB 4.33Å; Y222-L235 HydrophobicContact CE2-CD1 3.84Å; Y222-L235 HydrophobicContact CG-CB 4.22Å; Y222-L235 HydrophobicContact CG-CD1 4.08Å; Y222-L235 HydrophobicContact CG-CD2 4.18Å; Y222-L235 HydrophobicContact CG-CG 4.4Å
223	A	70.2	Confident	66.2	Low	9 Å²	9	41.6 Å²	41.6	7%	0.074	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-37.4	174	0	0	0	0	0	112.6	I219 L221 I252 A256 R259 L260	I219-A223 WeakPolarHBondContact O-CB 3.4Å; I219-A223 PolarHBondContact O-N 2.84Å; L221-A223 PolarHBondContact O-N 3.47Å; A223-I252 HydrophobicContact CB-CD1 4.27Å; A223-I252 HydrophobicContact CB-CG1 4.28Å; A223-I252 HydrophobicContact CB-CG2 3.66Å; A223-A256 HydrophobicContact CB-CB 3.86Å; A223-A256 VanDerWaalsContact O-CB 3.24Å; A223-A256 WeakPolarHBondContact O-CB 3.29Å; A223-R259 PolarHBondContact O-NH2 3.15Å; A223-L260 HydrophobicContact CB-CD1 4.14Å
224	K	67.8	Low	66.2	Low	122 Å²	122	42.7 Å²	42.7	53%	0.53	24%	0.235	S	C	.	.	H	α-helix	trans	-74.9	-25.8	-177.9	-73.7	-170.6	180	-153.8	0	114.5	Y184 S220 L221 Y222 S226	Y184-K224 HydrophobicContact CE2-CD 4.35Å; Y184-K224 PolarHBondContact OH-NZ 3.13Å; S220-K224 PolarHBondContact O-N 3.32Å; L221-K224 PolarHBondContact O-N 3.04Å; L221-K224 VanDerWaalsContact O-N 3.15Å; Y222-K224 VanDerWaalsContact C-N 3.33Å; K224-S226 PolarHBondContact O-N 3.41Å; K224-S226 VanDerWaalsContact O-N 3.07Å
225	I	67.2	Low	66.3	Low	6 Å²	6	42.4 Å²	42.4	3%	0.031	23%	0.234	C	C	.	.			trans	-68.6	111.4	178	-56	162.8	0	0	0	109.2	E193 L194 L197 L221 Y222 T231	E193-I225 HydrophobicContact CB-CG1 4.49Å; L194-I225 HydrophobicContact CD2-CD1 4.03Å; L194-I225 HydrophobicContact CD2-CG2 4.1Å; L194-I225 HydrophobicContact CG-CG2 4.4Å; L197-I225 HydrophobicContact CD1-CD1 3.01Å; L197-I225 HydrophobicContact CD1-CG1 3.73Å; L197-I225 HydrophobicContact CG-CD1 4.44Å; L221-I225 PolarHBondContact O-N 3.19Å; Y222-I225 HydrophobicContact CD1-CD1 4.28Å; I225-T231 HydrophobicContact CB-CG2 4.12Å; I225-T231 HydrophobicContact CD1-CG2 3.81Å; I225-T231 HydrophobicContact CG2-CG2 3.98Å
226	S	59.6	Low	66.3	Low	61 Å²	61	44.5 Å²	44.5	43%	0.427	24%	0.244	S	C	.	.			trans	-77.9	-21.7	-175	45.4	0	0	0	0	114.1	K224	K224-S226 PolarHBondContact O-N 3.41Å; K224-S226 VanDerWaalsContact O-N 3.07Å
227	N	57.4	Low	66.2	Low	145 Å²	145	52.8 Å²	52.8	78%	0.775	28%	0.28	S	S	*	.	S	Bend	trans	-132.1	25.7	-151.4	-75.3	-21.1	0	0	0	118.1
228	S	58.4	Low	66	Low	24 Å²	24	52 Å²	52	17%	0.168	28%	0.279	C	S	.	.			trans	-135.1	121.6	179.2	137.8	0	0	0	0	113.7	A230 T231	S228-A230 PolarHBondContact O-N 2.9Å; S228-A230 VanDerWaalsContact O-N 3.13Å; S228-A230 PolarHBondContact OG-N 3.22Å; S228-A230 VanDerWaalsContact OG-N 3.15Å; S228-T231 PolarHBondContact O-N 3.34Å; S228-T231 PolarHBondContact O-OG1 3.04Å; S228-T231 PolarHBondContact OG-N 2.74Å
229	S	55.4	Low	66	Low	123 Å²	123	52 Å²	52	86%	0.86	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.5	169.5	55	0	0	0	0	113.8	P232	S229-P232 WeakPolarHBondContact O-CD 3.39Å
230	A	61.1	Low	65.6	Low	31 Å²	31	55.1 Å²	55.1	26%	0.256	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-5.9	179.7	0	0	0	0	0	113.9	S228 R234	S228-A230 PolarHBondContact O-N 2.9Å; S228-A230 VanDerWaalsContact O-N 3.13Å; S228-A230 PolarHBondContact OG-N 3.22Å; S228-A230 VanDerWaalsContact OG-N 3.15Å; A230-R234 WeakPolarHBondContact O-CG 3.45Å; A230-R234 PolarHBondContact O-N 2.73Å
231	T	63.5	Low	65.5	Low	7 Å²	7	54.2 Å²	54.2	4%	0.043	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-42.1	-178.3	43.1	0	0	0	0	113.5	L194 Y222 I225 S228 L235	L194-T231 HydrophobicContact CD2-CG2 4.3Å; Y222-T231 HydrophobicContact CD1-CG2 3.97Å; Y222-T231 HydrophobicContact CE1-CG2 4.33Å; Y222-T231 WeakPolarHBondContact CE1-O 3.26Å; I225-T231 HydrophobicContact CB-CG2 4.12Å; I225-T231 HydrophobicContact CD1-CG2 3.81Å; I225-T231 HydrophobicContact CG2-CG2 3.98Å; S228-T231 PolarHBondContact O-N 3.34Å; S228-T231 PolarHBondContact O-OG1 3.04Å; S228-T231 PolarHBondContact OG-N 2.74Å; T231-L235 WeakPolarHBondContact O-CB 3.4Å; T231-L235 PolarHBondContact O-N 3.05Å; T231-L235 VanDerWaalsContact O-N 3.13Å
232	P	64.7	Low	65.3	Low	24 Å²	24	54 Å²	54	16%	0.156	29%	0.29	C	S	.	.	H	α-helix	trans	-65.2	-46.2	-178.9	-23.4	37.6	0	0	0	112.1	S229 R234 L235 I236 V263	S229-P232 WeakPolarHBondContact O-CD 3.39Å; P232-R234 PolarHBondContact O-N 2.84Å; P232-L235 PolarHBondContact O-N 3.37Å; P232-I236 WeakPolarHBondContact O-CD1 3.35Å; P232-I236 VanDerWaalsContact O-CG1 3.23Å; P232-I236 WeakPolarHBondContact O-CG1 3.17Å; P232-I236 PolarHBondContact O-N 3.31Å; P232-V263 HydrophobicContact CB-CG2 3.52Å; P232-V263 HydrophobicContact CG-CG2 4.46Å
233	Q	67.3	Low	65.1	Low	137 Å²	137	56.4 Å²	56.4	64%	0.64	30%	0.303	S	S	*	.	H	α-helix	trans	-67.8	-36.8	-175.4	-66.6	179.3	-4.1	0	0	112.6	K237	Q233-K237 WeakPolarHBondContact O-CG 3.24Å; Q233-K237 PolarHBondContact O-N 2.8Å
234	R	68	Low	64.9	Low	107 Å²	107	56.6 Å²	56.6	40%	0.404	30%	0.302	S	S	.	.	H	α-helix	trans	-70.4	-40.7	176.4	-71.2	-177.5	-179.5	-174.8	0.6	111.6	Y222 A230 P232 K237 A238	Y222-R234 HydrophobicContact CE1-CB 4.19Å; Y222-R234 WeakPolarHBondContact OH-CB 3.46Å; A230-R234 WeakPolarHBondContact O-CG 3.45Å; A230-R234 PolarHBondContact O-N 2.73Å; P232-R234 PolarHBondContact O-N 2.84Å; R234-K237 PolarHBondContact O-N 3.37Å; R234-A238 WeakPolarHBondContact O-CB 3.43Å; R234-A238 PolarHBondContact O-N 3.43Å
235	L	69.9	Low	64.8	Low	1 Å²	1	51.7 Å²	51.7	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-44.6	177.3	-177.9	57.8	0	0	0	111.7	Y222 T231 P232 K237 A238 L239 L260 V263 W267	Y222-L235 HydrophobicContact CD1-CB 4.08Å; Y222-L235 HydrophobicContact CD2-CB 4.35Å; Y222-L235 HydrophobicContact CD2-CD1 3.61Å; Y222-L235 HydrophobicContact CD2-CG 4.38Å; Y222-L235 HydrophobicContact CE1-CB 4.04Å; Y222-L235 HydrophobicContact CE2-CB 4.33Å; Y222-L235 HydrophobicContact CE2-CD1 3.84Å; Y222-L235 HydrophobicContact CG-CB 4.22Å; Y222-L235 HydrophobicContact CG-CD1 4.08Å; Y222-L235 HydrophobicContact CG-CD2 4.18Å; Y222-L235 HydrophobicContact CG-CG 4.4Å; T231-L235 WeakPolarHBondContact O-CB 3.4Å; T231-L235 PolarHBondContact O-N 3.05Å; T231-L235 VanDerWaalsContact O-N 3.13Å; P232-L235 PolarHBondContact O-N 3.37Å; L235-K237 VanDerWaalsContact C-N 3.35Å; L235-K237 PolarHBondContact O-N 2.92Å; L235-A238 PolarHBondContact O-N 2.81Å; L235-L239 HydrophobicContact CD1-CD1 3.68Å; L235-L239 HydrophobicContact CD1-CG 4.26Å; L235-L239 PolarHBondContact O-N 3.41Å; L235-L260 HydrophobicContact CD2-CD2 3.92Å; L235-V263 HydrophobicContact CD2-CG1 4.08Å; L235-V263 HydrophobicContact CG-CG1 4.39Å; L235-W267 HydrophobicContact CD1-CH2 4.42Å; L235-W267 HydrophobicContact CD1-CZ2 4.39Å; L235-W267 HydrophobicContact CD2-CH2 3.9Å; L235-W267 HydrophobicContact CD2-CZ2 4.27Å; L235-W267 HydrophobicContact CG-CH2 4.06Å; L235-W267 HydrophobicContact CG-CZ2 3.96Å
236	I	70	Confident	64.5	Low	44 Å²	44	52.8 Å²	52.8	23%	0.226	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-43.5	176.5	-68.3	160.1	0	0	0	111.3	P232 A238 L239 V263 L266	P232-I236 WeakPolarHBondContact O-CD1 3.35Å; P232-I236 VanDerWaalsContact O-CG1 3.23Å; P232-I236 WeakPolarHBondContact O-CG1 3.17Å; P232-I236 PolarHBondContact O-N 3.31Å; I236-A238 VanDerWaalsContact C-N 3.31Å; I236-A238 PolarHBondContact O-N 3.42Å; I236-L239 CarbonylContact O-C 3.58Å; I236-L239 PolarHBondContact O-N 2.67Å; I236-V263 HydrophobicContact CD1-CG2 4.25Å; I236-V263 HydrophobicContact CG1-CG1 3.92Å; I236-V263 HydrophobicContact CG1-CG2 4.33Å; I236-L266 HydrophobicContact CB-CD2 4.32Å; I236-L266 HydrophobicContact CD1-CD2 3.5Å; I236-L266 VanDerWaalsContact CD1-CD2 3.5Å; I236-L266 HydrophobicContact CG1-CD2 3.87Å; I236-L266 HydrophobicContact CG2-CD2 3.49Å; I236-L266 VanDerWaalsContact CG2-CD2 3.49Å
237	K	69.9	Low	64.6	Low	179 Å²	179	56.4 Å²	56.4	78%	0.778	30%	0.297	S	S	*	.	H	α-helix	trans	-65.2	-34.9	177.1	-76.1	-179.1	-179.6	-176.8	0	112.7	Q233 R234 L235	Q233-K237 WeakPolarHBondContact O-CG 3.24Å; Q233-K237 PolarHBondContact O-N 2.8Å; R234-K237 PolarHBondContact O-N 3.37Å; L235-K237 VanDerWaalsContact C-N 3.35Å; L235-K237 PolarHBondContact O-N 2.92Å
238	A	65.2	Low	64.9	Low	11 Å²	11	52.7 Å²	52.7	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-76.6	-34.8	179.3	0	0	0	0	0	112.4	T201 R234 L235 I236 P240	T201-A238 HydrophobicContact CG2-CB 4.02Å; R234-A238 WeakPolarHBondContact O-CB 3.43Å; R234-A238 PolarHBondContact O-N 3.43Å; L235-A238 PolarHBondContact O-N 2.81Å; I236-A238 VanDerWaalsContact C-N 3.31Å; I236-A238 PolarHBondContact O-N 3.42Å; A238-P240 WeakPolarHBondContact O-CD 3.36Å
239	L	70.2	Confident	65.1	Low	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.268	C	S	.	.			trans	-125	78.2	-175.9	-62.9	-179.1	0	0	0	110.5	A208 Q215 L218 I219 L235 I236 L241 W267	A208-L239 HydrophobicContact CB-CD2 4.09Å; Q215-L239 HydrophobicContact CB-CD1 4.28Å; Q215-L239 HydrophobicContact CB-CD2 4.4Å; Q215-L239 HydrophobicContact CG-CD1 4.43Å; Q215-L239 HydrophobicContact CG-CD2 3.71Å; L218-L239 HydrophobicContact CB-CD1 4.45Å; L218-L239 HydrophobicContact CD1-CD1 4.44Å; L218-L239 HydrophobicContact CD1-CD2 4.17Å; L218-L239 HydrophobicContact CD1-CG 4.5Å; I219-L239 HydrophobicContact CG1-CD1 4.35Å; L235-L239 HydrophobicContact CD1-CD1 3.68Å; L235-L239 HydrophobicContact CD1-CG 4.26Å; L235-L239 PolarHBondContact O-N 3.41Å; I236-L239 CarbonylContact O-C 3.58Å; I236-L239 PolarHBondContact O-N 2.67Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-W267 HydrophobicContact CB-CZ2 3.97Å; L239-W267 HydrophobicContact CD1-CH2 4.41Å; L239-W267 HydrophobicContact CD1-CZ2 4.15Å; L239-W267 PolarHBondContact O-NE1 3.11Å
240	P	64.6	Low	65.1	Low	69 Å²	69	49 Å²	49	45%	0.448	24%	0.244	S	C	.	.	S	Bend	trans	-69.5	-29.9	178	27.3	-33.7	0	0	0	112.2	A238 T270	A238-P240 WeakPolarHBondContact O-CD 3.36Å; P240-T270 WeakPolarHBondContact O-CG2 3.49Å
241	L	66.9	Low	65.2	Low	25 Å²	25	54.7 Å²	54.7	13%	0.131	27%	0.269	C	S	.	.	S	Bend	trans	-122	113.8	173.8	-166.4	75	0	0	0	110.3	Q215 L239 L243 H274	Q215-L241 PolarHBondContact NE2-O 3.26Å; Q215-L241 PolarHBondContact OE1-O 2.87Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L241-L243 HydrophobicContact CD2-CD2 4.17Å; L241-L243 HydrophobicContact CD2-CG 4.4Å; L241-L243 PolarHBondContact O-N 3.04Å; L241-H274 HydrophobicContact CD1-CB 4.31Å
242	P	64.8	Low	65.3	Low	5 Å²	5	55 Å²	55	3%	0.032	27%	0.271	C	S	.	.			trans	-76.4	110.9	177.5	29.4	-35.1	0	0	0	112	F244 W267 I271	P242-F244 HydrophobicContact CB-CD1 3.34Å; P242-F244 HydrophobicContact CB-CE1 3.11Å; P242-F244 HydrophobicContact CB-CZ 4.14Å; P242-F244 HydrophobicContact CG-CE1 4.24Å; P242-W267 HydrophobicContact CB-CD2 4.02Å; P242-W267 HydrophobicContact CB-CE3 4.4Å; P242-W267 HydrophobicContact CB-CG 4.1Å; P242-W267 HydrophobicContact CG-CB 3.94Å; P242-W267 HydrophobicContact CG-CD2 4.25Å; P242-W267 HydrophobicContact CG-CG 3.8Å; P242-I271 HydrophobicContact CG-CD1 3.59Å; P242-I271 HydrophobicContact CG-CG1 3.67Å
243	L	64.2	Low	65.3	Low	54 Å²	54	61.1 Å²	61.1	28%	0.283	30%	0.297	S	S	.	.			trans	-110.8	25.7	170.5	-61.5	-177.7	0	0	0	111.8	W209 L241 L288	W209-L243 VanDerWaalsContact O-CD1 3.27Å; W209-L243 WeakPolarHBondContact O-CD1 3.49Å; L241-L243 HydrophobicContact CD2-CD2 4.17Å; L241-L243 HydrophobicContact CD2-CG 4.4Å; L241-L243 PolarHBondContact O-N 3.04Å; L243-L288 HydrophobicContact CD2-CD2 4.4Å
244	F	66.7	Low	65.2	Low	14 Å²	14	59.4 Å²	59.4	6%	0.061	29%	0.292	C	S	.	.	S	Bend	trans	-80.1	170.8	-177.8	64.3	-105.4	0	0	0	112.8	Q215 N216 I219 P242 V249 W267 L295	Q215-F244 HydrophobicContact CB-CB 4.06Å; N216-F244 WeakPolarHBondContact OD1-CA 3.44Å; N216-F244 VanDerWaalsContact OD1-CB 3.27Å; N216-F244 WeakPolarHBondContact OD1-CB 3.44Å; I219-F244 HydrophobicContact CD1-CB 3.54Å; I219-F244 HydrophobicContact CD1-CD1 3.31Å; I219-F244 HydrophobicContact CD1-CD2 4.05Å; I219-F244 HydrophobicContact CD1-CE1 3.93Å; I219-F244 HydrophobicContact CD1-CG 3.37Å; P242-F244 HydrophobicContact CB-CD1 3.34Å; P242-F244 HydrophobicContact CB-CE1 3.11Å; P242-F244 HydrophobicContact CB-CZ 4.14Å; P242-F244 HydrophobicContact CG-CE1 4.24Å; F244-V249 HydrophobicContact CD2-CG2 3.52Å; F244-V249 HydrophobicContact CE2-CB 4.33Å; F244-V249 HydrophobicContact CE2-CG2 3.33Å; F244-V249 HydrophobicContact CG-CG2 4.47Å; F244-V249 HydrophobicContact CZ-CG2 4.09Å; F244-W267 HydrophobicContact CD1-CE3 4.37Å; F244-W267 HydrophobicContact CD1-CH2 4.36Å; F244-W267 HydrophobicContact CD1-CZ3 4.04Å; F244-W267 HydrophobicContact CE1-CD2 4.01Å; F244-W267 AromaticContact CE1-CE3 3.31Å; F244-W267 HydrophobicContact CE1-CE3 3.31Å; F244-W267 AromaticContact CE1-CH2 3.99Å; F244-W267 HydrophobicContact CE1-CH2 3.99Å; F244-W267 AromaticContact CE1-CZ3 3.29Å; F244-W267 HydrophobicContact CE1-CZ3 3.29Å; F244-W267 AromaticContact CZ-CE3 3.78Å; F244-W267 HydrophobicContact CZ-CE3 3.78Å; F244-W267 AromaticContact CZ-CZ3 3.88Å; F244-W267 HydrophobicContact CZ-CZ3 3.88Å; F244-L295 HydrophobicContact CZ-CD2 4.4Å
245	D	65.8	Low	65.1	Low	19 Å²	19	59.9 Å²	59.9	10%	0.102	30%	0.303	C	S	.	.			trans	-86.5	115.9	172.4	-67.5	-29.8	0	0	0	112.6	R212 N216 E247 Q248 V249	R212-D245 VanDerWaalsContact CD-OD1 3.3Å; R212-D245 WeakPolarHBondContact CD-OD1 3.25Å; R212-D245 IonicContact CZ-OD1 3.72Å; R212-D245 IonicContact CZ-OD2 3.54Å; R212-D245 IonicContact NE-OD1 2.87Å; R212-D245 PolarHBondContact NE-OD1 3.25Å; R212-D245 IonicContact NE-OD2 2.64Å; R212-D245 PolarHBondContact NE-OD2 3.17Å; R212-D245 IonicContact NH1-OD1 3.67Å; R212-D245 IonicContact NH2-OD1 3.34Å; R212-D245 PolarHBondContact NH2-OD1 2.99Å; R212-D245 IonicContact NH2-OD2 2.75Å; R212-D245 PolarHBondContact NH2-OD2 2.91Å; N216-D245 PolarHBondContact ND2-OD2 3.11Å; N216-D245 PolarHBondContact OD1-N 3.13Å; D245-E247 PolarHBondContact O-N 3.15Å; D245-Q248 HydrophobicContact CB-CB 4.26Å; D245-Q248 HydrophobicContact CB-CG 3.97Å; D245-Q248 PolarHBondContact O-N 3.43Å; D245-V249 PolarHBondContact O-N 3.07Å
246	I	60.6	Low	65	Low	29 Å²	29	59.9 Å²	59.9	15%	0.149	30%	0.303	C	S	.	.	H	α-helix	trans	-58.3	-35.3	179	-49.5	153.4	0	0	0	110.1	Q248 V249 L250 N290 A291 L294	I246-Q248 VanDerWaalsContact C-N 3.32Å; I246-Q248 PolarHBondContact O-N 2.93Å; I246-V249 WeakPolarHBondContact O-CB 3.44Å; I246-V249 PolarHBondContact O-N 3.21Å; I246-L250 PolarHBondContact O-N 2.87Å; I246-L250 VanDerWaalsContact O-N 3.16Å; I246-N290 HydrophobicContact CD1-CB 4.49Å; I246-A291 HydrophobicContact CD1-CB 3.6Å; I246-A291 HydrophobicContact CG1-CB 3.75Å; I246-L294 HydrophobicContact CB-CD1 4.48Å; I246-L294 HydrophobicContact CG2-CB 3.51Å; I246-L294 HydrophobicContact CG2-CD1 3.54Å; I246-L294 HydrophobicContact CG2-CD2 3.87Å; I246-L294 HydrophobicContact CG2-CG 3.79Å
247	E	62.2	Low	65	Low	136 Å²	136	60.5 Å²	60.5	64%	0.636	30%	0.303	S	S	*	.	H	α-helix	trans	-61.4	-37	175.5	-66.2	177.3	-176.3	0	0	112.7	D245 V249 L250 L251	D245-E247 PolarHBondContact O-N 3.15Å; E247-V249 VanDerWaalsContact C-N 3.33Å; E247-L250 WeakPolarHBondContact O-CB 3.33Å; E247-L250 PolarHBondContact O-N 2.92Å; E247-L251 PolarHBondContact O-N 3.02Å
248	Q	63.6	Low	65	Low	68 Å²	68	55.1 Å²	55.1	32%	0.318	29%	0.288	S	S	.	.	H	α-helix	trans	-72.8	-29.4	177	-65.7	-162.2	10.9	0	0	112.2	N216 D245 I246 L250 L251	N216-Q248 VanDerWaalsContact CG-OE1 3.24Å; N216-Q248 PolarHBondContact ND2-NE2 2.74Å; N216-Q248 PolarHBondContact ND2-OE1 2.59Å; D245-Q248 HydrophobicContact CB-CB 4.26Å; D245-Q248 HydrophobicContact CB-CG 3.97Å; D245-Q248 PolarHBondContact O-N 3.43Å; I246-Q248 VanDerWaalsContact C-N 3.32Å; I246-Q248 PolarHBondContact O-N 2.93Å; Q248-L250 VanDerWaalsContact C-N 3.27Å; Q248-L250 PolarHBondContact O-N 2.68Å; Q248-L251 PolarHBondContact O-N 3.32Å
249	V	61.7	Low	65.2	Low	2 Å²	2	58.7 Å²	58.7	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-67	-31	171.8	177.2	0	0	0	0	111.7	I219 F244 D245 I246 E247 L251 I252 F264 L298	I219-V249 HydrophobicContact CD1-CG2 4.48Å; I219-V249 HydrophobicContact CG2-CG2 4.27Å; F244-V249 HydrophobicContact CD2-CG2 3.52Å; F244-V249 HydrophobicContact CE2-CB 4.33Å; F244-V249 HydrophobicContact CE2-CG2 3.33Å; F244-V249 HydrophobicContact CG-CG2 4.47Å; F244-V249 HydrophobicContact CZ-CG2 4.09Å; D245-V249 PolarHBondContact O-N 3.07Å; I246-V249 WeakPolarHBondContact O-CB 3.44Å; I246-V249 PolarHBondContact O-N 3.21Å; E247-V249 VanDerWaalsContact C-N 3.33Å; V249-L251 VanDerWaalsContact C-N 3.31Å; V249-I252 HydrophobicContact CB-CD1 4.34Å; V249-I252 HydrophobicContact CG1-CD1 4.19Å; V249-I252 HydrophobicContact CG2-CD1 4.46Å; V249-I252 WeakPolarHBondContact O-CB 3.46Å; V249-I252 PolarHBondContact O-N 3.24Å; V249-F264 HydrophobicContact CG1-CD1 4.48Å; V249-F264 HydrophobicContact CG1-CE1 3.66Å; V249-F264 HydrophobicContact CG1-CE2 4.1Å; V249-F264 HydrophobicContact CG1-CZ 3.43Å; V249-F264 VanDerWaalsContact CG1-CZ 3.43Å; V249-L298 HydrophobicContact CG1-CD1 4.25Å
250	L	56.9	Low	65.3	Low	68 Å²	68	58.8 Å²	58.8	36%	0.356	30%	0.299	S	S	.	.	H	α-helix	trans	-69.1	-29.9	175	-67.1	172	0	0	0	112.7	I246 E247 Q248 I252 R257 L294 L298	I246-L250 PolarHBondContact O-N 2.87Å; I246-L250 VanDerWaalsContact O-N 3.16Å; E247-L250 WeakPolarHBondContact O-CB 3.33Å; E247-L250 PolarHBondContact O-N 2.92Å; Q248-L250 VanDerWaalsContact C-N 3.27Å; Q248-L250 PolarHBondContact O-N 2.68Å; L250-I252 PolarHBondContact O-N 3.34Å; L250-R257 PolarHBondContact O-NH2 3.29Å; L250-L294 HydrophobicContact CD1-CD2 3.96Å; L250-L294 HydrophobicContact CD2-CD2 3.73Å; L250-L294 HydrophobicContact CG-CD2 4.13Å; L250-L298 HydrophobicContact CD2-CD1 4.12Å; L250-L298 HydrophobicContact CD2-CD2 3.74Å; L250-L298 HydrophobicContact CD2-CG 4.35Å
251	L	63.3	Low	65.7	Low	150 Å²	150	57.9 Å²	57.9	79%	0.785	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-8.1	177.6	-65	172.1	0	0	0	113.8	E247 Q248 V249	E247-L251 PolarHBondContact O-N 3.02Å; Q248-L251 PolarHBondContact O-N 3.32Å; V249-L251 VanDerWaalsContact C-N 3.31Å
252	I	64.7	Low	66.1	Low	14 Å²	14	60.7 Å²	60.7	7%	0.072	31%	0.309	C	S	.	.	S	Bend	trans	-69.5	133.4	176.5	-61.3	172.2	0	0	0	109.8	I219 A223 V249 L250 A256 R257 L260	I219-I252 HydrophobicContact CG2-CD1 3.55Å; A223-I252 HydrophobicContact CB-CD1 4.27Å; A223-I252 HydrophobicContact CB-CG1 4.28Å; A223-I252 HydrophobicContact CB-CG2 3.66Å; V249-I252 HydrophobicContact CB-CD1 4.34Å; V249-I252 HydrophobicContact CG1-CD1 4.19Å; V249-I252 HydrophobicContact CG2-CD1 4.46Å; V249-I252 WeakPolarHBondContact O-CB 3.46Å; V249-I252 PolarHBondContact O-N 3.24Å; L250-I252 PolarHBondContact O-N 3.34Å; I252-A256 HydrophobicContact CG2-CB 3.38Å; I252-R257 PolarHBondContact O-NH2 2.83Å; I252-R257 VanDerWaalsContact O-NH2 3.09Å; I252-L260 HydrophobicContact CD1-CD1 4.24Å
253	E	64.2	Low	66.6	Low	151 Å²	151	60.4 Å²	60.4	71%	0.706	31%	0.307	S	S	*	.			trans	-51	144.3	175.8	-66.3	178.1	175.1	0	0	111.9	D255 A256 R257	E253-D255 PolarHBondContact O-N 3.37Å; E253-A256 PolarHBondContact O-N 3.1Å; E253-R257 PolarHBondContact O-N 3.33Å
254	D	65.4	Low	67.1	Low	101 Å²	101	58 Å²	58	54%	0.54	29%	0.294	S	S	.	.	H	α-helix	trans	-56.6	-37.1	-174.2	-73.2	-29.5	0	0	0	112.6	R257 S258	D254-R257 WeakPolarHBondContact O-CB 3.48Å; D254-R257 PolarHBondContact O-N 3.48Å; D254-R257 IonicContact OD1-CZ 2.69Å; D254-R257 IonicContact OD1-NH1 2.67Å; D254-R257 PolarHBondContact OD1-NH1 3.21Å; D254-R257 IonicContact OD1-NH2 2.79Å; D254-S258 PolarHBondContact O-N 2.98Å
255	D	67.1	Low	67.5	Low	117 Å²	117	58.5 Å²	58.5	63%	0.626	30%	0.301	S	S	*	.	H	α-helix	trans	-61.7	-46.1	175.4	-75.9	-5.9	0	0	0	111.9	E253 R257 S258 R259	E253-D255 PolarHBondContact O-N 3.37Å; D255-R257 VanDerWaalsContact C-N 3.34Å; D255-S258 PolarHBondContact O-N 2.85Å; D255-S258 PolarHBondContact O-OG 2.92Å; D255-R259 PolarHBondContact O-N 3.29Å
256	A	66.8	Low	68	Low	2 Å²	2	60.6 Å²	60.6	2%	0.017	31%	0.312	C	S	.	.	H	α-helix	trans	-69.3	-33.9	178.3	0	0	0	0	0	112	A223 I252 E253 R259 L260	A223-A256 HydrophobicContact CB-CB 3.86Å; A223-A256 VanDerWaalsContact O-CB 3.24Å; A223-A256 WeakPolarHBondContact O-CB 3.29Å; I252-A256 HydrophobicContact CG2-CB 3.38Å; E253-A256 PolarHBondContact O-N 3.1Å; A256-R259 PolarHBondContact O-N 3.28Å; A256-L260 WeakPolarHBondContact O-CB 3.27Å; A256-L260 WeakPolarHBondContact O-CG 3.36Å; A256-L260 PolarHBondContact O-N 3.06Å
257	R	70.6	Confident	68.7	Low	56 Å²	56	59.3 Å²	59.3	21%	0.211	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-41.9	174.3	-167.7	-173.4	-64.4	140.5	9.6	111.8	L250 I252 E253 D254 D255 R259 L260 Q261 F264	L250-R257 PolarHBondContact O-NH2 3.29Å; I252-R257 PolarHBondContact O-NH2 2.83Å; I252-R257 VanDerWaalsContact O-NH2 3.09Å; E253-R257 PolarHBondContact O-N 3.33Å; D254-R257 WeakPolarHBondContact O-CB 3.48Å; D254-R257 PolarHBondContact O-N 3.48Å; D254-R257 IonicContact OD1-CZ 2.69Å; D254-R257 IonicContact OD1-NH1 2.67Å; D254-R257 PolarHBondContact OD1-NH1 3.21Å; D254-R257 IonicContact OD1-NH2 2.79Å; D255-R257 VanDerWaalsContact C-N 3.34Å; R257-R259 VanDerWaalsContact C-N 3.33Å; R257-R259 PolarHBondContact O-N 3.21Å; R257-L260 PolarHBondContact O-N 3.13Å; R257-Q261 PolarHBondContact O-N 3.27Å; R257-F264 HydrophobicContact CG-CE2 4Å
258	S	70	Confident	69.3	Low	67 Å²	67	55.2 Å²	55.2	47%	0.469	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-41.1	176.3	77.2	0	0	0	0	112	D254 D255 Q261	D254-S258 PolarHBondContact O-N 2.98Å; D255-S258 PolarHBondContact O-N 2.85Å; D255-S258 PolarHBondContact O-OG 2.92Å; S258-Q261 WeakPolarHBondContact O-CB 3.27Å; S258-Q261 PolarHBondContact O-N 3.19Å
259	R	68.6	Low	70	Confident	86 Å²	86	57.2 Å²	57.2	33%	0.325	29%	0.293	S	S	.	.	H	α-helix	trans	-67.2	-36.6	177.2	-66.8	-170.2	-63.9	-114.3	1.2	113	A223 D255 A256 R257 P262	A223-R259 PolarHBondContact O-NH2 3.15Å; D255-R259 PolarHBondContact O-N 3.29Å; A256-R259 PolarHBondContact O-N 3.28Å; R257-R259 VanDerWaalsContact C-N 3.33Å; R257-R259 PolarHBondContact O-N 3.21Å; R259-P262 WeakPolarHBondContact O-CD 3.26Å
260	L	72.4	Confident	70.5	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-86.5	-5.6	-179.2	-66.8	175.3	0	0	0	113.5	A223 L235 I252 A256 R257 P262 V263 F264	A223-L260 HydrophobicContact CB-CD1 4.14Å; L235-L260 HydrophobicContact CD2-CD2 3.92Å; I252-L260 HydrophobicContact CD1-CD1 4.24Å; A256-L260 WeakPolarHBondContact O-CB 3.27Å; A256-L260 WeakPolarHBondContact O-CG 3.36Å; A256-L260 PolarHBondContact O-N 3.06Å; R257-L260 PolarHBondContact O-N 3.13Å; L260-P262 VanDerWaalsContact C-CD 3.42Å; L260-P262 VanDerWaalsContact C-N 3.33Å; L260-V263 HydrophobicContact CD2-CG2 4.24Å; L260-V263 WeakPolarHBondContact O-CA 3.39Å; L260-V263 VanDerWaalsContact O-CB 3.3Å; L260-V263 WeakPolarHBondContact O-CB 3.45Å; L260-V263 PolarHBondContact O-N 3.3Å; L260-F264 HydrophobicContact CB-CD2 4.31Å; L260-F264 HydrophobicContact CB-CE1 4.04Å; L260-F264 HydrophobicContact CB-CE2 3.65Å; L260-F264 HydrophobicContact CB-CZ 3.5Å; L260-F264 VanDerWaalsContact CB-CZ 3.5Å; L260-F264 HydrophobicContact CD1-CZ 4.05Å; L260-F264 HydrophobicContact CG-CZ 4.43Å; L260-F264 WeakPolarHBondContact O-CG 3.49Å; L260-F264 PolarHBondContact O-N 3.3Å
261	Q	73.2	Confident	71.3	Confident	50 Å²	50	55.5 Å²	55.5	23%	0.234	29%	0.286	C	S	.	.	H	α-helix	trans	-50.9	-41.8	179	-173.4	175.9	-10.6	0	0	114.1	R257 S258 V263 F264 A265 T299 T302	R257-Q261 PolarHBondContact O-N 3.27Å; S258-Q261 WeakPolarHBondContact O-CB 3.27Å; S258-Q261 PolarHBondContact O-N 3.19Å; Q261-V263 VanDerWaalsContact C-N 3.3Å; Q261-V263 PolarHBondContact O-N 2.93Å; Q261-F264 PolarHBondContact O-N 2.88Å; Q261-A265 PolarHBondContact O-N 3.2Å; Q261-T299 HydrophobicContact CG-CG2 4.29Å; Q261-T299 PolarHBondContact NE2-O 3.37Å; Q261-T302 PolarHBondContact NE2-OG1 3.25Å; Q261-T302 PolarHBondContact OE1-OG1 2.96Å; Q261-T302 VanDerWaalsContact OE1-OG1 3.13Å
262	P	74.7	Confident	71.9	Confident	83 Å²	83	52.7 Å²	52.7	54%	0.539	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-33.9	175.3	-22.1	34.7	0	0	0	113.3	R259 L260 L266	R259-P262 WeakPolarHBondContact O-CD 3.26Å; L260-P262 VanDerWaalsContact C-CD 3.42Å; L260-P262 VanDerWaalsContact C-N 3.33Å; P262-L266 PolarHBondContact O-N 2.92Å
263	V	75.2	Confident	72.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-68.7	-44.5	176.3	-175.8	0	0	0	0	110.1	P232 L235 I236 L260 Q261 A265 L266 W267	P232-V263 HydrophobicContact CB-CG2 3.52Å; P232-V263 HydrophobicContact CG-CG2 4.46Å; L235-V263 HydrophobicContact CD2-CG1 4.08Å; L235-V263 HydrophobicContact CG-CG1 4.39Å; I236-V263 HydrophobicContact CD1-CG2 4.25Å; I236-V263 HydrophobicContact CG1-CG1 3.92Å; I236-V263 HydrophobicContact CG1-CG2 4.33Å; L260-V263 HydrophobicContact CD2-CG2 4.24Å; L260-V263 WeakPolarHBondContact O-CA 3.39Å; L260-V263 VanDerWaalsContact O-CB 3.3Å; L260-V263 WeakPolarHBondContact O-CB 3.45Å; L260-V263 PolarHBondContact O-N 3.3Å; Q261-V263 VanDerWaalsContact C-N 3.3Å; Q261-V263 PolarHBondContact O-N 2.93Å; V263-A265 VanDerWaalsContact C-N 3.32Å; V263-A265 PolarHBondContact O-N 3.46Å; V263-L266 PolarHBondContact O-N 3.43Å; V263-W267 HydrophobicContact CG1-CD2 3.69Å; V263-W267 HydrophobicContact CG1-CE3 3.81Å; V263-W267 HydrophobicContact CG1-CG 4.4Å; V263-W267 HydrophobicContact CG1-CH2 3.81Å; V263-W267 HydrophobicContact CG1-CZ2 3.68Å; V263-W267 HydrophobicContact CG1-CZ3 3.88Å; V263-W267 WeakPolarHBondContact O-CB 3.44Å; V263-W267 PolarHBondContact O-N 2.75Å
264	F	76.1	Confident	72.6	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.009	27%	0.265	C	S	.	.	H	α-helix	trans	-61	-39.1	178.1	-63	-27.5	0	0	0	112.8	V249 R257 L260 Q261 W267 R268 L295 T299	V249-F264 HydrophobicContact CG1-CD1 4.48Å; V249-F264 HydrophobicContact CG1-CE1 3.66Å; V249-F264 HydrophobicContact CG1-CE2 4.1Å; V249-F264 HydrophobicContact CG1-CZ 3.43Å; V249-F264 VanDerWaalsContact CG1-CZ 3.43Å; R257-F264 HydrophobicContact CG-CE2 4Å; L260-F264 HydrophobicContact CB-CD2 4.31Å; L260-F264 HydrophobicContact CB-CE1 4.04Å; L260-F264 HydrophobicContact CB-CE2 3.65Å; L260-F264 HydrophobicContact CB-CZ 3.5Å; L260-F264 VanDerWaalsContact CB-CZ 3.5Å; L260-F264 HydrophobicContact CD1-CZ 4.05Å; L260-F264 HydrophobicContact CG-CZ 4.43Å; L260-F264 WeakPolarHBondContact O-CG 3.49Å; L260-F264 PolarHBondContact O-N 3.3Å; Q261-F264 PolarHBondContact O-N 2.88Å; F264-W267 AromaticContact CD1-CE3 3.93Å; F264-W267 HydrophobicContact CD1-CE3 3.93Å; F264-W267 HydrophobicContact CD1-CZ3 4.05Å; F264-W267 HydrophobicContact CE1-CE3 4.39Å; F264-W267 HydrophobicContact CE1-CZ3 4.04Å; F264-R268 WeakPolarHBondContact O-CB 3.42Å; F264-R268 PolarHBondContact O-N 3.32Å; F264-L295 HydrophobicContact CB-CD2 3.72Å; F264-L295 HydrophobicContact CD1-CD2 3.82Å; F264-L295 HydrophobicContact CG-CD2 3.88Å; F264-T299 HydrophobicContact CB-CG2 4.38Å
265	A	75.2	Confident	72.9	Confident	26 Å²	26	47 Å²	47	22%	0.215	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-45.9	175.1	0	0	0	0	0	112	Q261 V263 R268 E269 T299	Q261-A265 PolarHBondContact O-N 3.2Å; V263-A265 VanDerWaalsContact C-N 3.32Å; V263-A265 PolarHBondContact O-N 3.46Å; A265-R268 WeakPolarHBondContact O-CB 3.2Å; A265-R268 PolarHBondContact O-N 3.13Å; A265-E269 PolarHBondContact O-N 3.36Å; A265-E269 VanDerWaalsContact O-N 3.14Å; A265-T299 HydrophobicContact CB-CG2 4.35Å
266	L	75.4	Confident	73	Confident	63 Å²	63	45.4 Å²	45.4	33%	0.33	25%	0.248	S	C	.	.	H	α-helix	trans	-67.6	-39.2	179.2	-172.3	70.4	0	0	0	112.3	I236 P262 V263 R268 E269 T270	I236-L266 HydrophobicContact CB-CD2 4.32Å; I236-L266 HydrophobicContact CD1-CD2 3.5Å; I236-L266 VanDerWaalsContact CD1-CD2 3.5Å; I236-L266 HydrophobicContact CG1-CD2 3.87Å; I236-L266 HydrophobicContact CG2-CD2 3.49Å; I236-L266 VanDerWaalsContact CG2-CD2 3.49Å; P262-L266 PolarHBondContact O-N 2.92Å; V263-L266 PolarHBondContact O-N 3.43Å; L266-R268 VanDerWaalsContact C-N 3.33Å; L266-E269 PolarHBondContact O-N 3.11Å; L266-T270 WeakPolarHBondContact O-CB 3.03Å; L266-T270 PolarHBondContact O-N 3.26Å; L266-T270 PolarHBondContact O-OG1 2.97Å
267	W	75.3	Confident	72.9	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-63.3	-39.7	174.6	-82.5	-17.5	0	0	0	112.3	I219 L235 L239 P242 F244 V263 F264 T270 I271 L295	I219-W267 HydrophobicContact CD1-CH2 3.78Å; I219-W267 HydrophobicContact CD1-CZ3 3.97Å; I219-W267 HydrophobicContact CG1-CH2 3.8Å; I219-W267 HydrophobicContact CG1-CZ3 4.32Å; L235-W267 HydrophobicContact CD1-CH2 4.42Å; L235-W267 HydrophobicContact CD1-CZ2 4.39Å; L235-W267 HydrophobicContact CD2-CH2 3.9Å; L235-W267 HydrophobicContact CD2-CZ2 4.27Å; L235-W267 HydrophobicContact CG-CH2 4.06Å; L235-W267 HydrophobicContact CG-CZ2 3.96Å; L239-W267 HydrophobicContact CB-CZ2 3.97Å; L239-W267 HydrophobicContact CD1-CH2 4.41Å; L239-W267 HydrophobicContact CD1-CZ2 4.15Å; L239-W267 PolarHBondContact O-NE1 3.11Å; P242-W267 HydrophobicContact CB-CD2 4.02Å; P242-W267 HydrophobicContact CB-CE3 4.4Å; P242-W267 HydrophobicContact CB-CG 4.1Å; P242-W267 HydrophobicContact CG-CB 3.94Å; P242-W267 HydrophobicContact CG-CD2 4.25Å; P242-W267 HydrophobicContact CG-CG 3.8Å; F244-W267 HydrophobicContact CD1-CE3 4.37Å; F244-W267 HydrophobicContact CD1-CH2 4.36Å; F244-W267 HydrophobicContact CD1-CZ3 4.04Å; F244-W267 HydrophobicContact CE1-CD2 4.01Å; F244-W267 AromaticContact CE1-CE3 3.31Å; F244-W267 HydrophobicContact CE1-CE3 3.31Å; F244-W267 AromaticContact CE1-CH2 3.99Å; F244-W267 HydrophobicContact CE1-CH2 3.99Å; F244-W267 AromaticContact CE1-CZ3 3.29Å; F244-W267 HydrophobicContact CE1-CZ3 3.29Å; F244-W267 AromaticContact CZ-CE3 3.78Å; F244-W267 HydrophobicContact CZ-CE3 3.78Å; F244-W267 AromaticContact CZ-CZ3 3.88Å; F244-W267 HydrophobicContact CZ-CZ3 3.88Å; V263-W267 HydrophobicContact CG1-CD2 3.69Å; V263-W267 HydrophobicContact CG1-CE3 3.81Å; V263-W267 HydrophobicContact CG1-CG 4.4Å; V263-W267 HydrophobicContact CG1-CH2 3.81Å; V263-W267 HydrophobicContact CG1-CZ2 3.68Å; V263-W267 HydrophobicContact CG1-CZ3 3.88Å; V263-W267 WeakPolarHBondContact O-CB 3.44Å; V263-W267 PolarHBondContact O-N 2.75Å; F264-W267 AromaticContact CD1-CE3 3.93Å; F264-W267 HydrophobicContact CD1-CE3 3.93Å; F264-W267 HydrophobicContact CD1-CZ3 4.05Å; F264-W267 HydrophobicContact CE1-CE3 4.39Å; F264-W267 HydrophobicContact CE1-CZ3 4.04Å; W267-T270 PolarHBondContact O-N 2.9Å; W267-I271 WeakPolarHBondContact O-CB 3.09Å; W267-I271 WeakPolarHBondContact O-CD1 3.42Å; W267-I271 WeakPolarHBondContact O-CG1 3.47Å; W267-I271 PolarHBondContact O-N 3.45Å; W267-L295 HydrophobicContact CB-CD1 4.27Å
268	R	75.1	Confident	72.4	Confident	50 Å²	50	52.8 Å²	52.8	19%	0.189	29%	0.291	C	S	.	.	H	α-helix	trans	-56.8	-51.6	172.1	-179.9	-169.6	65.2	-147	-3.1	110.8	F264 A265 L266 T270 I271 E272 A292 L295 T299	F264-R268 WeakPolarHBondContact O-CB 3.42Å; F264-R268 PolarHBondContact O-N 3.32Å; A265-R268 WeakPolarHBondContact O-CB 3.2Å; A265-R268 PolarHBondContact O-N 3.13Å; L266-R268 VanDerWaalsContact C-N 3.33Å; R268-T270 VanDerWaalsContact C-N 3.28Å; R268-T270 PolarHBondContact O-N 3.45Å; R268-I271 PolarHBondContact O-N 3.45Å; R268-E272 HydrophobicContact CG-CG 4.39Å; R268-E272 WeakPolarHBondContact CG-OE1 3.33Å; R268-E272 WeakPolarHBondContact O-CB 3.18Å; R268-E272 WeakPolarHBondContact O-CG 3.39Å; R268-E272 PolarHBondContact O-N 2.85Å; R268-A292 HydrophobicContact CG-CB 4.46Å; R268-L295 HydrophobicContact CB-CB 4.17Å; R268-L295 HydrophobicContact CB-CD1 4.31Å; R268-T299 PolarHBondContact NH1-OG1 3.47Å
269	E	77.1	Confident	71.8	Confident	109 Å²	109	59.1 Å²	59.1	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-59.6	-40.4	178.5	-70.4	173	-173.2	0	0	112	A265 L266 E272 S273	A265-E269 PolarHBondContact O-N 3.36Å; A265-E269 VanDerWaalsContact O-N 3.14Å; L266-E269 PolarHBondContact O-N 3.11Å; E269-E272 PolarHBondContact O-N 2.8Å; E269-S273 WeakPolarHBondContact O-CB 3.48Å; E269-S273 PolarHBondContact O-N 3.19Å
270	T	73.9	Confident	71.4	Confident	34 Å²	34	57.8 Å²	57.8	21%	0.209	31%	0.309	C	S	.	.	H	α-helix	trans	-66.4	-42.7	178.7	-51.5	0	0	0	0	111.4	P240 L266 W267 R268 H274	P240-T270 WeakPolarHBondContact O-CG2 3.49Å; L266-T270 WeakPolarHBondContact O-CB 3.03Å; L266-T270 PolarHBondContact O-N 3.26Å; L266-T270 PolarHBondContact O-OG1 2.97Å; W267-T270 PolarHBondContact O-N 2.9Å; R268-T270 VanDerWaalsContact C-N 3.28Å; R268-T270 PolarHBondContact O-N 3.45Å; T270-H274 WeakPolarHBondContact O-CB 3.46Å; T270-H274 PolarHBondContact O-N 3.33Å; T270-H274 PolarHBondContact O-ND1 3.2Å
271	I	72.3	Confident	71	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.5	-48.5	176	-70.2	161.6	0	0	0	110.2	P242 W267 R268 S273 H274 I275 L288 A291 A292 L295	P242-I271 HydrophobicContact CG-CD1 3.59Å; P242-I271 HydrophobicContact CG-CG1 3.67Å; W267-I271 WeakPolarHBondContact O-CB 3.09Å; W267-I271 WeakPolarHBondContact O-CD1 3.42Å; W267-I271 WeakPolarHBondContact O-CG1 3.47Å; W267-I271 PolarHBondContact O-N 3.45Å; R268-I271 PolarHBondContact O-N 3.45Å; I271-S273 VanDerWaalsContact C-N 3.33Å; I271-S273 PolarHBondContact O-N 3.18Å; I271-H274 PolarHBondContact O-N 3.46Å; I271-H274 VanDerWaalsContact O-N 3.17Å; I271-I275 HydrophobicContact CG2-CD1 3.51Å; I271-I275 HydrophobicContact CG2-CG1 4.16Å; I271-I275 VanDerWaalsContact O-CG1 3.26Å; I271-I275 WeakPolarHBondContact O-CG1 3.41Å; I271-I275 PolarHBondContact O-N 3.33Å; I271-L288 HydrophobicContact CG1-CD2 4.25Å; I271-L288 HydrophobicContact CG2-CB 3.87Å; I271-L288 HydrophobicContact CG2-CD2 4.21Å; I271-L288 WeakPolarHBondContact CG2-O 2.9Å; I271-A291 HydrophobicContact CD1-CB 4.17Å; I271-A292 HydrophobicContact CG2-CB 4.16Å; I271-L295 HydrophobicContact CD1-CD1 3.84Å
272	E	75.6	Confident	70.7	Confident	92 Å²	92	64.2 Å²	64.2	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-60	-42.2	179.8	-74.1	170.9	176.6	0	0	111.6	R268 E269 A276 A292	R268-E272 HydrophobicContact CG-CG 4.39Å; R268-E272 WeakPolarHBondContact CG-OE1 3.33Å; R268-E272 WeakPolarHBondContact O-CB 3.18Å; R268-E272 WeakPolarHBondContact O-CG 3.39Å; R268-E272 PolarHBondContact O-N 2.85Å; E269-E272 PolarHBondContact O-N 2.8Å; E272-A276 PolarHBondContact O-N 3.21Å; E272-A292 HydrophobicContact CG-CB 4.34Å
273	S	74.5	Confident	70.4	Confident	60 Å²	60	67.1 Å²	67.1	42%	0.42	36%	0.364	S	S	.	.	H	α-helix	trans	-64.6	-44.8	173	-169.5	0	0	0	0	112	E269 I271 I275 A276 D277	E269-S273 WeakPolarHBondContact O-CB 3.48Å; E269-S273 PolarHBondContact O-N 3.19Å; I271-S273 VanDerWaalsContact C-N 3.33Å; I271-S273 PolarHBondContact O-N 3.18Å; S273-I275 PolarHBondContact O-N 3.22Å; S273-A276 WeakPolarHBondContact O-CB 3.48Å; S273-A276 PolarHBondContact O-N 3.27Å; S273-A276 VanDerWaalsContact O-N 3.15Å; S273-D277 VanDerWaalsContact O-CG 3.3Å; S273-D277 PolarHBondContact O-N 3.23Å; S273-D277 PolarHBondContact OG-OD2 3.32Å
274	H	70.3	Confident	69.8	Low	61 Å²	61	69.3 Å²	69.3	28%	0.282	38%	0.377	S	S	.	.	H	α-helix	trans	-67.3	-35.9	-178.9	-82.7	63.4	0	0	0	112.8	L241 T270 I271 A276 D277 L278 Y280	L241-H274 HydrophobicContact CD1-CB 4.31Å; T270-H274 WeakPolarHBondContact O-CB 3.46Å; T270-H274 PolarHBondContact O-N 3.33Å; T270-H274 PolarHBondContact O-ND1 3.2Å; I271-H274 PolarHBondContact O-N 3.46Å; I271-H274 VanDerWaalsContact O-N 3.17Å; H274-A276 VanDerWaalsContact C-N 3.26Å; H274-A276 PolarHBondContact O-N 3.45Å; H274-D277 PolarHBondContact O-N 3.22Å; H274-L278 PolarHBondContact O-N 3.05Å; H274-Y280 HydrophobicContact CB-CE2 4.5Å
275	I	70.8	Confident	69.4	Low	25 Å²	25	74.9 Å²	74.9	13%	0.128	40%	0.398	C	S	.	.	H	α-helix	trans	-63.8	-35.7	173.5	-67.6	163.6	0	0	0	110.4	I271 S273 R285 L288 E289	I271-I275 HydrophobicContact CG2-CD1 3.51Å; I271-I275 HydrophobicContact CG2-CG1 4.16Å; I271-I275 VanDerWaalsContact O-CG1 3.26Å; I271-I275 WeakPolarHBondContact O-CG1 3.41Å; I271-I275 PolarHBondContact O-N 3.33Å; S273-I275 PolarHBondContact O-N 3.22Å; I275-R285 HydrophobicContact CG2-CG 4.49Å; I275-L288 HydrophobicContact CD1-CB 3.88Å; I275-L288 HydrophobicContact CG1-CB 4.05Å; I275-L288 HydrophobicContact CG1-CD1 4.44Å; I275-E289 HydrophobicContact CD1-CG 3.85Å
276	A	69.3	Low	69.2	Low	83 Å²	83	79.2 Å²	79.2	69%	0.686	41%	0.414	S	S	*	.	H	α-helix	trans	-72.4	-33.6	178	0	0	0	0	0	112.9	E272 S273 H274	E272-A276 PolarHBondContact O-N 3.21Å; S273-A276 WeakPolarHBondContact O-CB 3.48Å; S273-A276 PolarHBondContact O-N 3.27Å; S273-A276 VanDerWaalsContact O-N 3.15Å; H274-A276 VanDerWaalsContact C-N 3.26Å; H274-A276 PolarHBondContact O-N 3.45Å
277	D	64.9	Low	68.9	Low	118 Å²	118	82.1 Å²	82.1	63%	0.631	42%	0.421	S	S	*	.	H	α-helix	trans	-90.1	-17.9	-172.2	-68.1	-30.1	0	0	0	114.6	S273 H274	S273-D277 VanDerWaalsContact O-CG 3.3Å; S273-D277 PolarHBondContact O-N 3.23Å; S273-D277 PolarHBondContact OG-OD2 3.32Å; H274-D277 PolarHBondContact O-N 3.22Å
278	L	60	Low	68.6	Low	95 Å²	95	82.4 Å²	82.4	50%	0.497	42%	0.422	S	S	.	.			trans	-136.8	132.8	-170.5	-70.3	165.1	0	0	0	114	H274 Y280	H274-L278 PolarHBondContact O-N 3.05Å; L278-Y280 HydrophobicContact CB-CD2 3.96Å; L278-Y280 HydrophobicContact CB-CE2 3.58Å; L278-Y280 HydrophobicContact CD1-CE2 4.1Å; L278-Y280 WeakPolarHBondContact CD1-OH 3.4Å; L278-Y280 HydrophobicContact CG-CE2 4.49Å; L278-Y280 WeakPolarHBondContact O-CD2 3.38Å; L278-Y280 PolarHBondContact O-N 3.07Å
279	E	57.4	Low	68.5	Low	200 Å²	200	83 Å²	83	94%	0.935	43%	0.427	S	S	*	.			trans	-73.4	87.9	167.5	-72.3	-174.8	165.2	0	0	110.3
280	Y	60.2	Low	68.3	Low	59 Å²	59	81 Å²	81	23%	0.231	42%	0.42	C	S	.	.			trans	-76.6	152.3	170.6	-72.8	-80.8	0	0	0	111.8	H274 L278 T284 L288	H274-Y280 HydrophobicContact CB-CE2 4.5Å; L278-Y280 HydrophobicContact CB-CD2 3.96Å; L278-Y280 HydrophobicContact CB-CE2 3.58Å; L278-Y280 HydrophobicContact CD1-CE2 4.1Å; L278-Y280 WeakPolarHBondContact CD1-OH 3.4Å; L278-Y280 HydrophobicContact CG-CE2 4.49Å; L278-Y280 WeakPolarHBondContact O-CD2 3.38Å; L278-Y280 PolarHBondContact O-N 3.07Å; Y280-T284 HydrophobicContact CD1-CG2 3.86Å; Y280-T284 HydrophobicContact CG-CG2 4.32Å; Y280-L288 HydrophobicContact CD2-CD1 4.39Å; Y280-L288 HydrophobicContact CE2-CD1 4.31Å
281	P	65.4	Low	68.1	Low	89 Å²	89	79.9 Å²	79.9	58%	0.578	41%	0.414	S	S	*	.			trans	-51	142.1	164.1	-22.6	32.6	0	0	0	110.5	E283 T284 R285	P281-E283 PolarHBondContact O-N 2.68Å; P281-E283 VanDerWaalsContact O-N 3.08Å; P281-T284 PolarHBondContact O-N 3.16Å; P281-R285 PolarHBondContact O-N 3.44Å; P281-R285 VanDerWaalsContact O-N 3.07Å
282	S	66.1	Low	68.1	Low	98 Å²	98	80.2 Å²	80.2	69%	0.685	42%	0.417	S	S	*	.	H	α-helix	trans	-49.3	-42.3	-172.1	51.8	0	0	0	0	113.4	T284 R285 E286	S282-T284 PolarHBondContact O-N 3.22Å; S282-R285 PolarHBondContact O-N 3.45Å; S282-E286 WeakPolarHBondContact O-CB 3.22Å; S282-E286 PolarHBondContact O-N 2.7Å
283	E	67.1	Low	68	Low	144 Å²	144	81 Å²	81	67%	0.673	42%	0.419	S	S	*	.	H	α-helix	trans	-64.5	-38.4	179.2	-63.9	179.7	176.1	0	0	113.2	P281 R287	P281-E283 PolarHBondContact O-N 2.68Å; P281-E283 VanDerWaalsContact O-N 3.08Å; E283-R287 WeakPolarHBondContact O-CB 3.43Å; E283-R287 WeakPolarHBondContact O-CD 3.22Å; E283-R287 WeakPolarHBondContact O-CG 3.42Å; E283-R287 PolarHBondContact O-N 2.85Å
284	T	63.6	Low	67.7	Low	46 Å²	46	80.4 Å²	80.4	28%	0.282	41%	0.411	S	S	.	.	H	α-helix	trans	-73.7	-38.8	179.8	-56.2	0	0	0	0	110.3	Y280 P281 S282 R287 L288	Y280-T284 HydrophobicContact CD1-CG2 3.86Å; Y280-T284 HydrophobicContact CG-CG2 4.32Å; P281-T284 PolarHBondContact O-N 3.16Å; S282-T284 PolarHBondContact O-N 3.22Å; T284-R287 PolarHBondContact O-N 2.92Å; T284-L288 HydrophobicContact CG2-CD1 4.2Å; T284-L288 WeakPolarHBondContact O-CB 3.27Å; T284-L288 VanDerWaalsContact O-CG 3.29Å; T284-L288 WeakPolarHBondContact O-CG 3.47Å; T284-L288 PolarHBondContact O-N 2.8Å
285	R	68.4	Low	67.7	Low	118 Å²	118	77.5 Å²	77.5	45%	0.445	40%	0.397	S	S	.	.	H	α-helix	trans	-62	-51	175.3	-178.4	177.2	177.4	151.2	4.8	111.7	I275 P281 S282 R287 L288 E289	I275-R285 HydrophobicContact CG2-CG 4.49Å; P281-R285 PolarHBondContact O-N 3.44Å; P281-R285 VanDerWaalsContact O-N 3.07Å; S282-R285 PolarHBondContact O-N 3.45Å; R285-R287 VanDerWaalsContact C-N 3.28Å; R285-R287 PolarHBondContact O-N 3.15Å; R285-L288 PolarHBondContact O-N 3.36Å; R285-L288 VanDerWaalsContact O-N 3.16Å; R285-E289 HydrophobicContact CG-CG 4.39Å; R285-E289 WeakPolarHBondContact CG-OE1 3.14Å; R285-E289 IonicContact CZ-OE1 3.66Å; R285-E289 IonicContact NE-OE1 3.54Å; R285-E289 PolarHBondContact NE-OE1 2.87Å; R285-E289 IonicContact NH2-OE1 2.69Å; R285-E289 WeakPolarHBondContact O-CG 3.23Å; R285-E289 PolarHBondContact O-N 3.43Å
286	E	71.4	Confident	67.8	Low	118 Å²	118	81.5 Å²	81.5	55%	0.551	42%	0.415	S	S	*	.	H	α-helix	trans	-57.3	-42.7	179.3	-176	-179.8	179	0	0	111.7	S282 E289 N290	S282-E286 WeakPolarHBondContact O-CB 3.22Å; S282-E286 PolarHBondContact O-N 2.7Å; E286-E289 PolarHBondContact O-N 2.84Å; E286-N290 WeakPolarHBondContact O-CB 3.5Å; E286-N290 VanDerWaalsContact O-CG 3.25Å; E286-N290 PolarHBondContact O-N 3.49Å; E286-N290 PolarHBondContact O-ND2 3.15Å
287	R	68.2	Low	67.8	Low	124 Å²	124	86 Å²	86	47%	0.468	41%	0.414	S	S	.	.	H	α-helix	trans	-63.5	-44.2	176.4	-73.3	174.8	67.5	-170.9	-2.9	112.8	E283 T284 R285 N290 A291	E283-R287 WeakPolarHBondContact O-CB 3.43Å; E283-R287 WeakPolarHBondContact O-CD 3.22Å; E283-R287 WeakPolarHBondContact O-CG 3.42Å; E283-R287 PolarHBondContact O-N 2.85Å; T284-R287 PolarHBondContact O-N 2.92Å; R285-R287 VanDerWaalsContact C-N 3.28Å; R285-R287 PolarHBondContact O-N 3.15Å; R287-N290 PolarHBondContact O-N 3.29Å; R287-A291 WeakPolarHBondContact O-CB 3.47Å; R287-A291 PolarHBondContact O-N 3.46Å
288	L	68.6	Low	67.7	Low	7 Å²	7	81.6 Å²	81.6	4%	0.037	39%	0.391	C	S	.	.	H	α-helix	trans	-65.8	-39.8	177.3	-72.7	174.2	0	0	0	111.5	L243 I271 I275 Y280 T284 R285 A291 A292	L243-L288 HydrophobicContact CD2-CD2 4.4Å; I271-L288 HydrophobicContact CG1-CD2 4.25Å; I271-L288 HydrophobicContact CG2-CB 3.87Å; I271-L288 HydrophobicContact CG2-CD2 4.21Å; I271-L288 WeakPolarHBondContact CG2-O 2.9Å; I275-L288 HydrophobicContact CD1-CB 3.88Å; I275-L288 HydrophobicContact CG1-CB 4.05Å; I275-L288 HydrophobicContact CG1-CD1 4.44Å; Y280-L288 HydrophobicContact CD2-CD1 4.39Å; Y280-L288 HydrophobicContact CE2-CD1 4.31Å; T284-L288 HydrophobicContact CG2-CD1 4.2Å; T284-L288 WeakPolarHBondContact O-CB 3.27Å; T284-L288 VanDerWaalsContact O-CG 3.29Å; T284-L288 WeakPolarHBondContact O-CG 3.47Å; T284-L288 PolarHBondContact O-N 2.8Å; R285-L288 PolarHBondContact O-N 3.36Å; R285-L288 VanDerWaalsContact O-N 3.16Å; L288-A291 WeakPolarHBondContact O-CB 3.42Å; L288-A291 PolarHBondContact O-N 2.92Å; L288-A292 PolarHBondContact O-N 3.22Å
289	E	73.4	Confident	67.9	Low	62 Å²	62	77.6 Å²	77.6	29%	0.29	37%	0.37	S	S	.	.	H	α-helix	trans	-63.2	-42.6	174.3	-73.1	177.8	-174.4	0	0	111.7	I275 R285 E286 A291 A292 K293	I275-E289 HydrophobicContact CD1-CG 3.85Å; R285-E289 HydrophobicContact CG-CG 4.39Å; R285-E289 WeakPolarHBondContact CG-OE1 3.14Å; R285-E289 IonicContact CZ-OE1 3.66Å; R285-E289 IonicContact NE-OE1 3.54Å; R285-E289 PolarHBondContact NE-OE1 2.87Å; R285-E289 IonicContact NH2-OE1 2.69Å; R285-E289 WeakPolarHBondContact O-CG 3.23Å; R285-E289 PolarHBondContact O-N 3.43Å; E286-E289 PolarHBondContact O-N 2.84Å; E289-A291 VanDerWaalsContact C-N 3.34Å; E289-A292 PolarHBondContact O-N 3.02Å; E289-K293 WeakPolarHBondContact O-CG 3.37Å; E289-K293 PolarHBondContact O-N 2.85Å
290	N	73	Confident	68	Low	69 Å²	69	70.7 Å²	70.7	37%	0.369	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-39	174.4	-73	-20.6	0	0	0	111.6	I246 E286 R287 K293 L294	I246-N290 HydrophobicContact CD1-CB 4.49Å; E286-N290 WeakPolarHBondContact O-CB 3.5Å; E286-N290 VanDerWaalsContact O-CG 3.25Å; E286-N290 PolarHBondContact O-N 3.49Å; E286-N290 PolarHBondContact O-ND2 3.15Å; R287-N290 PolarHBondContact O-N 3.29Å; N290-K293 PolarHBondContact O-N 3.46Å; N290-L294 WeakPolarHBondContact O-CB 3.3Å; N290-L294 PolarHBondContact O-N 2.92Å
291	A	69.4	Low	67.7	Low	9 Å²	9	76 Å²	76	7%	0.074	37%	0.372	C	S	.	.	H	α-helix	trans	-61.1	-48	173.6	0	0	0	0	0	111.9	I246 I271 R287 L288 E289 K293 L294 L295	I246-A291 HydrophobicContact CD1-CB 3.6Å; I246-A291 HydrophobicContact CG1-CB 3.75Å; I271-A291 HydrophobicContact CD1-CB 4.17Å; R287-A291 WeakPolarHBondContact O-CB 3.47Å; R287-A291 PolarHBondContact O-N 3.46Å; L288-A291 WeakPolarHBondContact O-CB 3.42Å; L288-A291 PolarHBondContact O-N 2.92Å; E289-A291 VanDerWaalsContact C-N 3.34Å; A291-K293 PolarHBondContact O-N 3.43Å; A291-L294 PolarHBondContact O-N 2.69Å; A291-L295 WeakPolarHBondContact O-CB 3.33Å; A291-L295 VanDerWaalsContact O-CG 3.24Å; A291-L295 WeakPolarHBondContact O-CG 3.23Å; A291-L295 PolarHBondContact O-N 3.15Å
292	A	71.5	Confident	66.7	Low	7 Å²	7	76 Å²	76	6%	0.058	37%	0.371	C	S	.	.	H	α-helix	trans	-59.6	-46.2	178.6	0	0	0	0	0	111.8	R268 I271 E272 L288 E289 L294 L295 Q296	R268-A292 HydrophobicContact CG-CB 4.46Å; I271-A292 HydrophobicContact CG2-CB 4.16Å; E272-A292 HydrophobicContact CG-CB 4.34Å; L288-A292 PolarHBondContact O-N 3.22Å; E289-A292 PolarHBondContact O-N 3.02Å; A292-L294 VanDerWaalsContact C-N 3.33Å; A292-L294 PolarHBondContact O-N 2.87Å; A292-L295 PolarHBondContact O-N 3.31Å; A292-Q296 WeakPolarHBondContact O-CB 3.37Å; A292-Q296 PolarHBondContact O-N 3.37Å
293	K	73.5	Confident	65.2	Low	110 Å²	110	79.4 Å²	79.4	48%	0.478	38%	0.376	S	S	.	.	H	α-helix	trans	-59.6	-41.1	176.3	-72.3	171.3	-173.2	166.9	0	112.3	E289 N290 A291 Q296 R297	E289-K293 WeakPolarHBondContact O-CG 3.37Å; E289-K293 PolarHBondContact O-N 2.85Å; N290-K293 PolarHBondContact O-N 3.46Å; A291-K293 PolarHBondContact O-N 3.43Å; K293-Q296 WeakPolarHBondContact O-CB 3.26Å; K293-Q296 PolarHBondContact O-N 3.14Å; K293-R297 WeakPolarHBondContact O-CG 3.4Å; K293-R297 PolarHBondContact O-N 2.84Å
294	L	69.3	Low	63.5	Low	46 Å²	46	75.2 Å²	75.2	24%	0.241	37%	0.371	C	S	.	.	H	α-helix	trans	-73.8	-42.4	-179.3	-124.3	148.3	0	0	0	111.9	I246 L250 N290 A291 A292 Q296 R297 L298	I246-L294 HydrophobicContact CB-CD1 4.48Å; I246-L294 HydrophobicContact CG2-CB 3.51Å; I246-L294 HydrophobicContact CG2-CD1 3.54Å; I246-L294 HydrophobicContact CG2-CD2 3.87Å; I246-L294 HydrophobicContact CG2-CG 3.79Å; L250-L294 HydrophobicContact CD1-CD2 3.96Å; L250-L294 HydrophobicContact CD2-CD2 3.73Å; L250-L294 HydrophobicContact CG-CD2 4.13Å; N290-L294 WeakPolarHBondContact O-CB 3.3Å; N290-L294 PolarHBondContact O-N 2.92Å; A291-L294 PolarHBondContact O-N 2.69Å; A292-L294 VanDerWaalsContact C-N 3.33Å; A292-L294 PolarHBondContact O-N 2.87Å; L294-Q296 PolarHBondContact O-N 2.86Å; L294-R297 PolarHBondContact O-N 2.71Å; L294-R297 VanDerWaalsContact O-N 3.12Å; L294-L298 HydrophobicContact CD2-CD1 4.27Å; L294-L298 HydrophobicContact CD2-CG 4.35Å; L294-L298 WeakPolarHBondContact O-CG 3.43Å; L294-L298 PolarHBondContact O-N 3.24Å
295	L	69.4	Low	61.8	Low	1 Å²	1	79.3 Å²	79.3	1%	0.005	40%	0.396	C	S	.	.	H	α-helix	trans	-58.6	-39.4	171.6	-69	171.2	0	0	0	110.9	F244 F264 W267 R268 I271 A291 A292 L298 T299	F244-L295 HydrophobicContact CZ-CD2 4.4Å; F264-L295 HydrophobicContact CB-CD2 3.72Å; F264-L295 HydrophobicContact CD1-CD2 3.82Å; F264-L295 HydrophobicContact CG-CD2 3.88Å; W267-L295 HydrophobicContact CB-CD1 4.27Å; R268-L295 HydrophobicContact CB-CB 4.17Å; R268-L295 HydrophobicContact CB-CD1 4.31Å; I271-L295 HydrophobicContact CD1-CD1 3.84Å; A291-L295 WeakPolarHBondContact O-CB 3.33Å; A291-L295 VanDerWaalsContact O-CG 3.24Å; A291-L295 WeakPolarHBondContact O-CG 3.23Å; A291-L295 PolarHBondContact O-N 3.15Å; A292-L295 PolarHBondContact O-N 3.31Å; L295-L298 PolarHBondContact O-N 3.17Å; L295-T299 VanDerWaalsContact O-CG2 3.3Å; L295-T299 WeakPolarHBondContact O-CG2 3.28Å; L295-T299 PolarHBondContact O-N 3.27Å; L295-T299 PolarHBondContact O-OG1 2.89Å
296	Q	73.3	Confident	59.9	Low	109 Å²	109	81.6 Å²	81.6	51%	0.509	42%	0.416	S	S	.	.	H	α-helix	trans	-59.7	-49.3	172.3	-171.4	-175.4	13.6	0	0	111.6	A292 K293 L294 L298 T299 A300	A292-Q296 WeakPolarHBondContact O-CB 3.37Å; A292-Q296 PolarHBondContact O-N 3.37Å; K293-Q296 WeakPolarHBondContact O-CB 3.26Å; K293-Q296 PolarHBondContact O-N 3.14Å; L294-Q296 PolarHBondContact O-N 2.86Å; Q296-L298 VanDerWaalsContact C-N 3.31Å; Q296-L298 PolarHBondContact O-N 3.37Å; Q296-T299 WeakPolarHBondContact CA-OG1 3.47Å; Q296-T299 PolarHBondContact O-N 3.46Å; Q296-T299 PolarHBondContact O-OG1 3.36Å; Q296-A300 VanDerWaalsContact O-CB 3.31Å; Q296-A300 WeakPolarHBondContact O-CB 3.34Å; Q296-A300 PolarHBondContact O-N 2.93Å
297	R	68.8	Low	57.8	Low	176 Å²	176	83.2 Å²	83.2	66%	0.664	43%	0.429	S	S	*	.	H	α-helix	trans	-60.1	-39.3	176.6	-71.9	175.6	-178.3	178.6	0.7	112.6	K293 L294 K301	K293-R297 WeakPolarHBondContact O-CG 3.4Å; K293-R297 PolarHBondContact O-N 2.84Å; L294-R297 PolarHBondContact O-N 2.71Å; L294-R297 VanDerWaalsContact O-N 3.12Å; R297-K301 PolarHBondContact O-N 2.9Å
298	L	64.2	Low	55.8	Low	26 Å²	26	83.1 Å²	83.1	14%	0.136	45%	0.447	C	S	.	.	H	α-helix	trans	-69.5	-36.4	178.8	-68.9	172.5	0	0	0	112.4	V249 L250 L294 L295 Q296	V249-L298 HydrophobicContact CG1-CD1 4.25Å; L250-L298 HydrophobicContact CD2-CD1 4.12Å; L250-L298 HydrophobicContact CD2-CD2 3.74Å; L250-L298 HydrophobicContact CD2-CG 4.35Å; L294-L298 HydrophobicContact CD2-CD1 4.27Å; L294-L298 HydrophobicContact CD2-CG 4.35Å; L294-L298 WeakPolarHBondContact O-CG 3.43Å; L294-L298 PolarHBondContact O-N 3.24Å; L295-L298 PolarHBondContact O-N 3.17Å; Q296-L298 VanDerWaalsContact C-N 3.31Å; Q296-L298 PolarHBondContact O-N 3.37Å
299	T	64.2	Low	54	Low	11 Å²	11	87.4 Å²	87.4	7%	0.067	48%	0.484	C	S	.	.	H	α-helix	trans	-75.8	-31.5	175.2	56.2	0	0	0	0	113.2	Q261 F264 A265 R268 L295 Q296 T302	Q261-T299 HydrophobicContact CG-CG2 4.29Å; Q261-T299 PolarHBondContact NE2-O 3.37Å; F264-T299 HydrophobicContact CB-CG2 4.38Å; A265-T299 HydrophobicContact CB-CG2 4.35Å; R268-T299 PolarHBondContact NH1-OG1 3.47Å; L295-T299 VanDerWaalsContact O-CG2 3.3Å; L295-T299 WeakPolarHBondContact O-CG2 3.28Å; L295-T299 PolarHBondContact O-N 3.27Å; L295-T299 PolarHBondContact O-OG1 2.89Å; Q296-T299 WeakPolarHBondContact CA-OG1 3.47Å; Q296-T299 PolarHBondContact O-N 3.46Å; Q296-T299 PolarHBondContact O-OG1 3.36Å; T299-T302 PolarHBondContact O-OG1 2.75Å
300	A	59.8	Low	51.8	Low	56 Å²	56	94.6 Å²	94.6	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-76.4	-32	-177.6	0	0	0	0	0	113.9	Q296 T302 Q303	Q296-A300 VanDerWaalsContact O-CB 3.31Å; Q296-A300 WeakPolarHBondContact O-CB 3.34Å; Q296-A300 PolarHBondContact O-N 2.93Å; A300-T302 PolarHBondContact O-N 2.94Å; A300-T302 VanDerWaalsContact O-N 3.12Å; A300-Q303 PolarHBondContact O-N 3Å
301	K	52.2	Low	49.7	Very low	169 Å²	169	94.2 Å²	94.2	74%	0.735	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.1	-176.9	-89.1	-176.8	175.5	179.1	0	114.9	R297	R297-K301 PolarHBondContact O-N 2.9Å
302	T	44.8	Very low	47.8	Very low	91 Å²	91	103.1 Å²	103.1	56%	0.558	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-5.8	177.2	47.7	0	0	0	0	114.3	Q261 T299 A300	Q261-T302 PolarHBondContact NE2-OG1 3.25Å; Q261-T302 PolarHBondContact OE1-OG1 2.96Å; Q261-T302 VanDerWaalsContact OE1-OG1 3.13Å; T299-T302 PolarHBondContact O-OG1 2.75Å; A300-T302 PolarHBondContact O-N 2.94Å; A300-T302 VanDerWaalsContact O-N 3.12Å
303	Q	35.5	Very low	45.8	Very low	169 Å²	169	110.8 Å²	110.8	79%	0.79	61%	0.606	S	S	*	*	S	Bend	trans	-108.2	0.6	-175.7	-87.1	173.8	-24.2	0	0	115.5	A300	A300-Q303 PolarHBondContact O-N 3Å
304	G	31	Very low	43.9	Very low	55 Å²	55	110.7 Å²	110.7	57%	0.567	62%	0.62	S	S	*	*			trans	-135.5	105.3	-176.6	0	0	0	0	0	113.4	L306	G304-L306 PolarHBondContact O-N 3.11Å
305	T	27.9	Very low	42.3	Very low	133 Å²	133	115.2 Å²	115.2	82%	0.816	65%	0.65	S	S	*	*			trans	-46.5	121.6	160.9	-31.1	0	0	0	0	109.7	D307	T305-D307 PolarHBondContact O-N 3.45Å; T305-D307 VanDerWaalsContact O-N 3.08Å
306	L	28.7	Very low	40.8	Very low	166 Å²	166	120.7 Å²	120.7	87%	0.869	68%	0.683	S	S	*	*	S	Bend	trans	-58.7	106.5	170.6	-85.7	108.4	0	0	0	109.1	G304	G304-L306 PolarHBondContact O-N 3.11Å
307	D	26.8	Very low	39.2	Very low	151 Å²	151	120.4 Å²	120.4	81%	0.807	69%	0.685	S	S	*	*			trans	-163.1	35.7	165.8	-92.8	-27.1	0	0	0	113.2	T305	T305-D307 PolarHBondContact O-N 3.45Å; T305-D307 VanDerWaalsContact O-N 3.08Å
308	S	27.3	Very low	37.8	Very low	123 Å²	123	120.7 Å²	120.7	86%	0.86	69%	0.694	S	S	*	*	S	Bend	trans	-162.6	30.6	174.6	72.2	0	0	0	0	118.3
309	A	29.3	Very low	36.8	Very low	97 Å²	97	123.8 Å²	123.8	80%	0.802	72%	0.717	S	S	*	*			trans	-138.2	44	176.5	0	0	0	0	0	114.1	G311	A309-G311 VanDerWaalsContact C-N 3.32Å; A309-G311 PolarHBondContact O-N 3.2Å
310	H	28.2	Very low	35.8	Very low	212 Å²	212	128.3 Å²	128.3	98%	0.981	74%	0.738	S	S	*	*			trans	-78.4	89.4	149.8	-82.8	-50.3	0	0	0	108.2
311	G	28.2	Very low	34.9	Very low	62 Å²	62	130.4 Å²	130.4	64%	0.639	75%	0.746	S	S	*	*			trans	-151.1	81	-176.3	0	0	0	0	0	111.8	A309	A309-G311 VanDerWaalsContact C-N 3.32Å; A309-G311 PolarHBondContact O-N 3.2Å
312	K	29.8	Very low	34.4	Very low	196 Å²	196	127.4 Å²	127.4	85%	0.852	73%	0.734	S	S	*	*			trans	39.2	104.4	144.7	-58.2	174.2	-178.4	176.4	0	116.3
313	N	29.1	Very low	34.3	Very low	167 Å²	167	124.5 Å²	124.5	89%	0.893	72%	0.717	S	S	*	*			trans	151.3	93	132.4	-73.5	-12.5	0	0	0	111.5
314	S	34.4	Very low	34.7	Very low	109 Å²	109	119.1 Å²	119.1	76%	0.762	70%	0.701	S	S	*	*			trans	-169.8	79.9	146.6	61.1	0	0	0	0	108.2	V316	S314-V316 PolarHBondContact O-N 3.05Å; S314-V316 VanDerWaalsContact O-N 3.13Å
315	T	34.8	Very low	35.5	Very low	141 Å²	141	120.8 Å²	120.8	87%	0.865	70%	0.696	S	S	*	*			trans	-61.8	110.3	157.4	45.2	0	0	0	0	106.2	D317	T315-D317 PolarHBondContact O-N 3.37Å; T315-D317 VanDerWaalsContact O-N 3.1Å
316	V	39.5	Very low	36.4	Very low	115 Å²	115	116.8 Å²	116.8	70%	0.697	67%	0.67	S	S	*	*			trans	-56.9	114.8	171.3	176.1	0	0	0	0	106.6	S314 E318	S314-V316 PolarHBondContact O-N 3.05Å; S314-V316 VanDerWaalsContact O-N 3.13Å; V316-E318 PolarHBondContact O-N 3.41Å
317	D	38.1	Very low	37.3	Very low	103 Å²	103	115 Å²	115	55%	0.551	66%	0.66	S	S	*	*			trans	-69.3	102	176.2	-170.7	-4.6	0	0	0	108.4	T315 S319 H320	T315-D317 PolarHBondContact O-N 3.37Å; T315-D317 VanDerWaalsContact O-N 3.1Å; D317-S319 PolarHBondContact O-N 3.2Å; D317-S319 WeakPolarHBondContact OD1-CB 3.27Å; D317-S319 PolarHBondContact OD1-N 2.87Å; D317-S319 PolarHBondContact OD1-OG 3.49Å; D317-S319 PolarHBondContact OD2-OG 3.35Å; D317-H320 PolarHBondContact O-N 3.32Å
318	E	40.5	Very low	38.4	Very low	183 Å²	183	113.3 Å²	113.3	86%	0.855	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-0.6	179	-66.3	-175.4	162.5	0	0	112.9	V316	V316-E318 PolarHBondContact O-N 3.41Å
319	S	43.5	Very low	39.4	Very low	90 Å²	90	111.2 Å²	111.2	63%	0.629	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-7	178.7	73.8	0	0	0	0	115.3	D317	D317-S319 PolarHBondContact O-N 3.2Å; D317-S319 WeakPolarHBondContact OD1-CB 3.27Å; D317-S319 PolarHBondContact OD1-N 2.87Å; D317-S319 PolarHBondContact OD1-OG 3.49Å; D317-S319 PolarHBondContact OD2-OG 3.35Å
320	H	42.2	Very low	40.4	Very low	107 Å²	107	108.4 Å²	108.4	50%	0.495	61%	0.606	S	S	.	*			trans	-82.6	127.3	-174.1	-152.6	-82.5	0	0	0	112.2	D317 F322 S323	D317-H320 PolarHBondContact O-N 3.32Å; H320-F322 VanDerWaalsContact ND1-CB 3.27Å; H320-F322 WeakPolarHBondContact ND1-CB 3.48Å; H320-F322 PolarHBondContact ND1-N 3.02Å; H320-F322 PolarHBondContact O-N 2.91Å; H320-S323 WeakPolarHBondContact O-CB 3.49Å; H320-S323 PolarHBondContact O-N 3.36Å; H320-S323 PolarHBondContact O-OG 3.46Å
321	P	41.9	Very low	41.4	Very low	100 Å²	100	102.6 Å²	102.6	65%	0.649	59%	0.59	S	S	*	*	H	α-helix	trans	-60.9	-11.7	-179.5	22.5	-32.4	0	0	0	114.5
322	F	40.9	Very low	42.6	Very low	106 Å²	106	106.9 Å²	106.9	47%	0.465	59%	0.593	S	S	.	*	H	α-helix	trans	-85.5	-22.8	176.8	-133.8	-96	0	0	0	112.9	H320 A324 I325 L326	H320-F322 VanDerWaalsContact ND1-CB 3.27Å; H320-F322 WeakPolarHBondContact ND1-CB 3.48Å; H320-F322 PolarHBondContact ND1-N 3.02Å; H320-F322 PolarHBondContact O-N 2.91Å; F322-A324 VanDerWaalsContact C-N 3.34Å; F322-I325 PolarHBondContact O-N 3.32Å; F322-L326 HydrophobicContact CD1-CD1 4.18Å; F322-L326 HydrophobicContact CD1-CG 4.42Å; F322-L326 WeakPolarHBondContact O-CB 3.47Å; F322-L326 WeakPolarHBondContact O-CG 3.26Å; F322-L326 PolarHBondContact O-N 2.86Å
323	S	42.7	Very low	43.5	Very low	29 Å²	29	100 Å²	100	20%	0.203	57%	0.565	C	S	.	*	H	α-helix	trans	-69	-34.9	175	70.7	0	0	0	0	111.3	H320 L326 L327	H320-S323 WeakPolarHBondContact O-CB 3.49Å; H320-S323 PolarHBondContact O-N 3.36Å; H320-S323 PolarHBondContact O-OG 3.46Å; S323-L326 PolarHBondContact O-N 3.44Å; S323-L327 WeakPolarHBondContact O-CB 3.46Å; S323-L327 WeakPolarHBondContact O-CG 3.41Å; S323-L327 PolarHBondContact O-N 3.01Å
324	A	43.4	Very low	44.3	Very low	57 Å²	57	98.1 Å²	98.1	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-65.9	-39.3	173.9	0	0	0	0	0	112.5	F322 Q328	F322-A324 VanDerWaalsContact C-N 3.34Å; A324-Q328 VanDerWaalsContact O-CB 3.29Å; A324-Q328 WeakPolarHBondContact O-CB 3.24Å; A324-Q328 PolarHBondContact O-N 2.99Å
325	I	47.9	Very low	44.9	Very low	89 Å²	89	98.7 Å²	98.7	46%	0.456	55%	0.545	S	S	.	.	H	α-helix	trans	-70.4	-40.7	177.3	-62	170.8	0	0	0	110.5	F322 Q328 V329	F322-I325 PolarHBondContact O-N 3.32Å; I325-Q328 PolarHBondContact O-N 3.21Å; I325-V329 HydrophobicContact CG2-CG2 4.46Å; I325-V329 WeakPolarHBondContact O-CG2 3.43Å; I325-V329 PolarHBondContact O-N 3.31Å
326	L	47.1	Very low	45.4	Very low	49 Å²	49	99.4 Å²	99.4	26%	0.257	54%	0.544	S	S	.	.	H	α-helix	trans	-63.7	-41	175.6	-78.6	164.5	0	0	0	112.5	F322 S323 Q328 V329 A330 L350	F322-L326 HydrophobicContact CD1-CD1 4.18Å; F322-L326 HydrophobicContact CD1-CG 4.42Å; F322-L326 WeakPolarHBondContact O-CB 3.47Å; F322-L326 WeakPolarHBondContact O-CG 3.26Å; F322-L326 PolarHBondContact O-N 2.86Å; S323-L326 PolarHBondContact O-N 3.44Å; L326-Q328 VanDerWaalsContact C-N 3.31Å; L326-V329 PolarHBondContact O-N 3.13Å; L326-A330 VanDerWaalsContact O-CB 3.25Å; L326-A330 WeakPolarHBondContact O-CB 3.43Å; L326-A330 PolarHBondContact O-N 3.34Å; L326-L350 HydrophobicContact CD2-CB 3.84Å; L326-L350 HydrophobicContact CD2-CD1 3.46Å; L326-L350 VanDerWaalsContact CD2-CD1 3.46Å; L326-L350 HydrophobicContact CD2-CG 4.17Å
327	L	48.3	Very low	46	Very low	128 Å²	128	101.1 Å²	101.1	67%	0.67	54%	0.542	S	S	*	.	H	α-helix	trans	-67.1	-31.9	173	-78	163.5	0	0	0	112.4	S323 S331	S323-L327 WeakPolarHBondContact O-CB 3.46Å; S323-L327 WeakPolarHBondContact O-CG 3.41Å; S323-L327 PolarHBondContact O-N 3.01Å; L327-S331 WeakPolarHBondContact O-CB 3.41Å; L327-S331 PolarHBondContact O-N 2.89Å; L327-S331 VanDerWaalsContact O-N 3.08Å; L327-S331 PolarHBondContact O-OG 2.93Å
328	Q	49.4	Very low	46.5	Very low	116 Å²	116	98.6 Å²	98.6	54%	0.542	53%	0.528	S	S	.	.	H	α-helix	trans	-75.4	-34.9	176.9	-171.6	169.4	-4.8	0	0	113.1	A324 I325 L326 S331 Q332	A324-Q328 VanDerWaalsContact O-CB 3.29Å; A324-Q328 WeakPolarHBondContact O-CB 3.24Å; A324-Q328 PolarHBondContact O-N 2.99Å; I325-Q328 PolarHBondContact O-N 3.21Å; L326-Q328 VanDerWaalsContact C-N 3.31Å; Q328-S331 WeakPolarHBondContact CA-OG 3.39Å; Q328-S331 PolarHBondContact O-OG 2.9Å; Q328-Q332 WeakPolarHBondContact O-CG 3.5Å; Q328-Q332 PolarHBondContact O-N 3.48Å
329	V	49.1	Very low	47.4	Very low	80 Å²	80	97.2 Å²	97.2	49%	0.485	52%	0.519	S	S	.	.	H	α-helix	trans	-73.5	-39.5	173.5	173.4	0	0	0	0	110.4	I325 L326 S331 Q332	I325-V329 HydrophobicContact CG2-CG2 4.46Å; I325-V329 WeakPolarHBondContact O-CG2 3.43Å; I325-V329 PolarHBondContact O-N 3.31Å; L326-V329 PolarHBondContact O-N 3.13Å; V329-S331 VanDerWaalsContact C-N 3.28Å; V329-S331 PolarHBondContact O-N 3.3Å; V329-Q332 PolarHBondContact O-N 3.39Å
330	A	49.1	Very low	47.8	Very low	37 Å²	37	97.5 Å²	97.5	31%	0.306	52%	0.521	S	S	.	.	H	α-helix	trans	-66.5	-27.1	175.5	0	0	0	0	0	113.4	L326	L326-A330 VanDerWaalsContact O-CB 3.25Å; L326-A330 WeakPolarHBondContact O-CB 3.43Å; L326-A330 PolarHBondContact O-N 3.34Å
331	S	50.5	Low	48.4	Very low	91 Å²	91	95.4 Å²	95.4	64%	0.636	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-11.5	176.7	68.9	0	0	0	0	114.5	L327 Q328 V329	L327-S331 WeakPolarHBondContact O-CB 3.41Å; L327-S331 PolarHBondContact O-N 2.89Å; L327-S331 VanDerWaalsContact O-N 3.08Å; L327-S331 PolarHBondContact O-OG 2.93Å; Q328-S331 WeakPolarHBondContact CA-OG 3.39Å; Q328-S331 PolarHBondContact O-OG 2.9Å; V329-S331 VanDerWaalsContact C-N 3.28Å; V329-S331 PolarHBondContact O-N 3.3Å
332	Q	52.9	Low	48.9	Very low	152 Å²	152	94.6 Å²	94.6	71%	0.71	51%	0.51	S	S	*	.	S	Bend	trans	-88.3	-8.7	172.9	-73	-173	21.5	0	0	113.5	Q328 V329	Q328-Q332 WeakPolarHBondContact O-CG 3.5Å; Q328-Q332 PolarHBondContact O-N 3.48Å; V329-Q332 PolarHBondContact O-N 3.39Å
333	I	49.1	Very low	49.3	Very low	51 Å²	51	92.6 Å²	92.6	26%	0.262	50%	0.501	S	S	.	.	S	Bend	trans	-85.7	112.5	174.6	-62.1	173.3	0	0	0	107.1	D335 L338	I333-D335 PolarHBondContact O-N 2.94Å; I333-D335 VanDerWaalsContact O-N 3.16Å; I333-L338 HydrophobicContact CD1-CD2 4.49Å; I333-L338 HydrophobicContact CG2-CB 4.17Å; I333-L338 HydrophobicContact CG2-CD1 3.71Å; I333-L338 HydrophobicContact CG2-CD2 4.45Å; I333-L338 HydrophobicContact CG2-CG 4.32Å
334	E	46.1	Very low	49.9	Very low	127 Å²	127	96.6 Å²	96.6	59%	0.593	52%	0.52	S	S	*	.			trans	-44	122.2	172.8	-71.1	177.8	159.8	0	0	110.1	D336 K337	E334-D336 PolarHBondContact O-N 2.73Å; E334-K337 PolarHBondContact O-N 3.25Å; E334-K337 IonicContact OE2-NZ 3.63Å; E334-K337 PolarHBondContact OE2-NZ 3.23Å
335	D	45.1	Very low	50.4	Low	122 Å²	122	101 Å²	101	65%	0.652	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-8.8	-172.9	-92.4	-34.7	0	0	0	114.2	I333 K343	I333-D335 PolarHBondContact O-N 2.94Å; I333-D335 VanDerWaalsContact O-N 3.16Å; D335-K343 IonicContact OD1-NZ 2.73Å; D335-K343 PolarHBondContact OD1-NZ 3.28Å
336	D	46.7	Very low	50.7	Low	155 Å²	155	100.4 Å²	100.4	83%	0.829	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-3.2	-171.1	-55.9	-15.4	0	0	0	113.7	E334	E334-D336 PolarHBondContact O-N 2.73Å
337	K	52.5	Low	50.8	Low	152 Å²	152	101.1 Å²	101.1	66%	0.661	53%	0.53	S	S	*	.	S	Bend	trans	-123.8	-7	-173.4	-69.9	-180	-172.7	143.7	0	116.4	E334	E334-K337 PolarHBondContact O-N 3.25Å; E334-K337 IonicContact OE2-NZ 3.63Å; E334-K337 PolarHBondContact OE2-NZ 3.23Å
338	L	46.8	Very low	51.2	Low	50 Å²	50	101.4 Å²	101.4	26%	0.262	53%	0.527	S	S	.	.			trans	-123	119.7	178.4	-108.5	90.5	0	0	0	111.4	I333 E342 K343 L346	I333-L338 HydrophobicContact CD1-CD2 4.49Å; I333-L338 HydrophobicContact CG2-CB 4.17Å; I333-L338 HydrophobicContact CG2-CD1 3.71Å; I333-L338 HydrophobicContact CG2-CD2 4.45Å; I333-L338 HydrophobicContact CG2-CG 4.32Å; L338-E342 WeakPolarHBondContact CA-OE2 3.48Å; L338-E342 HydrophobicContact CD2-CB 3.91Å; L338-E342 HydrophobicContact CG-CB 4.1Å; L338-K343 HydrophobicContact CB-CG 4.36Å; L338-K343 HydrophobicContact CD2-CG 4.2Å; L338-L346 HydrophobicContact CD2-CD1 3.77Å
339	K	61	Low	51.4	Low	153 Å²	153	100.5 Å²	100.5	67%	0.665	53%	0.526	S	S	*	.			trans	-63.4	149.2	172.8	-68.8	174.7	-179.1	170.6	0	109.6	A341 E342 K343	K339-A341 PolarHBondContact O-N 2.88Å; K339-E342 HydrophobicContact CB-CG 4.38Å; K339-E342 PolarHBondContact N-OE2 3.41Å; K339-E342 WeakPolarHBondContact O-CA 3.24Å; K339-E342 WeakPolarHBondContact O-CB 3.38Å; K339-E342 PolarHBondContact O-N 3.31Å; K339-K343 PolarHBondContact O-N 3.04Å
340	S	51.1	Low	51.1	Low	97 Å²	97	100 Å²	100	68%	0.678	52%	0.52	S	S	*	.	H	α-helix	trans	-52.8	-31.3	176.7	54.6	0	0	0	0	113.6	L344	S340-L344 PolarHBondContact O-N 3.31Å; S340-L344 VanDerWaalsContact O-N 3.11Å
341	A	54.5	Low	51.2	Low	63 Å²	63	101.9 Å²	101.9	52%	0.521	53%	0.531	S	S	.	.	H	α-helix	trans	-68.6	-31.4	174.3	0	0	0	0	0	113.8	K339 R345	K339-A341 PolarHBondContact O-N 2.88Å; A341-R345 PolarHBondContact O-N 3.41Å
342	E	53	Low	51.3	Low	82 Å²	82	101.2 Å²	101.2	38%	0.383	53%	0.526	S	S	.	.	H	α-helix	trans	-77	-36	177.4	-67.5	161.4	169.9	0	0	110.6	L338 K339 R345 L346	L338-E342 WeakPolarHBondContact CA-OE2 3.48Å; L338-E342 HydrophobicContact CD2-CB 3.91Å; L338-E342 HydrophobicContact CG-CB 4.1Å; K339-E342 HydrophobicContact CB-CG 4.38Å; K339-E342 PolarHBondContact N-OE2 3.41Å; K339-E342 WeakPolarHBondContact O-CA 3.24Å; K339-E342 WeakPolarHBondContact O-CB 3.38Å; K339-E342 PolarHBondContact O-N 3.31Å; E342-R345 PolarHBondContact O-N 3.14Å; E342-L346 WeakPolarHBondContact O-CB 3.37Å; E342-L346 PolarHBondContact O-N 3.31Å
343	K	49.4	Very low	51	Low	64 Å²	64	98.6 Å²	98.6	28%	0.278	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-45.1	170	-70.4	-174.2	177.1	-177.4	0	111.6	D335 L338 K339 L346 C347	D335-K343 IonicContact OD1-NZ 2.73Å; D335-K343 PolarHBondContact OD1-NZ 3.28Å; L338-K343 HydrophobicContact CB-CG 4.36Å; L338-K343 HydrophobicContact CD2-CG 4.2Å; K339-K343 PolarHBondContact O-N 3.04Å; K343-L346 WeakPolarHBondContact O-CB 3.3Å; K343-L346 PolarHBondContact O-N 3.02Å; K343-C347 PolarHBondContact O-N 3.26Å; K343-C347 PolarHBondContact O-SG 2.89Å
344	L	54.8	Low	50.7	Low	113 Å²	113	99.3 Å²	99.3	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-63	-40.9	175.3	-90	156.5	0	0	0	113	S340 C347 E348	S340-L344 PolarHBondContact O-N 3.31Å; S340-L344 VanDerWaalsContact O-N 3.11Å; L344-C347 PolarHBondContact O-N 2.9Å; L344-E348 PolarHBondContact O-N 3.48Å
345	R	54.8	Low	51	Low	151 Å²	151	101.9 Å²	101.9	57%	0.57	54%	0.535	S	S	*	.	H	α-helix	trans	-62.1	-41.5	174.6	-103.3	-176.5	176.3	-178.2	0.1	112.6	A341 E342 E348 L349	A341-R345 PolarHBondContact O-N 3.41Å; E342-R345 PolarHBondContact O-N 3.14Å; R345-E348 PolarHBondContact O-N 3.33Å; R345-L349 WeakPolarHBondContact O-CB 3.41Å; R345-L349 WeakPolarHBondContact O-CD1 3.28Å; R345-L349 WeakPolarHBondContact O-CG 3.26Å; R345-L349 PolarHBondContact O-N 2.77Å
346	L	53.4	Low	51.3	Low	75 Å²	75	101.6 Å²	101.6	39%	0.393	53%	0.534	S	S	.	.	H	α-helix	trans	-61.9	-44.5	174.6	-108.1	146.8	0	0	0	110.8	L338 E342 K343 L349 L350	L338-L346 HydrophobicContact CD2-CD1 3.77Å; E342-L346 WeakPolarHBondContact O-CB 3.37Å; E342-L346 PolarHBondContact O-N 3.31Å; K343-L346 WeakPolarHBondContact O-CB 3.3Å; K343-L346 PolarHBondContact O-N 3.02Å; L346-L349 PolarHBondContact O-N 2.64Å; L346-L350 HydrophobicContact CD2-CD1 3.82Å; L346-L350 VanDerWaalsContact O-CB 3.29Å; L346-L350 WeakPolarHBondContact O-CB 3.42Å; L346-L350 WeakPolarHBondContact O-CD1 3.36Å; L346-L350 WeakPolarHBondContact O-CG 3.44Å; L346-L350 PolarHBondContact O-N 2.83Å
347	C	49.7	Very low	51	Low	64 Å²	64	96 Å²	96	43%	0.432	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-43.4	176	-67.2	0	0	0	0	112.6	K343 L344 L350 S351	K343-C347 PolarHBondContact O-N 3.26Å; K343-C347 PolarHBondContact O-SG 2.89Å; L344-C347 PolarHBondContact O-N 2.9Å; C347-L350 PolarHBondContact O-N 3.28Å; C347-S351 WeakPolarHBondContact O-CB 3.47Å; C347-S351 PolarHBondContact O-N 2.88Å; C347-S351 PolarHBondContact O-OG 2.84Å; C347-S351 VanDerWaalsContact O-OG 3.1Å
348	E	56.2	Low	50.7	Low	134 Å²	134	93.3 Å²	93.3	63%	0.626	52%	0.519	S	S	*	.	H	α-helix	trans	-63.4	-42.6	175.9	-78	-177.2	162.7	0	0	112.5	L344 R345 S352	L344-E348 PolarHBondContact O-N 3.48Å; R345-E348 PolarHBondContact O-N 3.33Å; E348-S352 WeakPolarHBondContact O-CB 3.36Å; E348-S352 PolarHBondContact O-N 2.68Å; E348-S352 PolarHBondContact O-OG 3.46Å
349	L	53.9	Low	50.9	Low	97 Å²	97	99.5 Å²	99.5	51%	0.508	54%	0.544	S	S	.	.	H	α-helix	trans	-63	-43.2	176.7	-81	162.2	0	0	0	111.3	R345 L346 S352 H353	R345-L349 WeakPolarHBondContact O-CB 3.41Å; R345-L349 WeakPolarHBondContact O-CD1 3.28Å; R345-L349 WeakPolarHBondContact O-CG 3.26Å; R345-L349 PolarHBondContact O-N 2.77Å; L346-L349 PolarHBondContact O-N 2.64Å; L349-S352 PolarHBondContact O-N 2.95Å; L349-S352 PolarHBondContact O-OG 2.86Å; L349-H353 PolarHBondContact O-CD2 2.86Å; L349-H353 PolarHBondContact O-N 3.23Å; L349-H353 VanDerWaalsContact O-N 3.16Å
350	L	43.2	Very low	50.3	Low	70 Å²	70	94.2 Å²	94.2	37%	0.366	53%	0.526	S	S	.	.	H	α-helix	trans	-73.3	-34.6	-179.1	-69.1	165.9	0	0	0	112.4	L326 L346 C347 S352 H353 S354	L326-L350 HydrophobicContact CD2-CB 3.84Å; L326-L350 HydrophobicContact CD2-CD1 3.46Å; L326-L350 VanDerWaalsContact CD2-CD1 3.46Å; L326-L350 HydrophobicContact CD2-CG 4.17Å; L346-L350 HydrophobicContact CD2-CD1 3.82Å; L346-L350 VanDerWaalsContact O-CB 3.29Å; L346-L350 WeakPolarHBondContact O-CB 3.42Å; L346-L350 WeakPolarHBondContact O-CD1 3.36Å; L346-L350 WeakPolarHBondContact O-CG 3.44Å; L346-L350 PolarHBondContact O-N 2.83Å; C347-L350 PolarHBondContact O-N 3.28Å; L350-S352 VanDerWaalsContact C-N 3.34Å; L350-H353 PolarHBondContact O-N 2.93Å; L350-S354 PolarHBondContact O-N 2.75Å
351	S	50.4	Low	50.2	Low	77 Å²	77	93.7 Å²	93.7	54%	0.538	52%	0.519	S	S	.	.	H	α-helix	trans	-68.4	-31	171.2	-67.8	0	0	0	0	112.9	C347 H353 S354	C347-S351 WeakPolarHBondContact O-CB 3.47Å; C347-S351 PolarHBondContact O-N 2.88Å; C347-S351 PolarHBondContact O-OG 2.84Å; C347-S351 VanDerWaalsContact O-OG 3.1Å; S351-H353 VanDerWaalsContact C-N 3.33Å; S351-S354 PolarHBondContact O-OG 2.75Å; S351-S354 VanDerWaalsContact O-OG 3.04Å
352	S	52.1	Low	50	Low	76 Å²	76	93.8 Å²	93.8	53%	0.531	52%	0.515	S	S	.	.	H	α-helix	trans	-76.9	-19.7	174.5	69.9	0	0	0	0	113.7	E348 L349 L350	E348-S352 WeakPolarHBondContact O-CB 3.36Å; E348-S352 PolarHBondContact O-N 2.68Å; E348-S352 PolarHBondContact O-OG 3.46Å; L349-S352 PolarHBondContact O-N 2.95Å; L349-S352 PolarHBondContact O-OG 2.86Å; L350-S352 VanDerWaalsContact C-N 3.34Å
353	H	46.7	Very low	50	Low	97 Å²	97	93.5 Å²	93.5	45%	0.449	52%	0.522	S	S	.	.	H	α-helix	trans	-98.8	-7	179.9	-88.4	-55.8	0	0	0	114.4	L349 L350 S351 E355	L349-H353 PolarHBondContact O-CD2 2.86Å; L349-H353 PolarHBondContact O-N 3.23Å; L349-H353 VanDerWaalsContact O-N 3.16Å; L350-H353 PolarHBondContact O-N 2.93Å; S351-H353 VanDerWaalsContact C-N 3.33Å; H353-E355 VanDerWaalsContact C-N 3.29Å; H353-E355 PolarHBondContact O-N 3.35Å
354	S	43.2	Very low	50	Low	67 Å²	67	97.3 Å²	97.3	47%	0.469	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.3	-179	55.2	0	0	0	0	114.6	L350 S351	L350-S354 PolarHBondContact O-N 2.75Å; S351-S354 PolarHBondContact O-OG 2.75Å; S351-S354 VanDerWaalsContact O-OG 3.04Å
355	E	51.7	Low	49.8	Very low	180 Å²	180	96.4 Å²	96.4	84%	0.841	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-18	178.3	-67	-173.7	166.6	0	0	113.4	H353	H353-E355 VanDerWaalsContact C-N 3.29Å; H353-E355 PolarHBondContact O-N 3.35Å
356	D	51.4	Low	49.6	Very low	117 Å²	117	95 Å²	95	63%	0.626	54%	0.535	S	S	*	.	S	Bend	trans	-111.8	8.5	-175.7	-72.3	-35.1	0	0	0	114.4	A358 K359 S360	D356-A358 VanDerWaalsContact C-N 3.29Å; D356-A358 PolarHBondContact O-N 3.15Å; D356-K359 PolarHBondContact O-N 3.03Å; D356-S360 PolarHBondContact O-OG 3.47Å
357	G	41.5	Very low	49.2	Very low	37 Å²	37	94 Å²	94	38%	0.381	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-3.9	-153.8	0	0	0	0	0	119.8	V361	G357-V361 VanDerWaalsContact O-CG2 3.26Å; G357-V361 WeakPolarHBondContact O-CG2 3.43Å
358	A	47	Very low	49.4	Very low	96 Å²	96	94.4 Å²	94.4	79%	0.793	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-25.9	-177.5	0	0	0	0	0	114.3	D356	D356-A358 VanDerWaalsContact C-N 3.29Å; D356-A358 PolarHBondContact O-N 3.15Å
359	K	49.4	Very low	49.3	Very low	179 Å²	179	93.4 Å²	93.4	78%	0.778	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-19.6	179.8	-71.2	-179.2	178.2	177.6	0	113.2	D356 S362	D356-K359 PolarHBondContact O-N 3.03Å; K359-S362 PolarHBondContact O-OG 3.23Å
360	S	48	Very low	48.9	Very low	43 Å²	43	93.6 Å²	93.6	30%	0.301	54%	0.537	S	S	.	.	H	α-helix	trans	-84.5	-27.9	-176.2	51	0	0	0	0	113.6	D356 S362 C363 F364	D356-S360 PolarHBondContact O-OG 3.47Å; S360-S362 PolarHBondContact O-N 3.42Å; S360-C363 PolarHBondContact O-N 3.48Å; S360-F364 WeakPolarHBondContact O-CB 3.37Å; S360-F364 PolarHBondContact O-N 3.2Å
361	V	49.2	Very low	49.2	Very low	86 Å²	86	93 Å²	93	52%	0.521	54%	0.542	S	S	.	.	H	α-helix	trans	-63.1	-42.2	178.8	175.8	0	0	0	0	111.2	G357 C363 F364 D365	G357-V361 VanDerWaalsContact O-CG2 3.26Å; G357-V361 WeakPolarHBondContact O-CG2 3.43Å; V361-C363 PolarHBondContact O-N 2.85Å; V361-F364 PolarHBondContact O-N 3.38Å; V361-D365 PolarHBondContact O-N 3.04Å; V361-D365 VanDerWaalsContact O-N 3.11Å
362	S	51.4	Low	49.4	Very low	64 Å²	64	91.7 Å²	91.7	45%	0.448	54%	0.536	S	S	.	.	H	α-helix	trans	-68.6	-34.7	177.2	67.9	0	0	0	0	112.9	K359 S360 E366	K359-S362 PolarHBondContact O-OG 3.23Å; S360-S362 PolarHBondContact O-N 3.42Å; S362-E366 WeakPolarHBondContact O-CG 3.39Å; S362-E366 PolarHBondContact O-N 3.48Å
363	C	51.9	Low	49.2	Very low	77 Å²	77	90.6 Å²	90.6	52%	0.52	53%	0.531	S	S	.	.	H	α-helix	trans	-71.6	-31.5	175.7	-76	0	0	0	0	112.4	S360 V361 A367	S360-C363 PolarHBondContact O-N 3.48Å; V361-C363 PolarHBondContact O-N 2.85Å; C363-A367 WeakPolarHBondContact O-CB 3.16Å; C363-A367 PolarHBondContact O-N 3.02Å
364	F	49.3	Very low	49.3	Very low	144 Å²	144	90.1 Å²	90.1	63%	0.632	53%	0.531	S	S	*	.	H	α-helix	trans	-72.6	-42.7	178.2	-167.5	-96.2	0	0	0	111.5	S360 V361 E366 A367 V368	S360-F364 WeakPolarHBondContact O-CB 3.37Å; S360-F364 PolarHBondContact O-N 3.2Å; V361-F364 PolarHBondContact O-N 3.38Å; F364-E366 VanDerWaalsContact C-N 3.35Å; F364-E366 PolarHBondContact O-N 3.17Å; F364-A367 PolarHBondContact O-N 2.9Å; F364-V368 HydrophobicContact CD1-CG2 3.89Å; F364-V368 HydrophobicContact CE1-CG2 3.61Å; F364-V368 HydrophobicContact CZ-CG2 4.07Å; F364-V368 WeakPolarHBondContact O-CB 3.45Å; F364-V368 VanDerWaalsContact O-CG2 3.28Å; F364-V368 WeakPolarHBondContact O-CG2 3.27Å; F364-V368 PolarHBondContact O-N 3.07Å
365	D	52	Low	49.6	Very low	93 Å²	93	93 Å²	93	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-60.4	-44.6	174.9	-70.8	-21.7	0	0	0	111.1	V361 A367 V368 D369	V361-D365 PolarHBondContact O-N 3.04Å; V361-D365 VanDerWaalsContact O-N 3.11Å; D365-A367 PolarHBondContact O-N 3.47Å; D365-V368 PolarHBondContact O-N 3.08Å; D365-D369 WeakPolarHBondContact O-CB 3.43Å; D365-D369 PolarHBondContact O-N 3.46Å
366	E	49.5	Very low	49.7	Very low	123 Å²	123	88 Å²	88	58%	0.575	52%	0.517	S	S	*	.	H	α-helix	trans	-62	-41.4	175.2	-74.5	177.9	-171.1	0	0	112.6	S362 F364 D369 I370	S362-E366 WeakPolarHBondContact O-CG 3.39Å; S362-E366 PolarHBondContact O-N 3.48Å; F364-E366 VanDerWaalsContact C-N 3.35Å; F364-E366 PolarHBondContact O-N 3.17Å; E366-D369 PolarHBondContact O-N 3.29Å; E366-I370 WeakPolarHBondContact O-CB 3.3Å; E366-I370 WeakPolarHBondContact O-CD1 3.19Å; E366-I370 WeakPolarHBondContact O-CG1 3.42Å; E366-I370 PolarHBondContact O-N 2.7Å
367	A	46.2	Very low	49.3	Very low	54 Å²	54	89.2 Å²	89.2	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-68.4	-37.2	178.4	0	0	0	0	0	112.6	C363 F364 D365 A371	C363-A367 WeakPolarHBondContact O-CB 3.16Å; C363-A367 PolarHBondContact O-N 3.02Å; F364-A367 PolarHBondContact O-N 2.9Å; D365-A367 PolarHBondContact O-N 3.47Å; A367-A371 WeakPolarHBondContact O-CB 3.48Å; A367-A371 PolarHBondContact O-N 3.38Å
368	V	53.1	Low	49.5	Very low	72 Å²	72	91 Å²	91	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-66.3	-42.8	174.8	170.5	0	0	0	0	110.6	F364 D365 A371 A372	F364-V368 HydrophobicContact CD1-CG2 3.89Å; F364-V368 HydrophobicContact CE1-CG2 3.61Å; F364-V368 HydrophobicContact CZ-CG2 4.07Å; F364-V368 WeakPolarHBondContact O-CB 3.45Å; F364-V368 VanDerWaalsContact O-CG2 3.28Å; F364-V368 WeakPolarHBondContact O-CG2 3.27Å; F364-V368 PolarHBondContact O-N 3.07Å; D365-V368 PolarHBondContact O-N 3.08Å; V368-A371 PolarHBondContact O-N 3Å; V368-A372 WeakPolarHBondContact O-CB 3.42Å; V368-A372 PolarHBondContact O-N 2.92Å
369	D	53.5	Low	49.5	Very low	112 Å²	112	91 Å²	91	60%	0.599	50%	0.503	S	S	*	.	H	α-helix	trans	-63.5	-42.4	176.3	-78.6	-15	0	0	0	111.9	D365 E366 A372 A373	D365-D369 WeakPolarHBondContact O-CB 3.43Å; D365-D369 PolarHBondContact O-N 3.46Å; E366-D369 PolarHBondContact O-N 3.29Å; D369-A372 PolarHBondContact O-N 2.99Å; D369-A373 WeakPolarHBondContact O-CB 3.33Å; D369-A373 PolarHBondContact O-N 2.91Å
370	I	46.9	Very low	49.3	Very low	102 Å²	102	83 Å²	83	52%	0.523	47%	0.471	S	S	.	.	H	α-helix	trans	-64.6	-43.9	175.8	-68.2	164.9	0	0	0	110.8	E366 A372 A373 I374	E366-I370 WeakPolarHBondContact O-CB 3.3Å; E366-I370 WeakPolarHBondContact O-CD1 3.19Å; E366-I370 WeakPolarHBondContact O-CG1 3.42Å; E366-I370 PolarHBondContact O-N 2.7Å; I370-A372 PolarHBondContact O-N 3.42Å; I370-A373 PolarHBondContact O-N 3.44Å; I370-I374 HydrophobicContact CG2-CD1 3.74Å; I370-I374 HydrophobicContact CG2-CG1 4.37Å; I370-I374 VanDerWaalsContact O-CG1 3.28Å; I370-I374 WeakPolarHBondContact O-CG1 3.44Å; I370-I374 PolarHBondContact O-N 3.13Å
371	A	47.9	Very low	48.9	Very low	58 Å²	58	85.4 Å²	85.4	48%	0.479	48%	0.477	S	S	.	.	H	α-helix	trans	-63.7	-40.2	177.9	0	0	0	0	0	112	A367 V368 I374 K375	A367-A371 WeakPolarHBondContact O-CB 3.48Å; A367-A371 PolarHBondContact O-N 3.38Å; V368-A371 PolarHBondContact O-N 3Å; A371-I374 PolarHBondContact O-N 3.31Å; A371-K375 WeakPolarHBondContact O-CB 3.43Å; A371-K375 PolarHBondContact O-N 3.09Å
372	A	55.7	Low	48.4	Very low	49 Å²	49	85.4 Å²	85.4	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-64.9	-41.2	174.2	0	0	0	0	0	111.9	V368 D369 I370 K375 T376	V368-A372 WeakPolarHBondContact O-CB 3.42Å; V368-A372 PolarHBondContact O-N 2.92Å; D369-A372 PolarHBondContact O-N 2.99Å; I370-A372 PolarHBondContact O-N 3.42Å; A372-K375 PolarHBondContact O-N 3.37Å; A372-T376 WeakPolarHBondContact O-CB 3.37Å; A372-T376 PolarHBondContact O-N 3.5Å; A372-T376 PolarHBondContact O-OG1 3.17Å
373	A	48.6	Very low	47.7	Very low	52 Å²	52	87.4 Å²	87.4	43%	0.43	49%	0.486	S	S	.	.	H	α-helix	trans	-63.8	-45.5	176	0	0	0	0	0	111.9	D369 I370 K375 T376 Q377	D369-A373 WeakPolarHBondContact O-CB 3.33Å; D369-A373 PolarHBondContact O-N 2.91Å; I370-A373 PolarHBondContact O-N 3.44Å; A373-K375 VanDerWaalsContact C-N 3.35Å; A373-K375 PolarHBondContact O-N 3.39Å; A373-T376 PolarHBondContact O-N 3.16Å; A373-Q377 WeakPolarHBondContact O-CB 3.46Å; A373-Q377 WeakPolarHBondContact O-CG 3.26Å; A373-Q377 PolarHBondContact O-N 3.47Å
374	I	47.2	Very low	47	Very low	87 Å²	87	86.1 Å²	86.1	45%	0.446	49%	0.485	S	S	.	.	H	α-helix	trans	-61.4	-43.8	176	-69.2	167.2	0	0	0	110.5	I370 A371 Q377 L378	I370-I374 HydrophobicContact CG2-CD1 3.74Å; I370-I374 HydrophobicContact CG2-CG1 4.37Å; I370-I374 VanDerWaalsContact O-CG1 3.28Å; I370-I374 WeakPolarHBondContact O-CG1 3.44Å; I370-I374 PolarHBondContact O-N 3.13Å; A371-I374 PolarHBondContact O-N 3.31Å; I374-Q377 PolarHBondContact O-N 3.22Å; I374-L378 HydrophobicContact CG2-CD1 3.81Å; I374-L378 HydrophobicContact CG2-CG 4.3Å; I374-L378 WeakPolarHBondContact O-CB 3.29Å; I374-L378 VanDerWaalsContact O-CG 3.27Å; I374-L378 WeakPolarHBondContact O-CG 3.49Å; I374-L378 PolarHBondContact O-N 3.17Å
375	K	51.4	Low	46.4	Very low	128 Å²	128	83.9 Å²	83.9	56%	0.557	47%	0.473	S	S	*	.	H	α-helix	trans	-61	-46.1	177	-173.5	-178.7	175.4	-172.3	0	111.4	A371 A372 A373 Q377 L378 E379	A371-K375 WeakPolarHBondContact O-CB 3.43Å; A371-K375 PolarHBondContact O-N 3.09Å; A372-K375 PolarHBondContact O-N 3.37Å; A373-K375 VanDerWaalsContact C-N 3.35Å; A373-K375 PolarHBondContact O-N 3.39Å; K375-Q377 VanDerWaalsContact C-N 3.34Å; K375-Q377 PolarHBondContact O-N 3.28Å; K375-L378 PolarHBondContact O-N 3.35Å; K375-E379 WeakPolarHBondContact CE-OE1 3.48Å; K375-E379 WeakPolarHBondContact O-CB 3.44Å; K375-E379 WeakPolarHBondContact O-CG 3.37Å; K375-E379 PolarHBondContact O-N 3.28Å
376	T	52	Low	45.7	Very low	76 Å²	76	82.1 Å²	82.1	47%	0.466	47%	0.469	S	S	.	.	H	α-helix	trans	-63.1	-40.9	178.1	-49.3	0	0	0	0	111.5	A372 A373 E379 A380	A372-T376 WeakPolarHBondContact O-CB 3.37Å; A372-T376 PolarHBondContact O-N 3.5Å; A372-T376 PolarHBondContact O-OG1 3.17Å; A373-T376 PolarHBondContact O-N 3.16Å; T376-E379 PolarHBondContact O-N 3.41Å; T376-A380 WeakPolarHBondContact O-CB 3.11Å; T376-A380 PolarHBondContact O-N 2.95Å
377	Q	44.1	Very low	45.1	Very low	141 Å²	141	82.4 Å²	82.4	66%	0.659	47%	0.473	S	S	*	.	H	α-helix	trans	-64.7	-43.3	174	-79	-174.2	-24.4	0	0	111.8	A373 I374 K375 E379 A380 H381	A373-Q377 WeakPolarHBondContact O-CB 3.46Å; A373-Q377 WeakPolarHBondContact O-CG 3.26Å; A373-Q377 PolarHBondContact O-N 3.47Å; I374-Q377 PolarHBondContact O-N 3.22Å; K375-Q377 VanDerWaalsContact C-N 3.34Å; K375-Q377 PolarHBondContact O-N 3.28Å; Q377-E379 VanDerWaalsContact C-N 3.34Å; Q377-E379 PolarHBondContact O-N 2.97Å; Q377-A380 PolarHBondContact O-N 3.34Å; Q377-H381 WeakPolarHBondContact O-CB 3.4Å; Q377-H381 PolarHBondContact O-N 3.42Å
378	L	45.9	Very low	44.9	Very low	74 Å²	74	85.5 Å²	85.5	39%	0.387	48%	0.481	S	S	.	.	H	α-helix	trans	-62.8	-40.7	176.8	-75.5	169.2	0	0	0	111.8	I374 K375 S382	I374-L378 HydrophobicContact CG2-CD1 3.81Å; I374-L378 HydrophobicContact CG2-CG 4.3Å; I374-L378 WeakPolarHBondContact O-CB 3.29Å; I374-L378 VanDerWaalsContact O-CG 3.27Å; I374-L378 WeakPolarHBondContact O-CG 3.49Å; I374-L378 PolarHBondContact O-N 3.17Å; K375-L378 PolarHBondContact O-N 3.35Å; L378-S382 VanDerWaalsContact O-CB 3.23Å; L378-S382 WeakPolarHBondContact O-CB 3.3Å; L378-S382 PolarHBondContact O-N 2.86Å; L378-S382 PolarHBondContact O-OG 3.22Å
379	E	47.6	Very low	44.4	Very low	96 Å²	96	91.1 Å²	91.1	45%	0.449	50%	0.5	S	S	.	.	H	α-helix	trans	-65.4	-48.2	175.8	-74.9	173.3	-179.2	0	0	111.4	K375 T376 Q377 H381 S382 L383	K375-E379 WeakPolarHBondContact CE-OE1 3.48Å; K375-E379 WeakPolarHBondContact O-CB 3.44Å; K375-E379 WeakPolarHBondContact O-CG 3.37Å; K375-E379 PolarHBondContact O-N 3.28Å; T376-E379 PolarHBondContact O-N 3.41Å; Q377-E379 VanDerWaalsContact C-N 3.34Å; Q377-E379 PolarHBondContact O-N 2.97Å; E379-H381 PolarHBondContact O-N 2.91Å; E379-S382 WeakPolarHBondContact CA-OG 3.46Å; E379-S382 PolarHBondContact O-N 3.23Å; E379-S382 VanDerWaalsContact O-N 3.15Å; E379-S382 PolarHBondContact O-OG 2.91Å; E379-L383 WeakPolarHBondContact O-CG 3.34Å; E379-L383 PolarHBondContact O-N 3.34Å
380	A	43.8	Very low	43.8	Very low	13 Å²	13	90.3 Å²	90.3	11%	0.107	50%	0.501	C	S	.	.	H	α-helix	trans	-58	-48	174.2	0	0	0	0	0	111.4	T376 Q377 S382 L383 G384 Y385 I387	T376-A380 WeakPolarHBondContact O-CB 3.11Å; T376-A380 PolarHBondContact O-N 2.95Å; Q377-A380 PolarHBondContact O-N 3.34Å; A380-S382 VanDerWaalsContact C-N 3.26Å; A380-S382 PolarHBondContact O-N 3.46Å; A380-L383 PolarHBondContact O-N 3.24Å; A380-L383 VanDerWaalsContact O-N 3.16Å; A380-G384 PolarHBondContact O-N 3.45Å; A380-Y385 CarbonylContact C-O 3.58Å; A380-Y385 VanDerWaalsContact C-O 3.26Å; A380-I387 HydrophobicContact CB-CD1 4.48Å; A380-I387 HydrophobicContact CB-CG1 4.45Å
381	H	40.9	Very low	44.1	Very low	93 Å²	93	88 Å²	88	43%	0.431	50%	0.502	S	S	.	.	H	α-helix	trans	-68.7	-24.8	-179.7	-139	-91.5	0	0	0	112.2	R185 Q377 E379 L383	R185-H381 PolarHBondContact NH1-ND1 2.94Å; R185-H381 VanDerWaalsContact NH2-CB 3.32Å; R185-H381 PolarHBondContact NH2-ND1 3.44Å; R185-H381 PolarHBondContact NH2-O 2.97Å; Q377-H381 WeakPolarHBondContact O-CB 3.4Å; Q377-H381 PolarHBondContact O-N 3.42Å; E379-H381 PolarHBondContact O-N 2.91Å; H381-L383 VanDerWaalsContact C-N 3.34Å
382	S	37.2	Very low	44.8	Very low	85 Å²	85	86.7 Å²	86.7	59%	0.594	49%	0.494	S	S	*	.	H	α-helix	trans	-74.8	-23.7	175.5	74.5	0	0	0	0	113.3	L378 E379 A380	L378-S382 VanDerWaalsContact O-CB 3.23Å; L378-S382 WeakPolarHBondContact O-CB 3.3Å; L378-S382 PolarHBondContact O-N 2.86Å; L378-S382 PolarHBondContact O-OG 3.22Å; E379-S382 WeakPolarHBondContact CA-OG 3.46Å; E379-S382 PolarHBondContact O-N 3.23Å; E379-S382 VanDerWaalsContact O-N 3.15Å; E379-S382 PolarHBondContact O-OG 2.91Å; A380-S382 VanDerWaalsContact C-N 3.26Å; A380-S382 PolarHBondContact O-N 3.46Å
383	L	37.9	Very low	45.6	Very low	107 Å²	107	91 Å²	91	56%	0.56	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	4.9	179.2	-65.4	162.9	0	0	0	113.1	E379 A380 H381 Y385	E379-L383 WeakPolarHBondContact O-CG 3.34Å; E379-L383 PolarHBondContact O-N 3.34Å; A380-L383 PolarHBondContact O-N 3.24Å; A380-L383 VanDerWaalsContact O-N 3.16Å; H381-L383 VanDerWaalsContact C-N 3.34Å; L383-Y385 HydrophobicContact CB-CD1 3.56Å; L383-Y385 HydrophobicContact CB-CE1 3.16Å; L383-Y385 HydrophobicContact CD1-CE1 3.73Å; L383-Y385 WeakPolarHBondContact CD1-OH 3.39Å; L383-Y385 HydrophobicContact CG-CE1 4Å; L383-Y385 WeakPolarHBondContact O-CD1 3.4Å; L383-Y385 PolarHBondContact O-N 3.05Å
384	G	36	Very low	47	Very low	50 Å²	50	88.6 Å²	88.6	52%	0.515	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	7.7	175.3	0	0	0	0	0	115.1	A380	A380-G384 PolarHBondContact O-N 3.45Å
385	Y	36.6	Very low	48.4	Very low	96 Å²	96	86.7 Å²	86.7	38%	0.376	48%	0.477	S	S	.	.			trans	-124.1	132.8	176.4	63.9	-101	0	0	0	110.7	A380 L383 I387 F409	A380-Y385 CarbonylContact C-O 3.58Å; A380-Y385 VanDerWaalsContact C-O 3.26Å; L383-Y385 HydrophobicContact CB-CD1 3.56Å; L383-Y385 HydrophobicContact CB-CE1 3.16Å; L383-Y385 HydrophobicContact CD1-CE1 3.73Å; L383-Y385 WeakPolarHBondContact CD1-OH 3.39Å; L383-Y385 HydrophobicContact CG-CE1 4Å; L383-Y385 WeakPolarHBondContact O-CD1 3.4Å; L383-Y385 PolarHBondContact O-N 3.05Å; Y385-I387 HydrophobicContact CE2-CG1 4.37Å; Y385-F409 VanDerWaalsContact CB-O 3.27Å; Y385-F409 WeakPolarHBondContact CB-O 3.47Å
386	S	37.9	Very low	49.7	Very low	57 Å²	57	82.6 Å²	82.6	40%	0.399	47%	0.465	S	S	.	.			trans	-96.3	128.3	173.7	61.2	0	0	0	0	110.1	L388	S386-L388 PolarHBondContact O-N 2.91Å; S386-L388 VanDerWaalsContact O-N 3.11Å
387	I	36.2	Very low	51.1	Low	129 Å²	129	81.6 Å²	81.6	66%	0.662	46%	0.46	S	S	*	.			trans	-74.3	99.1	169.8	-57.1	171.9	0	0	0	107.6	A380 Y385	A380-I387 HydrophobicContact CB-CD1 4.48Å; A380-I387 HydrophobicContact CB-CG1 4.45Å; Y385-I387 HydrophobicContact CE2-CG1 4.37Å
388	L	43	Very low	52.6	Low	118 Å²	118	77.1 Å²	77.1	62%	0.618	45%	0.452	S	S	*	.			trans	-109.1	145.5	173	-84.1	163.7	0	0	0	110.3	S386	S386-L388 PolarHBondContact O-N 2.91Å; S386-L388 VanDerWaalsContact O-N 3.11Å
389	K	42.1	Very low	54.1	Low	191 Å²	191	79.1 Å²	79.1	83%	0.83	46%	0.463	S	S	*	.			trans	-40.7	143.2	-167.5	-70.6	174.5	177.9	173.2	0	114.8	G391	K389-G391 PolarHBondContact O-N 3.36Å
390	P	41.3	Very low	55.3	Low	95 Å²	95	82.2 Å²	82.2	62%	0.617	48%	0.475	S	S	*	.	S	Bend	trans	-58.6	123.3	179.7	24.2	-32.7	0	0	0	111	A403	P390-A403 HydrophobicContact CB-CB 3.78Å; P390-A403 HydrophobicContact CG-CB 4.21Å
391	G	53.3	Low	56.5	Low	53 Å²	53	81.9 Å²	81.9	55%	0.546	47%	0.471	S	S	.	.			trans	157.7	-6.4	-178.5	0	0	0	0	0	117.4	K389	K389-G391 PolarHBondContact O-N 3.36Å
392	G	63.2	Low	57.5	Low	30 Å²	30	80.5 Å²	80.5	31%	0.309	47%	0.472	S	S	.	.			trans	-66.1	165.1	177.5	0	0	0	0	0	114.1	K400 I401	G392-K400 CarbonylContact O-C 3.46Å; G392-K400 WeakPolarHBondContact O-CA 3.32Å; G392-I401 WeakPolarHBondContact O-CB 3.35Å; G392-I401 PolarHBondContact O-N 3.21Å
393	K	72.6	Confident	58.4	Low	140 Å²	140	80.3 Å²	80.3	61%	0.609	48%	0.475	S	S	*	.	B	Isolated β-bridge	trans	-108.9	134.4	170.9	-68.6	178.4	-175.8	171.4	0	109.4	S395 L399 S415	K393-S395 PolarHBondContact O-N 3.38Å; K393-L399 CarbonylContact C-O 3.34Å; K393-L399 WeakPolarHBondContact CA-O 3.48Å; K393-S415 PolarHBondContact O-OG 3.12Å
394	C	76.1	Confident	59.2	Low	1 Å²	1	86.7 Å²	86.7	1%	0.007	49%	0.492	C	S	.	.			trans	-58.4	125.9	174.4	177.5	0	0	0	0	110.2	S396 C397 G398 L399 I401 S415 C420	C394-S396 PolarHBondContact O-N 2.87Å; C394-C397 WeakPolarHBondContact CB-SG 3.24Å; C394-G398 WeakPolarHBondContact O-CA 3.4Å; C394-G398 PolarHBondContact O-N 2.9Å; C394-L399 PolarHBondContact N-O 3.26Å; C394-I401 HydrophobicContact CB-CD1 4.4Å; C394-I401 HydrophobicContact CB-CG1 4.16Å; C394-S415 CarbonylContact C-O 3.29Å; C394-S415 VanDerWaalsContact CA-O 3.3Å; C394-S415 WeakPolarHBondContact CA-O 3.47Å; C394-C420 VanDerWaalsContact SG-SG 3.66Å
395	S	77.5	Confident	60.2	Low	47 Å²	47	86 Å²	86	33%	0.329	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-22.6	-179.3	-56.6	0	0	0	0	113	K393 H414 S415	K393-S395 PolarHBondContact O-N 3.38Å; S395-H414 PolarHBondContact OG-CD2 3.29Å; S395-S415 PolarHBondContact N-O 3.33Å; S395-S415 PolarHBondContact OG-N 3.37Å; S395-S415 PolarHBondContact OG-O 2.88Å
396	S	78.6	Confident	61.1	Low	43 Å²	43	88.3 Å²	88.3	30%	0.301	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-47.8	175.3	172.8	0	0	0	0	112	C394 E424	C394-S396 PolarHBondContact O-N 2.87Å; S396-E424 WeakPolarHBondContact CB-OE1 3.47Å; S396-E424 PolarHBondContact OG-OE1 3.03Å
397	C	80.9	Confident	62.4	Low	54 Å²	54	88.4 Å²	88.4	37%	0.365	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-5.1	-173.5	72.4	0	0	0	0	116.2	C394 L399 H417 C420	C394-C397 WeakPolarHBondContact CB-SG 3.24Å; C397-L399 PolarHBondContact O-N 3.16Å; C397-H417 VanDerWaalsContact SG-CE1 3.52Å; C397-H417 PolarHBondContact SG-ND1 3.39Å; C397-H417 VanDerWaalsContact SG-ND1 3.37Å; C397-C420 VanDerWaalsContact SG-SG 3.68Å
398	G	76	Confident	63.6	Low	47 Å²	47	83.6 Å²	83.6	49%	0.485	46%	0.464	S	S	.	.			trans	70.5	-6.3	-179.7	0	0	0	0	0	116.1	C394	C394-G398 WeakPolarHBondContact O-CA 3.4Å; C394-G398 PolarHBondContact O-N 2.9Å
399	L	78.1	Confident	64.6	Low	116 Å²	116	80.2 Å²	80.2	61%	0.607	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-75.9	150.6	-179.8	-64.6	173.7	0	0	0	111.6	K393 C394 C397 I401	K393-L399 CarbonylContact C-O 3.34Å; K393-L399 WeakPolarHBondContact CA-O 3.48Å; C394-L399 PolarHBondContact N-O 3.26Å; C397-L399 PolarHBondContact O-N 3.16Å; L399-I401 PolarHBondContact O-N 3.33Å
400	K	72.7	Confident	65.6	Low	161 Å²	161	72.1 Å²	72.1	70%	0.7	41%	0.409	S	S	*	.	B	Isolated β-bridge	trans	-65.2	130.9	178.1	-73.5	-173.4	179.1	-177	0	110.9	G392	G392-K400 CarbonylContact O-C 3.46Å; G392-K400 WeakPolarHBondContact O-CA 3.32Å
401	I	68.5	Low	66.5	Low	6 Å²	6	71.6 Å²	71.6	3%	0.031	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-77	121.7	172.5	-65.9	177.4	0	0	0	107.6	G392 C394 L399 E407 F409 S415	G392-I401 WeakPolarHBondContact O-CB 3.35Å; G392-I401 PolarHBondContact O-N 3.21Å; C394-I401 HydrophobicContact CB-CD1 4.4Å; C394-I401 HydrophobicContact CB-CG1 4.16Å; L399-I401 PolarHBondContact O-N 3.33Å; I401-E407 HydrophobicContact CG2-CB 4.27Å; I401-E407 HydrophobicContact CG2-CG 3.42Å; I401-E407 VanDerWaalsContact CG2-CG 3.42Å; I401-E407 WeakPolarHBondContact CG2-OE1 3.47Å; I401-F409 HydrophobicContact CD1-CE1 4.24Å; I401-F409 HydrophobicContact CD1-CZ 4.5Å; I401-F409 HydrophobicContact CG2-CZ 4.3Å; I401-S415 VanDerWaalsContact CD1-CB 3.45Å; I401-S415 VanDerWaalsContact CD1-OG 3.22Å; I401-S415 WeakPolarHBondContact CD1-OG 3.4Å
402	S	62.5	Low	67.1	Low	65 Å²	65	71 Å²	71	46%	0.455	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-99.1	145.2	-175.7	73.3	0	0	0	0	110.3	R404 S405	S402-R404 PolarHBondContact O-N 3.38Å; S402-S405 PolarHBondContact N-OG 3.38Å; S402-S405 VanDerWaalsContact N-OG 3.15Å; S402-S405 PolarHBondContact O-N 2.94Å; S402-S405 PolarHBondContact O-OG 2.69Å; S402-S405 PolarHBondContact OG-N 2.87Å; S402-S405 PolarHBondContact OG-OG 3.44Å
403	A	56.4	Low	67.3	Low	80 Å²	80	76.4 Å²	76.4	66%	0.661	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-9.2	179.2	0	0	0	0	0	116.3	P390	P390-A403 HydrophobicContact CB-CB 3.78Å; P390-A403 HydrophobicContact CG-CB 4.21Å
404	R	53.1	Low	67.1	Low	242 Å²	242	72.2 Å²	72.2	91%	0.913	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-10.8	178.1	-65.6	-174.7	-180	-175.6	-0.2	114.1	S402	S402-R404 PolarHBondContact O-N 3.38Å
405	S	57.2	Low	67.1	Low	34 Å²	34	72.7 Å²	72.7	24%	0.238	41%	0.407	C	S	.	.	S	Bend	trans	-76.5	149.7	173.4	32.4	0	0	0	0	109.7	S402 E407	S402-S405 PolarHBondContact N-OG 3.38Å; S402-S405 VanDerWaalsContact N-OG 3.15Å; S402-S405 PolarHBondContact O-N 2.94Å; S402-S405 PolarHBondContact O-OG 2.69Å; S402-S405 PolarHBondContact OG-N 2.87Å; S402-S405 PolarHBondContact OG-OG 3.44Å; S405-E407 VanDerWaalsContact O-CG 3.3Å; S405-E407 WeakPolarHBondContact O-CG 3.43Å
406	Q	56.2	Low	66.9	Low	145 Å²	145	70.4 Å²	70.4	68%	0.678	39%	0.391	S	S	*	.			trans	-75.6	131.4	164.2	-71.1	175.3	-40.2	0	0	108.2	L418	Q406-L418 HydrophobicContact CB-CB 3.82Å; Q406-L418 HydrophobicContact CB-CD2 3.84Å; Q406-L418 HydrophobicContact CB-CG 4.46Å; Q406-L418 HydrophobicContact CG-CD2 4.48Å; Q406-L418 WeakPolarHBondContact O-CB 3.31Å; Q406-L418 PolarHBondContact O-N 3.47Å
407	E	64.6	Low	66.9	Low	60 Å²	60	69.8 Å²	69.8	28%	0.28	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	141	-164.2	-51.2	173.2	174.6	0	0	110	I401 S405 F409 F416	I401-E407 HydrophobicContact CG2-CB 4.27Å; I401-E407 HydrophobicContact CG2-CG 3.42Å; I401-E407 VanDerWaalsContact CG2-CG 3.42Å; I401-E407 WeakPolarHBondContact CG2-OE1 3.47Å; S405-E407 VanDerWaalsContact O-CG 3.3Å; S405-E407 WeakPolarHBondContact O-CG 3.43Å; E407-F409 HydrophobicContact CB-CD2 4.05Å; E407-F409 HydrophobicContact CB-CE2 3.25Å; E407-F409 HydrophobicContact CB-CZ 3.7Å; E407-F409 HydrophobicContact CG-CE2 4.16Å; E407-F409 HydrophobicContact CG-CZ 4.27Å; E407-F409 WeakPolarHBondContact OE2-CE2 3.38Å; E407-F409 WeakPolarHBondContact OE2-CZ 3.38Å; E407-F416 WeakPolarHBondContact CA-O 3.46Å
408	V	61.1	Low	66.3	Low	27 Å²	27	69.5 Å²	69.5	16%	0.164	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122	174.9	-173.7	0	0	0	0	108	F410 S415 F416 L418 F421	V408-F410 HydrophobicContact CG1-CD2 4.41Å; V408-F410 HydrophobicContact CG1-CE2 3.6Å; V408-F410 HydrophobicContact CG1-CZ 3.68Å; V408-S415 CarbonylContact O-C 3.6Å; V408-S415 WeakPolarHBondContact O-CA 3.19Å; V408-F416 PolarHBondContact N-O 3.03Å; V408-F416 PolarHBondContact O-N 3.03Å; V408-L418 HydrophobicContact CG2-CD1 3.84Å; V408-F421 HydrophobicContact CB-CB 4.42Å; V408-F421 HydrophobicContact CB-CD1 4.49Å; V408-F421 HydrophobicContact CB-CG 4.24Å; V408-F421 HydrophobicContact CG1-CD1 4.38Å; V408-F421 HydrophobicContact CG1-CD2 4.28Å; V408-F421 HydrophobicContact CG1-CE1 4.45Å; V408-F421 HydrophobicContact CG1-CE2 4.39Å; V408-F421 HydrophobicContact CG1-CG 4.28Å; V408-F421 HydrophobicContact CG1-CZ 4.46Å; V408-F421 HydrophobicContact CG2-CB 4.17Å; V408-F421 HydrophobicContact CG2-CD1 3.91Å; V408-F421 HydrophobicContact CG2-CG 4.05Å
409	F	64.3	Low	66.3	Low	48 Å²	48	70.5 Å²	70.5	21%	0.211	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.1	-179.9	-60.1	-85.8	0	0	0	110.1	Y385 I401 E407	Y385-F409 VanDerWaalsContact CB-O 3.27Å; Y385-F409 WeakPolarHBondContact CB-O 3.47Å; I401-F409 HydrophobicContact CD1-CE1 4.24Å; I401-F409 HydrophobicContact CD1-CZ 4.5Å; I401-F409 HydrophobicContact CG2-CZ 4.3Å; E407-F409 HydrophobicContact CB-CD2 4.05Å; E407-F409 HydrophobicContact CB-CE2 3.25Å; E407-F409 HydrophobicContact CB-CZ 3.7Å; E407-F409 HydrophobicContact CG-CE2 4.16Å; E407-F409 HydrophobicContact CG-CZ 4.27Å; E407-F409 WeakPolarHBondContact OE2-CE2 3.38Å; E407-F409 WeakPolarHBondContact OE2-CZ 3.38Å
410	F	63.5	Low	66.3	Low	20 Å²	20	65.7 Å²	65.7	9%	0.088	35%	0.353	C	S	.	.			trans	-108.9	155.5	177.5	-66.6	-82.9	0	0	0	111.1	V408 C412 L413 H414 F416 F421 E455 C456	V408-F410 HydrophobicContact CG1-CD2 4.41Å; V408-F410 HydrophobicContact CG1-CE2 3.6Å; V408-F410 HydrophobicContact CG1-CZ 3.68Å; F410-C412 PolarHBondContact O-N 3.01Å; F410-L413 PolarHBondContact O-N 2.91Å; F410-H414 PolarHBondContact N-O 2.9Å; F410-F416 AromaticContact CD2-CD2 3.99Å; F410-F416 HydrophobicContact CD2-CD2 3.99Å; F410-F416 AromaticContact CD2-CE2 3.73Å; F410-F416 HydrophobicContact CD2-CE2 3.73Å; F410-F416 AromaticContact CE2-CD2 3.74Å; F410-F416 HydrophobicContact CE2-CD2 3.74Å; F410-F416 AromaticContact CE2-CE2 3.71Å; F410-F416 HydrophobicContact CE2-CE2 3.71Å; F410-F421 HydrophobicContact CE2-CD2 4.03Å; F410-F421 AromaticContact CE2-CE2 3.76Å; F410-F421 HydrophobicContact CE2-CE2 3.76Å; F410-F421 HydrophobicContact CZ-CD2 4.12Å; F410-F421 AromaticContact CZ-CE2 3.4Å; F410-F421 HydrophobicContact CZ-CE2 3.4Å; F410-F421 VanDerWaalsContact CZ-CE2 3.4Å; F410-F421 AromaticContact CZ-CZ 3.91Å; F410-F421 HydrophobicContact CZ-CZ 3.91Å; F410-E455 WeakPolarHBondContact CE1-O 3.15Å; F410-E455 WeakPolarHBondContact CZ-O 3.47Å; F410-C456 HydrophobicContact CB-CB 3.84Å; F410-C456 HydrophobicContact CD1-CB 3.74Å; F410-C456 HydrophobicContact CD2-CB 3.9Å; F410-C456 HydrophobicContact CE1-CB 4.29Å; F410-C456 HydrophobicContact CE2-CB 4.41Å; F410-C456 HydrophobicContact CG-CB 3.52Å
411	A	60.5	Low	66.4	Low	84 Å²	84	58.9 Å²	58.9	69%	0.694	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-18.8	173.7	0	0	0	0	0	113.8	L413	A411-L413 PolarHBondContact O-N 2.91Å
412	C	66.3	Low	66.5	Low	42 Å²	42	63.6 Å²	63.6	28%	0.284	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	14.7	171.9	72.3	0	0	0	0	114.4	F410 H414 C456 C459	F410-C412 PolarHBondContact O-N 3.01Å; C412-H414 PolarHBondContact O-N 2.97Å; C412-H414 VanDerWaalsContact O-N 3.15Å; C412-H414 PolarHBondContact SG-ND1 3.27Å; C412-C456 VanDerWaalsContact SG-CB 3.56Å; C412-C459 HydrophobicContact CB-CB 4.14Å; C412-C459 WeakPolarHBondContact CB-SG 3.43Å; C412-C459 WeakPolarHBondContact SG-CB 3.25Å; C412-C459 CovalentContact SG-SG 2.06Å; C412-C459 PolarHBondContact SG-SG 3.46Å
413	L	66.4	Low	67.1	Low	142 Å²	142	67.4 Å²	67.4	74%	0.743	35%	0.354	S	S	*	.	S	Bend	trans	66.5	4.6	177.9	-56.3	171.7	0	0	0	115.9	F410 A411	F410-L413 PolarHBondContact O-N 2.91Å; A411-L413 PolarHBondContact O-N 2.91Å
414	H	69.2	Low	67.8	Low	53 Å²	53	65.9 Å²	65.9	25%	0.245	33%	0.333	C	S	.	.			trans	-69.6	135.8	166.7	-68.5	130.1	0	0	0	110.4	S395 F410 C412 F416 C456	S395-H414 PolarHBondContact OG-CD2 3.29Å; F410-H414 PolarHBondContact N-O 2.9Å; C412-H414 PolarHBondContact O-N 2.97Å; C412-H414 VanDerWaalsContact O-N 3.15Å; C412-H414 PolarHBondContact SG-ND1 3.27Å; H414-F416 HydrophobicContact CB-CE2 3.63Å; H414-F416 HydrophobicContact CB-CZ 3.79Å; H414-C456 PolarHBondContact ND1-SG 3.01Å
415	S	74.8	Confident	68.4	Low	10 Å²	10	55.5 Å²	55.5	7%	0.07	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.7	-177.9	63.2	0	0	0	0	109.8	K393 C394 S395 I401 V408	K393-S415 PolarHBondContact O-OG 3.12Å; C394-S415 CarbonylContact C-O 3.29Å; C394-S415 VanDerWaalsContact CA-O 3.3Å; C394-S415 WeakPolarHBondContact CA-O 3.47Å; S395-S415 PolarHBondContact N-O 3.33Å; S395-S415 PolarHBondContact OG-N 3.37Å; S395-S415 PolarHBondContact OG-O 2.88Å; I401-S415 VanDerWaalsContact CD1-CB 3.45Å; I401-S415 VanDerWaalsContact CD1-OG 3.22Å; I401-S415 WeakPolarHBondContact CD1-OG 3.4Å; V408-S415 CarbonylContact O-C 3.6Å; V408-S415 WeakPolarHBondContact O-CA 3.19Å
416	F	73.1	Confident	69	Low	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	144.3	-176.2	-57.5	-83.4	0	0	0	110.4	E407 V408 F410 H414 F421 P457 F458	E407-F416 WeakPolarHBondContact CA-O 3.46Å; V408-F416 PolarHBondContact N-O 3.03Å; V408-F416 PolarHBondContact O-N 3.03Å; F410-F416 AromaticContact CD2-CD2 3.99Å; F410-F416 HydrophobicContact CD2-CD2 3.99Å; F410-F416 AromaticContact CD2-CE2 3.73Å; F410-F416 HydrophobicContact CD2-CE2 3.73Å; F410-F416 AromaticContact CE2-CD2 3.74Å; F410-F416 HydrophobicContact CE2-CD2 3.74Å; F410-F416 AromaticContact CE2-CE2 3.71Å; F410-F416 HydrophobicContact CE2-CE2 3.71Å; H414-F416 HydrophobicContact CB-CE2 3.63Å; H414-F416 HydrophobicContact CB-CZ 3.79Å; F416-F421 HydrophobicContact CB-CB 3.73Å; F416-F421 HydrophobicContact CD2-CD2 4.26Å; F416-F421 HydrophobicContact CG-CB 4.25Å; F416-F421 HydrophobicContact CG-CD2 4.47Å; F416-P457 HydrophobicContact CE2-CG 4.31Å; F416-P457 HydrophobicContact CZ-CG 4.24Å; F416-F458 HydrophobicContact CD1-CE2 4.42Å; F416-F458 AromaticContact CE1-CD2 3.52Å; F416-F458 HydrophobicContact CE1-CD2 3.52Å; F416-F458 AromaticContact CE1-CE2 3.25Å; F416-F458 HydrophobicContact CE1-CE2 3.25Å; F416-F458 HydrophobicContact CE1-CZ 4.2Å; F416-F458 HydrophobicContact CE2-CD2 4.46Å; F416-F458 AromaticContact CZ-CD2 3.26Å; F416-F458 HydrophobicContact CZ-CD2 3.26Å; F416-F458 AromaticContact CZ-CE2 3.57Å; F416-F458 HydrophobicContact CZ-CE2 3.57Å; F416-F458 HydrophobicContact CZ-CG 4.22Å
417	H	78.7	Confident	69.6	Low	29 Å²	29	54.5 Å²	54.5	13%	0.134	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	142.3	153	-58.1	119	0	0	0	108	C397 S419 C420 F421	C397-H417 VanDerWaalsContact SG-CE1 3.52Å; C397-H417 PolarHBondContact SG-ND1 3.39Å; C397-H417 VanDerWaalsContact SG-ND1 3.37Å; H417-S419 PolarHBondContact O-N 2.86Å; H417-C420 HydrophobicContact CB-CB 4.08Å; H417-C420 WeakPolarHBondContact O-CA 3.42Å; H417-C420 WeakPolarHBondContact O-CB 3.48Å; H417-C420 PolarHBondContact O-N 3.37Å; H417-F421 PolarHBondContact O-N 3.04Å
418	L	69.9	Low	69.5	Low	49 Å²	49	53 Å²	53	26%	0.257	29%	0.291	S	S	.	.	H	α-helix	trans	-51.3	-43.7	175.7	-177.2	66.4	0	0	0	111.5	Q406 V408 C420 F421 E422	Q406-L418 HydrophobicContact CB-CB 3.82Å; Q406-L418 HydrophobicContact CB-CD2 3.84Å; Q406-L418 HydrophobicContact CB-CG 4.46Å; Q406-L418 HydrophobicContact CG-CD2 4.48Å; Q406-L418 WeakPolarHBondContact O-CB 3.31Å; Q406-L418 PolarHBondContact O-N 3.47Å; V408-L418 HydrophobicContact CG2-CD1 3.84Å; L418-C420 VanDerWaalsContact C-N 3.33Å; L418-C420 PolarHBondContact O-N 3.41Å; L418-F421 WeakPolarHBondContact O-CB 3.48Å; L418-F421 PolarHBondContact O-N 3.39Å; L418-E422 HydrophobicContact CD1-CG 4.46Å; L418-E422 HydrophobicContact CG-CG 4.41Å; L418-E422 WeakPolarHBondContact O-CB 3.35Å; L418-E422 VanDerWaalsContact O-CG 3.29Å; L418-E422 WeakPolarHBondContact O-CG 3.33Å; L418-E422 PolarHBondContact O-N 3.11Å
419	S	75.7	Confident	69.6	Low	68 Å²	68	53.4 Å²	53.4	48%	0.476	29%	0.294	S	S	.	.	H	α-helix	trans	-66.1	-30.1	177.4	60.6	0	0	0	0	114.3	H417 K423	H417-S419 PolarHBondContact O-N 2.86Å; S419-K423 VanDerWaalsContact O-CG 3.27Å; S419-K423 WeakPolarHBondContact O-CG 3.48Å; S419-K423 PolarHBondContact O-N 3.47Å
420	C	78.4	Confident	69.6	Low	14 Å²	14	57.3 Å²	57.3	10%	0.095	31%	0.313	C	S	.	.	H	α-helix	trans	-73.2	-45	172.5	-73.6	0	0	0	0	110.2	C394 C397 H417 L418 K423 E424	C394-C420 VanDerWaalsContact SG-SG 3.66Å; C397-C420 VanDerWaalsContact SG-SG 3.68Å; H417-C420 HydrophobicContact CB-CB 4.08Å; H417-C420 WeakPolarHBondContact O-CA 3.42Å; H417-C420 WeakPolarHBondContact O-CB 3.48Å; H417-C420 PolarHBondContact O-N 3.37Å; L418-C420 VanDerWaalsContact C-N 3.33Å; L418-C420 PolarHBondContact O-N 3.41Å; C420-K423 WeakPolarHBondContact O-CB 3.28Å; C420-K423 PolarHBondContact O-N 3.33Å; C420-E424 WeakPolarHBondContact O-CG 3.42Å; C420-E424 PolarHBondContact O-N 3.24Å
421	F	73.6	Confident	69.1	Low	19 Å²	19	58.7 Å²	58.7	8%	0.083	33%	0.325	C	S	.	.	H	α-helix	trans	-59.2	-47.9	177.1	177.3	-108.9	0	0	0	111.9	V408 F410 F416 H417 L418 K423 E424 V425 P457	V408-F421 HydrophobicContact CB-CB 4.42Å; V408-F421 HydrophobicContact CB-CD1 4.49Å; V408-F421 HydrophobicContact CB-CG 4.24Å; V408-F421 HydrophobicContact CG1-CD1 4.38Å; V408-F421 HydrophobicContact CG1-CD2 4.28Å; V408-F421 HydrophobicContact CG1-CE1 4.45Å; V408-F421 HydrophobicContact CG1-CE2 4.39Å; V408-F421 HydrophobicContact CG1-CG 4.28Å; V408-F421 HydrophobicContact CG1-CZ 4.46Å; V408-F421 HydrophobicContact CG2-CB 4.17Å; V408-F421 HydrophobicContact CG2-CD1 3.91Å; V408-F421 HydrophobicContact CG2-CG 4.05Å; F410-F421 HydrophobicContact CE2-CD2 4.03Å; F410-F421 AromaticContact CE2-CE2 3.76Å; F410-F421 HydrophobicContact CE2-CE2 3.76Å; F410-F421 HydrophobicContact CZ-CD2 4.12Å; F410-F421 AromaticContact CZ-CE2 3.4Å; F410-F421 HydrophobicContact CZ-CE2 3.4Å; F410-F421 VanDerWaalsContact CZ-CE2 3.4Å; F410-F421 AromaticContact CZ-CZ 3.91Å; F410-F421 HydrophobicContact CZ-CZ 3.91Å; F416-F421 HydrophobicContact CB-CB 3.73Å; F416-F421 HydrophobicContact CD2-CD2 4.26Å; F416-F421 HydrophobicContact CG-CB 4.25Å; F416-F421 HydrophobicContact CG-CD2 4.47Å; H417-F421 PolarHBondContact O-N 3.04Å; L418-F421 WeakPolarHBondContact O-CB 3.48Å; L418-F421 PolarHBondContact O-N 3.39Å; F421-K423 VanDerWaalsContact C-N 3.27Å; F421-K423 PolarHBondContact O-N 2.94Å; F421-E424 PolarHBondContact O-N 3.47Å; F421-V425 HydrophobicContact CD1-CG2 4.25Å; F421-V425 HydrophobicContact CD2-CG2 4.06Å; F421-V425 HydrophobicContact CE1-CG2 3.84Å; F421-V425 HydrophobicContact CE2-CG2 3.59Å; F421-V425 HydrophobicContact CG-CG2 4.36Å; F421-V425 HydrophobicContact CZ-CG2 3.49Å; F421-V425 VanDerWaalsContact CZ-CG2 3.49Å; F421-V425 WeakPolarHBondContact O-CB 3.36Å; F421-V425 WeakPolarHBondContact O-CG2 3.39Å; F421-V425 PolarHBondContact O-N 2.9Å; F421-P457 HydrophobicContact CD2-CG 4.01Å; F421-P457 HydrophobicContact CE2-CG 3.91Å
422	E	70.3	Confident	68.9	Low	104 Å²	104	58 Å²	58	49%	0.486	31%	0.312	S	S	.	.	H	α-helix	trans	-58.3	-38.5	176.8	-74.8	172.8	168.2	0	0	112.3	L418 S426	L418-E422 HydrophobicContact CD1-CG 4.46Å; L418-E422 HydrophobicContact CG-CG 4.41Å; L418-E422 WeakPolarHBondContact O-CB 3.35Å; L418-E422 VanDerWaalsContact O-CG 3.29Å; L418-E422 WeakPolarHBondContact O-CG 3.33Å; L418-E422 PolarHBondContact O-N 3.11Å; E422-S426 VanDerWaalsContact O-CB 3.25Å; E422-S426 WeakPolarHBondContact O-CB 3.47Å; E422-S426 PolarHBondContact O-N 3.28Å; E422-S426 PolarHBondContact O-OG 3.19Å
423	K	76.8	Confident	68.1	Low	146 Å²	146	64.3 Å²	64.3	64%	0.635	33%	0.33	S	S	*	.	H	α-helix	trans	-65.3	-48.9	175.2	-77.6	176.1	-178.3	-175	0	111.9	S419 C420 F421 S426 L427	S419-K423 VanDerWaalsContact O-CG 3.27Å; S419-K423 WeakPolarHBondContact O-CG 3.48Å; S419-K423 PolarHBondContact O-N 3.47Å; C420-K423 WeakPolarHBondContact O-CB 3.28Å; C420-K423 PolarHBondContact O-N 3.33Å; F421-K423 VanDerWaalsContact C-N 3.27Å; F421-K423 PolarHBondContact O-N 2.94Å; K423-S426 PolarHBondContact O-N 3.49Å; K423-L427 WeakPolarHBondContact O-CG 3.44Å; K423-L427 PolarHBondContact O-N 3.12Å
424	E	69.5	Low	67.3	Low	48 Å²	48	61.9 Å²	61.9	22%	0.224	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-47.9	177.9	-63.1	-63.9	166.8	0	0	110.5	S396 C420 F421 S426 L427 L428 P457 F458	S396-E424 WeakPolarHBondContact CB-OE1 3.47Å; S396-E424 PolarHBondContact OG-OE1 3.03Å; C420-E424 WeakPolarHBondContact O-CG 3.42Å; C420-E424 PolarHBondContact O-N 3.24Å; F421-E424 PolarHBondContact O-N 3.47Å; E424-S426 VanDerWaalsContact C-N 3.32Å; E424-S426 PolarHBondContact O-N 3.47Å; E424-L427 PolarHBondContact O-N 3.4Å; E424-L428 WeakPolarHBondContact O-CG 3.26Å; E424-L428 PolarHBondContact O-N 2.91Å; E424-P457 HydrophobicContact CB-CB 4.44Å; E424-P457 HydrophobicContact CB-CG 4.44Å; E424-F458 HydrophobicContact CG-CE2 4.1Å
425	V	66.5	Low	66.1	Low	24 Å²	24	65.3 Å²	65.3	15%	0.145	34%	0.339	C	S	.	.	H	α-helix	trans	-59.6	-41.8	176.6	171.3	0	0	0	0	111.8	F421 L427 L428 V429 V451	F421-V425 HydrophobicContact CD1-CG2 4.25Å; F421-V425 HydrophobicContact CD2-CG2 4.06Å; F421-V425 HydrophobicContact CE1-CG2 3.84Å; F421-V425 HydrophobicContact CE2-CG2 3.59Å; F421-V425 HydrophobicContact CG-CG2 4.36Å; F421-V425 HydrophobicContact CZ-CG2 3.49Å; F421-V425 VanDerWaalsContact CZ-CG2 3.49Å; F421-V425 WeakPolarHBondContact O-CB 3.36Å; F421-V425 WeakPolarHBondContact O-CG2 3.39Å; F421-V425 PolarHBondContact O-N 2.9Å; V425-L427 PolarHBondContact O-N 3.34Å; V425-L428 PolarHBondContact O-N 3.49Å; V425-V429 HydrophobicContact CG1-CG2 4.23Å; V425-V429 VanDerWaalsContact O-CG2 3.27Å; V425-V429 WeakPolarHBondContact O-CG2 3.44Å; V425-V429 PolarHBondContact O-N 3.34Å; V425-V451 HydrophobicContact CG1-CB 4.12Å; V425-V451 HydrophobicContact CG1-CG1 3.67Å; V425-V451 HydrophobicContact CG1-CG2 4.28Å
426	S	68.6	Low	64.4	Low	63 Å²	63	68.4 Å²	68.4	44%	0.441	37%	0.365	S	S	.	.	H	α-helix	trans	-61.8	-43.6	177.3	-61.9	0	0	0	0	111.8	E422 K423 E424 L428 V429 E430	E422-S426 VanDerWaalsContact O-CB 3.25Å; E422-S426 WeakPolarHBondContact O-CB 3.47Å; E422-S426 PolarHBondContact O-N 3.28Å; E422-S426 PolarHBondContact O-OG 3.19Å; K423-S426 PolarHBondContact O-N 3.49Å; E424-S426 VanDerWaalsContact C-N 3.32Å; E424-S426 PolarHBondContact O-N 3.47Å; S426-L428 VanDerWaalsContact C-N 3.33Å; S426-L428 PolarHBondContact O-N 3.35Å; S426-V429 PolarHBondContact O-N 2.79Å; S426-E430 WeakPolarHBondContact O-CG 3.37Å; S426-E430 PolarHBondContact O-N 2.83Å
427	L	69.4	Low	62.7	Low	95 Å²	95	77.8 Å²	77.8	50%	0.497	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-39	176.1	-69.9	170.4	0	0	0	112.1	K423 E424 V425 S431	K423-L427 WeakPolarHBondContact O-CG 3.44Å; K423-L427 PolarHBondContact O-N 3.12Å; E424-L427 PolarHBondContact O-N 3.4Å; V425-L427 PolarHBondContact O-N 3.34Å; L427-S431 WeakPolarHBondContact O-CB 3.4Å; L427-S431 PolarHBondContact O-N 3.07Å; L427-S431 PolarHBondContact O-OG 3.33Å
428	L	62.4	Low	60.7	Low	27 Å²	27	81.8 Å²	81.8	14%	0.141	44%	0.435	C	S	.	.	H	α-helix	trans	-65.9	-45.4	175.7	-62.6	167.3	0	0	0	110.9	E424 V425 S426 E430 S431 V432 P457 I462 L466	E424-L428 WeakPolarHBondContact O-CG 3.26Å; E424-L428 PolarHBondContact O-N 2.91Å; V425-L428 PolarHBondContact O-N 3.49Å; S426-L428 VanDerWaalsContact C-N 3.33Å; S426-L428 PolarHBondContact O-N 3.35Å; L428-E430 PolarHBondContact O-N 2.83Å; L428-S431 PolarHBondContact O-N 2.98Å; L428-V432 VanDerWaalsContact O-CG2 3.32Å; L428-V432 WeakPolarHBondContact O-CG2 3.47Å; L428-V432 PolarHBondContact O-N 3.38Å; L428-P457 HydrophobicContact CD1-CB 3.42Å; L428-P457 VanDerWaalsContact CD1-CB 3.42Å; L428-I462 HydrophobicContact CB-CG2 4.4Å; L428-I462 HydrophobicContact CD1-CG2 4.16Å; L428-I462 HydrophobicContact CD2-CG2 4.36Å; L428-L466 HydrophobicContact CB-CD1 4.46Å; L428-L466 HydrophobicContact CD2-CD1 3.03Å; L428-L466 HydrophobicContact CG-CD1 4.28Å
429	V	62.9	Low	59	Low	37 Å²	37	84 Å²	84	22%	0.224	46%	0.46	C	S	.	.	H	α-helix	trans	-62.8	-41.1	177.9	170.9	0	0	0	0	111.5	V425 S426 S431 V432 R433 V451	V425-V429 HydrophobicContact CG1-CG2 4.23Å; V425-V429 VanDerWaalsContact O-CG2 3.27Å; V425-V429 WeakPolarHBondContact O-CG2 3.44Å; V425-V429 PolarHBondContact O-N 3.34Å; S426-V429 PolarHBondContact O-N 2.79Å; V429-S431 VanDerWaalsContact C-N 3.35Å; V429-V432 PolarHBondContact O-N 3.41Å; V429-R433 HydrophobicContact CG1-CG 4.33Å; V429-R433 WeakPolarHBondContact O-CB 3.49Å; V429-R433 VanDerWaalsContact O-CG 3.28Å; V429-R433 WeakPolarHBondContact O-CG 3.49Å; V429-R433 PolarHBondContact O-N 3.44Å; V429-V451 HydrophobicContact CG2-CG1 4.46Å; V429-V451 HydrophobicContact CG2-CG2 3.72Å
430	E	64	Low	57.1	Low	129 Å²	129	87.8 Å²	87.8	60%	0.603	47%	0.474	S	S	*	.	H	α-helix	trans	-63.2	-41.4	174.8	-75.3	178.6	178.1	0	0	111.9	S426 L428 V432 R433 S434	S426-E430 WeakPolarHBondContact O-CG 3.37Å; S426-E430 PolarHBondContact O-N 2.83Å; L428-E430 PolarHBondContact O-N 2.83Å; E430-V432 VanDerWaalsContact C-N 3.33Å; E430-V432 PolarHBondContact O-N 3.32Å; E430-R433 PolarHBondContact O-N 3.08Å; E430-S434 PolarHBondContact O-N 3.33Å; E430-S434 VanDerWaalsContact O-N 3.13Å
431	S	54.5	Low	54.8	Low	49 Å²	49	91 Å²	91	34%	0.343	51%	0.511	S	S	.	.	H	α-helix	trans	-67.5	-30.7	177.5	-59	0	0	0	0	113	L427 L428 V429 S434	L427-S431 WeakPolarHBondContact O-CB 3.4Å; L427-S431 PolarHBondContact O-N 3.07Å; L427-S431 PolarHBondContact O-OG 3.33Å; L428-S431 PolarHBondContact O-N 2.98Å; V429-S431 VanDerWaalsContact C-N 3.35Å; S431-S434 PolarHBondContact O-OG 2.8Å
432	V	55.2	Low	53	Low	69 Å²	69	96.8 Å²	96.8	42%	0.418	55%	0.547	S	S	.	.	H	α-helix	trans	-79.1	-38	173.8	174.9	0	0	0	0	111.1	L428 V429 E430 S434 K435 L466	L428-V432 VanDerWaalsContact O-CG2 3.32Å; L428-V432 WeakPolarHBondContact O-CG2 3.47Å; L428-V432 PolarHBondContact O-N 3.38Å; V429-V432 PolarHBondContact O-N 3.41Å; E430-V432 VanDerWaalsContact C-N 3.33Å; E430-V432 PolarHBondContact O-N 3.32Å; V432-S434 VanDerWaalsContact C-N 3.32Å; V432-S434 PolarHBondContact O-N 2.97Å; V432-K435 WeakPolarHBondContact O-CB 3.38Å; V432-K435 PolarHBondContact O-N 2.92Å; V432-L466 HydrophobicContact CG2-CD2 4.47Å
433	R	49.7	Very low	51.2	Low	175 Å²	175	101 Å²	101	66%	0.66	56%	0.564	S	S	*	*	H	α-helix	trans	-65.9	-30.4	178.9	-79.7	178.5	178.4	-176.1	2.5	113.3	V429 E430 K435 A436	V429-R433 HydrophobicContact CG1-CG 4.33Å; V429-R433 WeakPolarHBondContact O-CB 3.49Å; V429-R433 VanDerWaalsContact O-CG 3.28Å; V429-R433 WeakPolarHBondContact O-CG 3.49Å; V429-R433 PolarHBondContact O-N 3.44Å; E430-R433 PolarHBondContact O-N 3.08Å; R433-K435 PolarHBondContact O-N 3.02Å; R433-A436 PolarHBondContact O-N 3.16Å
434	S	50.3	Low	48.9	Very low	91 Å²	91	104.4 Å²	104.4	64%	0.636	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-21.3	175.4	61.2	0	0	0	0	113.2	E430 S431 V432 A436	E430-S434 PolarHBondContact O-N 3.33Å; E430-S434 VanDerWaalsContact O-N 3.13Å; S431-S434 PolarHBondContact O-OG 2.8Å; V432-S434 VanDerWaalsContact C-N 3.32Å; V432-S434 PolarHBondContact O-N 2.97Å; S434-A436 VanDerWaalsContact C-N 3.34Å
435	K	43.1	Very low	47	Very low	126 Å²	126	108.2 Å²	108.2	55%	0.548	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	-19.9	170.7	-65.4	-174.7	175.2	175.1	0	113.7	V432 R433 K437 E465 V469	V432-K435 WeakPolarHBondContact O-CB 3.38Å; V432-K435 PolarHBondContact O-N 2.92Å; R433-K435 PolarHBondContact O-N 3.02Å; K435-K437 PolarHBondContact O-N 3.33Å; K435-E465 PolarHBondContact NZ-O 3.18Å; K435-V469 VanDerWaalsContact CE-CG2 3.5Å; K435-V469 VanDerWaalsContact NZ-CG2 3.34Å
436	A	39	Very low	45.2	Very low	75 Å²	75	119 Å²	119	62%	0.62	64%	0.643	S	S	*	*			trans	-99.4	58	-174.4	0	0	0	0	0	112.7	R433 S434 P438	R433-A436 PolarHBondContact O-N 3.16Å; S434-A436 VanDerWaalsContact C-N 3.34Å; A436-P438 WeakPolarHBondContact O-CD 3.29Å
437	K	38.4	Very low	43.5	Very low	196 Å²	196	122 Å²	122	85%	0.852	66%	0.659	S	S	*	*			trans	-90.6	109.3	157.5	-88.9	-176.1	178.2	175	0	108.5	K435 A439	K435-K437 PolarHBondContact O-N 3.33Å; K437-A439 PolarHBondContact O-N 3.36Å
438	P	36.5	Very low	41.7	Very low	114 Å²	114	123.4 Å²	123.4	74%	0.74	67%	0.667	S	S	*	*			trans	-81.4	118.1	-169.8	30.9	-31.8	0	0	0	110.9	A436	A436-P438 WeakPolarHBondContact O-CD 3.29Å
439	A	34.1	Very low	40.3	Very low	95 Å²	95	131.3 Å²	131.3	79%	0.785	70%	0.703	S	S	*	*	S	Bend	trans	-72.9	122	149.4	0	0	0	0	0	107.1	K437	K437-A439 PolarHBondContact O-N 3.36Å
440	N	35.9	Very low	39.1	Very low	147 Å²	147	135.6 Å²	135.6	79%	0.786	73%	0.725	S	S	*	*	S	Bend	trans	77	87.6	177.2	-61.7	-19.1	0	0	0	117.9	V442	N440-V442 PolarHBondContact O-N 3.17Å; N440-V442 VanDerWaalsContact O-N 3.09Å
441	G	31	Very low	38	Very low	83 Å²	83	132.3 Å²	132.3	86%	0.856	71%	0.713	S	S	*	*				40.1	58.9	118.2	0	0	0	0	0	119.4
442	V	35.1	Very low	37.7	Very low	139 Å²	139	133 Å²	133	84%	0.842	72%	0.717	S	S	*	*			trans	-133.6	137.5	161.1	-178.2	0	0	0	0	109.7	N440	N440-V442 PolarHBondContact O-N 3.17Å; N440-V442 VanDerWaalsContact O-N 3.09Å
443	K	32	Very low	37.7	Very low	194 Å²	194	135.3 Å²	135.3	84%	0.843	73%	0.731	S	S	*	*			trans	-49.6	136.1	-167.5	-72.5	170.2	173.1	173.7	0	114	T445	K443-T445 PolarHBondContact O-N 3.38Å
444	K	28.7	Very low	38	Very low	216 Å²	216	131.5 Å²	131.5	94%	0.939	73%	0.732	S	S	*	*			trans	-44.6	103.9	167.3	-75.9	173.6	170.9	174.7	0	112
445	T	30	Very low	38.4	Very low	129 Å²	129	129.9 Å²	129.9	79%	0.791	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-96.9	120.5	153.1	41.3	0	0	0	0	107.8	K443 V447	K443-T445 PolarHBondContact O-N 3.38Å; T445-V447 PolarHBondContact O-N 3.04Å
446	R	29.3	Very low	39.5	Very low	249 Å²	249	124 Å²	124	94%	0.94	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-51.2	120.3	169.9	-80.8	175.4	167.7	169.3	-6	108	D448	R446-D448 PolarHBondContact O-N 2.88Å
447	V	31.6	Very low	40.8	Very low	128 Å²	128	120.8 Å²	120.8	78%	0.776	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-67.5	119.7	164.9	176.8	0	0	0	0	106	T445	T445-V447 PolarHBondContact O-N 3.04Å
448	D	31.5	Very low	42	Very low	124 Å²	124	115 Å²	115	66%	0.663	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-53.5	138.2	176.6	-134.6	-3.6	0	0	0	109.8	R446 N450	R446-D448 PolarHBondContact O-N 2.88Å; D448-N450 PolarHBondContact O-N 3.16Å; D448-N450 PolarHBondContact OD2-ND2 3.05Å
449	E	34.3	Very low	43.4	Very low	192 Å²	192	112.7 Å²	112.7	90%	0.897	62%	0.622	S	S	*	*	S	Bend	trans	-68.6	17.9	178.8	-69.5	-178.2	151.7	0	0	113.5	V451	E449-V451 PolarHBondContact O-N 3.11Å
450	N	36.2	Very low	44.7	Very low	127 Å²	127	109 Å²	109	68%	0.679	59%	0.593	S	S	*	*			trans	-94.3	69.8	177.6	-69.1	-40.3	0	0	0	110.1	D448	D448-N450 PolarHBondContact O-N 3.16Å; D448-N450 PolarHBondContact OD2-ND2 3.05Å
451	V	42.5	Very low	45.9	Very low	60 Å²	60	106.7 Å²	106.7	36%	0.364	58%	0.581	S	S	.	*			trans	-64	133.6	161.1	-176.1	0	0	0	0	107.1	V425 V429 E449 T453	V425-V451 HydrophobicContact CG1-CB 4.12Å; V425-V451 HydrophobicContact CG1-CG1 3.67Å; V425-V451 HydrophobicContact CG1-CG2 4.28Å; V429-V451 HydrophobicContact CG2-CG1 4.46Å; V429-V451 HydrophobicContact CG2-CG2 3.72Å; E449-V451 PolarHBondContact O-N 3.11Å; V451-T453 PolarHBondContact O-N 3.19Å
452	P	47.2	Very low	47.1	Very low	64 Å²	64	104.3 Å²	104.3	42%	0.416	55%	0.548	S	S	.	.			trans	-66.8	107.7	-167.3	-11.2	25.3	0	0	0	109.8	S454	P452-S454 WeakPolarHBondContact CB-OG 3.35Å; P452-S454 PolarHBondContact O-N 2.67Å
453	T	54.5	Low	48.1	Very low	117 Å²	117	100.9 Å²	100.9	72%	0.718	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-3	167	39.5	0	0	0	0	112.6	V451	V451-T453 PolarHBondContact O-N 3.19Å
454	S	56.8	Low	49.1	Very low	96 Å²	96	94.2 Å²	94.2	67%	0.671	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-15.1	-177.3	57.3	0	0	0	0	114.9	P452	P452-S454 WeakPolarHBondContact CB-OG 3.35Å; P452-S454 PolarHBondContact O-N 2.67Å
455	E	59.8	Low	50.1	Low	56 Å²	56	90.1 Å²	90.1	26%	0.262	49%	0.49	S	S	.	.	S	Bend	trans	-122	139.4	-175.1	-65.4	-165.7	-177.7	0	0	113.2	F410 N461	F410-E455 WeakPolarHBondContact CE1-O 3.15Å; F410-E455 WeakPolarHBondContact CZ-O 3.47Å; E455-N461 PolarHBondContact OE1-ND2 2.96Å; E455-N461 VanDerWaalsContact OE2-CB 3.26Å; E455-N461 WeakPolarHBondContact OE2-CB 3.37Å; E455-N461 PolarHBondContact OE2-N 2.93Å
456	C	66.2	Low	51.1	Low	4 Å²	4	85.5 Å²	85.5	3%	0.027	46%	0.46	C	S	.	.			trans	-75.7	131.8	-179.8	-180	0	0	0	0	111.1	F410 C412 H414 F458 C459 G460	F410-C456 HydrophobicContact CB-CB 3.84Å; F410-C456 HydrophobicContact CD1-CB 3.74Å; F410-C456 HydrophobicContact CD2-CB 3.9Å; F410-C456 HydrophobicContact CE1-CB 4.29Å; F410-C456 HydrophobicContact CE2-CB 4.41Å; F410-C456 HydrophobicContact CG-CB 3.52Å; C412-C456 VanDerWaalsContact SG-CB 3.56Å; H414-C456 PolarHBondContact ND1-SG 3.01Å; C456-F458 PolarHBondContact O-N 3.27Å; C456-F458 PolarHBondContact SG-N 3.29Å; C456-C459 HydrophobicContact CB-CB 4.4Å; C456-C459 WeakPolarHBondContact CB-SG 3.37Å; C456-C459 PolarHBondContact O-N 3.31Å; C456-C459 VanDerWaalsContact SG-SG 3.68Å; C456-G460 VanDerWaalsContact O-CA 3.25Å; C456-G460 WeakPolarHBondContact O-CA 3.46Å; C456-G460 PolarHBondContact O-N 3.39Å
457	P	64.7	Low	51.9	Low	6 Å²	6	79.6 Å²	79.6	4%	0.039	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.7	179.7	20.6	-28.6	0	0	0	113.7	F416 F421 E424 L428	F416-P457 HydrophobicContact CE2-CG 4.31Å; F416-P457 HydrophobicContact CZ-CG 4.24Å; F421-P457 HydrophobicContact CD2-CG 4.01Å; F421-P457 HydrophobicContact CE2-CG 3.91Å; E424-P457 HydrophobicContact CB-CB 4.44Å; E424-P457 HydrophobicContact CB-CG 4.44Å; L428-P457 HydrophobicContact CD1-CB 3.42Å; L428-P457 VanDerWaalsContact CD1-CB 3.42Å
458	F	65.2	Low	52.4	Low	76 Å²	76	80.3 Å²	80.3	33%	0.333	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-17.1	-179.5	-78.1	-101.6	0	0	0	114.3	F416 E424 C456 L463	F416-F458 HydrophobicContact CD1-CE2 4.42Å; F416-F458 AromaticContact CE1-CD2 3.52Å; F416-F458 HydrophobicContact CE1-CD2 3.52Å; F416-F458 AromaticContact CE1-CE2 3.25Å; F416-F458 HydrophobicContact CE1-CE2 3.25Å; F416-F458 HydrophobicContact CE1-CZ 4.2Å; F416-F458 HydrophobicContact CE2-CD2 4.46Å; F416-F458 AromaticContact CZ-CD2 3.26Å; F416-F458 HydrophobicContact CZ-CD2 3.26Å; F416-F458 AromaticContact CZ-CE2 3.57Å; F416-F458 HydrophobicContact CZ-CE2 3.57Å; F416-F458 HydrophobicContact CZ-CG 4.22Å; E424-F458 HydrophobicContact CG-CE2 4.1Å; C456-F458 PolarHBondContact O-N 3.27Å; C456-F458 PolarHBondContact SG-N 3.29Å; F458-L463 WeakPolarHBondContact O-CD2 3.36Å
459	C	64.9	Low	52.8	Low	65 Å²	65	77 Å²	77	44%	0.439	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.4	-6.1	-170.9	84.6	0	0	0	0	113.8	C412 C456	C412-C459 HydrophobicContact CB-CB 4.14Å; C412-C459 WeakPolarHBondContact CB-SG 3.43Å; C412-C459 WeakPolarHBondContact SG-CB 3.25Å; C412-C459 CovalentContact SG-SG 2.06Å; C412-C459 PolarHBondContact SG-SG 3.46Å; C456-C459 HydrophobicContact CB-CB 4.4Å; C456-C459 WeakPolarHBondContact CB-SG 3.37Å; C456-C459 PolarHBondContact O-N 3.31Å; C456-C459 VanDerWaalsContact SG-SG 3.68Å
460	G	61.8	Low	53	Low	16 Å²	16	72.5 Å²	72.5	17%	0.165	42%	0.419	C	S	.	.	S	Bend	trans	-87.2	178.5	-177.6	0	0	0	0	0	113.4	C456 I462 L463	C456-G460 VanDerWaalsContact O-CA 3.25Å; C456-G460 WeakPolarHBondContact O-CA 3.46Å; C456-G460 PolarHBondContact O-N 3.39Å; G460-I462 PolarHBondContact O-N 3Å; G460-L463 PolarHBondContact O-N 3.1Å; G460-L463 VanDerWaalsContact O-N 3.09Å
461	N	59.9	Low	53.1	Low	100 Å²	100	74.3 Å²	74.3	54%	0.535	42%	0.422	S	S	.	.	H	α-helix	trans	-64.2	-27.4	-174.9	-59.8	-48.8	0	0	0	111.8	E455 L463 A464 E465	E455-N461 PolarHBondContact OE1-ND2 2.96Å; E455-N461 VanDerWaalsContact OE2-CB 3.26Å; E455-N461 WeakPolarHBondContact OE2-CB 3.37Å; E455-N461 PolarHBondContact OE2-N 2.93Å; N461-L463 VanDerWaalsContact C-N 3.26Å; N461-L463 PolarHBondContact O-N 3.08Å; N461-A464 WeakPolarHBondContact O-CA 3.27Å; N461-A464 WeakPolarHBondContact O-CB 3.5Å; N461-A464 PolarHBondContact O-N 2.87Å; N461-E465 PolarHBondContact O-N 2.87Å
462	I	56.8	Low	53	Low	33 Å²	33	76.8 Å²	76.8	17%	0.169	43%	0.433	C	S	.	.	H	α-helix	trans	-56.3	-39.1	174.9	-58.6	173.6	0	0	0	111.7	L428 G460 E465 L466	L428-I462 HydrophobicContact CB-CG2 4.4Å; L428-I462 HydrophobicContact CD1-CG2 4.16Å; L428-I462 HydrophobicContact CD2-CG2 4.36Å; G460-I462 PolarHBondContact O-N 3Å; I462-E465 PolarHBondContact O-N 3.47Å; I462-L466 HydrophobicContact CG2-CD1 4.15Å; I462-L466 WeakPolarHBondContact O-CD1 3.38Å; I462-L466 WeakPolarHBondContact O-CG 3.34Å; I462-L466 PolarHBondContact O-N 3.24Å
463	L	55.4	Low	52.6	Low	66 Å²	66	81.8 Å²	81.8	35%	0.346	45%	0.45	S	S	.	.	H	α-helix	trans	-70.2	-37.9	176.2	-166.2	78	0	0	0	111	F458 G460 N461 E465 L466 I467	F458-L463 WeakPolarHBondContact O-CD2 3.36Å; G460-L463 PolarHBondContact O-N 3.1Å; G460-L463 VanDerWaalsContact O-N 3.09Å; N461-L463 VanDerWaalsContact C-N 3.26Å; N461-L463 PolarHBondContact O-N 3.08Å; L463-E465 VanDerWaalsContact C-N 3.29Å; L463-E465 PolarHBondContact O-N 3.01Å; L463-L466 PolarHBondContact O-N 3.26Å; L463-L466 VanDerWaalsContact O-N 3.08Å; L463-I467 HydrophobicContact CG-CD1 4.48Å; L463-I467 WeakPolarHBondContact O-CG1 3.42Å; L463-I467 PolarHBondContact O-N 2.99Å
464	A	53.7	Low	52.1	Low	55 Å²	55	84.6 Å²	84.6	46%	0.455	45%	0.453	S	S	.	.	H	α-helix	trans	-60.3	-39.2	175.4	0	0	0	0	0	111.8	N461 L466 I467	N461-A464 WeakPolarHBondContact O-CA 3.27Å; N461-A464 WeakPolarHBondContact O-CB 3.5Å; N461-A464 PolarHBondContact O-N 2.87Å; A464-L466 VanDerWaalsContact C-N 3.27Å; A464-L466 PolarHBondContact O-N 3.4Å; A464-I467 PolarHBondContact O-N 3.5Å
465	E	50.7	Low	51.3	Low	129 Å²	129	83.7 Å²	83.7	60%	0.603	44%	0.443	S	S	*	.	H	α-helix	trans	-70.5	-19.2	175.4	-68.7	-173.6	173.9	0	0	114.2	K435 N461 I462 L463	K435-E465 PolarHBondContact NZ-O 3.18Å; N461-E465 PolarHBondContact O-N 2.87Å; I462-E465 PolarHBondContact O-N 3.47Å; L463-E465 VanDerWaalsContact C-N 3.29Å; L463-E465 PolarHBondContact O-N 3.01Å
466	L	49.6	Very low	50.5	Low	32 Å²	32	84 Å²	84	17%	0.168	45%	0.452	C	S	.	.	H	α-helix	trans	-93.3	-24	178.5	-74.1	163.7	0	0	0	113.5	L428 V432 I462 L463 A464 D468 V469	L428-L466 HydrophobicContact CB-CD1 4.46Å; L428-L466 HydrophobicContact CD2-CD1 3.03Å; L428-L466 HydrophobicContact CG-CD1 4.28Å; V432-L466 HydrophobicContact CG2-CD2 4.47Å; I462-L466 HydrophobicContact CG2-CD1 4.15Å; I462-L466 WeakPolarHBondContact O-CD1 3.38Å; I462-L466 WeakPolarHBondContact O-CG 3.34Å; I462-L466 PolarHBondContact O-N 3.24Å; L463-L466 PolarHBondContact O-N 3.26Å; L463-L466 VanDerWaalsContact O-N 3.08Å; A464-L466 VanDerWaalsContact C-N 3.27Å; A464-L466 PolarHBondContact O-N 3.4Å; L466-D468 PolarHBondContact O-N 2.97Å; L466-V469 HydrophobicContact CD2-CG2 4.01Å; L466-V469 VanDerWaalsContact O-CB 3.31Å; L466-V469 WeakPolarHBondContact O-CB 3.29Å; L466-V469 VanDerWaalsContact O-CG2 3.24Å; L466-V469 WeakPolarHBondContact O-CG2 3.48Å; L466-V469 PolarHBondContact O-N 2.93Å; L466-V469 VanDerWaalsContact O-N 3.07Å
467	I	46.7	Very low	49	Very low	125 Å²	125	91.5 Å²	91.5	64%	0.641	49%	0.486	S	S	*	.	H	α-helix	trans	-62.1	-29	173.3	-70.5	164.8	0	0	0	111	L463 A464 V469	L463-I467 HydrophobicContact CG-CD1 4.48Å; L463-I467 WeakPolarHBondContact O-CG1 3.42Å; L463-I467 PolarHBondContact O-N 2.99Å; A464-I467 PolarHBondContact O-N 3.5Å; I467-V469 PolarHBondContact O-N 3.39Å
468	D	42.2	Very low	47.7	Very low	143 Å²	143	99.1 Å²	99.1	77%	0.765	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	6.5	176.1	-73.9	-24.6	0	0	0	114.1	L466	L466-D468 PolarHBondContact O-N 2.97Å
469	V	40.6	Very low	46.1	Very low	54 Å²	54	100 Å²	100	33%	0.327	53%	0.529	S	S	.	.	S	Bend	trans	-87.4	115.9	176.5	-172.9	0	0	0	0	109.6	K435 L466 I467 F471	K435-V469 VanDerWaalsContact CE-CG2 3.5Å; K435-V469 VanDerWaalsContact NZ-CG2 3.34Å; L466-V469 HydrophobicContact CD2-CG2 4.01Å; L466-V469 VanDerWaalsContact O-CB 3.31Å; L466-V469 WeakPolarHBondContact O-CB 3.29Å; L466-V469 VanDerWaalsContact O-CG2 3.24Å; L466-V469 WeakPolarHBondContact O-CG2 3.48Å; L466-V469 PolarHBondContact O-N 2.93Å; L466-V469 VanDerWaalsContact O-N 3.07Å; I467-V469 PolarHBondContact O-N 3.39Å; V469-F471 PolarHBondContact O-N 3.43Å
470	S	37.2	Very low	44.6	Very low	98 Å²	98	106 Å²	106	69%	0.685	55%	0.551	S	S	*	*			trans	-56.5	124.6	166.1	47.8	0	0	0	0	110.1	D472	S470-D472 PolarHBondContact O-N 2.89Å
471	F	39	Very low	43.2	Very low	166 Å²	166	115.5 Å²	115.5	73%	0.728	58%	0.581	S	S	*	*			trans	-58.1	105.4	173	-73.1	-88.1	0	0	0	109.8	V469	V469-F471 PolarHBondContact O-N 3.43Å
472	D	40.8	Very low	41.8	Very low	111 Å²	111	119.9 Å²	119.9	59%	0.594	62%	0.616	S	S	*	*			trans	-69.4	134.2	165.8	-104.5	-8.5	0	0	0	108.7	S470 K474 T475 S476	S470-D472 PolarHBondContact O-N 2.89Å; D472-K474 PolarHBondContact O-N 2.82Å; D472-T475 PolarHBondContact O-N 3.13Å; D472-T475 PolarHBondContact O-OG1 3.1Å; D472-T475 VanDerWaalsContact O-OG1 3.11Å; D472-S476 PolarHBondContact O-OG 3.05Å
473	E	38.5	Very low	41.1	Very low	169 Å²	169	124.3 Å²	124.3	79%	0.79	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-19.3	-178	-74.7	-177.9	150.3	0	0	113.8	S476	E473-S476 VanDerWaalsContact C-OG 3.24Å; E473-S476 VanDerWaalsContact CA-OG 3.31Å; E473-S476 WeakPolarHBondContact CA-OG 3.33Å; E473-S476 PolarHBondContact O-OG 3.04Å
474	K	42.9	Very low	40.3	Very low	177 Å²	177	127.3 Å²	127.3	77%	0.77	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-25.7	179.2	-66.4	-177.1	179.8	178.3	0	114	D472	D472-K474 PolarHBondContact O-N 2.82Å
475	T	41.7	Very low	39.6	Very low	77 Å²	77	131.3 Å²	131.3	47%	0.472	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	-27.5	-180	-10.8	0	0	0	0	111.3	D472 Q477 H478	D472-T475 PolarHBondContact O-N 3.13Å; D472-T475 PolarHBondContact O-OG1 3.1Å; D472-T475 VanDerWaalsContact O-OG1 3.11Å; T475-Q477 VanDerWaalsContact C-N 3.28Å; T475-Q477 PolarHBondContact O-N 3.22Å; T475-H478 PolarHBondContact O-N 3.41Å
476	S	41.6	Very low	38.9	Very low	63 Å²	63	131.5 Å²	131.5	44%	0.441	67%	0.668	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.2	-12.7	178.3	26.1	0	0	0	0	115.4	D472 E473	D472-S476 PolarHBondContact O-OG 3.05Å; E473-S476 VanDerWaalsContact C-OG 3.24Å; E473-S476 VanDerWaalsContact CA-OG 3.31Å; E473-S476 WeakPolarHBondContact CA-OG 3.33Å; E473-S476 PolarHBondContact O-OG 3.04Å
477	Q	36.3	Very low	38.2	Very low	161 Å²	161	137.7 Å²	137.7	75%	0.752	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-11.3	178.3	-70.1	-174.3	-5.8	0	0	114.1	T475	T475-Q477 VanDerWaalsContact C-N 3.28Å; T475-Q477 PolarHBondContact O-N 3.22Å
478	H	36.7	Very low	37.7	Very low	166 Å²	166	138.5 Å²	138.5	77%	0.769	70%	0.703	S	S	*	*	S	Bend	trans	-114.8	0.3	-177.3	-66.3	-57.2	0	0	0	114.1	T475 E480	T475-H478 PolarHBondContact O-N 3.41Å; H478-E480 PolarHBondContact O-N 2.6Å
479	L	32.2	Very low	37.3	Very low	94 Å²	94	138.2 Å²	138.2	49%	0.492	70%	0.699	S	S	.	*			trans	-95.8	82.2	174.6	-79.7	153.1	0	0	0	109.1	W481	L479-W481 PolarHBondContact O-N 3.17Å; L479-W481 VanDerWaalsContact O-N 3.16Å
480	E	32.4	Very low	37.1	Very low	192 Å²	192	144.7 Å²	144.7	90%	0.897	73%	0.727	S	S	*	*			trans	-69.5	102.6	158.8	-74.4	-173.2	169.3	0	0	107.5	H478	H478-E480 PolarHBondContact O-N 2.6Å
481	W	31.7	Very low	37.1	Very low	214 Å²	214	148.6 Å²	148.6	81%	0.811	73%	0.731	S	S	*	*			trans	-68.4	131.3	174.1	-78.3	78.3	0	0	0	109.8	L479	L479-W481 PolarHBondContact O-N 3.17Å; L479-W481 VanDerWaalsContact O-N 3.16Å
482	P	31.5	Very low	36.9	Very low	193 Å²	193	147 Å²	147	100%	1.253	73%	0.731	S	S	*	*			trans	-69	0	175.1	24.8	-28.5	0	0	0	113.9

Retrieved 482 of 482 residues in 267.9 ms (Link to these results)

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