A0A087YLS8_POEFO Loading...

Stress-induced-phosphoprotein 1

Acts as a co-chaperone for HSP90AA1. Mediates the association of the molecular chaperones HSPA8/HSC70 and HSP90.

AlphaFold DB , UniProt , Accession A0A087YLS8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 574 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	36.4	Very low	44.6	Very low	229 Å²	229	135.4 Å²	135.4	100%	1.128	66%	0.66	S	S	*	*				0	93	0	-78.8	174.2	169.2	0	0	108.3	I3	M1-I3 PolarHBondContact O-N 2.66Å
2	Q	36	Very low	45	Very low	186 Å²	186	128.3 Å²	128.3	87%	0.869	64%	0.64	S	S	*	*			trans	-84.3	100.2	167.1	-87.2	179.1	-22.3	0	0	107	F4	Q2-F4 PolarHBondContact O-N 3.23Å
3	I	37.9	Very low	45.4	Very low	147 Å²	147	127.7 Å²	127.7	75%	0.754	63%	0.634	S	S	*	*			trans	-80.7	108.4	174.7	-60.7	172.8	0	0	0	105.7	M1 N5	M1-I3 PolarHBondContact O-N 2.66Å; I3-N5 PolarHBondContact O-N 3.25Å
4	F	41.3	Very low	46	Very low	181 Å²	181	125.2 Å²	125.2	79%	0.794	62%	0.623	S	S	*	*			trans	-60.1	107.4	168.7	-85.2	-90.9	0	0	0	107.9	Q2 I6	Q2-F4 PolarHBondContact O-N 3.23Å; F4-I6 VanDerWaalsContact C-N 3.32Å; F4-I6 PolarHBondContact O-N 3.43Å
5	N	44.9	Very low	46.5	Very low	150 Å²	150	123.1 Å²	123.1	80%	0.802	62%	0.619	S	S	*	*			trans	-77.3	86.2	176.6	-161	13.1	0	0	0	107.6	I3 P7	I3-N5 PolarHBondContact O-N 3.25Å; N5-P7 VanDerWaalsContact O-CD 3.28Å; N5-P7 WeakPolarHBondContact O-CD 3.43Å
6	I	47.8	Very low	46.8	Very low	77 Å²	77	122.9 Å²	122.9	40%	0.395	62%	0.615	S	S	.	*			trans	-68.8	116.1	173.1	-57.2	175.4	0	0	0	106.5	F4 N8 Q10 L11	F4-I6 VanDerWaalsContact C-N 3.32Å; F4-I6 PolarHBondContact O-N 3.43Å; I6-N8 PolarHBondContact O-N 3.07Å; I6-Q10 HydrophobicContact CG2-CB 3.62Å; I6-L11 HydrophobicContact CB-CD1 4.31Å; I6-L11 HydrophobicContact CB-CG 4.45Å; I6-L11 HydrophobicContact CG2-CD1 4.36Å; I6-L11 HydrophobicContact CG2-CG 4.05Å
7	P	50.5	Low	47.2	Very low	54 Å²	54	117.5 Å²	117.5	35%	0.351	60%	0.598	S	S	.	*			trans	-60.9	139.9	-179.2	9.7	-10.9	0	0	0	110.8	N5 W9 Q10	N5-P7 VanDerWaalsContact O-CD 3.28Å; N5-P7 WeakPolarHBondContact O-CD 3.43Å; P7-W9 PolarHBondContact O-N 3.37Å; P7-Q10 PolarHBondContact O-N 3.29Å
8	N	50.9	Low	47.4	Very low	139 Å²	139	117.6 Å²	117.6	74%	0.743	60%	0.596	S	S	*	*	H	α-helix	trans	-49.4	-26.7	-173.6	-84.7	-14.3	0	0	0	115.1	I6 A12	I6-N8 PolarHBondContact O-N 3.07Å; N8-A12 WeakPolarHBondContact O-CB 3.21Å; N8-A12 PolarHBondContact O-N 2.97Å
9	W	48.9	Very low	47.7	Very low	160 Å²	160	114.6 Å²	114.6	61%	0.606	59%	0.59	S	S	*	*	H	α-helix	trans	-70.2	-35	176.1	69.3	-96.3	0	0	0	112.9	P7 A12 H13	P7-W9 PolarHBondContact O-N 3.37Å; W9-A12 PolarHBondContact O-N 3.05Å; W9-H13 AromaticContact CE3-CD2 3.91Å; W9-H13 PolarHBondContact O-CD2 2.72Å; W9-H13 VanDerWaalsContact O-CD2 3.23Å; W9-H13 PolarHBondContact O-N 3.2Å; W9-H13 VanDerWaalsContact O-N 3.08Å
10	Q	47.3	Very low	48	Very low	85 Å²	85	114.9 Å²	114.9	40%	0.397	59%	0.592	S	S	.	*	H	α-helix	trans	-70.3	-37.6	175.1	-88.7	-179.3	-41	0	0	112.1	I6 P7 H13 I14	I6-Q10 HydrophobicContact CG2-CB 3.62Å; P7-Q10 PolarHBondContact O-N 3.29Å; Q10-H13 PolarHBondContact O-N 3.09Å; Q10-I14 VanDerWaalsContact O-CG1 3.32Å; Q10-I14 WeakPolarHBondContact O-CG1 3.38Å; Q10-I14 PolarHBondContact O-N 3.41Å; Q10-I14 VanDerWaalsContact O-N 3.08Å
11	L	48.7	Very low	48.3	Very low	81 Å²	81	114 Å²	114	42%	0.424	59%	0.592	S	S	.	*	H	α-helix	trans	-63.7	-39.8	172.1	-84	155.3	0	0	0	111.7	I6 I14 V15	I6-L11 HydrophobicContact CB-CD1 4.31Å; I6-L11 HydrophobicContact CB-CG 4.45Å; I6-L11 HydrophobicContact CG2-CD1 4.36Å; I6-L11 HydrophobicContact CG2-CG 4.05Å; L11-I14 PolarHBondContact O-N 2.9Å; L11-V15 WeakPolarHBondContact O-CG2 3.35Å; L11-V15 PolarHBondContact O-N 3.05Å
12	A	49.8	Very low	49.2	Very low	51 Å²	51	111.5 Å²	111.5	42%	0.421	57%	0.57	S	S	.	*	H	α-helix	trans	-64.4	-38.6	175.4	0	0	0	0	0	112.8	N8 W9 Q16	N8-A12 WeakPolarHBondContact O-CB 3.21Å; N8-A12 PolarHBondContact O-N 2.97Å; W9-A12 PolarHBondContact O-N 3.05Å; A12-Q16 WeakPolarHBondContact O-CB 3.41Å; A12-Q16 WeakPolarHBondContact O-CG 3.3Å; A12-Q16 PolarHBondContact O-N 3.46Å
13	H	49.5	Very low	50	Low	120 Å²	120	105.2 Å²	105.2	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-68.6	-35.9	175.4	-86.8	-74.2	0	0	0	113.4	W9 Q10 G17	W9-H13 AromaticContact CE3-CD2 3.91Å; W9-H13 PolarHBondContact O-CD2 2.72Å; W9-H13 VanDerWaalsContact O-CD2 3.23Å; W9-H13 PolarHBondContact O-N 3.2Å; W9-H13 VanDerWaalsContact O-N 3.08Å; Q10-H13 PolarHBondContact O-N 3.09Å; H13-G17 PolarHBondContact O-N 2.98Å
14	I	54	Low	50.8	Low	93 Å²	93	100.6 Å²	100.6	48%	0.477	53%	0.528	S	S	.	.	H	α-helix	trans	-68.1	-44.5	176.1	-67.9	166	0	0	0	110.5	Q10 L11 G17 E18	Q10-I14 VanDerWaalsContact O-CG1 3.32Å; Q10-I14 WeakPolarHBondContact O-CG1 3.38Å; Q10-I14 PolarHBondContact O-N 3.41Å; Q10-I14 VanDerWaalsContact O-N 3.08Å; L11-I14 PolarHBondContact O-N 2.9Å; I14-G17 PolarHBondContact O-N 3.35Å; I14-E18 PolarHBondContact O-N 3.28Å
15	V	54.4	Low	51.3	Low	94 Å²	94	98.3 Å²	98.3	57%	0.57	52%	0.518	S	S	*	.	H	α-helix	trans	-66.8	-37.9	177.3	174.9	0	0	0	0	111.8	L11 A19	L11-V15 WeakPolarHBondContact O-CG2 3.35Å; L11-V15 PolarHBondContact O-N 3.05Å; V15-A19 WeakPolarHBondContact O-CB 3.36Å; V15-A19 PolarHBondContact O-N 3.27Å
16	Q	51	Low	51.6	Low	120 Å²	120	99.8 Å²	99.8	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-66.5	-39.1	171.9	-84.1	179.9	-19.2	0	0	112.4	A12 A19 L20	A12-Q16 WeakPolarHBondContact O-CB 3.41Å; A12-Q16 WeakPolarHBondContact O-CG 3.3Å; A12-Q16 PolarHBondContact O-N 3.46Å; Q16-A19 PolarHBondContact O-N 2.86Å; Q16-L20 WeakPolarHBondContact O-CB 3.31Å; Q16-L20 WeakPolarHBondContact O-CD1 3.46Å; Q16-L20 WeakPolarHBondContact O-CG 3.49Å; Q16-L20 PolarHBondContact O-N 3.23Å
17	G	53.5	Low	52	Low	31 Å²	31	103.2 Å²	103.2	32%	0.32	52%	0.524	S	S	.	.	H	α-helix	trans	-63.3	-45.5	175.4	0	0	0	0	0	112.7	H13 I14 L20 V21	H13-G17 PolarHBondContact O-N 2.98Å; I14-G17 PolarHBondContact O-N 3.35Å; G17-L20 PolarHBondContact O-N 3.29Å; G17-V21 WeakPolarHBondContact O-CB 3.47Å; G17-V21 VanDerWaalsContact O-CG2 3.26Å; G17-V21 WeakPolarHBondContact O-CG2 3.25Å; G17-V21 PolarHBondContact O-N 2.89Å
18	E	51.2	Low	52.5	Low	119 Å²	119	107 Å²	107	56%	0.556	54%	0.537	S	S	*	.	H	α-helix	trans	-66.2	-36.7	175.5	-74.1	-173.6	166	0	0	112.8	I14 R22	I14-E18 PolarHBondContact O-N 3.28Å; E18-R22 WeakPolarHBondContact O-CB 3.15Å; E18-R22 WeakPolarHBondContact O-CG 3.28Å; E18-R22 PolarHBondContact O-N 3.02Å
19	A	51.9	Low	53.1	Low	60 Å²	60	103.4 Å²	103.4	50%	0.496	52%	0.523	S	S	.	.	H	α-helix	trans	-67.5	-37.7	174.1	0	0	0	0	0	112.2	V15 Q16 S23	V15-A19 WeakPolarHBondContact O-CB 3.36Å; V15-A19 PolarHBondContact O-N 3.27Å; Q16-A19 PolarHBondContact O-N 2.86Å; A19-S23 WeakPolarHBondContact O-CB 3.29Å; A19-S23 PolarHBondContact O-N 3.32Å
20	L	53.2	Low	54.1	Low	120 Å²	120	101.6 Å²	101.6	63%	0.628	52%	0.521	S	S	*	.	H	α-helix	trans	-68.1	-43.3	174.5	-86.7	156.9	0	0	0	112.1	Q16 G17 S23 S24	Q16-L20 WeakPolarHBondContact O-CB 3.31Å; Q16-L20 WeakPolarHBondContact O-CD1 3.46Å; Q16-L20 WeakPolarHBondContact O-CG 3.49Å; Q16-L20 PolarHBondContact O-N 3.23Å; G17-L20 PolarHBondContact O-N 3.29Å; L20-S23 PolarHBondContact O-N 3.35Å; L20-S24 WeakPolarHBondContact O-CB 3.41Å; L20-S24 PolarHBondContact O-N 3.14Å; L20-S24 PolarHBondContact O-OG 3.39Å
21	V	55.7	Low	55.1	Low	97 Å²	97	99.8 Å²	99.8	59%	0.588	52%	0.521	S	S	*	.	H	α-helix	trans	-67.4	-39.6	177.2	172.7	0	0	0	0	111.5	G17 S24 F25	G17-V21 WeakPolarHBondContact O-CB 3.47Å; G17-V21 VanDerWaalsContact O-CG2 3.26Å; G17-V21 WeakPolarHBondContact O-CG2 3.25Å; G17-V21 PolarHBondContact O-N 2.89Å; V21-S24 WeakPolarHBondContact CA-OG 3.43Å; V21-S24 PolarHBondContact O-OG 3.15Å; V21-F25 WeakPolarHBondContact O-CB 3.47Å; V21-F25 PolarHBondContact O-N 2.83Å
22	R	54.7	Low	56	Low	177 Å²	177	99.5 Å²	99.5	67%	0.668	53%	0.525	S	S	*	.	H	α-helix	trans	-64	-46.3	169.9	-75.5	179.7	178.1	-174.6	2.3	110.3	E18 S24 F25 W26	E18-R22 WeakPolarHBondContact O-CB 3.15Å; E18-R22 WeakPolarHBondContact O-CG 3.28Å; E18-R22 PolarHBondContact O-N 3.02Å; R22-S24 VanDerWaalsContact C-N 3.34Å; R22-S24 PolarHBondContact O-N 3.01Å; R22-F25 PolarHBondContact O-N 2.63Å; R22-W26 WeakPolarHBondContact O-CB 3.31Å; R22-W26 PolarHBondContact O-N 2.97Å
23	S	53.5	Low	57.5	Low	53 Å²	53	99.6 Å²	99.6	37%	0.371	52%	0.52	S	S	.	.	H	α-helix	trans	-60	-40.6	178.4	-174.4	0	0	0	0	112.9	A19 L20 K27	A19-S23 WeakPolarHBondContact O-CB 3.29Å; A19-S23 PolarHBondContact O-N 3.32Å; L20-S23 PolarHBondContact O-N 3.35Å; S23-K27 WeakPolarHBondContact O-CB 3.33Å; S23-K27 VanDerWaalsContact O-CG 3.23Å; S23-K27 WeakPolarHBondContact O-CG 3.4Å; S23-K27 PolarHBondContact O-N 3.38Å
24	S	55.1	Low	58.9	Low	51 Å²	51	98.6 Å²	98.6	36%	0.357	52%	0.517	S	S	.	.	H	α-helix	trans	-69.7	-43.5	176.1	60.6	0	0	0	0	111.9	L20 V21 R22 W26 K27 E28	L20-S24 WeakPolarHBondContact O-CB 3.41Å; L20-S24 PolarHBondContact O-N 3.14Å; L20-S24 PolarHBondContact O-OG 3.39Å; V21-S24 WeakPolarHBondContact CA-OG 3.43Å; V21-S24 PolarHBondContact O-OG 3.15Å; R22-S24 VanDerWaalsContact C-N 3.34Å; R22-S24 PolarHBondContact O-N 3.01Å; S24-W26 PolarHBondContact O-N 3.44Å; S24-K27 PolarHBondContact O-N 3.38Å; S24-E28 WeakPolarHBondContact O-CB 3.23Å; S24-E28 WeakPolarHBondContact O-CG 3.38Å; S24-E28 PolarHBondContact O-N 3.34Å
25	F	51.6	Low	60.4	Low	133 Å²	133	100.9 Å²	100.9	58%	0.583	53%	0.525	S	S	*	.	H	α-helix	trans	-64.1	-40.2	176.9	-173.6	-97.8	0	0	0	112.6	V21 R22 E28 S29	V21-F25 WeakPolarHBondContact O-CB 3.47Å; V21-F25 PolarHBondContact O-N 2.83Å; R22-F25 PolarHBondContact O-N 2.63Å; F25-E28 PolarHBondContact O-N 2.87Å; F25-S29 WeakPolarHBondContact O-CB 3.29Å; F25-S29 PolarHBondContact O-N 3.3Å
26	W	51.2	Low	62.1	Low	180 Å²	180	99.3 Å²	99.3	68%	0.682	52%	0.516	S	S	*	.	H	α-helix	trans	-66.4	-38.5	173.5	-83.4	93	0	0	0	111.5	R22 S24 H30	R22-W26 WeakPolarHBondContact O-CB 3.31Å; R22-W26 PolarHBondContact O-N 2.97Å; S24-W26 PolarHBondContact O-N 3.44Å; W26-H30 WeakPolarHBondContact O-CB 3.35Å; W26-H30 PolarHBondContact O-N 2.64Å
27	K	56.4	Low	64	Low	149 Å²	149	94 Å²	94	65%	0.648	49%	0.491	S	S	*	.	H	α-helix	trans	-66.2	-42.3	174.6	-78.2	173	-178.3	177.6	0	112.5	S23 S24 A31	S23-K27 WeakPolarHBondContact O-CB 3.33Å; S23-K27 VanDerWaalsContact O-CG 3.23Å; S23-K27 WeakPolarHBondContact O-CG 3.4Å; S23-K27 PolarHBondContact O-N 3.38Å; S24-K27 PolarHBondContact O-N 3.38Å; K27-A31 VanDerWaalsContact O-CB 3.24Å; K27-A31 WeakPolarHBondContact O-CB 3.5Å; K27-A31 PolarHBondContact O-N 2.91Å
28	E	59.1	Low	65.8	Low	134 Å²	134	94.6 Å²	94.6	63%	0.626	49%	0.491	S	S	*	.	H	α-helix	trans	-68	-44	177.9	-76.1	172	-178.8	0	0	112	S24 F25 A31 C32	S24-E28 WeakPolarHBondContact O-CB 3.23Å; S24-E28 WeakPolarHBondContact O-CG 3.38Å; S24-E28 PolarHBondContact O-N 3.34Å; F25-E28 PolarHBondContact O-N 2.87Å; E28-A31 PolarHBondContact O-N 2.98Å; E28-C32 WeakPolarHBondContact O-CB 3.41Å; E28-C32 PolarHBondContact O-N 3.03Å
29	S	65.3	Low	67.7	Low	63 Å²	63	91.7 Å²	91.7	44%	0.441	49%	0.487	S	S	.	.	H	α-helix	trans	-63.3	-43.7	175.6	-177.6	0	0	0	0	111.9	F25 C32 T33	F25-S29 WeakPolarHBondContact O-CB 3.29Å; F25-S29 PolarHBondContact O-N 3.3Å; S29-C32 PolarHBondContact O-N 3.25Å; S29-T33 PolarHBondContact O-N 3.14Å; S29-T33 PolarHBondContact O-OG1 3.18Å
30	H	68.9	Low	69.8	Low	122 Å²	122	89.9 Å²	89.9	57%	0.565	47%	0.469	S	S	*	.	H	α-helix	trans	-67.7	-38	177.7	-145	71.8	0	0	0	112.2	W26 T33 M34	W26-H30 WeakPolarHBondContact O-CB 3.35Å; W26-H30 PolarHBondContact O-N 2.64Å; H30-T33 VanDerWaalsContact CA-OG1 3.28Å; H30-T33 WeakPolarHBondContact CA-OG1 3.28Å; H30-T33 PolarHBondContact O-N 2.96Å; H30-T33 PolarHBondContact O-OG1 3.4Å; H30-M34 WeakPolarHBondContact O-CG 3.32Å; H30-M34 PolarHBondContact O-N 3.45Å
31	A	67.9	Low	71.8	Confident	48 Å²	48	86.8 Å²	86.8	40%	0.397	45%	0.451	S	S	.	.	H	α-helix	trans	-61.8	-46.1	173.3	0	0	0	0	0	111.5	K27 E28 T33 M34 E35	K27-A31 VanDerWaalsContact O-CB 3.24Å; K27-A31 WeakPolarHBondContact O-CB 3.5Å; K27-A31 PolarHBondContact O-N 2.91Å; E28-A31 PolarHBondContact O-N 2.98Å; A31-T33 VanDerWaalsContact C-N 3.31Å; A31-T33 PolarHBondContact O-N 3.17Å; A31-M34 PolarHBondContact O-N 3.09Å; A31-E35 WeakPolarHBondContact O-CG 3.41Å; A31-E35 PolarHBondContact O-N 2.72Å
32	C	68.9	Low	73.6	Confident	75 Å²	75	86 Å²	86	51%	0.507	44%	0.443	S	S	.	.	H	α-helix	trans	-60.2	-39.2	176.1	-169.7	0	0	0	0	112.1	E28 S29 T36	E28-C32 WeakPolarHBondContact O-CB 3.41Å; E28-C32 PolarHBondContact O-N 3.03Å; S29-C32 PolarHBondContact O-N 3.25Å; C32-T36 PolarHBondContact O-N 3.43Å; C32-T36 VanDerWaalsContact O-N 3.13Å; C32-T36 PolarHBondContact O-OG1 2.87Å
33	T	79.6	Confident	75.5	Confident	52 Å²	52	81.7 Å²	81.7	32%	0.319	43%	0.431	S	S	.	.	H	α-helix	trans	-67.7	-39.4	175.2	49.1	0	0	0	0	113	S29 H30 A31 T36 V37	S29-T33 PolarHBondContact O-N 3.14Å; S29-T33 PolarHBondContact O-OG1 3.18Å; H30-T33 VanDerWaalsContact CA-OG1 3.28Å; H30-T33 WeakPolarHBondContact CA-OG1 3.28Å; H30-T33 PolarHBondContact O-N 2.96Å; H30-T33 PolarHBondContact O-OG1 3.4Å; A31-T33 VanDerWaalsContact C-N 3.31Å; A31-T33 PolarHBondContact O-N 3.17Å; T33-T36 WeakPolarHBondContact O-CB 3.14Å; T33-T36 PolarHBondContact O-N 3.14Å; T33-V37 VanDerWaalsContact O-CG2 3.32Å; T33-V37 WeakPolarHBondContact O-CG2 3.34Å; T33-V37 PolarHBondContact O-N 3.07Å
34	M	79.8	Confident	77.5	Confident	100 Å²	100	79.2 Å²	79.2	49%	0.493	41%	0.413	S	S	.	.	H	α-helix	trans	-70.2	-36.7	179.1	-72	-65.5	-76.3	0	0	112.5	H30 A31 T36 V37 S38	H30-M34 WeakPolarHBondContact O-CG 3.32Å; H30-M34 PolarHBondContact O-N 3.45Å; A31-M34 PolarHBondContact O-N 3.09Å; M34-T36 VanDerWaalsContact C-N 3.34Å; M34-V37 PolarHBondContact O-N 2.88Å; M34-S38 PolarHBondContact O-N 3.25Å
35	E	85.3	Confident	79.4	Confident	140 Å²	140	79.6 Å²	79.6	65%	0.654	41%	0.411	S	S	*	.	H	α-helix	trans	-62	-43.4	171.6	-75.3	179.9	176.7	0	0	111.3	A31 V37 S38 A39	A31-E35 WeakPolarHBondContact O-CG 3.41Å; A31-E35 PolarHBondContact O-N 2.72Å; E35-V37 PolarHBondContact O-N 3.39Å; E35-S38 PolarHBondContact O-N 3.25Å; E35-A39 WeakPolarHBondContact O-CB 3.36Å; E35-A39 PolarHBondContact O-N 3.13Å
36	T	89.4	Confident	81.5	Confident	61 Å²	61	80.9 Å²	80.9	37%	0.374	42%	0.417	S	S	.	.	H	α-helix	trans	-62.1	-44	176.8	-54	0	0	0	0	111.7	C32 T33 M34 S38 A39 L40 L66	C32-T36 PolarHBondContact O-N 3.43Å; C32-T36 VanDerWaalsContact O-N 3.13Å; C32-T36 PolarHBondContact O-OG1 2.87Å; T33-T36 WeakPolarHBondContact O-CB 3.14Å; T33-T36 PolarHBondContact O-N 3.14Å; M34-T36 VanDerWaalsContact C-N 3.34Å; T36-S38 PolarHBondContact O-N 3.13Å; T36-A39 PolarHBondContact O-N 2.86Å; T36-L40 HydrophobicContact CG2-CD1 4.15Å; T36-L40 WeakPolarHBondContact O-CG 3.35Å; T36-L40 PolarHBondContact O-N 2.86Å; T36-L66 HydrophobicContact CG2-CD1 3.72Å
37	V	91.5	Very high	83.5	Confident	8 Å²	8	72.7 Å²	72.7	5%	0.048	39%	0.387	C	S	.	.	H	α-helix	trans	-60	-44.6	175.5	170.1	0	0	0	0	111.3	T33 M34 E35 K41 A63 L66 D67 L73	T33-V37 VanDerWaalsContact O-CG2 3.32Å; T33-V37 WeakPolarHBondContact O-CG2 3.34Å; T33-V37 PolarHBondContact O-N 3.07Å; M34-V37 PolarHBondContact O-N 2.88Å; E35-V37 PolarHBondContact O-N 3.39Å; V37-K41 WeakPolarHBondContact O-CB 3.25Å; V37-K41 PolarHBondContact O-N 3.33Å; V37-A63 HydrophobicContact CG1-CB 4.49Å; V37-L66 HydrophobicContact CG2-CB 3.49Å; V37-L66 VanDerWaalsContact CG2-CB 3.49Å; V37-L66 HydrophobicContact CG2-CD1 4.14Å; V37-L66 HydrophobicContact CG2-CG 4.48Å; V37-D67 HydrophobicContact CG1-CB 4.12Å; V37-D67 HydrophobicContact CG2-CB 3.99Å; V37-L73 HydrophobicContact CG1-CD1 3.99Å
38	S	90.8	Very high	85.2	Confident	44 Å²	44	66.7 Å²	66.7	31%	0.308	36%	0.362	S	S	.	.	H	α-helix	trans	-66.1	-41.7	178.3	-164.6	0	0	0	0	111.9	M34 E35 T36 K41 D42	M34-S38 PolarHBondContact O-N 3.25Å; E35-S38 PolarHBondContact O-N 3.25Å; T36-S38 PolarHBondContact O-N 3.13Å; S38-K41 WeakPolarHBondContact O-CB 3.35Å; S38-K41 PolarHBondContact O-N 3.39Å; S38-K41 PolarHBondContact OG-NZ 3.44Å; S38-D42 VanDerWaalsContact O-CG 3.25Å; S38-D42 PolarHBondContact O-N 3.41Å
39	A	92.5	Very high	86.8	Confident	58 Å²	58	65 Å²	65	48%	0.479	37%	0.365	S	S	.	.	H	α-helix	trans	-60.9	-45.8	177.3	0	0	0	0	0	112	E35 T36 K41 D42 Q43	E35-A39 WeakPolarHBondContact O-CB 3.36Å; E35-A39 PolarHBondContact O-N 3.13Å; T36-A39 PolarHBondContact O-N 2.86Å; A39-K41 PolarHBondContact O-N 3.44Å; A39-D42 PolarHBondContact O-N 3.02Å; A39-Q43 WeakPolarHBondContact O-CB 3.48Å; A39-Q43 PolarHBondContact O-N 3.14Å
40	L	95.1	Very high	88.1	Confident	22 Å²	22	65.3 Å²	65.3	12%	0.115	37%	0.371	C	S	.	.	H	α-helix	trans	-63.8	-40.4	176.3	-73.6	168.5	0	0	0	112.1	T36 D42 Q43 G44 C59 E62 A63 L66	T36-L40 HydrophobicContact CG2-CD1 4.15Å; T36-L40 WeakPolarHBondContact O-CG 3.35Å; T36-L40 PolarHBondContact O-N 2.86Å; L40-D42 VanDerWaalsContact C-N 3.34Å; L40-D42 PolarHBondContact O-N 2.94Å; L40-Q43 PolarHBondContact O-N 2.7Å; L40-G44 PolarHBondContact O-N 3.43Å; L40-C59 WeakPolarHBondContact O-CB 3.37Å; L40-E62 HydrophobicContact CD1-CB 3.99Å; L40-E62 HydrophobicContact CD2-CB 4.38Å; L40-A63 HydrophobicContact CB-CB 3.84Å; L40-A63 HydrophobicContact CD1-CB 4.37Å; L40-L66 HydrophobicContact CD1-CD1 3.96Å
41	K	95.6	Very high	89.1	Confident	55 Å²	55	61.8 Å²	61.8	24%	0.239	37%	0.368	C	S	.	.	H	α-helix	trans	-59.2	-45.9	173.5	-179.1	-160.3	75.4	-157.4	0	111.3	V37 S38 A39 G44 N45 L73	V37-K41 WeakPolarHBondContact O-CB 3.25Å; V37-K41 PolarHBondContact O-N 3.33Å; S38-K41 WeakPolarHBondContact O-CB 3.35Å; S38-K41 PolarHBondContact O-N 3.39Å; S38-K41 PolarHBondContact OG-NZ 3.44Å; A39-K41 PolarHBondContact O-N 3.44Å; K41-G44 PolarHBondContact O-N 3.37Å; K41-N45 PolarHBondContact O-N 2.88Å; K41-N45 PolarHBondContact O-ND2 2.96Å; K41-L73 HydrophobicContact CB-CD2 3.76Å; K41-L73 HydrophobicContact CD-CD2 4.36Å; K41-L73 HydrophobicContact CG-CD2 3.76Å
42	D	94.1	Very high	90.4	Very high	81 Å²	81	64.2 Å²	64.2	43%	0.433	37%	0.374	S	S	.	.	H	α-helix	trans	-70.7	-37.4	-177.8	-65.7	-23.9	0	0	0	111.7	S38 A39 L40 N45 K46	S38-D42 VanDerWaalsContact O-CG 3.25Å; S38-D42 PolarHBondContact O-N 3.41Å; A39-D42 PolarHBondContact O-N 3.02Å; L40-D42 VanDerWaalsContact C-N 3.34Å; L40-D42 PolarHBondContact O-N 2.94Å; D42-N45 PolarHBondContact O-N 3.25Å; D42-K46 WeakPolarHBondContact O-CB 3.39Å; D42-K46 PolarHBondContact O-N 3.37Å
43	Q	94.3	Very high	91.7	Very high	87 Å²	87	62.5 Å²	62.5	41%	0.407	36%	0.36	S	S	.	.	H	α-helix	trans	-61	-45.4	169.7	-176.6	176.2	-14.9	0	0	111.5	A39 L40 N45 K46 A47 E55	A39-Q43 WeakPolarHBondContact O-CB 3.48Å; A39-Q43 PolarHBondContact O-N 3.14Å; L40-Q43 PolarHBondContact O-N 2.7Å; Q43-N45 PolarHBondContact O-N 2.84Å; Q43-K46 PolarHBondContact O-N 2.93Å; Q43-A47 WeakPolarHBondContact O-CB 3.49Å; Q43-A47 PolarHBondContact O-N 3.34Å; Q43-E55 PolarHBondContact NE2-OE1 2.95Å
44	G	96.1	Very high	92.4	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61.1	-42.4	175.8	0	0	0	0	0	112.6	L40 K41 A47 L48 A56 Y60	L40-G44 PolarHBondContact O-N 3.43Å; K41-G44 PolarHBondContact O-N 3.37Å; G44-A47 PolarHBondContact O-N 3.44Å; G44-L48 WeakPolarHBondContact O-CB 3.47Å; G44-L48 PolarHBondContact O-N 3.12Å; G44-A56 WeakPolarHBondContact O-CB 3.36Å; G44-Y60 PolarHBondContact O-OH 3.36Å
45	N	93.9	Very high	93.1	Very high	59 Å²	59	63 Å²	63	32%	0.316	36%	0.36	S	S	.	.	H	α-helix	trans	-61.9	-44.2	175.6	-71	-28.4	0	0	0	111.1	K41 D42 Q43 L48 S49 Y60 N76	K41-N45 PolarHBondContact O-N 2.88Å; K41-N45 PolarHBondContact O-ND2 2.96Å; D42-N45 PolarHBondContact O-N 3.25Å; Q43-N45 PolarHBondContact O-N 2.84Å; N45-L48 PolarHBondContact O-N 3.09Å; N45-S49 PolarHBondContact O-N 2.98Å; N45-Y60 VanDerWaalsContact CA-OH 3.3Å; N45-Y60 WeakPolarHBondContact CA-OH 3.38Å; N45-Y60 PolarHBondContact N-OH 3.49Å; N45-Y60 VanDerWaalsContact N-OH 3.14Å; N45-Y60 PolarHBondContact OD1-OH 2.87Å; N45-N76 PolarHBondContact OD1-ND2 3.3Å; N45-N76 VanDerWaalsContact OD1-ND2 3.13Å
46	K	95.3	Very high	93.6	Very high	161 Å²	161	56.3 Å²	56.3	70%	0.7	33%	0.329	S	S	*	.	H	α-helix	trans	-63.1	-47.4	177.4	-171.8	177.6	-178.9	-179.8	0	111.3	D42 Q43 L48 S49 A50	D42-K46 WeakPolarHBondContact O-CB 3.39Å; D42-K46 PolarHBondContact O-N 3.37Å; Q43-K46 PolarHBondContact O-N 2.93Å; K46-L48 VanDerWaalsContact C-N 3.32Å; K46-L48 PolarHBondContact O-N 3.3Å; K46-S49 PolarHBondContact O-N 3.43Å; K46-S49 PolarHBondContact O-OG 3.06Å; K46-A50 WeakPolarHBondContact O-CB 3.29Å; K46-A50 PolarHBondContact O-N 3.17Å
47	A	94.9	Very high	93.9	Very high	8 Å²	8	54 Å²	54	7%	0.066	32%	0.315	C	S	.	.	H	α-helix	trans	-58.9	-43.3	175.9	0	0	0	0	0	111.8	Q43 G44 S49 A50 G51 N52 E55 A56	Q43-A47 WeakPolarHBondContact O-CB 3.49Å; Q43-A47 PolarHBondContact O-N 3.34Å; G44-A47 PolarHBondContact O-N 3.44Å; A47-S49 VanDerWaalsContact C-N 3.33Å; A47-S49 PolarHBondContact O-N 3.28Å; A47-A50 PolarHBondContact O-N 3.01Å; A47-G51 PolarHBondContact O-N 3.04Å; A47-N52 HydrophobicContact CB-CB 4.31Å; A47-N52 PolarHBondContact O-N 3.4Å; A47-E55 HydrophobicContact CB-CB 4.12Å; A47-E55 HydrophobicContact CB-CG 3.87Å; A47-A56 HydrophobicContact CB-CB 4.06Å
48	L	91.3	Very high	94.2	Very high	23 Å²	23	58.2 Å²	58.2	12%	0.12	33%	0.33	C	S	.	.	H	α-helix	trans	-65.5	-34.5	178.1	-168.8	63.8	0	0	0	112.9	G44 N45 K46 A56 A80 K83	G44-L48 WeakPolarHBondContact O-CB 3.47Å; G44-L48 PolarHBondContact O-N 3.12Å; N45-L48 PolarHBondContact O-N 3.09Å; K46-L48 VanDerWaalsContact C-N 3.32Å; K46-L48 PolarHBondContact O-N 3.3Å; L48-A56 HydrophobicContact CB-CB 3.83Å; L48-A56 HydrophobicContact CD1-CB 4.17Å; L48-A80 HydrophobicContact CD1-CB 3.8Å; L48-K83 HydrophobicContact CD1-CD 3.93Å
49	S	92	Very high	94.5	Very high	99 Å²	99	56.1 Å²	56.1	69%	0.692	32%	0.316	S	S	*	.	H	α-helix	trans	-71.8	-32.3	174.4	73.1	0	0	0	0	112.7	N45 K46 A47 G51	N45-S49 PolarHBondContact O-N 2.98Å; K46-S49 PolarHBondContact O-N 3.43Å; K46-S49 PolarHBondContact O-OG 3.06Å; A47-S49 VanDerWaalsContact C-N 3.33Å; A47-S49 PolarHBondContact O-N 3.28Å; S49-G51 VanDerWaalsContact C-N 3.27Å; S49-G51 PolarHBondContact O-N 3.38Å
50	A	92.6	Very high	94.7	Very high	68 Å²	68	53.4 Å²	53.4	56%	0.562	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.4	176.3	0	0	0	0	0	113.8	K46 A47 N52	K46-A50 WeakPolarHBondContact O-CB 3.29Å; K46-A50 PolarHBondContact O-N 3.17Å; A47-A50 PolarHBondContact O-N 3.01Å; A50-N52 VanDerWaalsContact C-N 3.32Å
51	G	90.9	Very high	94.8	Very high	49 Å²	49	54.1 Å²	54.1	51%	0.505	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	2.6	-177.3	0	0	0	0	0	114.8	A47 S49 I53	A47-G51 PolarHBondContact O-N 3.04Å; S49-G51 VanDerWaalsContact C-N 3.27Å; S49-G51 PolarHBondContact O-N 3.38Å; G51-I53 VanDerWaalsContact C-N 3.33Å; G51-I53 PolarHBondContact O-N 2.88Å
52	N	95.1	Very high	94.7	Very high	98 Å²	98	55.2 Å²	55.2	52%	0.524	31%	0.306	S	S	.	.			trans	-82.6	77.6	177.2	-66.5	-18.4	0	0	0	110	A47 A50 E55 A56	A47-N52 HydrophobicContact CB-CB 4.31Å; A47-N52 PolarHBondContact O-N 3.4Å; A50-N52 VanDerWaalsContact C-N 3.32Å; N52-E55 HydrophobicContact CB-CB 4.25Å; N52-A56 PolarHBondContact O-N 2.95Å; N52-A56 VanDerWaalsContact O-N 3.16Å
53	I	95.1	Very high	94.7	Very high	40 Å²	40	51.4 Å²	51.4	21%	0.205	29%	0.285	C	S	.	.	H	α-helix	trans	-66.8	-41.6	-169.9	-59.6	164.5	0	0	0	112.2	G51 E55 A56 V57 A80 K83 K84	G51-I53 VanDerWaalsContact C-N 3.33Å; G51-I53 PolarHBondContact O-N 2.88Å; I53-E55 PolarHBondContact O-N 3.36Å; I53-A56 WeakPolarHBondContact O-CB 3.47Å; I53-A56 PolarHBondContact O-N 3.04Å; I53-V57 WeakPolarHBondContact O-CG2 3.29Å; I53-V57 PolarHBondContact O-N 3.37Å; I53-A80 VanDerWaalsContact CG2-O 3.26Å; I53-A80 WeakPolarHBondContact CG2-O 3.35Å; I53-K83 HydrophobicContact CD1-CB 3.95Å; I53-K83 HydrophobicContact CG1-CB 4.33Å; I53-K84 HydrophobicContact CG2-CB 3.74Å; I53-K84 HydrophobicContact CG2-CD 4.43Å; I53-K84 HydrophobicContact CG2-CG 4.23Å
54	D	94.6	Very high	94.8	Very high	100 Å²	100	47.8 Å²	47.8	54%	0.535	27%	0.269	S	S	.	.	H	α-helix	trans	-62.4	-42.9	-179.6	-70.7	-58.6	0	0	0	112.5	A56 V57 R58 K84	D54-A56 VanDerWaalsContact C-N 3.33Å; D54-A56 PolarHBondContact O-N 2.94Å; D54-V57 PolarHBondContact O-N 3.31Å; D54-R58 PolarHBondContact O-N 3.48Å; D54-K84 WeakPolarHBondContact OD1-CE 3.41Å; D54-K84 IonicContact OD1-NZ 2.74Å; D54-K84 PolarHBondContact OD1-NZ 2.96Å
55	E	94.3	Very high	94.7	Very high	61 Å²	61	51.9 Å²	51.9	29%	0.285	30%	0.303	S	S	.	.	H	α-helix	trans	-65.5	-38.1	177	178.4	59.7	-171.4	0	0	111.6	Q43 A47 N52 I53 R58 C59	Q43-E55 PolarHBondContact NE2-OE1 2.95Å; A47-E55 HydrophobicContact CB-CB 4.12Å; A47-E55 HydrophobicContact CB-CG 3.87Å; N52-E55 HydrophobicContact CB-CB 4.25Å; I53-E55 PolarHBondContact O-N 3.36Å; E55-R58 PolarHBondContact O-N 3.01Å; E55-R58 IonicContact OE1-CZ 3.87Å; E55-R58 IonicContact OE1-NE 3.1Å; E55-R58 IonicContact OE1-NH2 3.62Å; E55-R58 PolarHBondContact OE1-NH2 3.4Å; E55-R58 IonicContact OE2-CZ 2.65Å; E55-R58 IonicContact OE2-NE 3.6Å; E55-R58 PolarHBondContact OE2-NE 3.09Å; E55-R58 IonicContact OE2-NH2 2.93Å; E55-R58 PolarHBondContact OE2-NH2 3.45Å; E55-C59 PolarHBondContact O-N 3.03Å; E55-C59 PolarHBondContact O-SG 3.41Å; E55-C59 PolarHBondContact OE1-SG 3.1Å
56	A	95.8	Very high	94.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-46.9	174.1	0	0	0	0	0	111.8	G44 A47 L48 N52 I53 D54 R58 C59 Y60 A80	G44-A56 WeakPolarHBondContact O-CB 3.36Å; A47-A56 HydrophobicContact CB-CB 4.06Å; L48-A56 HydrophobicContact CB-CB 3.83Å; L48-A56 HydrophobicContact CD1-CB 4.17Å; N52-A56 PolarHBondContact O-N 2.95Å; N52-A56 VanDerWaalsContact O-N 3.16Å; I53-A56 WeakPolarHBondContact O-CB 3.47Å; I53-A56 PolarHBondContact O-N 3.04Å; D54-A56 VanDerWaalsContact C-N 3.33Å; D54-A56 PolarHBondContact O-N 2.94Å; A56-R58 VanDerWaalsContact C-N 3.32Å; A56-R58 PolarHBondContact O-N 2.89Å; A56-C59 PolarHBondContact O-N 3.31Å; A56-Y60 HydrophobicContact CB-CE2 4.04Å; A56-Y60 WeakPolarHBondContact O-CD2 3.4Å; A56-Y60 PolarHBondContact O-N 3.03Å; A56-A80 HydrophobicContact CB-CB 4.43Å
57	V	97.2	Very high	94.4	Very high	14 Å²	14	46.7 Å²	46.7	9%	0.085	28%	0.282	C	S	.	.	H	α-helix	trans	-60.9	-41.5	177.1	171.8	0	0	0	0	111.2	I53 D54 S61 R77 A80 Y81	I53-V57 WeakPolarHBondContact O-CG2 3.29Å; I53-V57 PolarHBondContact O-N 3.37Å; D54-V57 PolarHBondContact O-N 3.31Å; V57-S61 WeakPolarHBondContact O-CB 3.49Å; V57-S61 PolarHBondContact O-N 3.08Å; V57-S61 PolarHBondContact O-OG 2.93Å; V57-R77 HydrophobicContact CG1-CG 4.47Å; V57-A80 HydrophobicContact CG2-CB 3.68Å; V57-Y81 HydrophobicContact CG1-CD1 4.42Å; V57-Y81 HydrophobicContact CG1-CE1 3.59Å; V57-Y81 HydrophobicContact CG2-CD1 4.13Å; V57-Y81 HydrophobicContact CG2-CE1 4.11Å
58	R	97.2	Very high	94.3	Very high	96 Å²	96	50.4 Å²	50.4	36%	0.362	31%	0.306	S	S	.	.	H	α-helix	trans	-59.4	-53.8	175.7	-171.1	-170.5	69.1	76.5	4.6	111	D54 E55 A56 Y60 S61 E62	D54-R58 PolarHBondContact O-N 3.48Å; E55-R58 PolarHBondContact O-N 3.01Å; E55-R58 IonicContact OE1-CZ 3.87Å; E55-R58 IonicContact OE1-NE 3.1Å; E55-R58 IonicContact OE1-NH2 3.62Å; E55-R58 PolarHBondContact OE1-NH2 3.4Å; E55-R58 IonicContact OE2-CZ 2.65Å; E55-R58 IonicContact OE2-NE 3.6Å; E55-R58 PolarHBondContact OE2-NE 3.09Å; E55-R58 IonicContact OE2-NH2 2.93Å; E55-R58 PolarHBondContact OE2-NH2 3.45Å; A56-R58 VanDerWaalsContact C-N 3.32Å; A56-R58 PolarHBondContact O-N 2.89Å; R58-Y60 PolarHBondContact O-N 3.39Å; R58-S61 PolarHBondContact O-N 3.27Å; R58-S61 VanDerWaalsContact O-N 3.07Å; R58-E62 IonicContact CZ-OE1 2.61Å; R58-E62 IonicContact CZ-OE2 3.08Å; R58-E62 IonicContact NH1-OE1 2.9Å; R58-E62 PolarHBondContact NH1-OE1 3.46Å; R58-E62 IonicContact NH1-OE2 3.79Å; R58-E62 PolarHBondContact NH1-OE2 3.39Å; R58-E62 PolarHBondContact O-N 3.05Å
59	C	96.2	Very high	94.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-58.3	-44	-179.4	-66.8	0	0	0	0	112.6	L40 E55 A56 S61 E62 A63	L40-C59 WeakPolarHBondContact O-CB 3.37Å; E55-C59 PolarHBondContact O-N 3.03Å; E55-C59 PolarHBondContact O-SG 3.41Å; E55-C59 PolarHBondContact OE1-SG 3.1Å; A56-C59 PolarHBondContact O-N 3.31Å; C59-S61 VanDerWaalsContact C-N 3.33Å; C59-S61 PolarHBondContact O-N 3.16Å; C59-E62 PolarHBondContact O-N 2.91Å; C59-A63 WeakPolarHBondContact O-CB 3.36Å; C59-A63 PolarHBondContact O-N 2.87Å
60	Y	97	Very high	94.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-68.2	-33.1	176.9	-59.9	-46.3	0	0	0	112.8	G44 N45 A56 R58 A63 L64 L73 N76 R77 A80	G44-Y60 PolarHBondContact O-OH 3.36Å; N45-Y60 VanDerWaalsContact CA-OH 3.3Å; N45-Y60 WeakPolarHBondContact CA-OH 3.38Å; N45-Y60 PolarHBondContact N-OH 3.49Å; N45-Y60 VanDerWaalsContact N-OH 3.14Å; N45-Y60 PolarHBondContact OD1-OH 2.87Å; A56-Y60 HydrophobicContact CB-CE2 4.04Å; A56-Y60 WeakPolarHBondContact O-CD2 3.4Å; A56-Y60 PolarHBondContact O-N 3.03Å; R58-Y60 PolarHBondContact O-N 3.39Å; Y60-A63 PolarHBondContact O-N 2.9Å; Y60-L64 WeakPolarHBondContact O-CB 3.42Å; Y60-L64 VanDerWaalsContact O-CG 3.29Å; Y60-L64 WeakPolarHBondContact O-CG 3.39Å; Y60-L64 PolarHBondContact O-N 2.78Å; Y60-L73 HydrophobicContact CD1-CD2 4.43Å; Y60-N76 HydrophobicContact CD1-CB 4.18Å; Y60-N76 HydrophobicContact CD2-CB 4.4Å; Y60-N76 HydrophobicContact CE1-CB 3.76Å; Y60-N76 HydrophobicContact CE2-CB 4Å; Y60-N76 HydrophobicContact CG-CB 4.49Å; Y60-R77 HydrophobicContact CD2-CB 4Å; Y60-R77 HydrophobicContact CD2-CG 4.35Å; Y60-R77 HydrophobicContact CG-CB 4.2Å; Y60-A80 HydrophobicContact CD2-CB 4.4Å; Y60-A80 HydrophobicContact CE2-CB 4.17Å
61	S	96.6	Very high	94.5	Very high	38 Å²	38	48.8 Å²	48.8	27%	0.266	29%	0.285	S	S	.	.	H	α-helix	trans	-69.9	-38.9	177.7	-59	0	0	0	0	111.8	V57 R58 C59 L64 A65 R77	V57-S61 WeakPolarHBondContact O-CB 3.49Å; V57-S61 PolarHBondContact O-N 3.08Å; V57-S61 PolarHBondContact O-OG 2.93Å; R58-S61 PolarHBondContact O-N 3.27Å; R58-S61 VanDerWaalsContact O-N 3.07Å; C59-S61 VanDerWaalsContact C-N 3.33Å; C59-S61 PolarHBondContact O-N 3.16Å; S61-L64 PolarHBondContact O-N 2.68Å; S61-A65 PolarHBondContact O-N 2.64Å; S61-R77 VanDerWaalsContact OG-CD 3.31Å; S61-R77 WeakPolarHBondContact OG-CD 3.5Å; S61-R77 PolarHBondContact OG-NH1 3.26Å; S61-R77 VanDerWaalsContact OG-NH1 3.11Å
62	E	95.1	Very high	94.7	Very high	78 Å²	78	48.6 Å²	48.6	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-65.6	-42.9	172	-73.3	172.1	-167.7	0	0	111.5	L40 R58 C59 L64 A65 L66	L40-E62 HydrophobicContact CD1-CB 3.99Å; L40-E62 HydrophobicContact CD2-CB 4.38Å; R58-E62 IonicContact CZ-OE1 2.61Å; R58-E62 IonicContact CZ-OE2 3.08Å; R58-E62 IonicContact NH1-OE1 2.9Å; R58-E62 PolarHBondContact NH1-OE1 3.46Å; R58-E62 IonicContact NH1-OE2 3.79Å; R58-E62 PolarHBondContact NH1-OE2 3.39Å; R58-E62 PolarHBondContact O-N 3.05Å; C59-E62 PolarHBondContact O-N 2.91Å; E62-L64 VanDerWaalsContact C-N 3.3Å; E62-L64 PolarHBondContact O-N 3.44Å; E62-A65 WeakPolarHBondContact O-CB 3.28Å; E62-A65 PolarHBondContact O-N 2.87Å; E62-L66 PolarHBondContact O-N 3.35Å
63	A	94.1	Very high	94.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-39.3	174.9	0	0	0	0	0	111.9	V37 L40 C59 Y60 L66 D67 L73	V37-A63 HydrophobicContact CG1-CB 4.49Å; L40-A63 HydrophobicContact CB-CB 3.84Å; L40-A63 HydrophobicContact CD1-CB 4.37Å; C59-A63 WeakPolarHBondContact O-CB 3.36Å; C59-A63 PolarHBondContact O-N 2.87Å; Y60-A63 PolarHBondContact O-N 2.9Å; A63-L66 PolarHBondContact O-N 2.95Å; A63-D67 PolarHBondContact O-N 2.9Å; A63-L73 HydrophobicContact CB-CD1 3.6Å; A63-L73 HydrophobicContact CB-CD2 3.89Å; A63-L73 HydrophobicContact CB-CG 4.38Å
64	L	95.1	Very high	94.8	Very high	12 Å²	12	43 Å²	43	6%	0.063	24%	0.243	C	C	.	.	H	α-helix	trans	-71.9	-25.9	176.7	-80.2	166.9	0	0	0	113.5	Y60 S61 E62 L66 D67 P68 L73 F74	Y60-L64 WeakPolarHBondContact O-CB 3.42Å; Y60-L64 VanDerWaalsContact O-CG 3.29Å; Y60-L64 WeakPolarHBondContact O-CG 3.39Å; Y60-L64 PolarHBondContact O-N 2.78Å; S61-L64 PolarHBondContact O-N 2.68Å; E62-L64 VanDerWaalsContact C-N 3.3Å; E62-L64 PolarHBondContact O-N 3.44Å; L64-L66 PolarHBondContact O-N 3.04Å; L64-D67 CarbonylContact O-C 3.52Å; L64-P68 VanDerWaalsContact O-CA 3.26Å; L64-P68 WeakPolarHBondContact O-CA 3.48Å; L64-P68 VanDerWaalsContact O-N 3.14Å; L64-L73 HydrophobicContact CD1-CB 4.23Å; L64-L73 HydrophobicContact CD2-CB 3.58Å; L64-L73 HydrophobicContact CD2-CD1 4.07Å; L64-L73 HydrophobicContact CD2-CG 4.48Å; L64-L73 HydrophobicContact CG-CB 3.65Å; L64-L73 HydrophobicContact CG-CD1 4.08Å; L64-F74 HydrophobicContact CD1-CD1 3.91Å; L64-F74 HydrophobicContact CD1-CE1 3.94Å; L64-F74 HydrophobicContact CD1-CG 4.28Å; L64-F74 HydrophobicContact CD1-CZ 4.32Å; L64-F74 HydrophobicContact CD2-CD1 4.26Å; L64-F74 HydrophobicContact CD2-CD2 3.61Å; L64-F74 HydrophobicContact CD2-CE1 4.11Å; L64-F74 HydrophobicContact CD2-CE2 3.42Å; L64-F74 VanDerWaalsContact CD2-CE2 3.42Å; L64-F74 HydrophobicContact CD2-CG 4.02Å; L64-F74 HydrophobicContact CD2-CZ 3.68Å
65	A	93.8	Very high	95	Very high	85 Å²	85	38.2 Å²	38.2	70%	0.702	22%	0.218	S	C	*	.	H	α-helix	trans	-67.3	-29.2	172.1	0	0	0	0	0	111.6	S61 E62	S61-A65 PolarHBondContact O-N 2.64Å; E62-A65 WeakPolarHBondContact O-CB 3.28Å; E62-A65 PolarHBondContact O-N 2.87Å
66	L	92.3	Very high	95.1	Very high	89 Å²	89	36.1 Å²	36.1	47%	0.466	21%	0.208	S	C	.	.	H	α-helix	trans	-88.2	-37.3	176.8	-61.6	175.9	0	0	0	112.7	T36 V37 L40 E62 A63 L64	T36-L66 HydrophobicContact CG2-CD1 3.72Å; V37-L66 HydrophobicContact CG2-CB 3.49Å; V37-L66 VanDerWaalsContact CG2-CB 3.49Å; V37-L66 HydrophobicContact CG2-CD1 4.14Å; V37-L66 HydrophobicContact CG2-CG 4.48Å; L40-L66 HydrophobicContact CD1-CD1 3.96Å; E62-L66 PolarHBondContact O-N 3.35Å; A63-L66 PolarHBondContact O-N 2.95Å; L64-L66 PolarHBondContact O-N 3.04Å
67	D	91.9	Very high	95.2	Very high	22 Å²	22	37.9 Å²	37.9	12%	0.118	22%	0.215	C	C	.	.			trans	-130.5	83.3	175.8	-178.5	6.3	0	0	0	111.5	V37 A63 L64 S69 N70	V37-D67 HydrophobicContact CG1-CB 4.12Å; V37-D67 HydrophobicContact CG2-CB 3.99Å; A63-D67 PolarHBondContact O-N 2.9Å; L64-D67 CarbonylContact O-C 3.52Å; D67-S69 PolarHBondContact O-N 3.2Å; D67-S69 VanDerWaalsContact O-N 3.16Å; D67-S69 PolarHBondContact OD1-N 3.42Å; D67-S69 PolarHBondContact OD1-OG 3.44Å; D67-N70 HydrophobicContact CB-CB 4.35Å; D67-N70 PolarHBondContact O-N 3.5Å; D67-N70 PolarHBondContact OD1-N 3.27Å; D67-N70 VanDerWaalsContact OD2-CB 3.26Å; D67-N70 WeakPolarHBondContact OD2-CB 3.27Å; D67-N70 PolarHBondContact OD2-ND2 3.04Å
68	P	92.1	Very high	95.2	Very high	87 Å²	87	37.3 Å²	37.3	57%	0.565	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-2.6	-178.5	30.4	-36.1	0	0	0	113.3	L64 F74	L64-P68 VanDerWaalsContact O-CA 3.26Å; L64-P68 WeakPolarHBondContact O-CA 3.48Å; L64-P68 VanDerWaalsContact O-N 3.14Å; P68-F74 WeakPolarHBondContact O-CE2 3.32Å
69	S	92.3	Very high	95.1	Very high	80 Å²	80	33.3 Å²	33.3	56%	0.559	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.2	4.1	179.3	72.5	0	0	0	0	113	D67 H71 I100	D67-S69 PolarHBondContact O-N 3.2Å; D67-S69 VanDerWaalsContact O-N 3.16Å; D67-S69 PolarHBondContact OD1-N 3.42Å; D67-S69 PolarHBondContact OD1-OG 3.44Å; S69-H71 PolarHBondContact O-N 3.35Å; S69-I100 WeakPolarHBondContact O-CG2 3.31Å
70	N	92.6	Very high	95.1	Very high	35 Å²	35	33.3 Å²	33.3	19%	0.187	20%	0.199	C	C	.	.			trans	-85.7	98.1	-174.7	-152.6	-54.5	0	0	0	113.3	D67 V72 L73 F74	D67-N70 HydrophobicContact CB-CB 4.35Å; D67-N70 PolarHBondContact O-N 3.5Å; D67-N70 PolarHBondContact OD1-N 3.27Å; D67-N70 VanDerWaalsContact OD2-CB 3.26Å; D67-N70 WeakPolarHBondContact OD2-CB 3.27Å; D67-N70 PolarHBondContact OD2-ND2 3.04Å; N70-V72 PolarHBondContact O-N 3.25Å; N70-V72 VanDerWaalsContact O-N 3.15Å; N70-V72 VanDerWaalsContact OD1-CB 3.32Å; N70-V72 WeakPolarHBondContact OD1-CB 3.44Å; N70-V72 PolarHBondContact OD1-N 3.03Å; N70-L73 HydrophobicContact CB-CB 4.06Å; N70-L73 HydrophobicContact CB-CD1 3.64Å; N70-L73 HydrophobicContact CB-CG 3.72Å; N70-L73 PolarHBondContact O-N 2.92Å; N70-L73 VanDerWaalsContact O-N 3.17Å; N70-L73 PolarHBondContact OD1-N 2.94Å; N70-F74 WeakPolarHBondContact O-CD2 3.28Å; N70-F74 PolarHBondContact O-N 3.16Å
71	H	94.3	Very high	95.2	Very high	41 Å²	41	35 Å²	35	19%	0.19	21%	0.206	C	C	.	.	H	α-helix	trans	-55.9	-29.4	174.4	62.7	-78.5	0	0	0	113.6	S69 S75 T97 I100 K101 W104	S69-H71 PolarHBondContact O-N 3.35Å; H71-S75 WeakPolarHBondContact O-CB 3.48Å; H71-S75 PolarHBondContact O-N 2.76Å; H71-T97 HydrophobicContact CB-CG2 4.2Å; H71-T97 WeakPolarHBondContact O-CG2 3.44Å; H71-I100 HydrophobicContact CB-CB 4.08Å; H71-I100 HydrophobicContact CB-CG2 3.8Å; H71-K101 HydrophobicContact CB-CB 3.88Å; H71-K101 VanDerWaalsContact NE2-CD 3.28Å; H71-K101 WeakPolarHBondContact NE2-CD 3.31Å; H71-W104 AromaticContact CD2-CD2 4Å; H71-W104 AromaticContact CD2-CE3 3.51Å; H71-W104 AromaticContact CD2-CZ3 3.58Å
72	V	95.5	Very high	95.1	Very high	44 Å²	44	34.2 Å²	34.2	27%	0.267	20%	0.201	S	C	.	.	H	α-helix	trans	-71.5	-40.3	179.5	-176.6	0	0	0	0	111.2	N70 S75 N76 W104	N70-V72 PolarHBondContact O-N 3.25Å; N70-V72 VanDerWaalsContact O-N 3.15Å; N70-V72 VanDerWaalsContact OD1-CB 3.32Å; N70-V72 WeakPolarHBondContact OD1-CB 3.44Å; N70-V72 PolarHBondContact OD1-N 3.03Å; V72-S75 WeakPolarHBondContact O-CB 3.48Å; V72-S75 PolarHBondContact O-N 3.45Å; V72-N76 WeakPolarHBondContact O-CB 3.25Å; V72-N76 PolarHBondContact O-N 3.24Å; V72-W104 HydrophobicContact CG2-CH2 4.14Å
73	L	95.8	Very high	95	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.4	-43.5	178	-63.5	178.1	0	0	0	111.5	V37 K41 Y60 A63 L64 N70 S75 N76 R77	V37-L73 HydrophobicContact CG1-CD1 3.99Å; K41-L73 HydrophobicContact CB-CD2 3.76Å; K41-L73 HydrophobicContact CD-CD2 4.36Å; K41-L73 HydrophobicContact CG-CD2 3.76Å; Y60-L73 HydrophobicContact CD1-CD2 4.43Å; A63-L73 HydrophobicContact CB-CD1 3.6Å; A63-L73 HydrophobicContact CB-CD2 3.89Å; A63-L73 HydrophobicContact CB-CG 4.38Å; L64-L73 HydrophobicContact CD1-CB 4.23Å; L64-L73 HydrophobicContact CD2-CB 3.58Å; L64-L73 HydrophobicContact CD2-CD1 4.07Å; L64-L73 HydrophobicContact CD2-CG 4.48Å; L64-L73 HydrophobicContact CG-CB 3.65Å; L64-L73 HydrophobicContact CG-CD1 4.08Å; N70-L73 HydrophobicContact CB-CB 4.06Å; N70-L73 HydrophobicContact CB-CD1 3.64Å; N70-L73 HydrophobicContact CB-CG 3.72Å; N70-L73 PolarHBondContact O-N 2.92Å; N70-L73 VanDerWaalsContact O-N 3.17Å; N70-L73 PolarHBondContact OD1-N 2.94Å; L73-S75 VanDerWaalsContact C-N 3.33Å; L73-S75 PolarHBondContact O-N 3.39Å; L73-N76 PolarHBondContact O-N 3.47Å; L73-R77 WeakPolarHBondContact O-CB 3.37Å; L73-R77 PolarHBondContact O-N 2.89Å
74	F	97.5	Very high	95	Very high	21 Å²	21	42 Å²	42	9%	0.092	23%	0.234	C	C	.	.	H	α-helix	trans	-58.9	-43.7	171.8	-77	-69.7	0	0	0	111.7	L64 P68 N70 N76 R77 S78 D93 Q96 T97 I100	L64-F74 HydrophobicContact CD1-CD1 3.91Å; L64-F74 HydrophobicContact CD1-CE1 3.94Å; L64-F74 HydrophobicContact CD1-CG 4.28Å; L64-F74 HydrophobicContact CD1-CZ 4.32Å; L64-F74 HydrophobicContact CD2-CD1 4.26Å; L64-F74 HydrophobicContact CD2-CD2 3.61Å; L64-F74 HydrophobicContact CD2-CE1 4.11Å; L64-F74 HydrophobicContact CD2-CE2 3.42Å; L64-F74 VanDerWaalsContact CD2-CE2 3.42Å; L64-F74 HydrophobicContact CD2-CG 4.02Å; L64-F74 HydrophobicContact CD2-CZ 3.68Å; P68-F74 WeakPolarHBondContact O-CE2 3.32Å; N70-F74 WeakPolarHBondContact O-CD2 3.28Å; N70-F74 PolarHBondContact O-N 3.16Å; F74-N76 VanDerWaalsContact C-N 3.33Å; F74-N76 PolarHBondContact O-N 3.3Å; F74-R77 PolarHBondContact O-N 3.3Å; F74-S78 WeakPolarHBondContact O-CB 3.24Å; F74-S78 PolarHBondContact O-N 2.99Å; F74-D93 HydrophobicContact CD1-CB 4.29Å; F74-D93 WeakPolarHBondContact CD1-OD1 3.48Å; F74-Q96 HydrophobicContact CD1-CB 4.01Å; F74-Q96 HydrophobicContact CD1-CG 3.84Å; F74-Q96 HydrophobicContact CD2-CG 3.85Å; F74-Q96 HydrophobicContact CE1-CB 4.16Å; F74-Q96 HydrophobicContact CE1-CG 3.61Å; F74-Q96 HydrophobicContact CE2-CG 3.62Å; F74-Q96 HydrophobicContact CG-CB 4.23Å; F74-Q96 HydrophobicContact CG-CG 3.97Å; F74-Q96 HydrophobicContact CZ-CG 3.5Å; F74-T97 VanDerWaalsContact CB-OG1 3.25Å; F74-T97 WeakPolarHBondContact CB-OG1 3.34Å; F74-I100 HydrophobicContact CD2-CD1 3.57Å; F74-I100 HydrophobicContact CE2-CD1 3.54Å
75	S	97.4	Very high	94.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.6	-37.5	177.3	-173.5	0	0	0	0	113.3	H71 V72 L73 A79 T97 R110	H71-S75 WeakPolarHBondContact O-CB 3.48Å; H71-S75 PolarHBondContact O-N 2.76Å; V72-S75 WeakPolarHBondContact O-CB 3.48Å; V72-S75 PolarHBondContact O-N 3.45Å; L73-S75 VanDerWaalsContact C-N 3.33Å; L73-S75 PolarHBondContact O-N 3.39Å; S75-A79 PolarHBondContact O-N 3.45Å; S75-T97 PolarHBondContact N-OG1 3.42Å; S75-R110 PolarHBondContact O-NE 2.81Å; S75-R110 VanDerWaalsContact O-NE 3.14Å; S75-R110 WeakPolarHBondContact OG-CG 3.24Å
76	N	96.8	Very high	95.1	Very high	16 Å²	16	41.4 Å²	41.4	9%	0.086	23%	0.228	C	C	.	.	H	α-helix	trans	-75.3	-40.3	178.9	-74.4	-1.9	0	0	0	111.9	N45 Y60 V72 L73 F74 A79 A80	N45-N76 PolarHBondContact OD1-ND2 3.3Å; N45-N76 VanDerWaalsContact OD1-ND2 3.13Å; Y60-N76 HydrophobicContact CD1-CB 4.18Å; Y60-N76 HydrophobicContact CD2-CB 4.4Å; Y60-N76 HydrophobicContact CE1-CB 3.76Å; Y60-N76 HydrophobicContact CE2-CB 4Å; Y60-N76 HydrophobicContact CG-CB 4.49Å; V72-N76 WeakPolarHBondContact O-CB 3.25Å; V72-N76 PolarHBondContact O-N 3.24Å; L73-N76 PolarHBondContact O-N 3.47Å; F74-N76 VanDerWaalsContact C-N 3.33Å; F74-N76 PolarHBondContact O-N 3.3Å; N76-A79 WeakPolarHBondContact O-CB 3.45Å; N76-A79 PolarHBondContact O-N 3.21Å; N76-A80 PolarHBondContact O-N 3.2Å
77	R	97.8	Very high	95.2	Very high	37 Å²	37	40.2 Å²	40.2	14%	0.14	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-38.4	175.1	-164.1	174.6	65.9	-178.6	-1.2	112	V57 Y60 S61 L73 F74 A79 A80 Y81 D93	V57-R77 HydrophobicContact CG1-CG 4.47Å; Y60-R77 HydrophobicContact CD2-CB 4Å; Y60-R77 HydrophobicContact CD2-CG 4.35Å; Y60-R77 HydrophobicContact CG-CB 4.2Å; S61-R77 VanDerWaalsContact OG-CD 3.31Å; S61-R77 WeakPolarHBondContact OG-CD 3.5Å; S61-R77 PolarHBondContact OG-NH1 3.26Å; S61-R77 VanDerWaalsContact OG-NH1 3.11Å; L73-R77 WeakPolarHBondContact O-CB 3.37Å; L73-R77 PolarHBondContact O-N 2.89Å; F74-R77 PolarHBondContact O-N 3.3Å; R77-A79 VanDerWaalsContact C-N 3.3Å; R77-A79 PolarHBondContact O-N 2.97Å; R77-A80 PolarHBondContact O-N 2.81Å; R77-A80 VanDerWaalsContact O-N 3.11Å; R77-Y81 HydrophobicContact CG-CD2 3.96Å; R77-Y81 HydrophobicContact CG-CE2 3.61Å; R77-Y81 WeakPolarHBondContact O-CD2 3.02Å; R77-Y81 PolarHBondContact O-N 3.08Å; R77-D93 WeakPolarHBondContact CB-OD2 3.31Å; R77-D93 WeakPolarHBondContact CG-OD2 3.15Å; R77-D93 IonicContact CZ-OD1 3.39Å; R77-D93 IonicContact CZ-OD2 2.68Å; R77-D93 IonicContact NE-OD1 2.8Å; R77-D93 IonicContact NE-OD2 3.51Å; R77-D93 PolarHBondContact NE-OD2 3.43Å; R77-D93 IonicContact NH2-OD1 3.57Å; R77-D93 PolarHBondContact NH2-OD1 3.08Å; R77-D93 IonicContact NH2-OD2 3.67Å
78	S	97.6	Very high	95.5	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.014	24%	0.236	C	C	.	.	H	α-helix	trans	-53.9	-46	169	175.6	0	0	0	0	111.7	F74 A80 Y81 A82 A90	F74-S78 WeakPolarHBondContact O-CB 3.24Å; F74-S78 PolarHBondContact O-N 2.99Å; S78-A80 PolarHBondContact O-N 3.32Å; S78-Y81 PolarHBondContact O-N 2.81Å; S78-A82 PolarHBondContact O-N 3.34Å; S78-A90 WeakPolarHBondContact CB-O 3.48Å; S78-A90 WeakPolarHBondContact O-CB 3.49Å; S78-A90 PolarHBondContact OG-O 3.36Å
79	A	95.5	Very high	95.7	Very high	12 Å²	12	42.4 Å²	42.4	10%	0.099	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-39.1	177.1	0	0	0	0	0	112.9	S75 N76 R77 A82 K83 R110	S75-A79 PolarHBondContact O-N 3.45Å; N76-A79 WeakPolarHBondContact O-CB 3.45Å; N76-A79 PolarHBondContact O-N 3.21Å; R77-A79 VanDerWaalsContact C-N 3.3Å; R77-A79 PolarHBondContact O-N 2.97Å; A79-A82 PolarHBondContact O-N 2.81Å; A79-K83 PolarHBondContact O-N 3.43Å; A79-R110 VanDerWaalsContact CB-CZ 3.42Å
80	A	96.6	Very high	96	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67.1	-43.4	177	0	0	0	0	0	111.7	L48 I53 A56 V57 Y60 N76 R77 S78 A82 K83 K84	L48-A80 HydrophobicContact CD1-CB 3.8Å; I53-A80 VanDerWaalsContact CG2-O 3.26Å; I53-A80 WeakPolarHBondContact CG2-O 3.35Å; A56-A80 HydrophobicContact CB-CB 4.43Å; V57-A80 HydrophobicContact CG2-CB 3.68Å; Y60-A80 HydrophobicContact CD2-CB 4.4Å; Y60-A80 HydrophobicContact CE2-CB 4.17Å; N76-A80 PolarHBondContact O-N 3.2Å; R77-A80 PolarHBondContact O-N 2.81Å; R77-A80 VanDerWaalsContact O-N 3.11Å; S78-A80 PolarHBondContact O-N 3.32Å; A80-A82 VanDerWaalsContact C-N 3.35Å; A80-A82 PolarHBondContact O-N 3.48Å; A80-K83 PolarHBondContact O-N 2.96Å; A80-K84 PolarHBondContact O-N 3.28Å
81	Y	97.8	Very high	96.2	Very high	36 Å²	36	38 Å²	38	14%	0.141	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-41.7	173.9	-78.8	-48.5	0	0	0	112.6	V57 R77 S78 K83 K84 G85 N86 N89 D93	V57-Y81 HydrophobicContact CG1-CD1 4.42Å; V57-Y81 HydrophobicContact CG1-CE1 3.59Å; V57-Y81 HydrophobicContact CG2-CD1 4.13Å; V57-Y81 HydrophobicContact CG2-CE1 4.11Å; R77-Y81 HydrophobicContact CG-CD2 3.96Å; R77-Y81 HydrophobicContact CG-CE2 3.61Å; R77-Y81 WeakPolarHBondContact O-CD2 3.02Å; R77-Y81 PolarHBondContact O-N 3.08Å; S78-Y81 PolarHBondContact O-N 2.81Å; Y81-K83 PolarHBondContact O-N 3.41Å; Y81-K84 WeakPolarHBondContact O-CB 3.25Å; Y81-K84 PolarHBondContact O-N 3.42Å; Y81-K84 VanDerWaalsContact O-N 3.1Å; Y81-G85 PolarHBondContact O-N 3.33Å; Y81-N86 WeakPolarHBondContact CB-O 3.37Å; Y81-N86 HydrophobicContact CD1-CB 4.31Å; Y81-N86 PolarHBondContact O-N 2.95Å; Y81-N89 HydrophobicContact CD1-CB 4.04Å; Y81-N89 HydrophobicContact CD2-CB 3.73Å; Y81-N89 HydrophobicContact CE1-CB 4.21Å; Y81-N89 HydrophobicContact CE2-CB 3.89Å; Y81-N89 HydrophobicContact CG-CB 3.83Å; Y81-D93 WeakPolarHBondContact CE2-OD2 3.46Å
82	A	94.9	Very high	96.4	Very high	21 Å²	21	42.1 Å²	42.1	17%	0.174	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-43.7	174.8	0	0	0	0	0	111.7	S78 A79 A80 K84 G85 Y87 A90	S78-A82 PolarHBondContact O-N 3.34Å; A79-A82 PolarHBondContact O-N 2.81Å; A80-A82 VanDerWaalsContact C-N 3.35Å; A80-A82 PolarHBondContact O-N 3.48Å; A82-K84 VanDerWaalsContact C-N 3.26Å; A82-K84 PolarHBondContact O-N 3.31Å; A82-G85 PolarHBondContact O-N 2.94Å; A82-G85 VanDerWaalsContact O-N 3.09Å; A82-Y87 WeakPolarHBondContact O-CE1 3.27Å; A82-A90 HydrophobicContact CB-CB 4.1Å
83	K	94.2	Very high	96.5	Very high	135 Å²	135	40.5 Å²	40.5	59%	0.587	20%	0.2	S	C	*	.	H	α-helix	trans	-63.5	-29.9	173.7	-76.5	-164.3	-179	-173.4	0	113.3	L48 I53 A79 A80 Y81 G85	L48-K83 HydrophobicContact CD1-CD 3.93Å; I53-K83 HydrophobicContact CD1-CB 3.95Å; I53-K83 HydrophobicContact CG1-CB 4.33Å; A79-K83 PolarHBondContact O-N 3.43Å; A80-K83 PolarHBondContact O-N 2.96Å; Y81-K83 PolarHBondContact O-N 3.41Å; K83-G85 PolarHBondContact O-N 2.88Å
84	K	94.3	Very high	96.5	Very high	106 Å²	106	40.5 Å²	40.5	46%	0.461	20%	0.2	S	C	.	.	H	α-helix	trans	-73.7	-13.8	175.4	-160.8	171.3	171.3	174.1	0	113	I53 D54 A80 Y81 A82 N86	I53-K84 HydrophobicContact CG2-CB 3.74Å; I53-K84 HydrophobicContact CG2-CD 4.43Å; I53-K84 HydrophobicContact CG2-CG 4.23Å; D54-K84 WeakPolarHBondContact OD1-CE 3.41Å; D54-K84 IonicContact OD1-NZ 2.74Å; D54-K84 PolarHBondContact OD1-NZ 2.96Å; A80-K84 PolarHBondContact O-N 3.28Å; Y81-K84 WeakPolarHBondContact O-CB 3.25Å; Y81-K84 PolarHBondContact O-N 3.42Å; Y81-K84 VanDerWaalsContact O-N 3.1Å; A82-K84 VanDerWaalsContact C-N 3.26Å; A82-K84 PolarHBondContact O-N 3.31Å; K84-N86 VanDerWaalsContact C-N 3.34Å
85	G	93.1	Very high	96.5	Very high	37 Å²	37	42.7 Å²	42.7	38%	0.381	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	11	-170.6	0	0	0	0	0	114.3	Y81 A82 K83 Y87	Y81-G85 PolarHBondContact O-N 3.33Å; A82-G85 PolarHBondContact O-N 2.94Å; A82-G85 VanDerWaalsContact O-N 3.09Å; K83-G85 PolarHBondContact O-N 2.88Å; G85-Y87 PolarHBondContact O-N 3Å
86	N	95.9	Very high	96.5	Very high	49 Å²	49	45.6 Å²	45.6	26%	0.262	23%	0.229	S	C	.	.			trans	-97.2	81.5	176.2	-172.2	-27.1	0	0	0	109.6	Y81 K84 N89 A90	Y81-N86 WeakPolarHBondContact CB-O 3.37Å; Y81-N86 HydrophobicContact CD1-CB 4.31Å; Y81-N86 PolarHBondContact O-N 2.95Å; K84-N86 VanDerWaalsContact C-N 3.34Å; N86-N89 PolarHBondContact ND2-ND2 2.84Å; N86-N89 WeakPolarHBondContact OD1-CB 3.25Å; N86-N89 PolarHBondContact OD1-N 3.16Å; N86-N89 PolarHBondContact OD1-ND2 3.07Å; N86-A90 PolarHBondContact O-N 3.11Å
87	Y	96.3	Very high	96.5	Very high	63 Å²	63	44.8 Å²	44.8	25%	0.247	23%	0.225	C	C	.	.	H	α-helix	trans	-78.8	-26.8	-168.6	-51	-60.1	0	0	0	113.2	A82 G85 A90 L91 F117	A82-Y87 WeakPolarHBondContact O-CE1 3.27Å; G85-Y87 PolarHBondContact O-N 3Å; Y87-A90 WeakPolarHBondContact O-CB 3.42Å; Y87-A90 PolarHBondContact O-N 3.09Å; Y87-L91 WeakPolarHBondContact O-CB 3.45Å; Y87-L91 PolarHBondContact O-N 3.3Å; Y87-F117 HydrophobicContact CD1-CB 3.34Å; Y87-F117 HydrophobicContact CD1-CD2 4Å; Y87-F117 AromaticContact CD1-CG 3.76Å; Y87-F117 HydrophobicContact CD1-CG 3.76Å; Y87-F117 HydrophobicContact CD2-CB 3.85Å; Y87-F117 HydrophobicContact CE1-CB 3.4Å; Y87-F117 VanDerWaalsContact CE1-CB 3.4Å; Y87-F117 AromaticContact CE1-CD1 3.84Å; Y87-F117 HydrophobicContact CE1-CD1 3.84Å; Y87-F117 AromaticContact CE1-CD2 3.8Å; Y87-F117 HydrophobicContact CE1-CD2 3.8Å; Y87-F117 AromaticContact CE1-CG 3.41Å; Y87-F117 HydrophobicContact CE1-CG 3.41Å; Y87-F117 VanDerWaalsContact CE1-CG 3.41Å; Y87-F117 HydrophobicContact CE2-CB 3.91Å; Y87-F117 HydrophobicContact CG-CB 3.56Å; Y87-F117 HydrophobicContact CG-CG 4.45Å; Y87-F117 AromaticContact CZ-CD1 3.88Å; Y87-F117 AromaticContact CZ-CG 3.84Å
88	E	97.3	Very high	96.5	Very high	107 Å²	107	44 Å²	44	50%	0.5	22%	0.223	S	C	.	.	H	α-helix	trans	-63.7	-48.1	174.8	-72.4	74.5	-169.1	0	0	111.4	A90 L91 Q92 L118	E88-A90 VanDerWaalsContact C-N 3.32Å; E88-A90 PolarHBondContact O-N 3.29Å; E88-L91 WeakPolarHBondContact O-CB 3.47Å; E88-L91 PolarHBondContact O-N 3.05Å; E88-Q92 WeakPolarHBondContact O-CG 3.41Å; E88-Q92 PolarHBondContact O-N 3.34Å; E88-L118 HydrophobicContact CG-CD2 4.43Å; E88-L118 WeakPolarHBondContact OE1-CD2 3.33Å
89	N	96.4	Very high	96.5	Very high	49 Å²	49	51.3 Å²	51.3	26%	0.262	26%	0.255	S	S	.	.	H	α-helix	trans	-67.7	-35.2	175.8	-72.5	-17.9	0	0	0	111.4	Y81 N86 L91 Q92 D93	Y81-N89 HydrophobicContact CD1-CB 4.04Å; Y81-N89 HydrophobicContact CD2-CB 3.73Å; Y81-N89 HydrophobicContact CE1-CB 4.21Å; Y81-N89 HydrophobicContact CE2-CB 3.89Å; Y81-N89 HydrophobicContact CG-CB 3.83Å; N86-N89 PolarHBondContact ND2-ND2 2.84Å; N86-N89 WeakPolarHBondContact OD1-CB 3.25Å; N86-N89 PolarHBondContact OD1-N 3.16Å; N86-N89 PolarHBondContact OD1-ND2 3.07Å; N89-L91 VanDerWaalsContact C-N 3.3Å; N89-L91 PolarHBondContact O-N 3.5Å; N89-Q92 PolarHBondContact O-N 3.42Å; N89-D93 PolarHBondContact O-N 3.24Å
90	A	97.7	Very high	96.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-41	173.2	0	0	0	0	0	112	S78 A82 N86 Y87 E88 A94 A114	S78-A90 WeakPolarHBondContact CB-O 3.48Å; S78-A90 WeakPolarHBondContact O-CB 3.49Å; S78-A90 PolarHBondContact OG-O 3.36Å; A82-A90 HydrophobicContact CB-CB 4.1Å; N86-A90 PolarHBondContact O-N 3.11Å; Y87-A90 WeakPolarHBondContact O-CB 3.42Å; Y87-A90 PolarHBondContact O-N 3.09Å; E88-A90 VanDerWaalsContact C-N 3.32Å; E88-A90 PolarHBondContact O-N 3.29Å; A90-A94 WeakPolarHBondContact O-CB 3.41Å; A90-A94 PolarHBondContact O-N 3.42Å; A90-A114 HydrophobicContact CB-CB 4.12Å
91	L	97.9	Very high	96.4	Very high	23 Å²	23	56.5 Å²	56.5	12%	0.12	28%	0.277	C	S	.	.	H	α-helix	trans	-66.3	-44.5	177	179.1	58.5	0	0	0	111.6	Y87 E88 N89 D93 A94 V95 K111 A114 L115 L118	Y87-L91 WeakPolarHBondContact O-CB 3.45Å; Y87-L91 PolarHBondContact O-N 3.3Å; E88-L91 WeakPolarHBondContact O-CB 3.47Å; E88-L91 PolarHBondContact O-N 3.05Å; N89-L91 VanDerWaalsContact C-N 3.3Å; N89-L91 PolarHBondContact O-N 3.5Å; L91-D93 PolarHBondContact O-N 3.01Å; L91-A94 PolarHBondContact O-N 3.03Å; L91-V95 HydrophobicContact CD1-CG2 4.28Å; L91-V95 WeakPolarHBondContact O-CG2 3.44Å; L91-V95 PolarHBondContact O-N 3.24Å; L91-K111 HydrophobicContact CD1-CG 3.75Å; L91-A114 HydrophobicContact CB-CB 3.91Å; L91-A114 HydrophobicContact CD1-CB 4.38Å; L91-L115 HydrophobicContact CD1-CD2 4.09Å; L91-L115 HydrophobicContact CD1-CG 3.94Å; L91-L115 HydrophobicContact CD2-CD2 3.92Å; L91-L118 HydrophobicContact CB-CD1 4.46Å; L91-L118 HydrophobicContact CD2-CD1 3.9Å
92	Q	97.8	Very high	96.3	Very high	126 Å²	126	57.8 Å²	57.8	59%	0.589	29%	0.289	S	S	*	.	H	α-helix	trans	-58.5	-48.6	177.3	-72.1	177.8	2.9	0	0	111.8	E88 N89 A94 V95 Q96	E88-Q92 WeakPolarHBondContact O-CG 3.41Å; E88-Q92 PolarHBondContact O-N 3.34Å; N89-Q92 PolarHBondContact O-N 3.42Å; Q92-A94 VanDerWaalsContact C-N 3.32Å; Q92-A94 PolarHBondContact O-N 2.84Å; Q92-V95 PolarHBondContact O-N 2.92Å; Q92-Q96 PolarHBondContact O-N 3.32Å
93	D	97.5	Very high	96.1	Very high	10 Å²	10	61.4 Å²	61.4	5%	0.053	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-36	177.9	-83.8	-7.4	0	0	0	112.2	F74 R77 Y81 N89 L91 Q96 T97	F74-D93 HydrophobicContact CD1-CB 4.29Å; F74-D93 WeakPolarHBondContact CD1-OD1 3.48Å; R77-D93 WeakPolarHBondContact CB-OD2 3.31Å; R77-D93 WeakPolarHBondContact CG-OD2 3.15Å; R77-D93 IonicContact CZ-OD1 3.39Å; R77-D93 IonicContact CZ-OD2 2.68Å; R77-D93 IonicContact NE-OD1 2.8Å; R77-D93 IonicContact NE-OD2 3.51Å; R77-D93 PolarHBondContact NE-OD2 3.43Å; R77-D93 IonicContact NH2-OD1 3.57Å; R77-D93 PolarHBondContact NH2-OD1 3.08Å; R77-D93 IonicContact NH2-OD2 3.67Å; Y81-D93 WeakPolarHBondContact CE2-OD2 3.46Å; N89-D93 PolarHBondContact O-N 3.24Å; L91-D93 PolarHBondContact O-N 3.01Å; D93-Q96 PolarHBondContact O-N 3.48Å; D93-T97 PolarHBondContact O-N 3.07Å; D93-T97 PolarHBondContact O-OG1 2.95Å
94	A	97.4	Very high	96.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-67.4	-39.3	175.7	0	0	0	0	0	112.4	A90 L91 Q92 Q96 T97 I98 R110 K111	A90-A94 WeakPolarHBondContact O-CB 3.41Å; A90-A94 PolarHBondContact O-N 3.42Å; L91-A94 PolarHBondContact O-N 3.03Å; Q92-A94 VanDerWaalsContact C-N 3.32Å; Q92-A94 PolarHBondContact O-N 2.84Å; A94-Q96 VanDerWaalsContact C-N 3.34Å; A94-T97 WeakPolarHBondContact O-CB 3.08Å; A94-T97 PolarHBondContact O-N 3.29Å; A94-I98 WeakPolarHBondContact O-CG1 3.47Å; A94-I98 PolarHBondContact O-N 3.12Å; A94-I98 VanDerWaalsContact O-N 3.12Å; A94-R110 HydrophobicContact CB-CB 3.74Å; A94-K111 VanDerWaalsContact CB-CA 3.48Å; A94-K111 HydrophobicContact CB-CB 3.79Å
95	V	97.6	Very high	96	Very high	68 Å²	68	52.2 Å²	52.2	41%	0.412	27%	0.265	S	S	.	.	H	α-helix	trans	-63.2	-42.8	173.1	169.1	0	0	0	0	110.6	L91 Q92 T97 I98 K99 K111	L91-V95 HydrophobicContact CD1-CG2 4.28Å; L91-V95 WeakPolarHBondContact O-CG2 3.44Å; L91-V95 PolarHBondContact O-N 3.24Å; Q92-V95 PolarHBondContact O-N 2.92Å; V95-T97 VanDerWaalsContact C-N 3.32Å; V95-T97 PolarHBondContact O-N 3.5Å; V95-I98 PolarHBondContact O-N 3.14Å; V95-K99 WeakPolarHBondContact O-CB 3.49Å; V95-K99 PolarHBondContact O-N 3.09Å; V95-K111 HydrophobicContact CG2-CD 4.13Å
96	Q	97.3	Very high	96	Very high	60 Å²	60	54.4 Å²	54.4	28%	0.28	26%	0.264	S	S	.	.	H	α-helix	trans	-64.8	-37	176.8	-171.9	61.7	14.8	0	0	112.1	F74 Q92 D93 A94 I98 K99 I100	F74-Q96 HydrophobicContact CD1-CB 4.01Å; F74-Q96 HydrophobicContact CD1-CG 3.84Å; F74-Q96 HydrophobicContact CD2-CG 3.85Å; F74-Q96 HydrophobicContact CE1-CB 4.16Å; F74-Q96 HydrophobicContact CE1-CG 3.61Å; F74-Q96 HydrophobicContact CE2-CG 3.62Å; F74-Q96 HydrophobicContact CG-CB 4.23Å; F74-Q96 HydrophobicContact CG-CG 3.97Å; F74-Q96 HydrophobicContact CZ-CG 3.5Å; Q92-Q96 PolarHBondContact O-N 3.32Å; D93-Q96 PolarHBondContact O-N 3.48Å; A94-Q96 VanDerWaalsContact C-N 3.34Å; Q96-I98 PolarHBondContact O-N 3.22Å; Q96-K99 PolarHBondContact O-N 2.94Å; Q96-I100 HydrophobicContact CG-CD1 4.09Å; Q96-I100 WeakPolarHBondContact O-CG1 3.27Å; Q96-I100 PolarHBondContact O-N 3.32Å
97	T	96.9	Very high	96	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.1	-50.3	172.2	-58.1	0	0	0	0	111.2	H71 F74 S75 D93 A94 V95 I100 K101 W104	H71-T97 HydrophobicContact CB-CG2 4.2Å; H71-T97 WeakPolarHBondContact O-CG2 3.44Å; F74-T97 VanDerWaalsContact CB-OG1 3.25Å; F74-T97 WeakPolarHBondContact CB-OG1 3.34Å; S75-T97 PolarHBondContact N-OG1 3.42Å; D93-T97 PolarHBondContact O-N 3.07Å; D93-T97 PolarHBondContact O-OG1 2.95Å; A94-T97 WeakPolarHBondContact O-CB 3.08Å; A94-T97 PolarHBondContact O-N 3.29Å; V95-T97 VanDerWaalsContact C-N 3.32Å; V95-T97 PolarHBondContact O-N 3.5Å; T97-I100 PolarHBondContact O-N 3.48Å; T97-K101 PolarHBondContact O-N 2.76Å; T97-W104 HydrophobicContact CG2-CE3 3.66Å; T97-W104 HydrophobicContact CG2-CZ3 3.58Å
98	I	97	Very high	96	Very high	19 Å²	19	49.2 Å²	49.2	10%	0.097	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-37.8	179.6	-64.1	165.4	0	0	0	110.8	A94 V95 Q96 I100 K101 P102 Y108 K111	A94-I98 WeakPolarHBondContact O-CG1 3.47Å; A94-I98 PolarHBondContact O-N 3.12Å; A94-I98 VanDerWaalsContact O-N 3.12Å; V95-I98 PolarHBondContact O-N 3.14Å; Q96-I98 PolarHBondContact O-N 3.22Å; I98-I100 VanDerWaalsContact C-N 3.32Å; I98-I100 PolarHBondContact O-N 3.05Å; I98-K101 CarbonylContact O-C 3.58Å; I98-K101 VanDerWaalsContact O-C 3.24Å; I98-K101 PolarHBondContact O-N 3.46Å; I98-P102 VanDerWaalsContact O-CA 3.24Å; I98-P102 WeakPolarHBondContact O-CA 3.28Å; I98-P102 WeakPolarHBondContact O-CD 3.38Å; I98-P102 VanDerWaalsContact O-CG 3.3Å; I98-P102 WeakPolarHBondContact O-CG 3.43Å; I98-Y108 HydrophobicContact CD1-CD1 3.89Å; I98-Y108 HydrophobicContact CD1-CE1 4.11Å; I98-Y108 HydrophobicContact CD1-CG 4.16Å; I98-Y108 HydrophobicContact CG1-CD2 4.42Å; I98-Y108 HydrophobicContact CG1-CE2 4.49Å; I98-Y108 HydrophobicContact CG1-CG 4.45Å; I98-Y108 HydrophobicContact CG2-CE1 4.09Å; I98-Y108 HydrophobicContact CG2-CE2 4.23Å; I98-K111 HydrophobicContact CD1-CB 3.82Å; I98-K111 HydrophobicContact CD1-CD 3.59Å; I98-K111 HydrophobicContact CD1-CG 4.33Å
99	K	96.8	Very high	96	Very high	156 Å²	156	45 Å²	45	68%	0.678	22%	0.222	S	C	*	.	H	α-helix	trans	-61.1	-41.3	177.4	-175.7	179.8	177.7	-178.7	0	112	V95 Q96	V95-K99 WeakPolarHBondContact O-CB 3.49Å; V95-K99 PolarHBondContact O-N 3.09Å; Q96-K99 PolarHBondContact O-N 2.94Å
100	I	95.1	Very high	96	Very high	53 Å²	53	46.1 Å²	46.1	27%	0.272	22%	0.223	S	C	.	.	H	α-helix	trans	-75.3	-43.9	178.2	-66.5	167.3	0	0	0	110.7	S69 H71 F74 Q96 T97 I98	S69-I100 WeakPolarHBondContact O-CG2 3.31Å; H71-I100 HydrophobicContact CB-CB 4.08Å; H71-I100 HydrophobicContact CB-CG2 3.8Å; F74-I100 HydrophobicContact CD2-CD1 3.57Å; F74-I100 HydrophobicContact CE2-CD1 3.54Å; Q96-I100 HydrophobicContact CG-CD1 4.09Å; Q96-I100 WeakPolarHBondContact O-CG1 3.27Å; Q96-I100 PolarHBondContact O-N 3.32Å; T97-I100 PolarHBondContact O-N 3.48Å; I98-I100 VanDerWaalsContact C-N 3.32Å; I98-I100 PolarHBondContact O-N 3.05Å
101	K	95.3	Very high	96	Very high	69 Å²	69	48.5 Å²	48.5	30%	0.3	23%	0.233	S	C	.	.			trans	-131.9	85.9	-177.4	-165.2	168.2	-175.9	168.1	0	112.1	H71 T97 I98 D103 W104	H71-K101 HydrophobicContact CB-CB 3.88Å; H71-K101 VanDerWaalsContact NE2-CD 3.28Å; H71-K101 WeakPolarHBondContact NE2-CD 3.31Å; T97-K101 PolarHBondContact O-N 2.76Å; I98-K101 CarbonylContact O-C 3.58Å; I98-K101 VanDerWaalsContact O-C 3.24Å; I98-K101 PolarHBondContact O-N 3.46Å; K101-D103 VanDerWaalsContact C-N 3.28Å; K101-D103 VanDerWaalsContact CE-OD1 3.24Å; K101-D103 WeakPolarHBondContact CE-OD1 3.49Å; K101-D103 WeakPolarHBondContact CG-OD1 3.25Å; K101-D103 PolarHBondContact O-N 3.22Å; K101-W104 HydrophobicContact CB-CB 4.32Å; K101-W104 HydrophobicContact CD-CB 3.8Å; K101-W104 HydrophobicContact CD-CG 4.31Å; K101-W104 HydrophobicContact CG-CB 3.75Å; K101-W104 PolarHBondContact O-N 3.24Å
102	P	94.9	Very high	95.9	Very high	62 Å²	62	47.4 Å²	47.4	40%	0.403	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-11	-174.7	-16.1	29.3	0	0	0	115.1	I98 Y108 K134	I98-P102 VanDerWaalsContact O-CA 3.24Å; I98-P102 WeakPolarHBondContact O-CA 3.28Å; I98-P102 WeakPolarHBondContact O-CD 3.38Å; I98-P102 VanDerWaalsContact O-CG 3.3Å; I98-P102 WeakPolarHBondContact O-CG 3.43Å; P102-Y108 WeakPolarHBondContact O-CE2 3.49Å; P102-Y108 PolarHBondContact O-OH 3.15Å; P102-K134 WeakPolarHBondContact O-CG 3.45Å
103	D	92.2	Very high	95.8	Very high	97 Å²	97	42.8 Å²	42.8	52%	0.519	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	0	-179.8	64	-30.8	0	0	0	112.8	K101	K101-D103 VanDerWaalsContact C-N 3.28Å; K101-D103 VanDerWaalsContact CE-OD1 3.24Å; K101-D103 WeakPolarHBondContact CE-OD1 3.49Å; K101-D103 WeakPolarHBondContact CG-OD1 3.25Å; K101-D103 PolarHBondContact O-N 3.22Å
104	W	93.3	Very high	95.8	Very high	49 Å²	49	42.4 Å²	42.4	19%	0.186	21%	0.209	C	C	.	.			trans	-101.2	109.2	-175.5	-171.5	48.9	0	0	0	112.5	H71 V72 T97 K101 K106 G107	H71-W104 AromaticContact CD2-CD2 4Å; H71-W104 AromaticContact CD2-CE3 3.51Å; H71-W104 AromaticContact CD2-CZ3 3.58Å; V72-W104 HydrophobicContact CG2-CH2 4.14Å; T97-W104 HydrophobicContact CG2-CE3 3.66Å; T97-W104 HydrophobicContact CG2-CZ3 3.58Å; K101-W104 HydrophobicContact CB-CB 4.32Å; K101-W104 HydrophobicContact CD-CB 3.8Å; K101-W104 HydrophobicContact CD-CG 4.31Å; K101-W104 HydrophobicContact CG-CB 3.75Å; K101-W104 PolarHBondContact O-N 3.24Å; W104-K106 HydrophobicContact CD2-CB 3.75Å; W104-K106 VanDerWaalsContact CE2-CB 3.47Å; W104-K106 HydrophobicContact CE3-CB 4.06Å; W104-K106 HydrophobicContact CG-CB 4.41Å; W104-K106 HydrophobicContact CH2-CB 3.98Å; W104-K106 HydrophobicContact CH2-CD 3.65Å; W104-K106 HydrophobicContact CH2-CG 4.24Å; W104-K106 HydrophobicContact CZ2-CB 3.62Å; W104-K106 HydrophobicContact CZ2-CD 3.39Å; W104-K106 HydrophobicContact CZ2-CG 4.08Å; W104-K106 HydrophobicContact CZ3-CB 4.17Å; W104-K106 PolarHBondContact O-N 3.27Å; W104-K106 VanDerWaalsContact O-N 3.1Å; W104-G107 PolarHBondContact O-N 3.23Å
105	G	92.1	Very high	95.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-26.9	-175.6	0	0	0	0	0	114.3	G107 Y108 S109 E135	G105-G107 PolarHBondContact O-N 2.93Å; G105-Y108 WeakPolarHBondContact O-CB 3.41Å; G105-Y108 PolarHBondContact O-N 3.49Å; G105-Y108 VanDerWaalsContact O-N 3.09Å; G105-S109 PolarHBondContact O-N 3.34Å; G105-S109 PolarHBondContact O-OG 3.25Å; G105-S109 VanDerWaalsContact O-OG 3.13Å; G105-E135 WeakPolarHBondContact CA-OE2 3.28Å; G105-E135 PolarHBondContact N-OE2 3.08Å
106	K	92.9	Very high	95.6	Very high	82 Å²	82	41.1 Å²	41.1	36%	0.357	20%	0.199	S	C	.	.	H	α-helix	trans	-61.8	-32.2	177.2	-158.5	178.6	-172.4	179.1	0	112.3	W104 S109 R110	W104-K106 HydrophobicContact CD2-CB 3.75Å; W104-K106 VanDerWaalsContact CE2-CB 3.47Å; W104-K106 HydrophobicContact CE3-CB 4.06Å; W104-K106 HydrophobicContact CG-CB 4.41Å; W104-K106 HydrophobicContact CH2-CB 3.98Å; W104-K106 HydrophobicContact CH2-CD 3.65Å; W104-K106 HydrophobicContact CH2-CG 4.24Å; W104-K106 HydrophobicContact CZ2-CB 3.62Å; W104-K106 HydrophobicContact CZ2-CD 3.39Å; W104-K106 HydrophobicContact CZ2-CG 4.08Å; W104-K106 HydrophobicContact CZ3-CB 4.17Å; W104-K106 PolarHBondContact O-N 3.27Å; W104-K106 VanDerWaalsContact O-N 3.1Å; K106-S109 PolarHBondContact O-N 3.16Å; K106-R110 WeakPolarHBondContact O-CG 3.29Å; K106-R110 PolarHBondContact O-N 2.84Å
107	G	95.5	Very high	95.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.3	-45.9	173.7	0	0	0	0	0	111.7	W104 G105 R110 K111	W104-G107 PolarHBondContact O-N 3.23Å; G105-G107 PolarHBondContact O-N 2.93Å; G107-R110 PolarHBondContact O-N 3.1Å; G107-K111 PolarHBondContact O-N 3.25Å
108	Y	97.6	Very high	95.1	Very high	3 Å²	3	46.3 Å²	46.3	1%	0.012	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-41.8	175	-66.9	-84.4	0	0	0	112.2	I98 P102 G105 R110 K111 A112 T127 E130 G131 K134	I98-Y108 HydrophobicContact CD1-CD1 3.89Å; I98-Y108 HydrophobicContact CD1-CE1 4.11Å; I98-Y108 HydrophobicContact CD1-CG 4.16Å; I98-Y108 HydrophobicContact CG1-CD2 4.42Å; I98-Y108 HydrophobicContact CG1-CE2 4.49Å; I98-Y108 HydrophobicContact CG1-CG 4.45Å; I98-Y108 HydrophobicContact CG2-CE1 4.09Å; I98-Y108 HydrophobicContact CG2-CE2 4.23Å; P102-Y108 WeakPolarHBondContact O-CE2 3.49Å; P102-Y108 PolarHBondContact O-OH 3.15Å; G105-Y108 WeakPolarHBondContact O-CB 3.41Å; G105-Y108 PolarHBondContact O-N 3.49Å; G105-Y108 VanDerWaalsContact O-N 3.09Å; Y108-R110 VanDerWaalsContact C-N 3.33Å; Y108-R110 PolarHBondContact O-N 2.86Å; Y108-K111 PolarHBondContact O-N 3.09Å; Y108-A112 WeakPolarHBondContact O-CB 3.34Å; Y108-A112 PolarHBondContact O-N 3.15Å; Y108-T127 HydrophobicContact CD1-CG2 4.04Å; Y108-T127 WeakPolarHBondContact O-CG2 3.38Å; Y108-E130 HydrophobicContact CD1-CB 4.33Å; Y108-E130 HydrophobicContact CE1-CB 3.99Å; Y108-E130 HydrophobicContact CE1-CG 3.8Å; Y108-E130 PolarHBondContact OH-OE1 3.44Å; Y108-G131 VanDerWaalsContact CG-CA 3.44Å; Y108-K134 HydrophobicContact CE2-CG 4.1Å
109	S	96.1	Very high	94.7	Very high	18 Å²	18	47.9 Å²	47.9	13%	0.126	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-40.8	174.4	-47.1	0	0	0	0	112.1	G105 K106 A113 L141	G105-S109 PolarHBondContact O-N 3.34Å; G105-S109 PolarHBondContact O-OG 3.25Å; G105-S109 VanDerWaalsContact O-OG 3.13Å; K106-S109 PolarHBondContact O-N 3.16Å; S109-A113 VanDerWaalsContact O-CB 3.29Å; S109-A113 WeakPolarHBondContact O-CB 3.5Å; S109-A113 PolarHBondContact O-N 2.94Å; S109-L141 WeakPolarHBondContact OG-CD2 3.43Å
110	R	97.1	Very high	94.4	Very high	74 Å²	74	45.4 Å²	45.4	28%	0.279	23%	0.23	S	C	.	.	H	α-helix	trans	-65.7	-44.1	176.8	-69.2	-61.4	-175.7	-145.8	0.6	112.2	S75 A79 A94 K106 G107 Y108 A113 A114	S75-R110 PolarHBondContact O-NE 2.81Å; S75-R110 VanDerWaalsContact O-NE 3.14Å; S75-R110 WeakPolarHBondContact OG-CG 3.24Å; A79-R110 VanDerWaalsContact CB-CZ 3.42Å; A94-R110 HydrophobicContact CB-CB 3.74Å; K106-R110 WeakPolarHBondContact O-CG 3.29Å; K106-R110 PolarHBondContact O-N 2.84Å; G107-R110 PolarHBondContact O-N 3.1Å; Y108-R110 VanDerWaalsContact C-N 3.33Å; Y108-R110 PolarHBondContact O-N 2.86Å; R110-A113 PolarHBondContact O-N 3.01Å; R110-A114 PolarHBondContact O-N 3.38Å
111	K	97.9	Very high	94.1	Very high	49 Å²	49	44 Å²	44	21%	0.213	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-45.9	179.5	177.9	179.7	170.8	-169.5	0	110.4	L91 A94 V95 I98 G107 Y108 A114 L115 T127	L91-K111 HydrophobicContact CD1-CG 3.75Å; A94-K111 VanDerWaalsContact CB-CA 3.48Å; A94-K111 HydrophobicContact CB-CB 3.79Å; V95-K111 HydrophobicContact CG2-CD 4.13Å; I98-K111 HydrophobicContact CD1-CB 3.82Å; I98-K111 HydrophobicContact CD1-CD 3.59Å; I98-K111 HydrophobicContact CD1-CG 4.33Å; G107-K111 PolarHBondContact O-N 3.25Å; Y108-K111 PolarHBondContact O-N 3.09Å; K111-A114 PolarHBondContact O-N 2.73Å; K111-L115 HydrophobicContact CG-CD1 4.05Å; K111-L115 VanDerWaalsContact O-CG 3.31Å; K111-L115 WeakPolarHBondContact O-CG 3.37Å; K111-L115 PolarHBondContact O-N 2.88Å; K111-T127 HydrophobicContact CB-CG2 3.89Å; K111-T127 HydrophobicContact CD-CG2 3.77Å; K111-T127 HydrophobicContact CG-CG2 3.83Å
112	A	96.8	Very high	93.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-47.6	177.3	0	0	0	0	0	111.4	Y108 A114 L115 E116 A124 T127 Y128	Y108-A112 WeakPolarHBondContact O-CB 3.34Å; Y108-A112 PolarHBondContact O-N 3.15Å; A112-A114 VanDerWaalsContact C-N 3.33Å; A112-A114 PolarHBondContact O-N 2.73Å; A112-L115 WeakPolarHBondContact O-CB 3.46Å; A112-L115 PolarHBondContact O-N 3.21Å; A112-L115 VanDerWaalsContact O-N 3.09Å; A112-E116 WeakPolarHBondContact O-CG 3.37Å; A112-E116 PolarHBondContact O-N 3.37Å; A112-A124 HydrophobicContact CB-CB 4.36Å; A112-T127 HydrophobicContact CB-CG2 4.05Å; A112-Y128 HydrophobicContact CB-CD1 4.02Å; A112-Y128 HydrophobicContact CB-CD2 3.77Å; A112-Y128 HydrophobicContact CB-CE1 3.67Å; A112-Y128 HydrophobicContact CB-CE2 3.4Å; A112-Y128 VanDerWaalsContact CB-CE2 3.4Å; A112-Y128 HydrophobicContact CB-CG 4.05Å
113	A	95.5	Very high	93.6	Very high	30 Å²	30	45.3 Å²	45.3	25%	0.248	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-41.9	177.1	0	0	0	0	0	112.9	S109 R110 E116 F117	S109-A113 VanDerWaalsContact O-CB 3.29Å; S109-A113 WeakPolarHBondContact O-CB 3.5Å; S109-A113 PolarHBondContact O-N 2.94Å; R110-A113 PolarHBondContact O-N 3.01Å; A113-E116 WeakPolarHBondContact O-CB 3.45Å; A113-E116 PolarHBondContact O-N 3.17Å; A113-F117 WeakPolarHBondContact O-CD2 3.39Å; A113-F117 PolarHBondContact O-N 3.36Å
114	A	97.1	Very high	93.8	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-42.1	175.5	0	0	0	0	0	112.1	A90 L91 R110 K111 A112 E116 F117 L118	A90-A114 HydrophobicContact CB-CB 4.12Å; L91-A114 HydrophobicContact CB-CB 3.91Å; L91-A114 HydrophobicContact CD1-CB 4.38Å; R110-A114 PolarHBondContact O-N 3.38Å; K111-A114 PolarHBondContact O-N 2.73Å; A112-A114 VanDerWaalsContact C-N 3.33Å; A112-A114 PolarHBondContact O-N 2.73Å; A114-E116 VanDerWaalsContact C-N 3.3Å; A114-E116 PolarHBondContact O-N 3.49Å; A114-F117 PolarHBondContact O-N 3.34Å; A114-L118 VanDerWaalsContact O-CG 3.3Å; A114-L118 WeakPolarHBondContact O-CG 3.5Å; A114-L118 PolarHBondContact O-N 3.09Å; A114-L118 VanDerWaalsContact O-N 3.11Å
115	L	96.4	Very high	93.8	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-35.6	175	-70.2	165.7	0	0	0	112.2	L91 K111 A112 L118 G119 R120 E123 A124	L91-L115 HydrophobicContact CD1-CD2 4.09Å; L91-L115 HydrophobicContact CD1-CG 3.94Å; L91-L115 HydrophobicContact CD2-CD2 3.92Å; K111-L115 HydrophobicContact CG-CD1 4.05Å; K111-L115 VanDerWaalsContact O-CG 3.31Å; K111-L115 WeakPolarHBondContact O-CG 3.37Å; K111-L115 PolarHBondContact O-N 2.88Å; A112-L115 WeakPolarHBondContact O-CB 3.46Å; A112-L115 PolarHBondContact O-N 3.21Å; A112-L115 VanDerWaalsContact O-N 3.09Å; L115-L118 CarbonylContact O-C 3.38Å; L115-L118 PolarHBondContact O-N 2.95Å; L115-G119 PolarHBondContact O-N 3.25Å; L115-R120 HydrophobicContact CB-CB 4.29Å; L115-R120 HydrophobicContact CD2-CB 3.93Å; L115-R120 PolarHBondContact O-N 2.88Å; L115-E123 HydrophobicContact CD1-CB 3.91Å; L115-E123 HydrophobicContact CD2-CB 4.19Å; L115-A124 HydrophobicContact CB-CB 3.94Å
116	E	93.6	Very high	94	Very high	39 Å²	39	45.5 Å²	45.5	18%	0.182	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-47	175.5	-71.6	-176.4	-123	0	0	112.3	A112 A113 A114 L118 G119 A124 Y128 I148 R151	A112-E116 WeakPolarHBondContact O-CG 3.37Å; A112-E116 PolarHBondContact O-N 3.37Å; A113-E116 WeakPolarHBondContact O-CB 3.45Å; A113-E116 PolarHBondContact O-N 3.17Å; A114-E116 VanDerWaalsContact C-N 3.3Å; A114-E116 PolarHBondContact O-N 3.49Å; E116-L118 VanDerWaalsContact C-N 3.26Å; E116-L118 PolarHBondContact O-N 3.34Å; E116-G119 PolarHBondContact O-N 3.45Å; E116-A124 HydrophobicContact CG-CB 3.85Å; E116-Y128 WeakPolarHBondContact OE1-CE2 3.47Å; E116-Y128 PolarHBondContact OE1-OH 2.83Å; E116-I148 HydrophobicContact CG-CD1 3.48Å; E116-I148 VanDerWaalsContact CG-CD1 3.48Å; E116-I148 HydrophobicContact CG-CG1 4.19Å; E116-R151 IonicContact OE2-NH1 3.67Å; E116-R151 PolarHBondContact OE2-NH1 3Å; E116-R151 VanDerWaalsContact OE2-NH1 3.12Å
117	F	91.7	Very high	94.1	Very high	124 Å²	124	41.8 Å²	41.8	54%	0.544	21%	0.207	S	C	.	.	H	α-helix	trans	-67.9	-26.6	177.1	-74.2	-66.1	0	0	0	113	Y87 A113 A114 G119	Y87-F117 HydrophobicContact CD1-CB 3.34Å; Y87-F117 HydrophobicContact CD1-CD2 4Å; Y87-F117 AromaticContact CD1-CG 3.76Å; Y87-F117 HydrophobicContact CD1-CG 3.76Å; Y87-F117 HydrophobicContact CD2-CB 3.85Å; Y87-F117 HydrophobicContact CE1-CB 3.4Å; Y87-F117 VanDerWaalsContact CE1-CB 3.4Å; Y87-F117 AromaticContact CE1-CD1 3.84Å; Y87-F117 HydrophobicContact CE1-CD1 3.84Å; Y87-F117 AromaticContact CE1-CD2 3.8Å; Y87-F117 HydrophobicContact CE1-CD2 3.8Å; Y87-F117 AromaticContact CE1-CG 3.41Å; Y87-F117 HydrophobicContact CE1-CG 3.41Å; Y87-F117 VanDerWaalsContact CE1-CG 3.41Å; Y87-F117 HydrophobicContact CE2-CB 3.91Å; Y87-F117 HydrophobicContact CG-CB 3.56Å; Y87-F117 HydrophobicContact CG-CG 4.45Å; Y87-F117 AromaticContact CZ-CD1 3.88Å; Y87-F117 AromaticContact CZ-CG 3.84Å; A113-F117 WeakPolarHBondContact O-CD2 3.39Å; A113-F117 PolarHBondContact O-N 3.36Å; A114-F117 PolarHBondContact O-N 3.34Å; F117-G119 PolarHBondContact O-N 3.35Å
118	L	92.1	Very high	94.2	Very high	46 Å²	46	42.4 Å²	42.4	24%	0.241	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-1.5	171.2	-68.3	169.3	0	0	0	113.5	E88 L91 A114 L115 E116 R120	E88-L118 HydrophobicContact CG-CD2 4.43Å; E88-L118 WeakPolarHBondContact OE1-CD2 3.33Å; L91-L118 HydrophobicContact CB-CD1 4.46Å; L91-L118 HydrophobicContact CD2-CD1 3.9Å; A114-L118 VanDerWaalsContact O-CG 3.3Å; A114-L118 WeakPolarHBondContact O-CG 3.5Å; A114-L118 PolarHBondContact O-N 3.09Å; A114-L118 VanDerWaalsContact O-N 3.11Å; L115-L118 CarbonylContact O-C 3.38Å; L115-L118 PolarHBondContact O-N 2.95Å; E116-L118 VanDerWaalsContact C-N 3.26Å; E116-L118 PolarHBondContact O-N 3.34Å; L118-R120 HydrophobicContact CB-CG 4.27Å; L118-R120 PolarHBondContact O-N 3.4Å
119	G	87.8	Confident	94.1	Very high	52 Å²	52	44.3 Å²	44.3	54%	0.536	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	7.5	-177.7	0	0	0	0	0	114.8	L115 E116 F117 L121	L115-G119 PolarHBondContact O-N 3.25Å; E116-G119 PolarHBondContact O-N 3.45Å; F117-G119 PolarHBondContact O-N 3.35Å; G119-L121 PolarHBondContact O-N 3.45Å
120	R	91.9	Very high	94.1	Very high	104 Å²	104	47.1 Å²	47.1	39%	0.392	23%	0.229	S	C	.	.			trans	-86.1	57.8	-179.3	-64.8	167.9	66.8	175.7	1.7	110.7	L115 L118 E122 E123 A124	L115-R120 HydrophobicContact CB-CB 4.29Å; L115-R120 HydrophobicContact CD2-CB 3.93Å; L115-R120 PolarHBondContact O-N 2.88Å; L118-R120 HydrophobicContact CB-CG 4.27Å; L118-R120 PolarHBondContact O-N 3.4Å; R120-E122 VanDerWaalsContact C-N 3.32Å; R120-E122 PolarHBondContact O-N 3.14Å; R120-E123 HydrophobicContact CB-CB 4.46Å; R120-E123 IonicContact CZ-OE1 3.65Å; R120-E123 VanDerWaalsContact CZ-OE1 3.23Å; R120-E123 IonicContact CZ-OE2 2.63Å; R120-E123 IonicContact NE-OE1 2.89Å; R120-E123 PolarHBondContact NE-OE1 3.41Å; R120-E123 IonicContact NE-OE2 3.41Å; R120-E123 IonicContact NH2-OE1 2.82Å; R120-E123 PolarHBondContact NH2-OE1 2.84Å; R120-E123 IonicContact NH2-OE2 3.15Å; R120-E123 PolarHBondContact NH2-OE2 3.46Å; R120-E123 PolarHBondContact O-N 3.14Å; R120-A124 PolarHBondContact O-N 2.98Å; R120-A124 VanDerWaalsContact O-N 3.08Å
121	L	88.3	Confident	94	Very high	22 Å²	22	43.6 Å²	43.6	12%	0.115	22%	0.216	C	C	.	.	H	α-helix	trans	-61.3	-35.5	-168.9	-59.2	-177.7	0	0	0	113.9	G119 A124 R125 I148 L152	G119-L121 PolarHBondContact O-N 3.45Å; L121-A124 WeakPolarHBondContact O-CB 3.46Å; L121-A124 PolarHBondContact O-N 3.25Å; L121-R125 PolarHBondContact O-N 2.88Å; L121-I148 HydrophobicContact CD2-CD1 3.84Å; L121-L152 HydrophobicContact CB-CD2 3.84Å; L121-L152 HydrophobicContact CB-CG 4.33Å; L121-L152 HydrophobicContact CD1-CD2 4.35Å
122	E	87.6	Confident	93.9	Very high	73 Å²	73	42.6 Å²	42.6	34%	0.341	21%	0.213	S	C	.	.	H	α-helix	trans	-68.6	-40.5	-179.7	-165.8	56.3	-144	0	0	111.5	R120 A124 R125 M126 L152	R120-E122 VanDerWaalsContact C-N 3.32Å; R120-E122 PolarHBondContact O-N 3.14Å; E122-A124 VanDerWaalsContact C-N 3.3Å; E122-A124 PolarHBondContact O-N 2.96Å; E122-R125 WeakPolarHBondContact O-CB 3.47Å; E122-R125 PolarHBondContact O-N 3.04Å; E122-R125 IonicContact OE1-CZ 2.62Å; E122-R125 IonicContact OE1-NE 2.61Å; E122-R125 PolarHBondContact OE1-NE 3.4Å; E122-R125 IonicContact OE1-NH2 3.72Å; E122-R125 PolarHBondContact OE1-NH2 3.07Å; E122-R125 IonicContact OE2-NE 2.79Å; E122-M126 WeakPolarHBondContact O-CG 3.36Å; E122-M126 PolarHBondContact O-N 3.19Å; E122-L152 WeakPolarHBondContact OE2-CD1 3.41Å
123	E	92.6	Very high	93.8	Very high	86 Å²	86	51.6 Å²	51.6	40%	0.402	25%	0.247	S	C	.	.	H	α-helix	trans	-68.1	-33.1	174.7	-63.8	-178.2	-105.2	0	0	111.6	L115 R120 T127	L115-E123 HydrophobicContact CD1-CB 3.91Å; L115-E123 HydrophobicContact CD2-CB 4.19Å; R120-E123 HydrophobicContact CB-CB 4.46Å; R120-E123 IonicContact CZ-OE1 3.65Å; R120-E123 VanDerWaalsContact CZ-OE1 3.23Å; R120-E123 IonicContact CZ-OE2 2.63Å; R120-E123 IonicContact NE-OE1 2.89Å; R120-E123 PolarHBondContact NE-OE1 3.41Å; R120-E123 IonicContact NE-OE2 3.41Å; R120-E123 IonicContact NH2-OE1 2.82Å; R120-E123 PolarHBondContact NH2-OE1 2.84Å; R120-E123 IonicContact NH2-OE2 3.15Å; R120-E123 PolarHBondContact NH2-OE2 3.46Å; R120-E123 PolarHBondContact O-N 3.14Å; E123-T127 WeakPolarHBondContact O-CB 3.49Å; E123-T127 PolarHBondContact O-N 3.37Å; E123-T127 PolarHBondContact O-OG1 3.02Å
124	A	95.3	Very high	93.6	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-45.3	171.2	0	0	0	0	0	111.2	A112 L115 E116 R120 L121 E122 M126 T127 Y128 I148	A112-A124 HydrophobicContact CB-CB 4.36Å; L115-A124 HydrophobicContact CB-CB 3.94Å; E116-A124 HydrophobicContact CG-CB 3.85Å; R120-A124 PolarHBondContact O-N 2.98Å; R120-A124 VanDerWaalsContact O-N 3.08Å; L121-A124 WeakPolarHBondContact O-CB 3.46Å; L121-A124 PolarHBondContact O-N 3.25Å; E122-A124 VanDerWaalsContact C-N 3.3Å; E122-A124 PolarHBondContact O-N 2.96Å; A124-M126 PolarHBondContact O-N 3.47Å; A124-T127 WeakPolarHBondContact O-CB 3.12Å; A124-T127 PolarHBondContact O-N 3.37Å; A124-Y128 VanDerWaalsContact O-CD2 3.22Å; A124-Y128 WeakPolarHBondContact O-CD2 3.22Å; A124-Y128 PolarHBondContact O-N 2.93Å; A124-I148 HydrophobicContact CB-CD1 4.39Å
125	R	94.9	Very high	93.5	Very high	64 Å²	64	58.7 Å²	58.7	24%	0.242	27%	0.273	C	S	.	.	H	α-helix	trans	-55.3	-51.4	175	-169.8	-176	69.1	99.7	2.5	111.3	L121 E122 T127 Y128 Q129 L145 I148 E149 L152	L121-R125 PolarHBondContact O-N 2.88Å; E122-R125 WeakPolarHBondContact O-CB 3.47Å; E122-R125 PolarHBondContact O-N 3.04Å; E122-R125 IonicContact OE1-CZ 2.62Å; E122-R125 IonicContact OE1-NE 2.61Å; E122-R125 PolarHBondContact OE1-NE 3.4Å; E122-R125 IonicContact OE1-NH2 3.72Å; E122-R125 PolarHBondContact OE1-NH2 3.07Å; E122-R125 IonicContact OE2-NE 2.79Å; R125-T127 VanDerWaalsContact C-N 3.29Å; R125-T127 PolarHBondContact O-N 3.36Å; R125-Y128 PolarHBondContact O-N 3.3Å; R125-Q129 WeakPolarHBondContact O-CG 3.49Å; R125-Q129 PolarHBondContact O-N 3.18Å; R125-L145 HydrophobicContact CG-CD1 3.65Å; R125-I148 HydrophobicContact CB-CG2 3.68Å; R125-I148 HydrophobicContact CG-CG2 4.25Å; R125-E149 HydrophobicContact CG-CG 4.39Å; R125-L152 HydrophobicContact CB-CD1 4.16Å; R125-L152 HydrophobicContact CG-CD1 4.41Å
126	M	95.1	Very high	93.3	Very high	86 Å²	86	62.4 Å²	62.4	42%	0.424	30%	0.297	S	S	.	.	H	α-helix	trans	-61.9	-38.6	178.9	-66.1	-55.4	-61.8	0	0	111.9	E122 A124 Q129 E130	E122-M126 WeakPolarHBondContact O-CG 3.36Å; E122-M126 PolarHBondContact O-N 3.19Å; A124-M126 PolarHBondContact O-N 3.47Å; M126-Q129 PolarHBondContact O-N 3.46Å; M126-E130 WeakPolarHBondContact O-CB 3.19Å; M126-E130 PolarHBondContact O-N 2.88Å
127	T	96.3	Very high	93.1	Very high	5 Å²	5	67.5 Å²	67.5	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-64.8	-42	177.3	-60.7	0	0	0	0	111.9	Y108 K111 A112 E123 A124 R125 E130 G131	Y108-T127 HydrophobicContact CD1-CG2 4.04Å; Y108-T127 WeakPolarHBondContact O-CG2 3.38Å; K111-T127 HydrophobicContact CB-CG2 3.89Å; K111-T127 HydrophobicContact CD-CG2 3.77Å; K111-T127 HydrophobicContact CG-CG2 3.83Å; A112-T127 HydrophobicContact CB-CG2 4.05Å; E123-T127 WeakPolarHBondContact O-CB 3.49Å; E123-T127 PolarHBondContact O-N 3.37Å; E123-T127 PolarHBondContact O-OG1 3.02Å; A124-T127 WeakPolarHBondContact O-CB 3.12Å; A124-T127 PolarHBondContact O-N 3.37Å; R125-T127 VanDerWaalsContact C-N 3.29Å; R125-T127 PolarHBondContact O-N 3.36Å; T127-E130 PolarHBondContact O-N 3.03Å; T127-G131 PolarHBondContact O-N 3.33Å
128	Y	96.6	Very high	93.1	Very high	12 Å²	12	63.3 Å²	63.3	5%	0.047	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-42.8	174.6	-76.9	-61.4	0	0	0	111.9	A112 E116 A124 R125 E130 G131 L132 L141 L145 I148	A112-Y128 HydrophobicContact CB-CD1 4.02Å; A112-Y128 HydrophobicContact CB-CD2 3.77Å; A112-Y128 HydrophobicContact CB-CE1 3.67Å; A112-Y128 HydrophobicContact CB-CE2 3.4Å; A112-Y128 VanDerWaalsContact CB-CE2 3.4Å; A112-Y128 HydrophobicContact CB-CG 4.05Å; E116-Y128 WeakPolarHBondContact OE1-CE2 3.47Å; E116-Y128 PolarHBondContact OE1-OH 2.83Å; A124-Y128 VanDerWaalsContact O-CD2 3.22Å; A124-Y128 WeakPolarHBondContact O-CD2 3.22Å; A124-Y128 PolarHBondContact O-N 2.93Å; R125-Y128 PolarHBondContact O-N 3.3Å; Y128-E130 PolarHBondContact O-N 3.4Å; Y128-G131 PolarHBondContact O-N 2.86Å; Y128-L132 WeakPolarHBondContact O-CG 3.47Å; Y128-L132 PolarHBondContact O-N 2.68Å; Y128-L141 HydrophobicContact CD1-CB 4.44Å; Y128-L141 HydrophobicContact CD1-CD2 3.66Å; Y128-L141 HydrophobicContact CE1-CD2 4.07Å; Y128-L145 HydrophobicContact CG-CB 4.39Å; Y128-I148 HydrophobicContact CD2-CG1 4.26Å; Y128-I148 HydrophobicContact CE2-CG1 3.86Å
129	Q	96.1	Very high	93	Very high	43 Å²	43	66.3 Å²	66.3	20%	0.201	32%	0.322	C	S	.	.	H	α-helix	trans	-62.2	-41.9	176.1	-70.8	177.9	-9.3	0	0	112.2	R125 M126 L132 R133 L145	R125-Q129 WeakPolarHBondContact O-CG 3.49Å; R125-Q129 PolarHBondContact O-N 3.18Å; M126-Q129 PolarHBondContact O-N 3.46Å; Q129-L132 PolarHBondContact O-N 3.47Å; Q129-R133 WeakPolarHBondContact O-CG 3.49Å; Q129-R133 PolarHBondContact O-N 3.18Å; Q129-L145 HydrophobicContact CG-CD1 3.92Å; Q129-L145 HydrophobicContact CG-CD2 3.93Å
130	E	95.4	Very high	93.1	Very high	77 Å²	77	69.3 Å²	69.3	36%	0.36	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-45.3	175.5	-163.9	-168.9	153.5	0	0	111.3	Y108 M126 T127 Y128 L132 R133 K134	Y108-E130 HydrophobicContact CD1-CB 4.33Å; Y108-E130 HydrophobicContact CE1-CB 3.99Å; Y108-E130 HydrophobicContact CE1-CG 3.8Å; Y108-E130 PolarHBondContact OH-OE1 3.44Å; M126-E130 WeakPolarHBondContact O-CB 3.19Å; M126-E130 PolarHBondContact O-N 2.88Å; T127-E130 PolarHBondContact O-N 3.03Å; Y128-E130 PolarHBondContact O-N 3.4Å; E130-L132 VanDerWaalsContact C-N 3.33Å; E130-L132 PolarHBondContact O-N 2.8Å; E130-R133 WeakPolarHBondContact O-CB 3.36Å; E130-R133 PolarHBondContact O-N 2.98Å; E130-R133 VanDerWaalsContact O-N 3.15Å; E130-K134 PolarHBondContact O-N 3.44Å
131	G	95.1	Very high	93.2	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60	-40.7	175.2	0	0	0	0	0	112.7	Y108 T127 Y128 R133 K134 E135	Y108-G131 VanDerWaalsContact CG-CA 3.44Å; T127-G131 PolarHBondContact O-N 3.33Å; Y128-G131 PolarHBondContact O-N 2.86Å; G131-R133 VanDerWaalsContact C-N 3.31Å; G131-R133 PolarHBondContact O-N 3.07Å; G131-K134 WeakPolarHBondContact O-CA 3.26Å; G131-K134 WeakPolarHBondContact O-CB 3.39Å; G131-K134 PolarHBondContact O-N 3.39Å; G131-E135 PolarHBondContact O-N 2.95Å
132	L	94.9	Very high	93.4	Very high	29 Å²	29	67.4 Å²	67.4	15%	0.152	32%	0.316	C	S	.	.	H	α-helix	trans	-68.9	-26.3	176.5	-74	169.5	0	0	0	113.3	Y128 Q129 E130 K134 E135 P136 L141 K142 L145	Y128-L132 WeakPolarHBondContact O-CG 3.47Å; Y128-L132 PolarHBondContact O-N 2.68Å; Q129-L132 PolarHBondContact O-N 3.47Å; E130-L132 VanDerWaalsContact C-N 3.33Å; E130-L132 PolarHBondContact O-N 2.8Å; L132-K134 PolarHBondContact O-N 3.01Å; L132-E135 CarbonylContact O-C 3.23Å; L132-P136 WeakPolarHBondContact O-CA 3.41Å; L132-P136 WeakPolarHBondContact O-CD 3.24Å; L132-P136 WeakPolarHBondContact O-CG 3.29Å; L132-P136 VanDerWaalsContact O-N 3.1Å; L132-L141 HydrophobicContact CD2-CB 3.62Å; L132-L141 HydrophobicContact CG-CB 3.81Å; L132-K142 HydrophobicContact CD1-CG 4.39Å; L132-K142 HydrophobicContact CD2-CG 3.66Å; L132-L145 HydrophobicContact CD1-CB 4.35Å; L132-L145 HydrophobicContact CD1-CD2 3.69Å
133	R	94.9	Very high	93.6	Very high	189 Å²	189	67.8 Å²	67.8	71%	0.713	32%	0.317	S	S	*	.	H	α-helix	trans	-67.1	-27	169.6	-70.7	174.4	-176.4	157	1.6	112	Q129 E130 G131	Q129-R133 WeakPolarHBondContact O-CG 3.49Å; Q129-R133 PolarHBondContact O-N 3.18Å; E130-R133 WeakPolarHBondContact O-CB 3.36Å; E130-R133 PolarHBondContact O-N 2.98Å; E130-R133 VanDerWaalsContact O-N 3.15Å; G131-R133 VanDerWaalsContact C-N 3.31Å; G131-R133 PolarHBondContact O-N 3.07Å
134	K	92.8	Very high	93.5	Very high	114 Å²	114	63.9 Å²	63.9	50%	0.496	30%	0.301	S	S	.	.	H	α-helix	trans	-85.8	-44.8	176.6	-58.4	-63.4	-173.8	179.8	0	112	P102 Y108 E130 G131 L132	P102-K134 WeakPolarHBondContact O-CG 3.45Å; Y108-K134 HydrophobicContact CE2-CG 4.1Å; E130-K134 PolarHBondContact O-N 3.44Å; G131-K134 WeakPolarHBondContact O-CA 3.26Å; G131-K134 WeakPolarHBondContact O-CB 3.39Å; G131-K134 PolarHBondContact O-N 3.39Å; L132-K134 PolarHBondContact O-N 3.01Å
135	E	94.1	Very high	93.4	Very high	65 Å²	65	65 Å²	65	30%	0.304	31%	0.306	S	S	.	.			trans	-126.1	83.1	176.6	-64.9	-170.3	126.8	0	0	111.6	G105 G131 L132 N137 N138	G105-E135 WeakPolarHBondContact CA-OE2 3.28Å; G105-E135 PolarHBondContact N-OE2 3.08Å; G131-E135 PolarHBondContact O-N 2.95Å; L132-E135 CarbonylContact O-C 3.23Å; E135-N137 PolarHBondContact O-N 3.47Å; E135-N137 VanDerWaalsContact O-N 3.07Å; E135-N138 HydrophobicContact CB-CB 3.8Å; E135-N138 WeakPolarHBondContact O-CB 3.47Å; E135-N138 PolarHBondContact O-N 3.3Å; E135-N138 VanDerWaalsContact O-N 3.08Å; E135-N138 PolarHBondContact OE2-ND2 2.72Å
136	P	91.4	Very high	93.1	Very high	80 Å²	80	68.1 Å²	68.1	52%	0.519	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.2	-175.3	-25.3	34.2	0	0	0	115	L132 K142	L132-P136 WeakPolarHBondContact O-CA 3.41Å; L132-P136 WeakPolarHBondContact O-CD 3.24Å; L132-P136 WeakPolarHBondContact O-CG 3.29Å; L132-P136 VanDerWaalsContact O-N 3.1Å; P136-K142 WeakPolarHBondContact O-CE 3.33Å; P136-K142 PolarHBondContact O-NZ 3.27Å; P136-K142 VanDerWaalsContact O-NZ 3.15Å
137	N	90.4	Very high	92.7	Very high	146 Å²	146	68.8 Å²	68.8	78%	0.781	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	6.1	-178.4	-66.2	-25.6	0	0	0	113.4	E135 Q139	E135-N137 PolarHBondContact O-N 3.47Å; E135-N137 VanDerWaalsContact O-N 3.07Å; N137-Q139 PolarHBondContact O-N 2.82Å; N137-Q139 VanDerWaalsContact O-N 3.14Å
138	N	91.3	Very high	92.4	Very high	37 Å²	37	68.5 Å²	68.5	20%	0.198	33%	0.327	C	S	.	.			trans	-74.6	105.3	-179.7	-170.9	-43.8	0	0	0	111.2	E135 Q140 L141 K142	E135-N138 HydrophobicContact CB-CB 3.8Å; E135-N138 WeakPolarHBondContact O-CB 3.47Å; E135-N138 PolarHBondContact O-N 3.3Å; E135-N138 VanDerWaalsContact O-N 3.08Å; E135-N138 PolarHBondContact OE2-ND2 2.72Å; N138-Q140 VanDerWaalsContact C-N 3.35Å; N138-Q140 PolarHBondContact O-N 2.63Å; N138-Q140 WeakPolarHBondContact OD1-CB 3.49Å; N138-Q140 PolarHBondContact OD1-N 2.95Å; N138-Q140 VanDerWaalsContact OD1-N 3.16Å; N138-L141 HydrophobicContact CB-CB 4.29Å; N138-L141 HydrophobicContact CB-CD1 3.97Å; N138-L141 HydrophobicContact CB-CG 4.18Å; N138-L141 PolarHBondContact O-N 3.15Å; N138-L141 PolarHBondContact OD1-N 3.27Å; N138-K142 PolarHBondContact O-N 3.08Å
139	Q	91.2	Very high	91.9	Very high	109 Å²	109	72 Å²	72	51%	0.509	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-39.6	-176.7	-174	61.5	18	0	0	113	N137 L141 K142 E143	N137-Q139 PolarHBondContact O-N 2.82Å; N137-Q139 VanDerWaalsContact O-N 3.14Å; Q139-L141 VanDerWaalsContact C-N 3.29Å; Q139-L141 PolarHBondContact O-N 3.5Å; Q139-K142 PolarHBondContact O-N 3.49Å; Q139-K142 VanDerWaalsContact O-N 3.16Å; Q139-E143 WeakPolarHBondContact CG-OE1 3.37Å; Q139-E143 PolarHBondContact NE2-OE1 2.88Å; Q139-E143 WeakPolarHBondContact O-CG 3.44Å; Q139-E143 PolarHBondContact O-N 3.39Å
140	Q	89.6	Confident	91	Very high	114 Å²	114	72.8 Å²	72.8	53%	0.533	36%	0.357	S	S	.	.	H	α-helix	trans	-61.5	-37.6	179.4	-178.3	65.1	63	0	0	112.1	N138 G144	N138-Q140 VanDerWaalsContact C-N 3.35Å; N138-Q140 PolarHBondContact O-N 2.63Å; N138-Q140 WeakPolarHBondContact OD1-CB 3.49Å; N138-Q140 PolarHBondContact OD1-N 2.95Å; N138-Q140 VanDerWaalsContact OD1-N 3.16Å; Q140-G144 PolarHBondContact O-N 2.89Å
141	L	93	Very high	90.2	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-73.2	-35.9	176.9	-67	178.8	0	0	0	112.1	S109 Y128 L132 N138 Q139 L145	S109-L141 WeakPolarHBondContact OG-CD2 3.43Å; Y128-L141 HydrophobicContact CD1-CB 4.44Å; Y128-L141 HydrophobicContact CD1-CD2 3.66Å; Y128-L141 HydrophobicContact CE1-CD2 4.07Å; L132-L141 HydrophobicContact CD2-CB 3.62Å; L132-L141 HydrophobicContact CG-CB 3.81Å; N138-L141 HydrophobicContact CB-CB 4.29Å; N138-L141 HydrophobicContact CB-CD1 3.97Å; N138-L141 HydrophobicContact CB-CG 4.18Å; N138-L141 PolarHBondContact O-N 3.15Å; N138-L141 PolarHBondContact OD1-N 3.27Å; Q139-L141 VanDerWaalsContact C-N 3.29Å; Q139-L141 PolarHBondContact O-N 3.5Å; L141-L145 WeakPolarHBondContact O-CB 3.42Å; L141-L145 PolarHBondContact O-N 3.48Å
142	K	93.4	Very high	89.4	Confident	87 Å²	87	76 Å²	76	38%	0.378	37%	0.369	S	S	.	.	H	α-helix	trans	-63.2	-47.6	175	-68.9	-178.3	-177.6	175.2	0	111.4	L132 P136 N138 Q139 L145 Q146	L132-K142 HydrophobicContact CD1-CG 4.39Å; L132-K142 HydrophobicContact CD2-CG 3.66Å; P136-K142 WeakPolarHBondContact O-CE 3.33Å; P136-K142 PolarHBondContact O-NZ 3.27Å; P136-K142 VanDerWaalsContact O-NZ 3.15Å; N138-K142 PolarHBondContact O-N 3.08Å; Q139-K142 PolarHBondContact O-N 3.49Å; Q139-K142 VanDerWaalsContact O-N 3.16Å; K142-L145 PolarHBondContact O-N 2.89Å; K142-Q146 WeakPolarHBondContact O-CB 3.28Å; K142-Q146 PolarHBondContact O-N 3.19Å
143	E	90.9	Very high	88.2	Confident	80 Å²	80	76.8 Å²	76.8	37%	0.374	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-42.9	177.8	-71	171.7	-171.3	0	0	111.6	Q139 L145 Q146 N147	Q139-E143 WeakPolarHBondContact CG-OE1 3.37Å; Q139-E143 PolarHBondContact NE2-OE1 2.88Å; Q139-E143 WeakPolarHBondContact O-CG 3.44Å; Q139-E143 PolarHBondContact O-N 3.39Å; E143-L145 PolarHBondContact O-N 2.87Å; E143-Q146 PolarHBondContact O-N 3.42Å; E143-N147 WeakPolarHBondContact O-CB 3.39Å; E143-N147 VanDerWaalsContact O-CG 3.25Å; E143-N147 PolarHBondContact O-N 3.04Å; E143-N147 PolarHBondContact O-ND2 3.47Å
144	G	90.1	Very high	86.8	Confident	5 Å²	5	73.1 Å²	73.1	5%	0.052	37%	0.371	C	S	.	.	H	α-helix	trans	-59.8	-44.7	174.9	0	0	0	0	0	112.8	Q140 N147 I148	Q140-G144 PolarHBondContact O-N 2.89Å; G144-N147 PolarHBondContact O-N 2.86Å; G144-I148 PolarHBondContact O-N 3.19Å; G144-I148 VanDerWaalsContact O-N 3.07Å
145	L	93.5	Very high	85.4	Confident	22 Å²	22	74.3 Å²	74.3	12%	0.115	38%	0.376	C	S	.	.	H	α-helix	trans	-61.7	-48.6	175.8	-178.1	57.8	0	0	0	111.5	R125 Y128 Q129 L132 L141 K142 E143 N147 I148 E149	R125-L145 HydrophobicContact CG-CD1 3.65Å; Y128-L145 HydrophobicContact CG-CB 4.39Å; Q129-L145 HydrophobicContact CG-CD1 3.92Å; Q129-L145 HydrophobicContact CG-CD2 3.93Å; L132-L145 HydrophobicContact CD1-CB 4.35Å; L132-L145 HydrophobicContact CD1-CD2 3.69Å; L141-L145 WeakPolarHBondContact O-CB 3.42Å; L141-L145 PolarHBondContact O-N 3.48Å; K142-L145 PolarHBondContact O-N 2.89Å; E143-L145 PolarHBondContact O-N 2.87Å; L145-N147 VanDerWaalsContact C-N 3.32Å; L145-N147 PolarHBondContact O-N 3.42Å; L145-I148 PolarHBondContact O-N 3.4Å; L145-E149 HydrophobicContact CD1-CG 4.06Å; L145-E149 HydrophobicContact CG-CG 4.35Å; L145-E149 WeakPolarHBondContact O-CB 3.46Å; L145-E149 WeakPolarHBondContact O-CG 3.39Å; L145-E149 PolarHBondContact O-N 3.29Å
146	Q	89.7	Confident	83.8	Confident	131 Å²	131	73.2 Å²	73.2	61%	0.612	38%	0.375	S	S	*	.	H	α-helix	trans	-59.9	-42.5	180	-174	179.7	10.9	0	0	111.9	K142 E143 I148 E149 A150	K142-Q146 WeakPolarHBondContact O-CB 3.28Å; K142-Q146 PolarHBondContact O-N 3.19Å; E143-Q146 PolarHBondContact O-N 3.42Å; Q146-I148 VanDerWaalsContact C-N 3.34Å; Q146-I148 PolarHBondContact O-N 2.86Å; Q146-E149 PolarHBondContact O-N 3.01Å; Q146-A150 WeakPolarHBondContact O-CB 3.48Å; Q146-A150 PolarHBondContact O-N 3.46Å
147	N	86.9	Confident	82.2	Confident	99 Å²	99	76.2 Å²	76.2	53%	0.529	38%	0.384	S	S	.	.	H	α-helix	trans	-63.2	-40.9	176.9	-74.3	-21.6	0	0	0	111.8	E143 G144 L145 R151	E143-N147 WeakPolarHBondContact O-CB 3.39Å; E143-N147 VanDerWaalsContact O-CG 3.25Å; E143-N147 PolarHBondContact O-N 3.04Å; E143-N147 PolarHBondContact O-ND2 3.47Å; G144-N147 PolarHBondContact O-N 2.86Å; L145-N147 VanDerWaalsContact C-N 3.32Å; L145-N147 PolarHBondContact O-N 3.42Å; N147-R151 VanDerWaalsContact O-CG 3.3Å; N147-R151 WeakPolarHBondContact O-CG 3.49Å; N147-R151 PolarHBondContact O-N 2.82Å
148	I	89.9	Confident	81.1	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-69.8	-41.3	177.5	-75.1	-68.5	0	0	0	112	E116 L121 A124 R125 Y128 G144 L145 Q146 A150 R151 L152	E116-I148 HydrophobicContact CG-CD1 3.48Å; E116-I148 VanDerWaalsContact CG-CD1 3.48Å; E116-I148 HydrophobicContact CG-CG1 4.19Å; L121-I148 HydrophobicContact CD2-CD1 3.84Å; A124-I148 HydrophobicContact CB-CD1 4.39Å; R125-I148 HydrophobicContact CB-CG2 3.68Å; R125-I148 HydrophobicContact CG-CG2 4.25Å; Y128-I148 HydrophobicContact CD2-CG1 4.26Å; Y128-I148 HydrophobicContact CE2-CG1 3.86Å; G144-I148 PolarHBondContact O-N 3.19Å; G144-I148 VanDerWaalsContact O-N 3.07Å; L145-I148 PolarHBondContact O-N 3.4Å; Q146-I148 VanDerWaalsContact C-N 3.34Å; Q146-I148 PolarHBondContact O-N 2.86Å; I148-A150 VanDerWaalsContact C-N 3.32Å; I148-A150 PolarHBondContact O-N 3.26Å; I148-R151 PolarHBondContact O-N 2.62Å; I148-L152 HydrophobicContact CG2-CD1 3.68Å; I148-L152 HydrophobicContact CG2-CG 4.29Å; I148-L152 WeakPolarHBondContact O-CB 3.45Å; I148-L152 WeakPolarHBondContact O-CG 3.29Å; I148-L152 PolarHBondContact O-N 2.93Å
149	E	84.8	Confident	80.4	Confident	86 Å²	86	75.4 Å²	75.4	40%	0.402	38%	0.377	S	S	.	.	H	α-helix	trans	-62.6	-39.5	175.5	-73.5	179	165.4	0	0	111.6	R125 L145 Q146 L152 A153	R125-E149 HydrophobicContact CG-CG 4.39Å; L145-E149 HydrophobicContact CD1-CG 4.06Å; L145-E149 HydrophobicContact CG-CG 4.35Å; L145-E149 WeakPolarHBondContact O-CB 3.46Å; L145-E149 WeakPolarHBondContact O-CG 3.39Å; L145-E149 PolarHBondContact O-N 3.29Å; Q146-E149 PolarHBondContact O-N 3.01Å; E149-L152 PolarHBondContact O-N 3.3Å; E149-A153 WeakPolarHBondContact O-CB 3.26Å; E149-A153 PolarHBondContact O-N 2.89Å
150	A	77.1	Confident	79.8	Confident	58 Å²	58	70.8 Å²	70.8	48%	0.479	36%	0.356	S	S	.	.	H	α-helix	trans	-63	-44.3	173.8	0	0	0	0	0	112.3	Q146 I148 A153 E154	Q146-A150 WeakPolarHBondContact O-CB 3.48Å; Q146-A150 PolarHBondContact O-N 3.46Å; I148-A150 VanDerWaalsContact C-N 3.32Å; I148-A150 PolarHBondContact O-N 3.26Å; A150-A153 PolarHBondContact O-N 3.5Å; A150-E154 WeakPolarHBondContact O-CB 3.37Å; A150-E154 PolarHBondContact O-N 3.32Å
151	R	78.6	Confident	79.7	Confident	108 Å²	108	65.4 Å²	65.4	41%	0.408	33%	0.331	S	S	.	.	H	α-helix	trans	-67.1	-38.2	177.9	-71.5	171.6	68.9	-170.3	2.4	112.6	E116 N147 I148 K155	E116-R151 IonicContact OE2-NH1 3.67Å; E116-R151 PolarHBondContact OE2-NH1 3Å; E116-R151 VanDerWaalsContact OE2-NH1 3.12Å; N147-R151 VanDerWaalsContact O-CG 3.3Å; N147-R151 WeakPolarHBondContact O-CG 3.49Å; N147-R151 PolarHBondContact O-N 2.82Å; I148-R151 PolarHBondContact O-N 2.62Å; R151-K155 WeakPolarHBondContact O-CB 3.32Å; R151-K155 PolarHBondContact O-N 3.16Å
152	L	78.1	Confident	79	Confident	36 Å²	36	67.7 Å²	67.7	19%	0.188	35%	0.35	C	S	.	.	H	α-helix	trans	-68.4	-39.2	174.3	-73.9	169.2	0	0	0	111.2	L121 E122 R125 I148 E149 K155 S156	L121-L152 HydrophobicContact CB-CD2 3.84Å; L121-L152 HydrophobicContact CB-CG 4.33Å; L121-L152 HydrophobicContact CD1-CD2 4.35Å; E122-L152 WeakPolarHBondContact OE2-CD1 3.41Å; R125-L152 HydrophobicContact CB-CD1 4.16Å; R125-L152 HydrophobicContact CG-CD1 4.41Å; I148-L152 HydrophobicContact CG2-CD1 3.68Å; I148-L152 HydrophobicContact CG2-CG 4.29Å; I148-L152 WeakPolarHBondContact O-CB 3.45Å; I148-L152 WeakPolarHBondContact O-CG 3.29Å; I148-L152 PolarHBondContact O-N 2.93Å; E149-L152 PolarHBondContact O-N 3.3Å; L152-K155 PolarHBondContact O-N 2.96Å; L152-S156 WeakPolarHBondContact O-CB 3.37Å; L152-S156 PolarHBondContact O-N 3.26Å
153	A	69.8	Low	78.2	Confident	46 Å²	46	65.3 Å²	65.3	38%	0.38	34%	0.341	S	S	.	.	H	α-helix	trans	-65.4	-40.1	173.9	0	0	0	0	0	112	E149 A150 S156 M157	E149-A153 WeakPolarHBondContact O-CB 3.26Å; E149-A153 PolarHBondContact O-N 2.89Å; A150-A153 PolarHBondContact O-N 3.5Å; A153-S156 CarbonylContact O-C 3.46Å; A153-S156 PolarHBondContact O-N 2.93Å; A153-M157 WeakPolarHBondContact O-CB 3.34Å; A153-M157 WeakPolarHBondContact O-CG 3.45Å; A153-M157 PolarHBondContact O-N 3.36Å
154	E	66.4	Low	77.2	Confident	113 Å²	113	66.9 Å²	66.9	53%	0.528	36%	0.358	S	S	.	.	H	α-helix	trans	-63	-45.1	173.7	-174.4	176.8	-163.5	0	0	111.7	A150 S156 M157 M158	A150-E154 WeakPolarHBondContact O-CB 3.37Å; A150-E154 PolarHBondContact O-N 3.32Å; E154-S156 VanDerWaalsContact C-N 3.32Å; E154-S156 PolarHBondContact O-N 3.48Å; E154-M157 PolarHBondContact O-N 2.87Å; E154-M157 VanDerWaalsContact O-N 3.15Å; E154-M158 PolarHBondContact O-N 3.36Å
155	K	64.1	Low	76.6	Confident	138 Å²	138	71.2 Å²	71.2	60%	0.6	38%	0.38	S	S	*	.	H	α-helix	trans	-61.9	-39.9	174.4	-170.2	177.2	-179.4	-178.5	0	112	R151 L152 M157 M158 N159	R151-K155 WeakPolarHBondContact O-CB 3.32Å; R151-K155 PolarHBondContact O-N 3.16Å; L152-K155 PolarHBondContact O-N 2.96Å; K155-M157 VanDerWaalsContact C-N 3.34Å; K155-M158 PolarHBondContact O-N 3.36Å; K155-N159 PolarHBondContact O-N 2.95Å
156	S	58.8	Low	76.2	Confident	42 Å²	42	70.4 Å²	70.4	29%	0.294	38%	0.375	S	S	.	.	H	α-helix	trans	-69.1	-30.2	174.9	-170.4	0	0	0	0	112.7	L152 A153 E154 N159 P160	L152-S156 WeakPolarHBondContact O-CB 3.37Å; L152-S156 PolarHBondContact O-N 3.26Å; A153-S156 CarbonylContact O-C 3.46Å; A153-S156 PolarHBondContact O-N 2.93Å; E154-S156 VanDerWaalsContact C-N 3.32Å; E154-S156 PolarHBondContact O-N 3.48Å; S156-N159 CarbonylContact O-C 3.58Å; S156-N159 VanDerWaalsContact O-C 3.23Å; S156-P160 VanDerWaalsContact O-CA 3.26Å; S156-P160 WeakPolarHBondContact O-CA 3.38Å; S156-P160 VanDerWaalsContact O-N 3.17Å
157	M	59.5	Low	76.1	Confident	143 Å²	143	67.5 Å²	67.5	70%	0.704	36%	0.36	S	S	*	.	H	α-helix	trans	-74.9	-34.4	173	-79.3	-168.8	-71.7	0	0	112	A153 E154 K155 N159	A153-M157 WeakPolarHBondContact O-CB 3.34Å; A153-M157 WeakPolarHBondContact O-CG 3.45Å; A153-M157 PolarHBondContact O-N 3.36Å; E154-M157 PolarHBondContact O-N 2.87Å; E154-M157 VanDerWaalsContact O-N 3.15Å; K155-M157 VanDerWaalsContact C-N 3.34Å; M157-N159 VanDerWaalsContact C-N 3.35Å
158	M	66.6	Low	76	Confident	151 Å²	151	68.2 Å²	68.2	74%	0.744	36%	0.36	S	S	*	.	H	α-helix	trans	-67.5	-32.7	175.2	-80.9	-173	155.5	0	0	112.9	E154 K155	E154-M158 PolarHBondContact O-N 3.36Å; K155-M158 PolarHBondContact O-N 3.36Å
159	N	77.3	Confident	75.7	Confident	15 Å²	15	72 Å²	72	8%	0.08	38%	0.376	C	S	.	.			trans	-145.4	97.6	169.3	-171.9	-4.3	0	0	0	111.3	K155 S156 M157 F161 A162 L192 R193 P196	K155-N159 PolarHBondContact O-N 2.95Å; S156-N159 CarbonylContact O-C 3.58Å; S156-N159 VanDerWaalsContact O-C 3.23Å; M157-N159 VanDerWaalsContact C-N 3.35Å; N159-F161 PolarHBondContact O-N 3.44Å; N159-F161 WeakPolarHBondContact OD1-CB 3.46Å; N159-F161 PolarHBondContact OD1-N 3.42Å; N159-A162 HydrophobicContact CB-CB 3.94Å; N159-A162 PolarHBondContact O-N 2.69Å; N159-L192 PolarHBondContact ND2-O 3.15Å; N159-R193 PolarHBondContact ND2-O 3.16Å; N159-P196 HydrophobicContact CB-CB 4.13Å; N159-P196 HydrophobicContact CB-CG 4.41Å
160	P	78.6	Confident	75.9	Confident	13 Å²	13	68 Å²	68	8%	0.084	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-63.8	-21.8	179.5	23.9	-31.8	0	0	0	113	S156 A162 M163 L212 L215 L216	S156-P160 VanDerWaalsContact O-CA 3.26Å; S156-P160 WeakPolarHBondContact O-CA 3.38Å; S156-P160 VanDerWaalsContact O-N 3.17Å; P160-A162 VanDerWaalsContact C-N 3.32Å; P160-M163 WeakPolarHBondContact O-CG 3.43Å; P160-L212 HydrophobicContact CB-CD2 4.48Å; P160-L212 HydrophobicContact CG-CD2 3.66Å; P160-L215 HydrophobicContact CB-CB 4.33Å; P160-L215 HydrophobicContact CB-CD1 4.4Å; P160-L216 HydrophobicContact CB-CD2 4.02Å; P160-L216 HydrophobicContact CG-CD2 4.48Å
161	F	85.8	Confident	76.5	Confident	1 Å²	1	70.1 Å²	70.1	0%	0.004	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-81.5	-9.5	176.9	-56.5	-90.9	0	0	0	113.3	N159 L166 L189 L192 R193 L199 V208 T211 L212 L215	N159-F161 PolarHBondContact O-N 3.44Å; N159-F161 WeakPolarHBondContact OD1-CB 3.46Å; N159-F161 PolarHBondContact OD1-N 3.42Å; F161-L166 WeakPolarHBondContact O-CD2 3.46Å; F161-L189 HydrophobicContact CD1-CD2 3.88Å; F161-L189 HydrophobicContact CE1-CD2 4.05Å; F161-L192 HydrophobicContact CB-CB 4.22Å; F161-L192 HydrophobicContact CD1-CB 4.06Å; F161-L192 HydrophobicContact CD1-CD1 4.22Å; F161-L192 HydrophobicContact CD2-CB 4Å; F161-L192 HydrophobicContact CE1-CB 4.41Å; F161-L192 HydrophobicContact CE1-CD1 3.75Å; F161-L192 HydrophobicContact CE2-CB 4.38Å; F161-L192 HydrophobicContact CE2-CD1 4.19Å; F161-L192 HydrophobicContact CG-CB 3.83Å; F161-L192 HydrophobicContact CZ-CD1 3.74Å; F161-R193 HydrophobicContact CB-CB 4.44Å; F161-R193 WeakPolarHBondContact O-CG 3.4Å; F161-L199 HydrophobicContact CE2-CD1 3.5Å; F161-L199 VanDerWaalsContact CE2-CD1 3.5Å; F161-L199 HydrophobicContact CE2-CD2 4.17Å; F161-L199 HydrophobicContact CE2-CG 4.45Å; F161-L199 HydrophobicContact CZ-CD1 3.88Å; F161-V208 HydrophobicContact CZ-CG1 4.1Å; F161-T211 HydrophobicContact CD1-CG2 4.38Å; F161-T211 HydrophobicContact CE1-CG2 3.79Å; F161-L212 HydrophobicContact CE2-CD2 3.52Å; F161-L212 HydrophobicContact CE2-CG 4.14Å; F161-L212 HydrophobicContact CZ-CD2 3.6Å; F161-L212 HydrophobicContact CZ-CG 3.76Å; F161-L215 HydrophobicContact CD1-CD1 3.91Å; F161-L215 HydrophobicContact CE1-CD1 4.08Å; F161-L215 HydrophobicContact CG-CD1 4.36Å
162	A	78.9	Confident	76.9	Confident	48 Å²	48	71 Å²	71	40%	0.397	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-96.6	11.8	176.8	0	0	0	0	0	113.4	N159 P160 R193	N159-A162 HydrophobicContact CB-CB 3.94Å; N159-A162 PolarHBondContact O-N 2.69Å; P160-A162 VanDerWaalsContact C-N 3.32Å; A162-R193 HydrophobicContact CB-CG 4.23Å
163	M	77.3	Confident	77.3	Confident	36 Å²	36	70.8 Å²	70.8	18%	0.177	37%	0.369	C	S	.	.			trans	-69.9	138.9	179.5	68.6	-178.1	-65.9	0	0	111.7	P160 N165 L166 K169 L215	P160-M163 WeakPolarHBondContact O-CG 3.43Å; M163-N165 VanDerWaalsContact C-N 3.26Å; M163-N165 PolarHBondContact O-N 2.97Å; M163-L166 HydrophobicContact CG-CB 3.92Å; M163-L166 HydrophobicContact CG-CD1 4.11Å; M163-L166 WeakPolarHBondContact O-CB 3.43Å; M163-L166 PolarHBondContact O-N 3.2Å; M163-L166 VanDerWaalsContact O-N 3.15Å; M163-K169 HydrophobicContact CE-CD 3.73Å; M163-K169 HydrophobicContact SD-CD 4.18Å; M163-L215 HydrophobicContact SD-CD2 3.7Å
164	P	68.7	Low	78	Confident	113 Å²	113	73 Å²	73	73%	0.734	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-33.4	-175.3	-26.9	34.4	0	0	0	114.7
165	N	79.3	Confident	79	Confident	97 Å²	97	72.5 Å²	72.5	52%	0.519	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	28.4	-177.5	-61.3	-8.6	0	0	0	112.4	M163 Y167 Q168 K169	M163-N165 VanDerWaalsContact C-N 3.26Å; M163-N165 PolarHBondContact O-N 2.97Å; N165-Y167 PolarHBondContact O-N 3.41Å; N165-Q168 PolarHBondContact O-N 2.93Å; N165-K169 WeakPolarHBondContact O-CB 3.32Å; N165-K169 PolarHBondContact O-N 3.36Å
166	L	83.6	Confident	80.1	Confident	4 Å²	4	66 Å²	66	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	-49.8	-59.3	-176.8	177.6	72.1	0	0	0	111.8	F161 M163 Q168 K169 L170 L215	F161-L166 WeakPolarHBondContact O-CD2 3.46Å; M163-L166 HydrophobicContact CG-CB 3.92Å; M163-L166 HydrophobicContact CG-CD1 4.11Å; M163-L166 WeakPolarHBondContact O-CB 3.43Å; M163-L166 PolarHBondContact O-N 3.2Å; M163-L166 VanDerWaalsContact O-N 3.15Å; L166-Q168 PolarHBondContact O-N 3.42Å; L166-K169 PolarHBondContact O-N 2.91Å; L166-L170 HydrophobicContact CD1-CD1 4.04Å; L166-L170 HydrophobicContact CG-CD1 4.06Å; L166-L170 WeakPolarHBondContact O-CG 3.38Å; L166-L170 PolarHBondContact O-N 3.18Å; L166-L215 HydrophobicContact CD1-CD1 3.57Å; L166-L215 HydrophobicContact CD1-CD2 3.5Å; L166-L215 HydrophobicContact CD1-CG 4.18Å
167	Y	88.1	Confident	81.6	Confident	71 Å²	71	70.8 Å²	70.8	28%	0.278	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-42.9	-175.3	-67.1	-74.7	0	0	0	112.2	N165 K169 L170 E171 L180 L189 E190	N165-Y167 PolarHBondContact O-N 3.41Å; Y167-K169 VanDerWaalsContact C-N 3.26Å; Y167-K169 PolarHBondContact O-N 3.25Å; Y167-L170 PolarHBondContact O-N 3.01Å; Y167-L170 VanDerWaalsContact O-N 3.16Å; Y167-E171 WeakPolarHBondContact O-CB 3.22Å; Y167-E171 WeakPolarHBondContact O-CG 3.36Å; Y167-E171 PolarHBondContact O-N 3.25Å; Y167-L180 HydrophobicContact CD1-CD2 3.9Å; Y167-L180 HydrophobicContact CE1-CD2 4.22Å; Y167-L189 HydrophobicContact CE1-CD1 4.14Å; Y167-E190 PolarHBondContact OH-OE1 3.19Å
168	Q	85.3	Confident	83	Confident	113 Å²	113	70.9 Å²	70.9	53%	0.528	36%	0.355	S	S	.	.	H	α-helix	trans	-59.5	-38.3	177.4	-168.5	-179.1	11.1	0	0	111.9	N165 L166 N172	N165-Q168 PolarHBondContact O-N 2.93Å; L166-Q168 PolarHBondContact O-N 3.42Å; Q168-N172 WeakPolarHBondContact O-CB 3.33Å; Q168-N172 PolarHBondContact O-N 3.16Å; Q168-N172 PolarHBondContact O-ND2 3.47Å
169	K	83	Confident	84	Confident	81 Å²	81	65.7 Å²	65.7	35%	0.352	33%	0.33	S	S	.	.	H	α-helix	trans	-71.1	-38.7	178.1	-163.1	171.9	-178.2	-176	0	112	M163 N165 L166 Y167 N172 D173 V214 L215	M163-K169 HydrophobicContact CE-CD 3.73Å; M163-K169 HydrophobicContact SD-CD 4.18Å; N165-K169 WeakPolarHBondContact O-CB 3.32Å; N165-K169 PolarHBondContact O-N 3.36Å; L166-K169 PolarHBondContact O-N 2.91Å; Y167-K169 VanDerWaalsContact C-N 3.26Å; Y167-K169 PolarHBondContact O-N 3.25Å; K169-N172 PolarHBondContact O-N 3.48Å; K169-D173 PolarHBondContact O-N 2.61Å; K169-V214 WeakPolarHBondContact CE-O 3.45Å; K169-L215 HydrophobicContact CD-CD2 4.47Å; K169-L215 PolarHBondContact NZ-O 3.14Å
170	L	90.1	Very high	84.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-73	-31	177.2	-64.9	177.8	0	0	0	113	L166 Y167 N172 T176 R177 L180 L189 T211 V214 L215	L166-L170 HydrophobicContact CD1-CD1 4.04Å; L166-L170 HydrophobicContact CG-CD1 4.06Å; L166-L170 WeakPolarHBondContact O-CG 3.38Å; L166-L170 PolarHBondContact O-N 3.18Å; Y167-L170 PolarHBondContact O-N 3.01Å; Y167-L170 VanDerWaalsContact O-N 3.16Å; L170-N172 VanDerWaalsContact C-N 3.34Å; L170-T176 WeakPolarHBondContact CA-OG1 3.26Å; L170-T176 HydrophobicContact CD2-CG2 3.85Å; L170-T176 CarbonylContact O-C 3.49Å; L170-T176 PolarHBondContact O-OG1 3.4Å; L170-R177 PolarHBondContact O-N 3.31Å; L170-L180 HydrophobicContact CB-CD1 3.79Å; L170-L180 HydrophobicContact CB-CD2 4.43Å; L170-L180 HydrophobicContact CB-CG 4.32Å; L170-L180 HydrophobicContact CD1-CD2 4.39Å; L170-L189 HydrophobicContact CD1-CD1 3.7Å; L170-L189 HydrophobicContact CD1-CD2 4.21Å; L170-T211 HydrophobicContact CD1-CG2 3.97Å; L170-T211 HydrophobicContact CD2-CG2 3.65Å; L170-T211 HydrophobicContact CG-CG2 4.47Å; L170-V214 HydrophobicContact CD2-CB 4.23Å; L170-V214 HydrophobicContact CD2-CG1 4.01Å; L170-L215 HydrophobicContact CD2-CD2 3.82Å; L170-L215 HydrophobicContact CD2-CG 4.21Å; L170-L215 HydrophobicContact CG-CD2 4.1Å
171	E	89.6	Confident	84.9	Confident	104 Å²	104	70.1 Å²	70.1	49%	0.486	36%	0.357	S	S	.	.	H	α-helix	trans	-70.2	-31.2	173.6	-75.8	177.2	175.5	0	0	112.4	Y167 R177 L180	Y167-E171 WeakPolarHBondContact O-CB 3.22Å; Y167-E171 WeakPolarHBondContact O-CG 3.36Å; Y167-E171 PolarHBondContact O-N 3.25Å; E171-R177 VanDerWaalsContact O-CD 3.3Å; E171-R177 WeakPolarHBondContact O-CD 3.47Å; E171-R177 WeakPolarHBondContact O-CG 3.21Å; E171-L180 HydrophobicContact CB-CD1 4.28Å; E171-L180 HydrophobicContact CG-CD1 3.43Å; E171-L180 VanDerWaalsContact CG-CD1 3.43Å
172	N	86.1	Confident	85.2	Confident	125 Å²	125	72.7 Å²	72.7	67%	0.668	37%	0.371	S	S	*	.	H	α-helix	trans	-80.9	-14.6	-179.2	-72.9	-25.5	0	0	0	113.7	Q168 K169 L170	Q168-N172 WeakPolarHBondContact O-CB 3.33Å; Q168-N172 PolarHBondContact O-N 3.16Å; Q168-N172 PolarHBondContact O-ND2 3.47Å; K169-N172 PolarHBondContact O-N 3.48Å; L170-N172 VanDerWaalsContact C-N 3.34Å
173	D	86.1	Confident	85.6	Confident	32 Å²	32	75.2 Å²	75.2	17%	0.171	38%	0.383	C	S	.	.	S	Bend	trans	-98.5	125.1	174.9	-171.1	-63.1	0	0	0	110.8	K169 R175 T176 R177 V214	K169-D173 PolarHBondContact O-N 2.61Å; D173-R175 PolarHBondContact O-N 3.11Å; D173-R175 VanDerWaalsContact O-N 3.14Å; D173-R175 VanDerWaalsContact OD1-CB 3.27Å; D173-R175 WeakPolarHBondContact OD1-CB 3.04Å; D173-R175 IonicContact OD1-CZ 3.95Å; D173-R175 PolarHBondContact OD1-N 3.03Å; D173-R175 IonicContact OD1-NE 3.1Å; D173-R175 PolarHBondContact OD1-NE 2.79Å; D173-R175 VanDerWaalsContact OD1-NE 3.1Å; D173-R175 IonicContact OD1-NH2 3.12Å; D173-R175 IonicContact OD2-CZ 3.67Å; D173-R175 IonicContact OD2-NE 3.56Å; D173-R175 IonicContact OD2-NH2 2.8Å; D173-R175 PolarHBondContact OD2-NH2 3.47Å; D173-T176 PolarHBondContact O-N 3.4Å; D173-T176 PolarHBondContact O-OG1 3.09Å; D173-R177 WeakPolarHBondContact O-CB 3.38Å; D173-R177 PolarHBondContact O-N 3.39Å; D173-V214 HydrophobicContact CB-CB 4.44Å; D173-V214 HydrophobicContact CB-CG1 3.6Å; D173-V214 HydrophobicContact CB-CG2 3.9Å; D173-V214 VanDerWaalsContact CG-CG2 3.41Å; D173-V214 WeakPolarHBondContact OD2-CG2 3.3Å
174	P	85.6	Confident	86.3	Confident	92 Å²	92	76.1 Å²	76.1	60%	0.597	39%	0.393	S	S	*	.	H	α-helix	trans	-55.4	-31.9	-178.3	-26.1	33.8	0	0	0	114.6
175	R	86.6	Confident	87.4	Confident	104 Å²	104	70.7 Å²	70.7	39%	0.392	36%	0.358	S	S	.	.	H	α-helix	trans	-73.7	-29.9	-176.1	-59.9	172	-69.6	-176	-3.8	112.7	D173 T210 N219	D173-R175 PolarHBondContact O-N 3.11Å; D173-R175 VanDerWaalsContact O-N 3.14Å; D173-R175 VanDerWaalsContact OD1-CB 3.27Å; D173-R175 WeakPolarHBondContact OD1-CB 3.04Å; D173-R175 IonicContact OD1-CZ 3.95Å; D173-R175 PolarHBondContact OD1-N 3.03Å; D173-R175 IonicContact OD1-NE 3.1Å; D173-R175 PolarHBondContact OD1-NE 2.79Å; D173-R175 VanDerWaalsContact OD1-NE 3.1Å; D173-R175 IonicContact OD1-NH2 3.12Å; D173-R175 IonicContact OD2-CZ 3.67Å; D173-R175 IonicContact OD2-NE 3.56Å; D173-R175 IonicContact OD2-NH2 2.8Å; D173-R175 PolarHBondContact OD2-NH2 3.47Å; R175-T210 HydrophobicContact CB-CG2 3.81Å; R175-N219 PolarHBondContact NH1-OD1 3Å
176	T	88.3	Confident	87.8	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-103.9	-19.1	-176.8	49.4	0	0	0	0	113	L170 D173 E178 L179 L180 T210 V214	L170-T176 WeakPolarHBondContact CA-OG1 3.26Å; L170-T176 HydrophobicContact CD2-CG2 3.85Å; L170-T176 CarbonylContact O-C 3.49Å; L170-T176 PolarHBondContact O-OG1 3.4Å; D173-T176 PolarHBondContact O-N 3.4Å; D173-T176 PolarHBondContact O-OG1 3.09Å; T176-E178 PolarHBondContact O-N 3.24Å; T176-L179 PolarHBondContact O-N 3.46Å; T176-L180 WeakPolarHBondContact O-CG 3.28Å; T176-L180 PolarHBondContact O-N 2.85Å; T176-L180 VanDerWaalsContact O-N 3.13Å; T176-T210 HydrophobicContact CG2-CG2 4.13Å; T176-V214 HydrophobicContact CG2-CB 4.28Å; T176-V214 HydrophobicContact CG2-CG2 3.72Å
177	R	90.4	Very high	88.1	Confident	143 Å²	143	77.7 Å²	77.7	54%	0.54	38%	0.382	S	S	.	.	H	α-helix	trans	-60	-42.6	179.8	-173.3	177.7	67.2	-175.9	0.1	113.1	L170 E171 D173 L180	L170-R177 PolarHBondContact O-N 3.31Å; E171-R177 VanDerWaalsContact O-CD 3.3Å; E171-R177 WeakPolarHBondContact O-CD 3.47Å; E171-R177 WeakPolarHBondContact O-CG 3.21Å; D173-R177 WeakPolarHBondContact O-CB 3.38Å; D173-R177 PolarHBondContact O-N 3.39Å; R177-L180 PolarHBondContact O-N 3.08Å
178	E	87.3	Confident	88.1	Confident	146 Å²	146	74.8 Å²	74.8	68%	0.682	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-37.8	178	-68.2	-175.1	178.7	0	0	111.7	T176 L180 T181	T176-E178 PolarHBondContact O-N 3.24Å; E178-L180 PolarHBondContact O-N 3.39Å; E178-T181 WeakPolarHBondContact O-CB 3.26Å; E178-T181 PolarHBondContact O-N 3.47Å; E178-T181 PolarHBondContact O-OG1 2.87Å
179	L	88.9	Confident	88.4	Confident	42 Å²	42	69.5 Å²	69.5	22%	0.22	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-60.6	-33.6	177.2	-58.6	179	0	0	0	111.9	T176 T181 D182 Y185 R207	T176-L179 PolarHBondContact O-N 3.46Å; L179-T181 PolarHBondContact O-N 3.26Å; L179-T181 VanDerWaalsContact O-N 3.07Å; L179-D182 WeakPolarHBondContact O-CB 3.29Å; L179-D182 PolarHBondContact O-N 3.05Å; L179-Y185 HydrophobicContact CB-CD1 3.63Å; L179-Y185 HydrophobicContact CB-CD2 4.39Å; L179-Y185 HydrophobicContact CB-CE1 3.52Å; L179-Y185 HydrophobicContact CB-CE2 4.34Å; L179-Y185 HydrophobicContact CB-CG 4.04Å; L179-Y185 HydrophobicContact CD1-CE2 4.26Å; L179-Y185 WeakPolarHBondContact O-CD1 3.28Å; L179-R207 HydrophobicContact CD1-CB 4.15Å; L179-R207 HydrophobicContact CD1-CG 4.19Å; L179-R207 HydrophobicContact CD2-CG 4.15Å
180	L	88.6	Confident	88.6	Confident	6 Å²	6	68.4 Å²	68.4	3%	0.031	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-63.2	-11.4	176.3	-73.5	173.9	0	0	0	114.2	Y167 L170 E171 T176 R177 E178 Y185 R186 L189	Y167-L180 HydrophobicContact CD1-CD2 3.9Å; Y167-L180 HydrophobicContact CE1-CD2 4.22Å; L170-L180 HydrophobicContact CB-CD1 3.79Å; L170-L180 HydrophobicContact CB-CD2 4.43Å; L170-L180 HydrophobicContact CB-CG 4.32Å; L170-L180 HydrophobicContact CD1-CD2 4.39Å; E171-L180 HydrophobicContact CB-CD1 4.28Å; E171-L180 HydrophobicContact CG-CD1 3.43Å; E171-L180 VanDerWaalsContact CG-CD1 3.43Å; T176-L180 WeakPolarHBondContact O-CG 3.28Å; T176-L180 PolarHBondContact O-N 2.85Å; T176-L180 VanDerWaalsContact O-N 3.13Å; R177-L180 PolarHBondContact O-N 3.08Å; E178-L180 PolarHBondContact O-N 3.39Å; L180-Y185 HydrophobicContact CD2-CD1 4.31Å; L180-Y185 HydrophobicContact CD2-CE1 3.9Å; L180-Y185 HydrophobicContact CG-CE1 4.2Å; L180-R186 PolarHBondContact O-NE 2.93Å; L180-R186 PolarHBondContact O-NH2 2.96Å; L180-L189 HydrophobicContact CD2-CD1 3.93Å
181	T	86.4	Confident	88.3	Confident	114 Å²	114	71.6 Å²	71.6	70%	0.699	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-81.8	-17.9	173.7	67	0	0	0	0	112.8	E178 L179 P183	E178-T181 WeakPolarHBondContact O-CB 3.26Å; E178-T181 PolarHBondContact O-N 3.47Å; E178-T181 PolarHBondContact O-OG1 2.87Å; L179-T181 PolarHBondContact O-N 3.26Å; L179-T181 VanDerWaalsContact O-N 3.07Å; T181-P183 WeakPolarHBondContact O-CD 3.21Å
182	D	90.4	Very high	88.1	Confident	56 Å²	56	66.7 Å²	66.7	30%	0.299	34%	0.335	S	S	.	.			trans	-82.8	119.1	178.2	178.2	-2.6	0	0	0	111	L179 S184 Y185 R186 R207	L179-D182 WeakPolarHBondContact O-CB 3.29Å; L179-D182 PolarHBondContact O-N 3.05Å; D182-S184 VanDerWaalsContact C-N 3.25Å; D182-S184 PolarHBondContact O-N 3.14Å; D182-S184 WeakPolarHBondContact OD1-CB 3.48Å; D182-S184 PolarHBondContact OD1-N 3.24Å; D182-S184 PolarHBondContact OD1-OG 3.5Å; D182-S184 PolarHBondContact OD2-OG 2.95Å; D182-Y185 PolarHBondContact O-N 2.93Å; D182-R186 PolarHBondContact O-N 3.19Å; D182-R207 IonicContact OD2-NH1 3.06Å; D182-R207 PolarHBondContact OD2-NH1 3.41Å
183	P	88.4	Confident	88	Confident	101 Å²	101	65 Å²	65	66%	0.656	32%	0.319	S	S	*	.	H	α-helix	trans	-57.9	-34.8	177.1	-23.9	34.1	0	0	0	113.6	T181 Y185 R186 E187	T181-P183 WeakPolarHBondContact O-CD 3.21Å; P183-Y185 VanDerWaalsContact C-N 3.32Å; P183-Y185 PolarHBondContact O-N 2.93Å; P183-R186 PolarHBondContact O-N 3.11Å; P183-E187 PolarHBondContact O-N 3.35Å; P183-E187 VanDerWaalsContact O-N 3.09Å
184	S	91.4	Very high	87.7	Confident	54 Å²	54	68.8 Å²	68.8	38%	0.378	34%	0.339	S	S	.	.	H	α-helix	trans	-69	-32.6	-178.8	77	0	0	0	0	112.3	D182 L188 R207	D182-S184 VanDerWaalsContact C-N 3.25Å; D182-S184 PolarHBondContact O-N 3.14Å; D182-S184 WeakPolarHBondContact OD1-CB 3.48Å; D182-S184 PolarHBondContact OD1-N 3.24Å; D182-S184 PolarHBondContact OD1-OG 3.5Å; D182-S184 PolarHBondContact OD2-OG 2.95Å; S184-L188 WeakPolarHBondContact O-CB 3.45Å; S184-L188 PolarHBondContact O-N 3.17Å; S184-R207 PolarHBondContact OG-NH1 3.39Å
185	Y	91.3	Very high	87.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-73	-37.3	175.7	176.1	-110.2	0	0	0	111.5	L179 L180 D182 P183 E187 L188 L189 R207 T211	L179-Y185 HydrophobicContact CB-CD1 3.63Å; L179-Y185 HydrophobicContact CB-CD2 4.39Å; L179-Y185 HydrophobicContact CB-CE1 3.52Å; L179-Y185 HydrophobicContact CB-CE2 4.34Å; L179-Y185 HydrophobicContact CB-CG 4.04Å; L179-Y185 HydrophobicContact CD1-CE2 4.26Å; L179-Y185 WeakPolarHBondContact O-CD1 3.28Å; L180-Y185 HydrophobicContact CD2-CD1 4.31Å; L180-Y185 HydrophobicContact CD2-CE1 3.9Å; L180-Y185 HydrophobicContact CG-CE1 4.2Å; D182-Y185 PolarHBondContact O-N 2.93Å; P183-Y185 VanDerWaalsContact C-N 3.32Å; P183-Y185 PolarHBondContact O-N 2.93Å; Y185-E187 VanDerWaalsContact C-N 3.33Å; Y185-E187 PolarHBondContact O-N 3.11Å; Y185-L188 HydrophobicContact CD2-CD2 4.41Å; Y185-L188 WeakPolarHBondContact O-CB 3.32Å; Y185-L188 PolarHBondContact O-N 3.36Å; Y185-L189 HydrophobicContact CD1-CD1 4.14Å; Y185-L189 HydrophobicContact CE1-CD1 3.71Å; Y185-L189 HydrophobicContact CE1-CG 4.29Å; Y185-L189 HydrophobicContact CE2-CD2 4.29Å; Y185-L189 HydrophobicContact CE2-CG 4.38Å; Y185-L189 WeakPolarHBondContact O-CG 3.4Å; Y185-L189 PolarHBondContact O-N 2.84Å; Y185-R207 HydrophobicContact CD2-CB 3.82Å; Y185-R207 HydrophobicContact CD2-CG 4.47Å; Y185-R207 HydrophobicContact CE2-CB 3.8Å; Y185-T211 WeakPolarHBondContact CE2-OG1 3.48Å; Y185-T211 PolarHBondContact OH-OG1 2.92Å
186	R	89.1	Confident	87	Confident	127 Å²	127	67.7 Å²	67.7	48%	0.479	33%	0.334	S	S	.	.	H	α-helix	trans	-62.6	-41.6	172.8	-66.9	-174.9	-178.5	-162.3	-2	112	L180 D182 P183 L188 L189 E190	L180-R186 PolarHBondContact O-NE 2.93Å; L180-R186 PolarHBondContact O-NH2 2.96Å; D182-R186 PolarHBondContact O-N 3.19Å; P183-R186 PolarHBondContact O-N 3.11Å; R186-L188 VanDerWaalsContact C-N 3.33Å; R186-L189 PolarHBondContact O-N 3.35Å; R186-E190 WeakPolarHBondContact O-CG 3.47Å; R186-E190 PolarHBondContact O-N 2.9Å
187	E	88.7	Confident	86.5	Confident	121 Å²	121	73 Å²	73	57%	0.565	37%	0.371	S	S	*	.	H	α-helix	trans	-63.5	-39.9	175.5	-167.1	178.5	174.9	0	0	111.7	P183 Y185 E190 Q191	P183-E187 PolarHBondContact O-N 3.35Å; P183-E187 VanDerWaalsContact O-N 3.09Å; Y185-E187 VanDerWaalsContact C-N 3.33Å; Y185-E187 PolarHBondContact O-N 3.11Å; E187-E190 WeakPolarHBondContact O-CB 3.2Å; E187-E190 PolarHBondContact O-N 3.22Å; E187-Q191 VanDerWaalsContact O-CG 3.3Å; E187-Q191 WeakPolarHBondContact O-CG 3.49Å; E187-Q191 PolarHBondContact O-N 3.45Å
188	L	89.4	Confident	86	Confident	10 Å²	10	68.8 Å²	68.8	5%	0.052	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-43	174.2	-179.4	63.2	0	0	0	112.6	S184 Y185 R186 E190 Q191 L192 K202 V208	S184-L188 WeakPolarHBondContact O-CB 3.45Å; S184-L188 PolarHBondContact O-N 3.17Å; Y185-L188 HydrophobicContact CD2-CD2 4.41Å; Y185-L188 WeakPolarHBondContact O-CB 3.32Å; Y185-L188 PolarHBondContact O-N 3.36Å; R186-L188 VanDerWaalsContact C-N 3.33Å; L188-E190 VanDerWaalsContact C-N 3.35Å; L188-Q191 PolarHBondContact O-N 3.03Å; L188-L192 HydrophobicContact CD1-CD1 4.32Å; L188-L192 HydrophobicContact CD1-CG 4.5Å; L188-L192 HydrophobicContact CG-CD1 4.3Å; L188-L192 WeakPolarHBondContact O-CG 3.37Å; L188-L192 PolarHBondContact O-N 2.89Å; L188-K202 HydrophobicContact CD1-CB 4.49Å; L188-K202 HydrophobicContact CD1-CD 3.92Å; L188-K202 HydrophobicContact CD1-CG 4.2Å; L188-V208 HydrophobicContact CD1-CG2 4.34Å; L188-V208 HydrophobicContact CD2-CG2 3.55Å; L188-V208 HydrophobicContact CG-CG2 4.11Å
189	L	90.1	Very high	85.7	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-63.5	-40.2	175.5	-67.1	175.9	0	0	0	111.9	F161 Y167 L170 L180 Y185 R186 L192 R193 T211	F161-L189 HydrophobicContact CD1-CD2 3.88Å; F161-L189 HydrophobicContact CE1-CD2 4.05Å; Y167-L189 HydrophobicContact CE1-CD1 4.14Å; L170-L189 HydrophobicContact CD1-CD1 3.7Å; L170-L189 HydrophobicContact CD1-CD2 4.21Å; L180-L189 HydrophobicContact CD2-CD1 3.93Å; Y185-L189 HydrophobicContact CD1-CD1 4.14Å; Y185-L189 HydrophobicContact CE1-CD1 3.71Å; Y185-L189 HydrophobicContact CE1-CG 4.29Å; Y185-L189 HydrophobicContact CE2-CD2 4.29Å; Y185-L189 HydrophobicContact CE2-CG 4.38Å; Y185-L189 WeakPolarHBondContact O-CG 3.4Å; Y185-L189 PolarHBondContact O-N 2.84Å; R186-L189 PolarHBondContact O-N 3.35Å; L189-L192 PolarHBondContact O-N 3.44Å; L189-R193 VanDerWaalsContact O-CB 3.25Å; L189-R193 WeakPolarHBondContact O-CB 3.36Å; L189-R193 PolarHBondContact O-N 3.32Å; L189-T211 HydrophobicContact CD2-CG2 3.69Å
190	E	86.8	Confident	85.2	Confident	57 Å²	57	64.4 Å²	64.4	27%	0.266	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-42.7	174.9	-77.4	-65.4	152.9	0	0	112.3	Y167 R186 E187 L188 R193 N194	Y167-E190 PolarHBondContact OH-OE1 3.19Å; R186-E190 WeakPolarHBondContact O-CG 3.47Å; R186-E190 PolarHBondContact O-N 2.9Å; E187-E190 WeakPolarHBondContact O-CB 3.2Å; E187-E190 PolarHBondContact O-N 3.22Å; L188-E190 VanDerWaalsContact C-N 3.35Å; E190-R193 PolarHBondContact O-N 3.35Å; E190-R193 IonicContact OE1-CZ 2.79Å; E190-R193 IonicContact OE1-NE 3.86Å; E190-R193 IonicContact OE1-NH1 2.76Å; E190-R193 PolarHBondContact OE1-NH1 3.25Å; E190-R193 IonicContact OE1-NH2 3.59Å; E190-R193 PolarHBondContact OE1-NH2 3.14Å; E190-R193 IonicContact OE2-CZ 3.78Å; E190-R193 IonicContact OE2-NE 2.82Å; E190-R193 PolarHBondContact OE2-NE 2.96Å; E190-R193 IonicContact OE2-NH1 3.57Å; E190-R193 IonicContact OE2-NH2 2.7Å; E190-R193 PolarHBondContact OE2-NH2 3.21Å; E190-N194 WeakPolarHBondContact O-CB 3.27Å; E190-N194 VanDerWaalsContact O-CG 3.24Å; E190-N194 PolarHBondContact O-N 3.01Å; E190-N194 PolarHBondContact O-ND2 3.18Å
191	Q	85.7	Confident	85	Confident	68 Å²	68	69 Å²	69	32%	0.318	38%	0.381	S	S	.	.	H	α-helix	trans	-60.9	-48	175.5	-73.7	173.8	9.2	0	0	111.1	E187 L188 R193 N194 K195	E187-Q191 VanDerWaalsContact O-CG 3.3Å; E187-Q191 WeakPolarHBondContact O-CG 3.49Å; E187-Q191 PolarHBondContact O-N 3.45Å; L188-Q191 PolarHBondContact O-N 3.03Å; Q191-R193 VanDerWaalsContact C-N 3.33Å; Q191-R193 PolarHBondContact O-N 3.01Å; Q191-N194 PolarHBondContact O-N 3.35Å; Q191-K195 WeakPolarHBondContact O-CA 3.48Å; Q191-K195 PolarHBondContact O-N 3.29Å
192	L	84.8	Confident	84.8	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-68.4	-30.8	178.9	-68.7	175.1	0	0	0	112.9	N159 F161 L188 L189 L199 K202 V208	N159-L192 PolarHBondContact ND2-O 3.15Å; F161-L192 HydrophobicContact CB-CB 4.22Å; F161-L192 HydrophobicContact CD1-CB 4.06Å; F161-L192 HydrophobicContact CD1-CD1 4.22Å; F161-L192 HydrophobicContact CD2-CB 4Å; F161-L192 HydrophobicContact CE1-CB 4.41Å; F161-L192 HydrophobicContact CE1-CD1 3.75Å; F161-L192 HydrophobicContact CE2-CB 4.38Å; F161-L192 HydrophobicContact CE2-CD1 4.19Å; F161-L192 HydrophobicContact CG-CB 3.83Å; F161-L192 HydrophobicContact CZ-CD1 3.74Å; L188-L192 HydrophobicContact CD1-CD1 4.32Å; L188-L192 HydrophobicContact CD1-CG 4.5Å; L188-L192 HydrophobicContact CG-CD1 4.3Å; L188-L192 WeakPolarHBondContact O-CG 3.37Å; L188-L192 PolarHBondContact O-N 2.89Å; L189-L192 PolarHBondContact O-N 3.44Å; L192-L199 HydrophobicContact CD1-CD1 4.28Å; L192-L199 HydrophobicContact CD2-CB 4.22Å; L192-L199 HydrophobicContact CD2-CD1 4.01Å; L192-K202 HydrophobicContact CD2-CB 4.1Å; L192-K202 HydrophobicContact CD2-CG 4.04Å; L192-V208 HydrophobicContact CD1-CG1 3.93Å; L192-V208 HydrophobicContact CD1-CG2 3.97Å
193	R	83.6	Confident	84.3	Confident	89 Å²	89	67.7 Å²	67.7	34%	0.336	37%	0.366	S	S	.	.	H	α-helix	trans	-65.3	-44.5	172	-174.6	171.9	81.4	-163.3	9.3	112	N159 F161 A162 L189 E190 Q191	N159-R193 PolarHBondContact ND2-O 3.16Å; F161-R193 HydrophobicContact CB-CB 4.44Å; F161-R193 WeakPolarHBondContact O-CG 3.4Å; A162-R193 HydrophobicContact CB-CG 4.23Å; L189-R193 VanDerWaalsContact O-CB 3.25Å; L189-R193 WeakPolarHBondContact O-CB 3.36Å; L189-R193 PolarHBondContact O-N 3.32Å; E190-R193 PolarHBondContact O-N 3.35Å; E190-R193 IonicContact OE1-CZ 2.79Å; E190-R193 IonicContact OE1-NE 3.86Å; E190-R193 IonicContact OE1-NH1 2.76Å; E190-R193 PolarHBondContact OE1-NH1 3.25Å; E190-R193 IonicContact OE1-NH2 3.59Å; E190-R193 PolarHBondContact OE1-NH2 3.14Å; E190-R193 IonicContact OE2-CZ 3.78Å; E190-R193 IonicContact OE2-NE 2.82Å; E190-R193 PolarHBondContact OE2-NE 2.96Å; E190-R193 IonicContact OE2-NH1 3.57Å; E190-R193 IonicContact OE2-NH2 2.7Å; E190-R193 PolarHBondContact OE2-NH2 3.21Å; Q191-R193 VanDerWaalsContact C-N 3.33Å; Q191-R193 PolarHBondContact O-N 3.01Å
194	N	79.7	Confident	83.9	Confident	111 Å²	111	71.6 Å²	71.6	59%	0.594	38%	0.375	S	S	*	.	H	α-helix	trans	-86.1	-24.8	-174.7	-63.1	-32.7	0	0	0	113	E190 Q191	E190-N194 WeakPolarHBondContact O-CB 3.27Å; E190-N194 VanDerWaalsContact O-CG 3.24Å; E190-N194 PolarHBondContact O-N 3.01Å; E190-N194 PolarHBondContact O-ND2 3.18Å; Q191-N194 PolarHBondContact O-N 3.35Å
195	K	81.5	Confident	83.6	Confident	113 Å²	113	70.7 Å²	70.7	49%	0.491	37%	0.366	S	S	.	.			trans	-136	76.3	-179.2	-64.1	-174.2	-174	177.9	0	111.9	Q191 S197 E198	Q191-K195 WeakPolarHBondContact O-CA 3.48Å; Q191-K195 PolarHBondContact O-N 3.29Å; K195-S197 PolarHBondContact O-N 3.35Å; K195-S197 VanDerWaalsContact O-N 3.07Å; K195-E198 HydrophobicContact CB-CG 4.15Å; K195-E198 HydrophobicContact CD-CG 4.34Å; K195-E198 WeakPolarHBondContact CD-OE1 3.48Å; K195-E198 IonicContact NZ-OE1 3.12Å; K195-E198 PolarHBondContact NZ-OE1 3.37Å; K195-E198 PolarHBondContact O-N 3.39Å
196	P	75.9	Confident	83	Confident	61 Å²	61	75.3 Å²	75.3	40%	0.396	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-60.5	-21.1	180	17.3	-27.3	0	0	0	114.3	N159 E198 L199	N159-P196 HydrophobicContact CB-CB 4.13Å; N159-P196 HydrophobicContact CB-CG 4.41Å; P196-E198 PolarHBondContact O-N 2.95Å; P196-L199 VanDerWaalsContact O-CB 3.22Å; P196-L199 WeakPolarHBondContact O-CB 3.4Å; P196-L199 PolarHBondContact O-N 3.41Å
197	S	77.3	Confident	83	Confident	111 Å²	111	72.1 Å²	72.1	78%	0.776	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-65.1	-23.7	174.6	54.2	0	0	0	0	113.7	K195 L199	K195-S197 PolarHBondContact O-N 3.35Å; K195-S197 VanDerWaalsContact O-N 3.07Å; S197-L199 PolarHBondContact O-N 2.95Å
198	E	80.9	Confident	83	Confident	55 Å²	55	66.4 Å²	66.4	26%	0.257	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-79.9	-5.8	177	-65.7	-175.2	-170.1	0	0	112.3	K195 P196 G200 T201 K202	K195-E198 HydrophobicContact CB-CG 4.15Å; K195-E198 HydrophobicContact CD-CG 4.34Å; K195-E198 WeakPolarHBondContact CD-OE1 3.48Å; K195-E198 IonicContact NZ-OE1 3.12Å; K195-E198 PolarHBondContact NZ-OE1 3.37Å; K195-E198 PolarHBondContact O-N 3.39Å; P196-E198 PolarHBondContact O-N 2.95Å; E198-G200 VanDerWaalsContact C-N 3.26Å; E198-G200 PolarHBondContact O-N 2.75Å; E198-T201 PolarHBondContact O-N 2.97Å; E198-T201 VanDerWaalsContact O-N 3.17Å; E198-T201 PolarHBondContact O-OG1 3.18Å; E198-K202 WeakPolarHBondContact O-CG 3.5Å; E198-K202 PolarHBondContact O-N 3.34Å
199	L	81.3	Confident	82.6	Confident	40 Å²	40	69 Å²	69	21%	0.209	37%	0.37	C	S	.	.	H	α-helix	trans	-54.4	-43.9	179.1	-176.2	58.4	0	0	0	111.8	F161 L192 P196 S197 T201 K202 L203 V208 L212	F161-L199 HydrophobicContact CE2-CD1 3.5Å; F161-L199 VanDerWaalsContact CE2-CD1 3.5Å; F161-L199 HydrophobicContact CE2-CD2 4.17Å; F161-L199 HydrophobicContact CE2-CG 4.45Å; F161-L199 HydrophobicContact CZ-CD1 3.88Å; L192-L199 HydrophobicContact CD1-CD1 4.28Å; L192-L199 HydrophobicContact CD2-CB 4.22Å; L192-L199 HydrophobicContact CD2-CD1 4.01Å; P196-L199 VanDerWaalsContact O-CB 3.22Å; P196-L199 WeakPolarHBondContact O-CB 3.4Å; P196-L199 PolarHBondContact O-N 3.41Å; S197-L199 PolarHBondContact O-N 2.95Å; L199-T201 VanDerWaalsContact C-N 3.29Å; L199-T201 PolarHBondContact O-N 3.32Å; L199-K202 CarbonylContact O-C 3.21Å; L199-K202 PolarHBondContact O-N 3.13Å; L199-L203 WeakPolarHBondContact O-CG 3.46Å; L199-L203 PolarHBondContact O-N 2.91Å; L199-V208 HydrophobicContact CD1-CG1 3.83Å; L199-L212 HydrophobicContact CD1-CD1 4.2Å
200	G	78.8	Confident	82.4	Confident	56 Å²	56	71 Å²	71	58%	0.577	38%	0.383	S	S	*	.	H	α-helix	trans	-58.6	-35.6	-178.5	0	0	0	0	0	114.2	E198	E198-G200 VanDerWaalsContact C-N 3.26Å; E198-G200 PolarHBondContact O-N 2.75Å
201	T	82.8	Confident	82.4	Confident	103 Å²	103	68.3 Å²	68.3	63%	0.632	37%	0.37	S	S	*	.	H	α-helix	trans	-82.7	-22.1	178.4	59.4	0	0	0	0	112.4	E198 L199	E198-T201 PolarHBondContact O-N 2.97Å; E198-T201 VanDerWaalsContact O-N 3.17Å; E198-T201 PolarHBondContact O-OG1 3.18Å; L199-T201 VanDerWaalsContact C-N 3.29Å; L199-T201 PolarHBondContact O-N 3.32Å
202	K	82.3	Confident	82.4	Confident	68 Å²	68	65.7 Å²	65.7	30%	0.296	36%	0.358	S	S	.	.	H	α-helix	trans	-92.9	-6.3	-179.9	-59.2	-64.8	-175	172.9	0	113.8	L188 L192 E198 L199 Q204 D205 V208	L188-K202 HydrophobicContact CD1-CB 4.49Å; L188-K202 HydrophobicContact CD1-CD 3.92Å; L188-K202 HydrophobicContact CD1-CG 4.2Å; L192-K202 HydrophobicContact CD2-CB 4.1Å; L192-K202 HydrophobicContact CD2-CG 4.04Å; E198-K202 WeakPolarHBondContact O-CG 3.5Å; E198-K202 PolarHBondContact O-N 3.34Å; L199-K202 CarbonylContact O-C 3.21Å; L199-K202 PolarHBondContact O-N 3.13Å; K202-Q204 PolarHBondContact O-N 3.31Å; K202-Q204 VanDerWaalsContact O-N 3.15Å; K202-D205 WeakPolarHBondContact O-CB 3.43Å; K202-D205 PolarHBondContact O-N 3.27Å; K202-V208 HydrophobicContact CB-CG2 4.3Å; K202-V208 WeakPolarHBondContact O-CB 3.48Å; K202-V208 WeakPolarHBondContact O-CG2 3.41Å
203	L	81.5	Confident	82.3	Confident	74 Å²	74	65.9 Å²	65.9	39%	0.387	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-21.2	175.7	-77.7	171.1	0	0	0	113.6	L199 D205 M209 L212	L199-L203 WeakPolarHBondContact O-CG 3.46Å; L199-L203 PolarHBondContact O-N 2.91Å; L203-D205 PolarHBondContact O-N 3.33Å; L203-M209 HydrophobicContact CD2-SD 3.56Å; L203-M209 VanDerWaalsContact CD2-SD 3.56Å; L203-M209 WeakPolarHBondContact O-CG 3.43Å; L203-L212 HydrophobicContact CD2-CD1 3.68Å
204	Q	79.3	Confident	82.4	Confident	182 Å²	182	62.1 Å²	62.1	85%	0.85	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-16.2	175.7	-63.8	-178.9	-4.3	0	0	113.1	K202 P206	K202-Q204 PolarHBondContact O-N 3.31Å; K202-Q204 VanDerWaalsContact O-N 3.15Å; Q204-P206 WeakPolarHBondContact O-CD 3.45Å
205	D	84.7	Confident	82.5	Confident	36 Å²	36	57.2 Å²	57.2	19%	0.193	32%	0.32	C	S	.	.	S	Bend	trans	-80.5	118.3	174.8	-172.8	-34	0	0	0	109.3	K202 L203 R207 V208 M209	K202-D205 WeakPolarHBondContact O-CB 3.43Å; K202-D205 PolarHBondContact O-N 3.27Å; L203-D205 PolarHBondContact O-N 3.33Å; D205-R207 PolarHBondContact O-N 3.49Å; D205-R207 VanDerWaalsContact O-N 3.09Å; D205-R207 WeakPolarHBondContact OD1-CB 3.48Å; D205-R207 WeakPolarHBondContact OD1-CG 3.42Å; D205-R207 PolarHBondContact OD1-N 3.42Å; D205-R207 IonicContact OD1-NE 3.87Å; D205-R207 PolarHBondContact OD1-NE 3.01Å; D205-R207 VanDerWaalsContact OD1-NE 3.12Å; D205-R207 IonicContact OD2-CZ 3.52Å; D205-R207 IonicContact OD2-NE 2.75Å; D205-R207 PolarHBondContact OD2-NE 2.98Å; D205-R207 IonicContact OD2-NH2 3.56Å; D205-R207 PolarHBondContact OD2-NH2 2.94Å; D205-V208 HydrophobicContact CB-CB 4.44Å; D205-V208 HydrophobicContact CB-CG2 3.89Å; D205-V208 WeakPolarHBondContact O-CB 3.32Å; D205-V208 PolarHBondContact O-N 3.49Å; D205-M209 PolarHBondContact O-N 3.48Å
206	P	79.6	Confident	82.4	Confident	96 Å²	96	55.8 Å²	55.8	62%	0.623	32%	0.317	S	S	*	.	H	α-helix	trans	-61.1	-24.2	-177	24.7	-34.4	0	0	0	112.7	Q204 V208 T210	Q204-P206 WeakPolarHBondContact O-CD 3.45Å; P206-V208 VanDerWaalsContact C-N 3.33Å; P206-T210 WeakPolarHBondContact O-CB 3.39Å; P206-T210 PolarHBondContact O-N 2.95Å; P206-T210 VanDerWaalsContact O-N 3.09Å; P206-T210 PolarHBondContact O-OG1 3.47Å
207	R	89.1	Confident	82.2	Confident	60 Å²	60	56 Å²	56	23%	0.226	33%	0.33	C	S	.	.	H	α-helix	trans	-66.4	-37.5	174.4	-57.1	176.6	-67	178.2	2.3	110.6	L179 D182 S184 Y185 D205 T211	L179-R207 HydrophobicContact CD1-CB 4.15Å; L179-R207 HydrophobicContact CD1-CG 4.19Å; L179-R207 HydrophobicContact CD2-CG 4.15Å; D182-R207 IonicContact OD2-NH1 3.06Å; D182-R207 PolarHBondContact OD2-NH1 3.41Å; S184-R207 PolarHBondContact OG-NH1 3.39Å; Y185-R207 HydrophobicContact CD2-CB 3.82Å; Y185-R207 HydrophobicContact CD2-CG 4.47Å; Y185-R207 HydrophobicContact CE2-CB 3.8Å; D205-R207 PolarHBondContact O-N 3.49Å; D205-R207 VanDerWaalsContact O-N 3.09Å; D205-R207 WeakPolarHBondContact OD1-CB 3.48Å; D205-R207 WeakPolarHBondContact OD1-CG 3.42Å; D205-R207 PolarHBondContact OD1-N 3.42Å; D205-R207 IonicContact OD1-NE 3.87Å; D205-R207 PolarHBondContact OD1-NE 3.01Å; D205-R207 VanDerWaalsContact OD1-NE 3.12Å; D205-R207 IonicContact OD2-CZ 3.52Å; D205-R207 IonicContact OD2-NE 2.75Å; D205-R207 PolarHBondContact OD2-NE 2.98Å; D205-R207 IonicContact OD2-NH2 3.56Å; D205-R207 PolarHBondContact OD2-NH2 2.94Å; R207-T211 WeakPolarHBondContact O-CB 3.38Å; R207-T211 PolarHBondContact O-N 3.47Å; R207-T211 PolarHBondContact O-OG1 3.18Å
208	V	87.9	Confident	81.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	32%	0.316	C	S	.	.	H	α-helix	trans	-68.7	-42.1	-179.5	177.7	0	0	0	0	111.1	F161 L188 L192 L199 K202 D205 P206 T211 L212	F161-V208 HydrophobicContact CZ-CG1 4.1Å; L188-V208 HydrophobicContact CD1-CG2 4.34Å; L188-V208 HydrophobicContact CD2-CG2 3.55Å; L188-V208 HydrophobicContact CG-CG2 4.11Å; L192-V208 HydrophobicContact CD1-CG1 3.93Å; L192-V208 HydrophobicContact CD1-CG2 3.97Å; L199-V208 HydrophobicContact CD1-CG1 3.83Å; K202-V208 HydrophobicContact CB-CG2 4.3Å; K202-V208 WeakPolarHBondContact O-CB 3.48Å; K202-V208 WeakPolarHBondContact O-CG2 3.41Å; D205-V208 HydrophobicContact CB-CB 4.44Å; D205-V208 HydrophobicContact CB-CG2 3.89Å; D205-V208 WeakPolarHBondContact O-CB 3.32Å; D205-V208 PolarHBondContact O-N 3.49Å; P206-V208 VanDerWaalsContact C-N 3.33Å; V208-T211 WeakPolarHBondContact O-CB 3.49Å; V208-T211 PolarHBondContact O-N 3.29Å; V208-L212 HydrophobicContact CG1-CD1 4.36Å; V208-L212 WeakPolarHBondContact O-CB 3.44Å; V208-L212 WeakPolarHBondContact O-CG 3.3Å; V208-L212 PolarHBondContact O-N 2.99Å
209	M	82.3	Confident	80.4	Confident	65 Å²	65	57 Å²	57	32%	0.32	33%	0.328	S	S	.	.	H	α-helix	trans	-64.6	-44.2	176	-73.2	-61.1	-71.3	0	0	112.3	L203 D205 T211 L212 S213 L220	L203-M209 HydrophobicContact CD2-SD 3.56Å; L203-M209 VanDerWaalsContact CD2-SD 3.56Å; L203-M209 WeakPolarHBondContact O-CG 3.43Å; D205-M209 PolarHBondContact O-N 3.48Å; M209-T211 VanDerWaalsContact C-N 3.29Å; M209-T211 PolarHBondContact O-N 2.86Å; M209-L212 PolarHBondContact O-N 3.39Å; M209-L212 HydrophobicContact SD-CD1 4.39Å; M209-S213 WeakPolarHBondContact O-CB 2.98Å; M209-S213 PolarHBondContact O-N 3.38Å; M209-L220 HydrophobicContact CE-CB 4.14Å; M209-L220 HydrophobicContact CE-CD1 4.22Å; M209-L220 HydrophobicContact CE-CD2 4.39Å; M209-L220 HydrophobicContact CE-CG 4.49Å
210	T	84.6	Confident	78.9	Confident	45 Å²	45	57.5 Å²	57.5	28%	0.276	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-40.9	173.9	-54.9	0	0	0	0	110.9	R175 T176 P206 S213 V214	R175-T210 HydrophobicContact CB-CG2 3.81Å; T176-T210 HydrophobicContact CG2-CG2 4.13Å; P206-T210 WeakPolarHBondContact O-CB 3.39Å; P206-T210 PolarHBondContact O-N 2.95Å; P206-T210 VanDerWaalsContact O-N 3.09Å; P206-T210 PolarHBondContact O-OG1 3.47Å; T210-S213 WeakPolarHBondContact O-CB 3.31Å; T210-S213 PolarHBondContact O-N 3.13Å; T210-V214 WeakPolarHBondContact O-CG2 3.34Å; T210-V214 PolarHBondContact O-N 2.88Å; T210-V214 VanDerWaalsContact O-N 3.13Å
211	T	88.1	Confident	77.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.7	-50.5	176	-50.7	0	0	0	0	111.3	F161 L170 Y185 L189 R207 V208 M209 S213 V214 L215	F161-T211 HydrophobicContact CD1-CG2 4.38Å; F161-T211 HydrophobicContact CE1-CG2 3.79Å; L170-T211 HydrophobicContact CD1-CG2 3.97Å; L170-T211 HydrophobicContact CD2-CG2 3.65Å; L170-T211 HydrophobicContact CG-CG2 4.47Å; Y185-T211 WeakPolarHBondContact CE2-OG1 3.48Å; Y185-T211 PolarHBondContact OH-OG1 2.92Å; L189-T211 HydrophobicContact CD2-CG2 3.69Å; R207-T211 WeakPolarHBondContact O-CB 3.38Å; R207-T211 PolarHBondContact O-N 3.47Å; R207-T211 PolarHBondContact O-OG1 3.18Å; V208-T211 WeakPolarHBondContact O-CB 3.49Å; V208-T211 PolarHBondContact O-N 3.29Å; M209-T211 VanDerWaalsContact C-N 3.29Å; M209-T211 PolarHBondContact O-N 2.86Å; T211-S213 PolarHBondContact O-N 3.46Å; T211-V214 PolarHBondContact O-N 3.29Å; T211-V214 VanDerWaalsContact O-N 3.12Å; T211-L215 HydrophobicContact CG2-CD1 3.78Å; T211-L215 HydrophobicContact CG2-CG 4.11Å; T211-L215 VanDerWaalsContact O-CG 3.24Å; T211-L215 WeakPolarHBondContact O-CG 3.29Å; T211-L215 PolarHBondContact O-N 2.88Å
212	L	85.1	Confident	75.1	Confident	13 Å²	13	61.9 Å²	61.9	7%	0.068	34%	0.34	C	S	.	.	H	α-helix	trans	-57.5	-39.7	176.8	-79.3	173.7	0	0	0	112	P160 F161 L199 L203 V208 M209 V214 L215 L216 L220	P160-L212 HydrophobicContact CB-CD2 4.48Å; P160-L212 HydrophobicContact CG-CD2 3.66Å; F161-L212 HydrophobicContact CE2-CD2 3.52Å; F161-L212 HydrophobicContact CE2-CG 4.14Å; F161-L212 HydrophobicContact CZ-CD2 3.6Å; F161-L212 HydrophobicContact CZ-CG 3.76Å; L199-L212 HydrophobicContact CD1-CD1 4.2Å; L203-L212 HydrophobicContact CD2-CD1 3.68Å; V208-L212 HydrophobicContact CG1-CD1 4.36Å; V208-L212 WeakPolarHBondContact O-CB 3.44Å; V208-L212 WeakPolarHBondContact O-CG 3.3Å; V208-L212 PolarHBondContact O-N 2.99Å; M209-L212 PolarHBondContact O-N 3.39Å; M209-L212 HydrophobicContact SD-CD1 4.39Å; L212-V214 VanDerWaalsContact C-N 3.35Å; L212-V214 PolarHBondContact O-N 2.95Å; L212-L215 PolarHBondContact O-N 2.98Å; L212-L216 HydrophobicContact CD2-CD1 4.3Å; L212-L216 VanDerWaalsContact O-CB 3.25Å; L212-L216 WeakPolarHBondContact O-CB 3.39Å; L212-L216 WeakPolarHBondContact O-CG 3.36Å; L212-L216 PolarHBondContact O-N 3.01Å; L212-L220 HydrophobicContact CB-CD1 4.27Å
213	S	82.1	Confident	72.9	Confident	4 Å²	4	66.1 Å²	66.1	3%	0.028	36%	0.362	C	S	.	.	H	α-helix	trans	-56.5	-48.3	175.2	171	0	0	0	0	111.7	M209 T210 T211 G217 L218	M209-S213 WeakPolarHBondContact O-CB 2.98Å; M209-S213 PolarHBondContact O-N 3.38Å; T210-S213 WeakPolarHBondContact O-CB 3.31Å; T210-S213 PolarHBondContact O-N 3.13Å; T211-S213 PolarHBondContact O-N 3.46Å; S213-G217 CarbonylContact O-C 3.56Å; S213-G217 WeakPolarHBondContact O-CA 3.4Å; S213-G217 PolarHBondContact O-N 2.74Å; S213-L218 CarbonylContact C-O 3.47Å; S213-L218 WeakPolarHBondContact CA-O 3.29Å; S213-L218 WeakPolarHBondContact CB-O 3.16Å; S213-L218 PolarHBondContact O-N 3.11Å; S213-L218 PolarHBondContact OG-O 3.07Å
214	V	85.5	Confident	70.6	Confident	10 Å²	10	71.6 Å²	71.6	6%	0.061	39%	0.386	C	S	.	.	H	α-helix	trans	-68	-42.3	177	177.1	0	0	0	0	112.1	K169 L170 D173 T176 T210 T211 L212	K169-V214 WeakPolarHBondContact CE-O 3.45Å; L170-V214 HydrophobicContact CD2-CB 4.23Å; L170-V214 HydrophobicContact CD2-CG1 4.01Å; D173-V214 HydrophobicContact CB-CB 4.44Å; D173-V214 HydrophobicContact CB-CG1 3.6Å; D173-V214 HydrophobicContact CB-CG2 3.9Å; D173-V214 VanDerWaalsContact CG-CG2 3.41Å; D173-V214 WeakPolarHBondContact OD2-CG2 3.3Å; T176-V214 HydrophobicContact CG2-CB 4.28Å; T176-V214 HydrophobicContact CG2-CG2 3.72Å; T210-V214 WeakPolarHBondContact O-CG2 3.34Å; T210-V214 PolarHBondContact O-N 2.88Å; T210-V214 VanDerWaalsContact O-N 3.13Å; T211-V214 PolarHBondContact O-N 3.29Å; T211-V214 VanDerWaalsContact O-N 3.12Å; L212-V214 VanDerWaalsContact C-N 3.35Å; L212-V214 PolarHBondContact O-N 2.95Å
215	L	83.2	Confident	68.2	Low	9 Å²	9	71.8 Å²	71.8	5%	0.047	39%	0.387	C	S	.	.	H	α-helix	trans	-69.1	-41.2	-177	-64.1	-179.7	0	0	0	112.4	P160 F161 M163 L166 K169 L170 T211 L212	P160-L215 HydrophobicContact CB-CB 4.33Å; P160-L215 HydrophobicContact CB-CD1 4.4Å; F161-L215 HydrophobicContact CD1-CD1 3.91Å; F161-L215 HydrophobicContact CE1-CD1 4.08Å; F161-L215 HydrophobicContact CG-CD1 4.36Å; M163-L215 HydrophobicContact SD-CD2 3.7Å; L166-L215 HydrophobicContact CD1-CD1 3.57Å; L166-L215 HydrophobicContact CD1-CD2 3.5Å; L166-L215 HydrophobicContact CD1-CG 4.18Å; K169-L215 HydrophobicContact CD-CD2 4.47Å; K169-L215 PolarHBondContact NZ-O 3.14Å; L170-L215 HydrophobicContact CD2-CD2 3.82Å; L170-L215 HydrophobicContact CD2-CG 4.21Å; L170-L215 HydrophobicContact CG-CD2 4.1Å; T211-L215 HydrophobicContact CG2-CD1 3.78Å; T211-L215 HydrophobicContact CG2-CG 4.11Å; T211-L215 VanDerWaalsContact O-CG 3.24Å; T211-L215 WeakPolarHBondContact O-CG 3.29Å; T211-L215 PolarHBondContact O-N 2.88Å; L212-L215 PolarHBondContact O-N 2.98Å
216	L	78.5	Confident	65.8	Low	83 Å²	83	79.4 Å²	79.4	44%	0.435	42%	0.422	S	S	.	.	H	α-helix	trans	-88.8	-9.9	-179.8	-59.8	176.2	0	0	0	113.2	P160 L212 L218	P160-L216 HydrophobicContact CB-CD2 4.02Å; P160-L216 HydrophobicContact CG-CD2 4.48Å; L212-L216 HydrophobicContact CD2-CD1 4.3Å; L212-L216 VanDerWaalsContact O-CB 3.25Å; L212-L216 WeakPolarHBondContact O-CB 3.39Å; L212-L216 WeakPolarHBondContact O-CG 3.36Å; L212-L216 PolarHBondContact O-N 3.01Å; L216-L218 VanDerWaalsContact C-N 3.28Å; L216-L218 HydrophobicContact CB-CD1 3.93Å; L216-L218 HydrophobicContact CB-CG 4.01Å; L216-L218 HydrophobicContact CD1-CD1 4.28Å; L216-L218 PolarHBondContact O-N 3.36Å
217	G	70.6	Confident	63.3	Low	64 Å²	64	83.9 Å²	83.9	66%	0.66	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	29.5	-177.1	0	0	0	0	0	113.2	S213	S213-G217 CarbonylContact O-C 3.56Å; S213-G217 WeakPolarHBondContact O-CA 3.4Å; S213-G217 PolarHBondContact O-N 2.74Å
218	L	66	Low	60.7	Low	94 Å²	94	89.1 Å²	89.1	49%	0.492	46%	0.461	S	S	.	.			trans	-113.1	124.7	-179	-62.4	174.2	0	0	0	108.4	S213 L216 L220	S213-L218 CarbonylContact C-O 3.47Å; S213-L218 WeakPolarHBondContact CA-O 3.29Å; S213-L218 WeakPolarHBondContact CB-O 3.16Å; S213-L218 PolarHBondContact O-N 3.11Å; S213-L218 PolarHBondContact OG-O 3.07Å; L216-L218 VanDerWaalsContact C-N 3.28Å; L216-L218 HydrophobicContact CB-CD1 3.93Å; L216-L218 HydrophobicContact CB-CG 4.01Å; L216-L218 HydrophobicContact CD1-CD1 4.28Å; L216-L218 PolarHBondContact O-N 3.36Å; L218-L220 HydrophobicContact CB-CG 4.31Å; L218-L220 PolarHBondContact O-N 3.39Å; L218-L220 VanDerWaalsContact O-N 3.13Å
219	N	54.7	Low	57.9	Low	94 Å²	94	98 Å²	98	50%	0.503	50%	0.502	S	S	.	.			trans	-77.3	98.9	168.8	-83.8	-22.8	0	0	0	109.1	R175 S221	R175-N219 PolarHBondContact NH1-OD1 3Å; N219-S221 VanDerWaalsContact C-N 3.32Å
220	L	49.9	Very low	55.3	Low	51 Å²	51	99 Å²	99	27%	0.267	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-85	-3.4	-177.7	-77.5	156.7	0	0	0	113.4	M209 L212 L218 E222 M223	M209-L220 HydrophobicContact CE-CB 4.14Å; M209-L220 HydrophobicContact CE-CD1 4.22Å; M209-L220 HydrophobicContact CE-CD2 4.39Å; M209-L220 HydrophobicContact CE-CG 4.49Å; L212-L220 HydrophobicContact CB-CD1 4.27Å; L218-L220 HydrophobicContact CB-CG 4.31Å; L218-L220 PolarHBondContact O-N 3.39Å; L218-L220 VanDerWaalsContact O-N 3.13Å; L220-E222 VanDerWaalsContact C-N 3.31Å; L220-M223 HydrophobicContact CD2-SD 4.31Å
221	S	41.5	Very low	52.8	Low	98 Å²	98	103.3 Å²	103.3	69%	0.685	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-82.5	-1.6	178.7	49.5	0	0	0	0	114.2	N219	N219-S221 VanDerWaalsContact C-N 3.32Å
222	E	41.6	Very low	50.2	Low	153 Å²	153	108.7 Å²	108.7	72%	0.715	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-100.3	9.9	-179.6	-69.5	178.2	-179.3	0	0	113	L220	L220-E222 VanDerWaalsContact C-N 3.31Å
223	M	35.4	Very low	47.8	Very low	156 Å²	156	113.6 Å²	113.6	77%	0.768	62%	0.62	S	S	*	*	S	Bend	trans	-98.5	-0.5	-176	-73	-173.2	67.8	0	0	115	L220	L220-M223 HydrophobicContact CD2-SD 4.31Å
224	E	33.5	Very low	45.6	Very low	189 Å²	189	119.6 Å²	119.6	88%	0.883	66%	0.659	S	S	*	*	S	Bend	trans	-107.8	-1.1	-177.1	-76.9	-173	165.3	0	0	115.8
225	E	29.1	Very low	43.2	Very low	187 Å²	187	128.6 Å²	128.6	87%	0.874	70%	0.697	S	S	*	*			trans	-132.9	92.8	177.6	-68.7	-176.1	177.7	0	0	111.6
226	E	32.6	Very low	40.9	Very low	196 Å²	196	134.1 Å²	134.1	92%	0.916	73%	0.733	S	S	*	*			trans	-93.4	100.9	156	-82.4	-172	163.4	0	0	108.4
227	E	28.6	Very low	38.8	Very low	190 Å²	190	139.4 Å²	139.4	89%	0.888	75%	0.753	S	S	*	*			trans	-164.1	131.2	140.4	-111.1	176	-164.1	0	0	111.2
228	E	34.5	Very low	37.2	Very low	170 Å²	170	145.4 Å²	145.4	79%	0.794	76%	0.764	S	S	*	*			trans	17.9	108.7	166.8	-60.1	-171.8	159.9	0	0	119.8
229	H	27.6	Very low	35.5	Very low	186 Å²	186	146.5 Å²	146.5	86%	0.861	77%	0.774	S	S	*	*				-174.9	153.7	123.5	-96.3	21.8	0	0	0	113.4
230	A	28.7	Very low	34.8	Very low	86 Å²	86	147.4 Å²	147.4	71%	0.711	79%	0.785	S	S	*	*			trans	-56.3	151.6	-167.1	0	0	0	0	0	116.2	S232	A230-S232 PolarHBondContact O-N 3.47Å
231	P	32	Very low	34.1	Very low	137 Å²	137	149.3 Å²	149.3	89%	0.89	81%	0.809	S	S	*	*			trans	-73.5	131	-177.5	29.2	-32	0	0	0	111.7
232	S	32.7	Very low	33.7	Very low	113 Å²	113	149 Å²	149	79%	0.79	80%	0.804	S	S	*	*			trans	-113.8	156.5	165.4	40.2	0	0	0	0	110.2	A230	A230-S232 PolarHBondContact O-N 3.47Å
233	P	35.9	Very low	33.9	Very low	115 Å²	115	146.9 Å²	146.9	75%	0.747	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-90.2	153.2	-132.6	32.9	-35.1	0	0	0	114.5
234	P	36.2	Very low	33.9	Very low	131 Å²	131	143.8 Å²	143.8	85%	0.851	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-74.6	134.4	178.4	28.9	-31	0	0	0	112
235	K	33.3	Very low	34.4	Very low	199 Å²	199	141.6 Å²	141.6	87%	0.865	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-86.1	157.6	165	-97.6	-175.5	179.3	176	0	111
236	P	35.2	Very low	35.4	Very low	124 Å²	124	140 Å²	140	81%	0.805	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-83.4	134.3	-133.3	-9.9	26.5	0	0	0	114
237	K	35.4	Very low	36	Very low	194 Å²	194	138 Å²	138	84%	0.843	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-78.4	139.1	158.2	-76.3	177.7	175.6	175.2	0	108.8	T239	K237-T239 PolarHBondContact O-N 2.96Å
238	E	37.4	Very low	37.2	Very low	191 Å²	191	135 Å²	135	89%	0.893	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-48.3	122.7	164.7	-74	179.6	154.4	0	0	109.1	P240	E238-P240 VanDerWaalsContact O-CD 3.24Å; E238-P240 WeakPolarHBondContact O-CD 3.44Å
239	T	29.1	Very low	38.6	Very low	116 Å²	116	128.9 Å²	128.9	71%	0.712	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-68.1	118.7	-173.9	32.7	0	0	0	0	110.5	K237	K237-T239 PolarHBondContact O-N 2.96Å
240	P	40	Very low	41.1	Very low	113 Å²	113	123.4 Å²	123.4	73%	0.734	71%	0.709	S	S	*	*	S	Bend	trans	-54.4	143.1	136.7	-5.6	22.8	0	0	0	106.2	E238	E238-P240 VanDerWaalsContact O-CD 3.24Å; E238-P240 WeakPolarHBondContact O-CD 3.44Å
241	A	35.3	Very low	43.7	Very low	92 Å²	92	125.2 Å²	125.2	76%	0.76	70%	0.703	S	S	*	*	S	Bend	trans	-41	123.4	175.1	0	0	0	0	0	109
242	P	34.5	Very low	46.2	Very low	90 Å²	90	122 Å²	122	58%	0.584	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-56.4	136.5	-171.6	19.9	-29.8	0	0	0	108.1
243	P	44.3	Very low	48.7	Very low	110 Å²	110	120.2 Å²	120.2	71%	0.714	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-51.8	141.8	162	24.1	-30.2	0	0	0	107	K245	P243-K245 PolarHBondContact O-N 3.23Å; P243-K245 VanDerWaalsContact O-N 3.12Å
244	P	36.2	Very low	51.1	Low	90 Å²	90	118.1 Å²	118.1	58%	0.584	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-47.8	128.3	-176.7	17.3	-29	0	0	0	108.7	E246	P244-E246 PolarHBondContact O-N 3.46Å
245	K	44.5	Very low	53.6	Low	143 Å²	143	115.4 Å²	115.4	62%	0.622	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-48.7	143.8	178.9	-70	175.8	178	179.9	0	108	P243 E247 D248	P243-K245 PolarHBondContact O-N 3.23Å; P243-K245 VanDerWaalsContact O-N 3.12Å; K245-E247 PolarHBondContact O-N 3.49Å; K245-D248 PolarHBondContact O-N 3.06Å
246	E	48.3	Very low	56.3	Low	153 Å²	153	105.9 Å²	105.9	72%	0.715	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-49.8	-21.5	177.5	-81.2	-178	151.3	0	0	112.8	P244 K254	P244-E246 PolarHBondContact O-N 3.46Å; E246-K254 WeakPolarHBondContact O-CE 3.18Å
247	E	46.8	Very low	58.9	Low	154 Å²	154	102.4 Å²	102.4	72%	0.72	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-65.3	-30.6	175	-67.8	176.8	152.7	0	0	114.5	K245 K254	K245-E247 PolarHBondContact O-N 3.49Å; E247-K254 PolarHBondContact O-NZ 3.47Å
248	D	53.7	Low	61.6	Low	129 Å²	129	100.3 Å²	100.3	69%	0.69	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-96	-0.1	-176.2	-75.7	-36.9	0	0	0	114.5	K245	K245-D248 PolarHBondContact O-N 3.06Å
249	L	63.9	Low	64.3	Low	41 Å²	41	93.2 Å²	93.2	22%	0.215	50%	0.503	C	S	.	.	S	Bend	trans	-73.9	137.3	178	-79.3	162.9	0	0	0	111.1	E251 K253 K254 L257	L249-E251 PolarHBondContact O-N 2.96Å; L249-K253 HydrophobicContact CD2-CB 4.33Å; L249-K253 HydrophobicContact CD2-CD 4.1Å; L249-K254 HydrophobicContact CB-CG 4.05Å; L249-K254 WeakPolarHBondContact O-CE 3.3Å; L249-K254 PolarHBondContact O-NZ 3.39Å; L249-K254 VanDerWaalsContact O-NZ 3.17Å; L249-L257 HydrophobicContact CD1-CD1 4.1Å
250	P	79.7	Confident	67.3	Low	70 Å²	70	89.3 Å²	89.3	46%	0.455	48%	0.477	S	S	.	.			trans	-49.3	139.8	169.1	-30.6	37.8	0	0	0	111.8	N252 K253 K254	P250-N252 WeakPolarHBondContact CB-OD1 3.15Å; P250-N252 PolarHBondContact O-N 3.1Å; P250-N252 VanDerWaalsContact O-N 3.09Å; P250-K253 WeakPolarHBondContact O-CA 3.28Å; P250-K253 WeakPolarHBondContact O-CB 3.29Å; P250-K253 PolarHBondContact O-N 3.35Å; P250-K254 PolarHBondContact O-N 3.18Å
251	E	83	Confident	69.8	Low	124 Å²	124	88.8 Å²	88.8	58%	0.579	46%	0.464	S	S	*	.	H	α-helix	trans	-54.9	-34.8	-173.2	-169.6	60.6	-161.1	0	0	112.9	L249 K253 K254 M255	L249-E251 PolarHBondContact O-N 2.96Å; E251-K253 PolarHBondContact O-N 3.46Å; E251-K254 PolarHBondContact O-N 3.47Å; E251-M255 HydrophobicContact CG-CE 4.27Å; E251-M255 WeakPolarHBondContact O-CG 3.4Å; E251-M255 PolarHBondContact O-N 3.19Å
252	N	83.9	Confident	72.6	Confident	69 Å²	69	88 Å²	88	37%	0.369	45%	0.447	S	S	.	.	H	α-helix	trans	-63	-38.8	174.9	66.9	-40.9	0	0	0	112.9	P250 A256 H285	P250-N252 WeakPolarHBondContact CB-OD1 3.15Å; P250-N252 PolarHBondContact O-N 3.1Å; P250-N252 VanDerWaalsContact O-N 3.09Å; N252-A256 WeakPolarHBondContact O-CB 3.32Å; N252-A256 PolarHBondContact O-N 3.48Å; N252-H285 WeakPolarHBondContact CB-O 3.4Å; N252-H285 PolarHBondContact ND2-O 2.96Å
253	K	85.6	Confident	75.4	Confident	77 Å²	77	83.7 Å²	83.7	34%	0.335	42%	0.419	S	S	.	.	H	α-helix	trans	-70.9	-35.5	176.2	-66.5	-166.8	172.2	-170.1	0	112.3	L249 P250 E251 A256 L257	L249-K253 HydrophobicContact CD2-CB 4.33Å; L249-K253 HydrophobicContact CD2-CD 4.1Å; P250-K253 WeakPolarHBondContact O-CA 3.28Å; P250-K253 WeakPolarHBondContact O-CB 3.29Å; P250-K253 PolarHBondContact O-N 3.35Å; E251-K253 PolarHBondContact O-N 3.46Å; K253-A256 PolarHBondContact O-N 3.09Å; K253-L257 WeakPolarHBondContact O-CG 3.37Å; K253-L257 PolarHBondContact O-N 3.45Å
254	K	87.5	Confident	77.7	Confident	70 Å²	70	80.1 Å²	80.1	30%	0.304	39%	0.394	S	S	.	.	H	α-helix	trans	-62.4	-48	173.6	-71.4	170.7	171.8	157.8	0	111.4	E246 E247 L249 P250 E251 A256 L257 K258	E246-K254 WeakPolarHBondContact O-CE 3.18Å; E247-K254 PolarHBondContact O-NZ 3.47Å; L249-K254 HydrophobicContact CB-CG 4.05Å; L249-K254 WeakPolarHBondContact O-CE 3.3Å; L249-K254 PolarHBondContact O-NZ 3.39Å; L249-K254 VanDerWaalsContact O-NZ 3.17Å; P250-K254 PolarHBondContact O-N 3.18Å; E251-K254 PolarHBondContact O-N 3.47Å; K254-A256 PolarHBondContact O-N 3.01Å; K254-L257 PolarHBondContact O-N 3.49Å; K254-K258 PolarHBondContact O-N 2.89Å; K254-K258 VanDerWaalsContact O-N 3.07Å
255	M	88.5	Confident	80.5	Confident	74 Å²	74	78.2 Å²	78.2	37%	0.365	39%	0.385	S	S	.	.	H	α-helix	trans	-60.6	-43.8	175.6	-69.9	-172.8	-69.4	0	0	111.7	E251 L257 K258 E259	E251-M255 HydrophobicContact CG-CE 4.27Å; E251-M255 WeakPolarHBondContact O-CG 3.4Å; E251-M255 PolarHBondContact O-N 3.19Å; M255-L257 PolarHBondContact O-N 2.95Å; M255-K258 PolarHBondContact O-N 3.36Å; M255-E259 WeakPolarHBondContact O-CG 3.43Å; M255-E259 PolarHBondContact O-N 3.11Å
256	A	90	Very high	82.8	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-61.9	-40.4	178	0	0	0	0	0	112.9	N252 K253 K254 K260 A282 H285 D286 Y292	N252-A256 WeakPolarHBondContact O-CB 3.32Å; N252-A256 PolarHBondContact O-N 3.48Å; K253-A256 PolarHBondContact O-N 3.09Å; K254-A256 PolarHBondContact O-N 3.01Å; A256-K260 WeakPolarHBondContact O-CB 3.27Å; A256-K260 PolarHBondContact O-N 2.9Å; A256-A282 WeakPolarHBondContact CB-O 3.46Å; A256-A282 WeakPolarHBondContact O-CB 3.26Å; A256-H285 HydrophobicContact CB-CB 3.78Å; A256-D286 HydrophobicContact CB-CB 3.7Å; A256-Y292 HydrophobicContact CB-CE2 4.1Å; A256-Y292 VanDerWaalsContact CB-OH 3.28Å; A256-Y292 WeakPolarHBondContact CB-OH 3.27Å
257	L	89	Confident	85	Confident	50 Å²	50	67.3 Å²	67.3	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-65.7	-40.7	175.8	-73.6	170.6	0	0	0	112.4	L249 K253 K254 M255 K260 E261	L249-L257 HydrophobicContact CD1-CD1 4.1Å; K253-L257 WeakPolarHBondContact O-CG 3.37Å; K253-L257 PolarHBondContact O-N 3.45Å; K254-L257 PolarHBondContact O-N 3.49Å; M255-L257 PolarHBondContact O-N 2.95Å; L257-K260 WeakPolarHBondContact O-CB 3.28Å; L257-K260 PolarHBondContact O-N 2.7Å; L257-E261 PolarHBondContact O-N 2.99Å
258	K	91.8	Very high	87.2	Confident	150 Å²	150	68 Å²	68	65%	0.652	34%	0.336	S	S	*	.	H	α-helix	trans	-61.8	-47.7	176.1	-174.6	178.9	179.2	-179.7	0	111.6	K254 M255 K260 E261 L262	K254-K258 PolarHBondContact O-N 2.89Å; K254-K258 VanDerWaalsContact O-N 3.07Å; M255-K258 PolarHBondContact O-N 3.36Å; K258-K260 VanDerWaalsContact C-N 3.31Å; K258-K260 PolarHBondContact O-N 2.93Å; K258-E261 PolarHBondContact O-N 3.24Å; K258-L262 WeakPolarHBondContact O-CG 3.4Å; K258-L262 PolarHBondContact O-N 3.38Å; K258-L262 VanDerWaalsContact O-N 3.09Å
259	E	93.8	Very high	89.1	Confident	42 Å²	42	68.2 Å²	68.2	20%	0.196	34%	0.337	C	S	.	.	H	α-helix	trans	-61.1	-40.7	175.6	-70.8	-60.9	151.9	0	0	111.5	M255 E261 L262 G263 H278 Q281 A282	M255-E259 WeakPolarHBondContact O-CG 3.43Å; M255-E259 PolarHBondContact O-N 3.11Å; E259-E261 PolarHBondContact O-N 3.23Å; E259-L262 PolarHBondContact O-N 2.98Å; E259-G263 PolarHBondContact O-N 3.31Å; E259-H278 WeakPolarHBondContact O-CB 3.45Å; E259-H278 IonicContact OE2-CE1 2.74Å; E259-H278 IonicContact OE2-CG 2.9Å; E259-H278 IonicContact OE2-ND1 3.2Å; E259-H278 PolarHBondContact OE2-ND1 3.49Å; E259-Q281 HydrophobicContact CG-CB 4.19Å; E259-Q281 HydrophobicContact CG-CG 3.99Å; E259-A282 HydrophobicContact CB-CB 3.89Å
260	K	92.8	Very high	90.5	Very high	35 Å²	35	74 Å²	74	15%	0.152	36%	0.361	C	S	.	.	H	α-helix	trans	-59.5	-44.1	174.2	-179.2	-148.2	67.6	175.8	0	112.5	A256 L257 K258 G263 N264 Y279 A282 Y292	A256-K260 WeakPolarHBondContact O-CB 3.27Å; A256-K260 PolarHBondContact O-N 2.9Å; L257-K260 WeakPolarHBondContact O-CB 3.28Å; L257-K260 PolarHBondContact O-N 2.7Å; K258-K260 VanDerWaalsContact C-N 3.31Å; K258-K260 PolarHBondContact O-N 2.93Å; K260-G263 PolarHBondContact O-N 2.88Å; K260-N264 WeakPolarHBondContact O-CB 3.35Å; K260-N264 PolarHBondContact O-N 3.08Å; K260-N264 PolarHBondContact O-OD1 2.89Å; K260-Y279 HydrophobicContact CG-CE1 4.49Å; K260-A282 HydrophobicContact CB-CB 4.48Å; K260-Y292 HydrophobicContact CB-CD1 3.89Å; K260-Y292 HydrophobicContact CB-CE1 3.56Å; K260-Y292 HydrophobicContact CD-CD1 4.3Å; K260-Y292 HydrophobicContact CD-CE1 3.87Å; K260-Y292 HydrophobicContact CG-CD1 3.85Å; K260-Y292 HydrophobicContact CG-CE1 3.75Å
261	E	93.4	Very high	91.2	Very high	101 Å²	101	74 Å²	74	47%	0.472	36%	0.357	S	S	.	.	H	α-helix	trans	-67.2	-36.1	178.2	-65.6	-52.1	150.5	0	0	112.6	L257 K258 E259 G263 N264 A265	L257-E261 PolarHBondContact O-N 2.99Å; K258-E261 PolarHBondContact O-N 3.24Å; E259-E261 PolarHBondContact O-N 3.23Å; E261-G263 VanDerWaalsContact C-N 3.33Å; E261-N264 PolarHBondContact O-N 3.45Å; E261-N264 PolarHBondContact OE2-ND2 3.15Å; E261-N264 VanDerWaalsContact OE2-ND2 3.1Å; E261-A265 WeakPolarHBondContact O-CB 3.42Å; E261-A265 PolarHBondContact O-N 3.01Å
262	L	93.2	Very high	91.7	Very high	75 Å²	75	70.4 Å²	70.4	39%	0.393	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-41.6	170.8	-68	174	0	0	0	111.5	K258 E259 A265 A266 H278	K258-L262 WeakPolarHBondContact O-CG 3.4Å; K258-L262 PolarHBondContact O-N 3.38Å; K258-L262 VanDerWaalsContact O-N 3.09Å; E259-L262 PolarHBondContact O-N 2.98Å; L262-A265 PolarHBondContact O-N 3.25Å; L262-A266 WeakPolarHBondContact O-CB 3.47Å; L262-A266 PolarHBondContact O-N 3.31Å; L262-H278 HydrophobicContact CB-CB 4.43Å
263	G	93.8	Very high	92.2	Very high	0 Å²	0	74 Å²	74	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62.6	-43.3	173.6	0	0	0	0	0	112.6	E259 K260 E261 A265 A266 Y267 A275 Y279	E259-G263 PolarHBondContact O-N 3.31Å; K260-G263 PolarHBondContact O-N 2.88Å; E261-G263 VanDerWaalsContact C-N 3.33Å; G263-A265 VanDerWaalsContact C-N 3.34Å; G263-A265 PolarHBondContact O-N 2.98Å; G263-A266 PolarHBondContact O-N 3.42Å; G263-Y267 WeakPolarHBondContact O-CB 3.45Å; G263-Y267 PolarHBondContact O-N 3.24Å; G263-A275 WeakPolarHBondContact O-CB 3.39Å; G263-Y279 VanDerWaalsContact C-CZ 3.46Å; G263-Y279 VanDerWaalsContact C-OH 3.24Å; G263-Y279 PolarHBondContact O-OH 2.92Å
264	N	92.7	Very high	92.6	Very high	36 Å²	36	75.3 Å²	75.3	19%	0.193	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-41.6	176.1	-69.8	-18.4	0	0	0	111.4	K260 E261 Y267 K268 Y279 N295	K260-N264 WeakPolarHBondContact O-CB 3.35Å; K260-N264 PolarHBondContact O-N 3.08Å; K260-N264 PolarHBondContact O-OD1 2.89Å; E261-N264 PolarHBondContact O-N 3.45Å; E261-N264 PolarHBondContact OE2-ND2 3.15Å; E261-N264 VanDerWaalsContact OE2-ND2 3.1Å; N264-Y267 PolarHBondContact O-N 3.32Å; N264-K268 WeakPolarHBondContact O-CG 3.26Å; N264-K268 PolarHBondContact O-N 2.96Å; N264-Y279 WeakPolarHBondContact CA-OH 3.34Å; N264-Y279 PolarHBondContact N-OH 2.96Å; N264-Y279 PolarHBondContact OD1-OH 3.26Å; N264-N295 PolarHBondContact OD1-ND2 3.11Å
265	A	94.1	Very high	93	Very high	49 Å²	49	72 Å²	72	41%	0.405	35%	0.345	S	S	.	.	H	α-helix	trans	-64.5	-45.1	176.5	0	0	0	0	0	111.5	E261 L262 G263 Y267 K268 N269	E261-A265 WeakPolarHBondContact O-CB 3.42Å; E261-A265 PolarHBondContact O-N 3.01Å; L262-A265 PolarHBondContact O-N 3.25Å; G263-A265 VanDerWaalsContact C-N 3.34Å; G263-A265 PolarHBondContact O-N 2.98Å; A265-Y267 VanDerWaalsContact C-N 3.35Å; A265-Y267 PolarHBondContact O-N 2.97Å; A265-K268 PolarHBondContact O-N 2.92Å; A265-N269 PolarHBondContact O-N 3.3Å; A265-N269 VanDerWaalsContact O-N 3.13Å; A265-N269 PolarHBondContact O-ND2 3.28Å
266	A	94	Very high	93.3	Very high	6 Å²	6	69.4 Å²	69.4	5%	0.05	33%	0.333	C	S	.	.	H	α-helix	trans	-62.1	-40.8	174.3	0	0	0	0	0	112.1	L262 G263 N269 K270 D271 K274 A275	L262-A266 WeakPolarHBondContact O-CB 3.47Å; L262-A266 PolarHBondContact O-N 3.31Å; G263-A266 PolarHBondContact O-N 3.42Å; A266-N269 CarbonylContact O-C 3.45Å; A266-N269 PolarHBondContact O-N 3.42Å; A266-N269 VanDerWaalsContact O-N 3.15Å; A266-K270 PolarHBondContact O-N 3.26Å; A266-D271 HydrophobicContact CB-CB 4.42Å; A266-D271 PolarHBondContact O-N 3.5Å; A266-K274 HydrophobicContact CB-CB 4.13Å; A266-K274 HydrophobicContact CB-CD 4.39Å; A266-K274 HydrophobicContact CB-CG 4.16Å; A266-A275 HydrophobicContact CB-CB 3.94Å
267	Y	93.6	Very high	93.6	Very high	61 Å²	61	76.4 Å²	76.4	24%	0.239	36%	0.363	C	S	.	.	H	α-helix	trans	-61.3	-44.7	176.2	179	-97.1	0	0	0	112.4	G263 N264 A265 N269 K270 F272 A298 V299 E302	G263-Y267 WeakPolarHBondContact O-CB 3.45Å; G263-Y267 PolarHBondContact O-N 3.24Å; N264-Y267 PolarHBondContact O-N 3.32Å; A265-Y267 VanDerWaalsContact C-N 3.35Å; A265-Y267 PolarHBondContact O-N 2.97Å; Y267-N269 PolarHBondContact O-N 3.34Å; Y267-K270 WeakPolarHBondContact O-CA 3.5Å; Y267-K270 PolarHBondContact O-N 2.89Å; Y267-F272 HydrophobicContact CD2-CD1 4.13Å; Y267-F272 HydrophobicContact CD2-CE1 4.02Å; Y267-F272 HydrophobicContact CE2-CD1 4.45Å; Y267-F272 HydrophobicContact CE2-CE1 4.04Å; Y267-A298 HydrophobicContact CE2-CB 4.3Å; Y267-V299 HydrophobicContact CD2-CG2 3.79Å; Y267-V299 HydrophobicContact CE2-CG2 4.12Å; Y267-E302 HydrophobicContact CE2-CG 4.1Å; Y267-E302 WeakPolarHBondContact OH-CG 3.37Å
268	K	93.6	Very high	93.9	Very high	170 Å²	170	75.9 Å²	75.9	74%	0.739	36%	0.359	S	S	*	.	H	α-helix	trans	-60.4	-35.6	174.8	-74.4	177.1	-179.2	-178.5	0	112	N264 A265 K270	N264-K268 WeakPolarHBondContact O-CG 3.26Å; N264-K268 PolarHBondContact O-N 2.96Å; A265-K268 PolarHBondContact O-N 2.92Å; K268-K270 PolarHBondContact O-N 3.37Å
269	N	93.8	Very high	94.1	Very high	133 Å²	133	68.9 Å²	68.9	71%	0.711	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	4.4	175.1	-65.3	-18.3	0	0	0	113.5	A265 A266 Y267 D271	A265-N269 PolarHBondContact O-N 3.3Å; A265-N269 VanDerWaalsContact O-N 3.13Å; A265-N269 PolarHBondContact O-ND2 3.28Å; A266-N269 CarbonylContact O-C 3.45Å; A266-N269 PolarHBondContact O-N 3.42Å; A266-N269 VanDerWaalsContact O-N 3.15Å; Y267-N269 PolarHBondContact O-N 3.34Å; N269-D271 PolarHBondContact O-N 2.79Å; N269-D271 VanDerWaalsContact O-N 3.13Å
270	K	92.3	Very high	94.1	Very high	162 Å²	162	70.4 Å²	70.4	70%	0.704	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	18	-173.8	-57.9	-176.6	176.7	-177.7	0	114.5	A266 Y267 K268 F272	A266-K270 PolarHBondContact O-N 3.26Å; Y267-K270 WeakPolarHBondContact O-CA 3.5Å; Y267-K270 PolarHBondContact O-N 2.89Å; K268-K270 PolarHBondContact O-N 3.37Å; K270-F272 VanDerWaalsContact C-N 3.26Å; K270-F272 HydrophobicContact CB-CE1 4.48Å; K270-F272 HydrophobicContact CB-CE2 4.49Å; K270-F272 HydrophobicContact CB-CZ 4.18Å; K270-F272 HydrophobicContact CG-CZ 4.36Å; K270-F272 PolarHBondContact O-N 2.99Å
271	D	95.1	Very high	94.1	Very high	71 Å²	71	71.8 Å²	71.8	38%	0.38	35%	0.346	S	S	.	.			trans	-82.6	77.1	170.9	-174	-9.6	0	0	0	108.8	A266 N269 E273 K274 A275	A266-D271 HydrophobicContact CB-CB 4.42Å; A266-D271 PolarHBondContact O-N 3.5Å; N269-D271 PolarHBondContact O-N 2.79Å; N269-D271 VanDerWaalsContact O-N 3.13Å; D271-E273 PolarHBondContact O-N 2.79Å; D271-K274 HydrophobicContact CB-CB 4.29Å; D271-K274 PolarHBondContact O-N 2.86Å; D271-K274 WeakPolarHBondContact OD1-CB 3.38Å; D271-K274 PolarHBondContact OD1-N 3.16Å; D271-K274 WeakPolarHBondContact OD2-CB 3.48Å; D271-K274 VanDerWaalsContact OD2-CD 3.3Å; D271-K274 WeakPolarHBondContact OD2-CD 3.19Å; D271-A275 WeakPolarHBondContact O-CB 3.22Å; D271-A275 PolarHBondContact O-N 3.35Å
272	F	94.3	Very high	94	Very high	48 Å²	48	67 Å²	67	21%	0.211	32%	0.323	C	S	.	.	H	α-helix	trans	-66.7	-34	-172	-64.9	-41.8	0	0	0	113.4	Y267 K270 A275 L276 V299 E302 K303	Y267-F272 HydrophobicContact CD2-CD1 4.13Å; Y267-F272 HydrophobicContact CD2-CE1 4.02Å; Y267-F272 HydrophobicContact CE2-CD1 4.45Å; Y267-F272 HydrophobicContact CE2-CE1 4.04Å; K270-F272 VanDerWaalsContact C-N 3.26Å; K270-F272 HydrophobicContact CB-CE1 4.48Å; K270-F272 HydrophobicContact CB-CE2 4.49Å; K270-F272 HydrophobicContact CB-CZ 4.18Å; K270-F272 HydrophobicContact CG-CZ 4.36Å; K270-F272 PolarHBondContact O-N 2.99Å; F272-A275 PolarHBondContact O-N 3.39Å; F272-L276 VanDerWaalsContact O-CG 3.29Å; F272-L276 WeakPolarHBondContact O-CG 3.24Å; F272-L276 PolarHBondContact O-N 3.35Å; F272-V299 HydrophobicContact CB-CG1 3.51Å; F272-V299 HydrophobicContact CD1-CG1 3.68Å; F272-V299 HydrophobicContact CG-CG1 3.78Å; F272-E302 HydrophobicContact CE1-CB 4.06Å; F272-E302 HydrophobicContact CE2-CB 4.4Å; F272-E302 HydrophobicContact CZ-CB 3.71Å; F272-E302 HydrophobicContact CZ-CG 4.44Å; F272-K303 HydrophobicContact CB-CD 4.37Å; F272-K303 HydrophobicContact CD2-CG 3.92Å; F272-K303 HydrophobicContact CE2-CG 4.43Å; F272-K303 HydrophobicContact CG-CG 4.34Å
273	E	94.4	Very high	94	Very high	145 Å²	145	65.4 Å²	65.4	68%	0.678	32%	0.315	S	S	*	.	H	α-helix	trans	-68.4	-44.1	178.1	-65.6	-172.3	179.1	0	0	111.4	D271 L276 K277	D271-E273 PolarHBondContact O-N 2.79Å; E273-L276 PolarHBondContact O-N 3.37Å; E273-K277 WeakPolarHBondContact O-CG 3.19Å; E273-K277 PolarHBondContact O-N 2.92Å; E273-K277 VanDerWaalsContact O-N 3.11Å
274	K	94.2	Very high	93.9	Very high	104 Å²	104	72.8 Å²	72.8	45%	0.452	35%	0.347	S	S	.	.	H	α-helix	trans	-67.4	-38.2	175.8	-170	176.1	179.9	180	0	111.6	A266 D271 K277 H278	A266-K274 HydrophobicContact CB-CB 4.13Å; A266-K274 HydrophobicContact CB-CD 4.39Å; A266-K274 HydrophobicContact CB-CG 4.16Å; D271-K274 HydrophobicContact CB-CB 4.29Å; D271-K274 PolarHBondContact O-N 2.86Å; D271-K274 WeakPolarHBondContact OD1-CB 3.38Å; D271-K274 PolarHBondContact OD1-N 3.16Å; D271-K274 WeakPolarHBondContact OD2-CB 3.48Å; D271-K274 VanDerWaalsContact OD2-CD 3.3Å; D271-K274 WeakPolarHBondContact OD2-CD 3.19Å; K274-K277 PolarHBondContact O-N 3.3Å; K274-H278 PolarHBondContact O-CD2 3.48Å; K274-H278 PolarHBondContact O-N 3.49Å; K274-H278 VanDerWaalsContact O-N 3.1Å
275	A	94.3	Very high	93.8	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-59.1	-48	174.6	0	0	0	0	0	111.7	G263 A266 D271 F272 K277 H278 Y279 V299	G263-A275 WeakPolarHBondContact O-CB 3.39Å; A266-A275 HydrophobicContact CB-CB 3.94Å; D271-A275 WeakPolarHBondContact O-CB 3.22Å; D271-A275 PolarHBondContact O-N 3.35Å; F272-A275 PolarHBondContact O-N 3.39Å; A275-K277 PolarHBondContact O-N 2.86Å; A275-H278 PolarHBondContact O-N 3.2Å; A275-Y279 HydrophobicContact CB-CD2 4.49Å; A275-Y279 HydrophobicContact CB-CE2 4.01Å; A275-Y279 WeakPolarHBondContact O-CD2 3.28Å; A275-Y279 VanDerWaalsContact O-CG 3.28Å; A275-Y279 PolarHBondContact O-N 3.02Å; A275-V299 HydrophobicContact CB-CG2 4.39Å
276	L	94.9	Very high	93.5	Very high	20 Å²	20	71.3 Å²	71.3	11%	0.105	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-43.4	177.4	-72.7	170.9	0	0	0	112.2	F272 E273 H278 Y279 D280 Q296 V299 Y300	F272-L276 VanDerWaalsContact O-CG 3.29Å; F272-L276 WeakPolarHBondContact O-CG 3.24Å; F272-L276 PolarHBondContact O-N 3.35Å; E273-L276 PolarHBondContact O-N 3.37Å; L276-H278 PolarHBondContact O-N 2.7Å; L276-Y279 PolarHBondContact O-N 3.17Å; L276-D280 PolarHBondContact O-N 2.96Å; L276-Q296 HydrophobicContact CD2-CB 3.96Å; L276-Q296 HydrophobicContact CD2-CG 3.95Å; L276-V299 HydrophobicContact CD1-CG1 4.1Å; L276-V299 HydrophobicContact CD2-CB 3.94Å; L276-V299 HydrophobicContact CD2-CG1 4.16Å; L276-V299 HydrophobicContact CD2-CG2 4.03Å; L276-V299 HydrophobicContact CG-CB 4.24Å; L276-V299 HydrophobicContact CG-CG1 3.93Å; L276-V299 HydrophobicContact CG-CG2 4.33Å; L276-Y300 HydrophobicContact CD1-CE1 4.43Å; L276-Y300 HydrophobicContact CD1-CE2 4.24Å; L276-Y300 HydrophobicContact CD2-CD2 4.3Å; L276-Y300 HydrophobicContact CD2-CE2 3.7Å
277	K	95.9	Very high	93.2	Very high	147 Å²	147	75 Å²	75	64%	0.639	35%	0.354	S	S	*	.	H	α-helix	trans	-58.4	-45.5	176.7	-74.3	175.7	-176.9	173.1	0	112.5	E273 K274 A275 D280 Q281	E273-K277 WeakPolarHBondContact O-CG 3.19Å; E273-K277 PolarHBondContact O-N 2.92Å; E273-K277 VanDerWaalsContact O-N 3.11Å; K274-K277 PolarHBondContact O-N 3.3Å; A275-K277 PolarHBondContact O-N 2.86Å; K277-D280 PolarHBondContact O-N 3.01Å; K277-Q281 PolarHBondContact O-N 2.74Å
278	H	96.1	Very high	92.9	Very high	38 Å²	38	74.8 Å²	74.8	18%	0.176	36%	0.359	C	S	.	.	H	α-helix	trans	-68.3	-38	178	-76.9	-60.3	0	0	0	112.1	E259 L262 K274 A275 L276 Q281 A282	E259-H278 WeakPolarHBondContact O-CB 3.45Å; E259-H278 IonicContact OE2-CE1 2.74Å; E259-H278 IonicContact OE2-CG 2.9Å; E259-H278 IonicContact OE2-ND1 3.2Å; E259-H278 PolarHBondContact OE2-ND1 3.49Å; L262-H278 HydrophobicContact CB-CB 4.43Å; K274-H278 PolarHBondContact O-CD2 3.48Å; K274-H278 PolarHBondContact O-N 3.49Å; K274-H278 VanDerWaalsContact O-N 3.1Å; A275-H278 PolarHBondContact O-N 3.2Å; L276-H278 PolarHBondContact O-N 2.7Å; H278-Q281 PolarHBondContact O-N 2.89Å; H278-A282 PolarHBondContact O-N 3.26Å
279	Y	95.3	Very high	92.5	Very high	3 Å²	3	68.1 Å²	68.1	1%	0.012	33%	0.332	C	S	.	.	H	α-helix	trans	-68.2	-37	174.3	-61.4	-41.9	0	0	0	113.2	K260 G263 N264 A275 L276 Q281 A282 L283 N295 Q296 V299	K260-Y279 HydrophobicContact CG-CE1 4.49Å; G263-Y279 VanDerWaalsContact C-CZ 3.46Å; G263-Y279 VanDerWaalsContact C-OH 3.24Å; G263-Y279 PolarHBondContact O-OH 2.92Å; N264-Y279 WeakPolarHBondContact CA-OH 3.34Å; N264-Y279 PolarHBondContact N-OH 2.96Å; N264-Y279 PolarHBondContact OD1-OH 3.26Å; A275-Y279 HydrophobicContact CB-CD2 4.49Å; A275-Y279 HydrophobicContact CB-CE2 4.01Å; A275-Y279 WeakPolarHBondContact O-CD2 3.28Å; A275-Y279 VanDerWaalsContact O-CG 3.28Å; A275-Y279 PolarHBondContact O-N 3.02Å; L276-Y279 PolarHBondContact O-N 3.17Å; Y279-Q281 VanDerWaalsContact C-N 3.29Å; Y279-Q281 PolarHBondContact O-N 2.9Å; Y279-A282 WeakPolarHBondContact O-CB 3.33Å; Y279-A282 PolarHBondContact O-N 2.9Å; Y279-L283 PolarHBondContact O-N 3.25Å; Y279-N295 HydrophobicContact CD1-CB 4.14Å; Y279-N295 HydrophobicContact CD2-CB 4.17Å; Y279-N295 HydrophobicContact CE1-CB 3.81Å; Y279-N295 HydrophobicContact CE2-CB 3.84Å; Y279-N295 HydrophobicContact CG-CB 4.32Å; Y279-Q296 HydrophobicContact CD2-CG 4Å; Y279-Q296 HydrophobicContact CG-CG 4.16Å; Y279-V299 HydrophobicContact CD2-CG2 4.28Å; Y279-V299 HydrophobicContact CE2-CG2 3.89Å
280	D	94.5	Very high	92.4	Very high	74 Å²	74	61.9 Å²	61.9	40%	0.396	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-41.1	172.2	-79.6	-33.6	0	0	0	111	L276 K277 L283 K284 Q296	L276-D280 PolarHBondContact O-N 2.96Å; K277-D280 PolarHBondContact O-N 3.01Å; D280-L283 PolarHBondContact O-N 3Å; D280-K284 WeakPolarHBondContact O-CG 3.49Å; D280-K284 PolarHBondContact O-N 3.45Å; D280-K284 VanDerWaalsContact O-N 3.08Å; D280-Q296 PolarHBondContact OD1-NE2 3.48Å
281	Q	93.1	Very high	92.3	Very high	65 Å²	65	55.5 Å²	55.5	30%	0.304	27%	0.273	S	S	.	.	H	α-helix	trans	-67.8	-39.3	177.3	-163.5	64	10.8	0	0	111.6	E259 K277 H278 Y279 L283 K284 H285	E259-Q281 HydrophobicContact CG-CB 4.19Å; E259-Q281 HydrophobicContact CG-CG 3.99Å; K277-Q281 PolarHBondContact O-N 2.74Å; H278-Q281 PolarHBondContact O-N 2.89Å; Y279-Q281 VanDerWaalsContact C-N 3.29Å; Y279-Q281 PolarHBondContact O-N 2.9Å; Q281-L283 VanDerWaalsContact C-N 3.34Å; Q281-L283 PolarHBondContact O-N 3.48Å; Q281-K284 PolarHBondContact O-N 2.87Å; Q281-K284 VanDerWaalsContact OE1-NZ 3.14Å; Q281-H285 PolarHBondContact NE2-NE2 2.75Å; Q281-H285 PolarHBondContact O-CD2 3.35Å; Q281-H285 PolarHBondContact O-N 3.17Å
282	A	91.7	Very high	92.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-43.7	172.6	0	0	0	0	0	112	A256 E259 K260 H278 Y279 K284 H285 D286 Y292	A256-A282 WeakPolarHBondContact CB-O 3.46Å; A256-A282 WeakPolarHBondContact O-CB 3.26Å; E259-A282 HydrophobicContact CB-CB 3.89Å; K260-A282 HydrophobicContact CB-CB 4.48Å; H278-A282 PolarHBondContact O-N 3.26Å; Y279-A282 WeakPolarHBondContact O-CB 3.33Å; Y279-A282 PolarHBondContact O-N 2.9Å; A282-K284 VanDerWaalsContact C-N 3.34Å; A282-K284 PolarHBondContact O-N 3.26Å; A282-H285 PolarHBondContact O-N 2.76Å; A282-H285 VanDerWaalsContact O-N 3.15Å; A282-D286 PolarHBondContact O-N 2.84Å; A282-Y292 HydrophobicContact CB-CD1 3.75Å; A282-Y292 HydrophobicContact CB-CD2 4.19Å; A282-Y292 HydrophobicContact CB-CE1 3.95Å; A282-Y292 HydrophobicContact CB-CE2 4.33Å; A282-Y292 HydrophobicContact CB-CG 3.89Å
283	L	92.1	Very high	92	Very high	42 Å²	42	50.9 Å²	50.9	22%	0.22	25%	0.25	C	C	.	.	H	α-helix	trans	-65.3	-33.6	178.6	-167.9	69.8	0	0	0	112.8	Y279 D280 Q281 H285 D286 P287 Y292 M293	Y279-L283 PolarHBondContact O-N 3.25Å; D280-L283 PolarHBondContact O-N 3Å; Q281-L283 VanDerWaalsContact C-N 3.34Å; Q281-L283 PolarHBondContact O-N 3.48Å; L283-H285 VanDerWaalsContact C-N 3.31Å; L283-H285 PolarHBondContact O-N 2.92Å; L283-D286 CarbonylContact O-C 3.31Å; L283-D286 VanDerWaalsContact O-C 3.31Å; L283-P287 VanDerWaalsContact O-CA 3.28Å; L283-P287 WeakPolarHBondContact O-CA 3.45Å; L283-P287 VanDerWaalsContact O-N 3.11Å; L283-Y292 HydrophobicContact CD1-CD2 4.39Å; L283-M293 HydrophobicContact CD1-CG 3.8Å; L283-M293 HydrophobicContact CD1-SD 4.23Å; L283-M293 HydrophobicContact CD2-CG 4.17Å
284	K	92.6	Very high	92	Very high	154 Å²	154	44.1 Å²	44.1	67%	0.67	22%	0.219	S	C	*	.	H	α-helix	trans	-65.8	-34.5	173.4	-71.2	174.4	-164.7	164.1	0	112.6	D280 Q281 A282	D280-K284 WeakPolarHBondContact O-CG 3.49Å; D280-K284 PolarHBondContact O-N 3.45Å; D280-K284 VanDerWaalsContact O-N 3.08Å; Q281-K284 PolarHBondContact O-N 2.87Å; Q281-K284 VanDerWaalsContact OE1-NZ 3.14Å; A282-K284 VanDerWaalsContact C-N 3.34Å; A282-K284 PolarHBondContact O-N 3.26Å
285	H	89.8	Confident	92	Very high	48 Å²	48	40.6 Å²	40.6	22%	0.222	20%	0.204	C	C	.	.	H	α-helix	trans	-80.2	-36.2	-180	-72	-59.3	0	0	0	112.4	N252 A256 Q281 A282 L283	N252-H285 WeakPolarHBondContact CB-O 3.4Å; N252-H285 PolarHBondContact ND2-O 2.96Å; A256-H285 HydrophobicContact CB-CB 3.78Å; Q281-H285 PolarHBondContact NE2-NE2 2.75Å; Q281-H285 PolarHBondContact O-CD2 3.35Å; Q281-H285 PolarHBondContact O-N 3.17Å; A282-H285 PolarHBondContact O-N 2.76Å; A282-H285 VanDerWaalsContact O-N 3.15Å; L283-H285 VanDerWaalsContact C-N 3.31Å; L283-H285 PolarHBondContact O-N 2.92Å
286	D	88.4	Confident	92	Very high	7 Å²	7	41.1 Å²	41.1	4%	0.037	21%	0.207	C	C	.	.			trans	-140.2	90.5	174.9	-179.2	10.8	0	0	0	111.2	A256 A282 L283 T288 Y292	A256-D286 HydrophobicContact CB-CB 3.7Å; A282-D286 PolarHBondContact O-N 2.84Å; L283-D286 CarbonylContact O-C 3.31Å; L283-D286 VanDerWaalsContact O-C 3.31Å; D286-T288 PolarHBondContact O-N 3.37Å; D286-T288 PolarHBondContact OD1-N 2.86Å; D286-T288 VanDerWaalsContact OD1-N 3.15Å; D286-T288 PolarHBondContact OD1-OG1 3.11Å; D286-Y292 HydrophobicContact CB-CE2 4.02Å; D286-Y292 WeakPolarHBondContact O-CE2 3.21Å
287	P	87.9	Confident	92.1	Very high	82 Å²	82	40.1 Å²	40.1	53%	0.532	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-8.4	-179.8	30	-35.3	0	0	0	113.3	L283 N289	L283-P287 VanDerWaalsContact O-CA 3.28Å; L283-P287 WeakPolarHBondContact O-CA 3.45Å; L283-P287 VanDerWaalsContact O-N 3.11Å; P287-N289 VanDerWaalsContact C-N 3.33Å
288	T	86.6	Confident	92.1	Very high	57 Å²	57	33.7 Å²	33.7	35%	0.35	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-8.6	-176.2	64.9	0	0	0	0	113.3	D286 N323 E325	D286-T288 PolarHBondContact O-N 3.37Å; D286-T288 PolarHBondContact OD1-N 2.86Å; D286-T288 VanDerWaalsContact OD1-N 3.15Å; D286-T288 PolarHBondContact OD1-OG1 3.11Å; T288-N323 PolarHBondContact O-ND2 3.44Å; T288-E325 VanDerWaalsContact O-OE1 3.14Å
289	N	86.5	Confident	92.1	Very high	31 Å²	31	31.9 Å²	31.9	17%	0.166	17%	0.167	C	C	.	.			trans	-100.7	113.4	-174.8	-169.1	-34.3	0	0	0	112.4	P287 T291 Y292 E325	P287-N289 VanDerWaalsContact C-N 3.33Å; N289-T291 PolarHBondContact O-N 3.42Å; N289-T291 WeakPolarHBondContact OD1-CB 3.39Å; N289-T291 PolarHBondContact OD1-N 3.24Å; N289-T291 PolarHBondContact OD1-OG1 3.04Å; N289-Y292 HydrophobicContact CB-CD2 3.93Å; N289-Y292 HydrophobicContact CB-CE2 3.5Å; N289-E325 WeakPolarHBondContact CA-OE1 3.46Å
290	M	90.4	Very high	92.1	Very high	1 Å²	1	34 Å²	34	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-66	-20.5	-179.2	75.4	174.2	-67.6	0	0	113.8	Y292 M293 S294 A316 I317 E325 Q329 I330 A333	M290-Y292 VanDerWaalsContact C-N 3.26Å; M290-Y292 PolarHBondContact O-N 3.39Å; M290-M293 PolarHBondContact O-N 3.22Å; M290-S294 VanDerWaalsContact O-CB 3.32Å; M290-S294 WeakPolarHBondContact O-CB 3.34Å; M290-S294 PolarHBondContact O-N 3.14Å; M290-A316 HydrophobicContact CB-CB 4.21Å; M290-A316 WeakPolarHBondContact CB-O 3.42Å; M290-A316 HydrophobicContact CE-CB 4.17Å; M290-A316 WeakPolarHBondContact CE-O 3.47Å; M290-I317 HydrophobicContact CE-CG1 4.44Å; M290-E325 WeakPolarHBondContact CG-OE2 3.45Å; M290-E325 PolarHBondContact N-OE1 3.25Å; M290-E325 HydrophobicContact SD-CB 4.4Å; M290-Q329 HydrophobicContact CE-CB 4.36Å; M290-Q329 HydrophobicContact CG-CB 4.22Å; M290-Q329 HydrophobicContact SD-CB 3.69Å; M290-I330 HydrophobicContact CE-CG1 4.13Å; M290-I330 HydrophobicContact SD-CG1 3.75Å; M290-A333 HydrophobicContact CE-CB 3.94Å
291	T	89.8	Confident	92.2	Very high	29 Å²	29	32.3 Å²	32.3	18%	0.178	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-36.2	-174.2	-56.2	0	0	0	0	111.4	N289 S294 N295	N289-T291 PolarHBondContact O-N 3.42Å; N289-T291 WeakPolarHBondContact OD1-CB 3.39Å; N289-T291 PolarHBondContact OD1-N 3.24Å; N289-T291 PolarHBondContact OD1-OG1 3.04Å; T291-S294 PolarHBondContact O-N 3.43Å; T291-N295 WeakPolarHBondContact O-CB 3.39Å; T291-N295 PolarHBondContact O-N 3.43Å; T291-N295 PolarHBondContact O-OD1 3.24Å
292	Y	91.9	Very high	92.3	Very high	1 Å²	1	34.3 Å²	34.3	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-66.2	-46.2	-179.9	-48.6	-46.7	0	0	0	111.4	A256 K260 A282 L283 D286 N289 M290 S294 N295 Q296	A256-Y292 HydrophobicContact CB-CE2 4.1Å; A256-Y292 VanDerWaalsContact CB-OH 3.28Å; A256-Y292 WeakPolarHBondContact CB-OH 3.27Å; K260-Y292 HydrophobicContact CB-CD1 3.89Å; K260-Y292 HydrophobicContact CB-CE1 3.56Å; K260-Y292 HydrophobicContact CD-CD1 4.3Å; K260-Y292 HydrophobicContact CD-CE1 3.87Å; K260-Y292 HydrophobicContact CG-CD1 3.85Å; K260-Y292 HydrophobicContact CG-CE1 3.75Å; A282-Y292 HydrophobicContact CB-CD1 3.75Å; A282-Y292 HydrophobicContact CB-CD2 4.19Å; A282-Y292 HydrophobicContact CB-CE1 3.95Å; A282-Y292 HydrophobicContact CB-CE2 4.33Å; A282-Y292 HydrophobicContact CB-CG 3.89Å; L283-Y292 HydrophobicContact CD1-CD2 4.39Å; D286-Y292 HydrophobicContact CB-CE2 4.02Å; D286-Y292 WeakPolarHBondContact O-CE2 3.21Å; N289-Y292 HydrophobicContact CB-CD2 3.93Å; N289-Y292 HydrophobicContact CB-CE2 3.5Å; M290-Y292 VanDerWaalsContact C-N 3.26Å; M290-Y292 PolarHBondContact O-N 3.39Å; Y292-S294 VanDerWaalsContact C-N 3.35Å; Y292-S294 PolarHBondContact O-N 3.41Å; Y292-N295 WeakPolarHBondContact O-CB 3.41Å; Y292-N295 PolarHBondContact O-N 2.97Å; Y292-Q296 WeakPolarHBondContact O-CG 3.37Å; Y292-Q296 PolarHBondContact O-N 3.23Å
293	M	92.3	Very high	92.4	Very high	21 Å²	21	38.9 Å²	38.9	10%	0.103	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-38.9	176.4	-58.5	179.2	78.1	0	0	111.7	L283 M290 N295 Q296 A297 K315 A316 V319	L283-M293 HydrophobicContact CD1-CG 3.8Å; L283-M293 HydrophobicContact CD1-SD 4.23Å; L283-M293 HydrophobicContact CD2-CG 4.17Å; M290-M293 PolarHBondContact O-N 3.22Å; M293-N295 VanDerWaalsContact C-N 3.3Å; M293-N295 PolarHBondContact O-N 3.36Å; M293-Q296 PolarHBondContact O-N 3.49Å; M293-A297 WeakPolarHBondContact O-CB 3.33Å; M293-A297 PolarHBondContact O-N 3.36Å; M293-K315 HydrophobicContact CE-CB 3.43Å; M293-K315 VanDerWaalsContact CE-CB 3.43Å; M293-K315 HydrophobicContact CE-CD 4.25Å; M293-K315 HydrophobicContact CE-CG 4.46Å; M293-A316 HydrophobicContact CB-CB 3.72Å; M293-V319 HydrophobicContact SD-CG2 4.02Å
294	S	93.6	Very high	92.5	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-36.9	173.2	-174	0	0	0	0	112.1	M290 T291 Y292 A297 A298 R336	M290-S294 VanDerWaalsContact O-CB 3.32Å; M290-S294 WeakPolarHBondContact O-CB 3.34Å; M290-S294 PolarHBondContact O-N 3.14Å; T291-S294 PolarHBondContact O-N 3.43Å; Y292-S294 VanDerWaalsContact C-N 3.35Å; Y292-S294 PolarHBondContact O-N 3.41Å; S294-A297 WeakPolarHBondContact O-CB 3.37Å; S294-A297 PolarHBondContact O-N 3.24Å; S294-A298 PolarHBondContact O-N 3.45Å; S294-A298 VanDerWaalsContact O-N 3.1Å; S294-R336 PolarHBondContact O-NH1 3.42Å; S294-R336 VanDerWaalsContact O-NH1 3.1Å; S294-R336 PolarHBondContact O-NH2 2.98Å; S294-R336 PolarHBondContact OG-NH1 3.24Å
295	N	94.3	Very high	92.7	Very high	29 Å²	29	33.7 Å²	33.7	16%	0.155	18%	0.181	C	C	.	.	H	α-helix	trans	-72.7	-39.3	175.1	-73.9	-1.8	0	0	0	112.1	N264 Y279 T291 Y292 M293 A297 A298 V299	N264-N295 PolarHBondContact OD1-ND2 3.11Å; Y279-N295 HydrophobicContact CD1-CB 4.14Å; Y279-N295 HydrophobicContact CD2-CB 4.17Å; Y279-N295 HydrophobicContact CE1-CB 3.81Å; Y279-N295 HydrophobicContact CE2-CB 3.84Å; Y279-N295 HydrophobicContact CG-CB 4.32Å; T291-N295 WeakPolarHBondContact O-CB 3.39Å; T291-N295 PolarHBondContact O-N 3.43Å; T291-N295 PolarHBondContact O-OD1 3.24Å; Y292-N295 WeakPolarHBondContact O-CB 3.41Å; Y292-N295 PolarHBondContact O-N 2.97Å; M293-N295 VanDerWaalsContact C-N 3.3Å; M293-N295 PolarHBondContact O-N 3.36Å; N295-A297 VanDerWaalsContact C-N 3.31Å; N295-A297 PolarHBondContact O-N 3.45Å; N295-A298 VanDerWaalsContact O-CB 3.31Å; N295-A298 WeakPolarHBondContact O-CB 3.48Å; N295-A298 PolarHBondContact O-N 2.88Å; N295-A298 VanDerWaalsContact O-N 3.12Å; N295-V299 WeakPolarHBondContact O-CG2 3.48Å; N295-V299 PolarHBondContact O-N 3.39Å; N295-V299 VanDerWaalsContact O-N 3.15Å
296	Q	95.1	Very high	93	Very high	11 Å²	11	33.2 Å²	33.2	5%	0.051	18%	0.178	C	C	.	.	H	α-helix	trans	-59.2	-43.8	170.6	-67.6	-180	-51.6	0	0	111.2	L276 Y279 D280 Y292 M293 A298 V299 Y300 L312	L276-Q296 HydrophobicContact CD2-CB 3.96Å; L276-Q296 HydrophobicContact CD2-CG 3.95Å; Y279-Q296 HydrophobicContact CD2-CG 4Å; Y279-Q296 HydrophobicContact CG-CG 4.16Å; D280-Q296 PolarHBondContact OD1-NE2 3.48Å; Y292-Q296 WeakPolarHBondContact O-CG 3.37Å; Y292-Q296 PolarHBondContact O-N 3.23Å; M293-Q296 PolarHBondContact O-N 3.49Å; Q296-A298 PolarHBondContact O-N 3.43Å; Q296-V299 WeakPolarHBondContact O-CA 3.36Å; Q296-V299 VanDerWaalsContact O-CB 3.3Å; Q296-V299 WeakPolarHBondContact O-CB 3.14Å; Q296-V299 PolarHBondContact O-N 3.28Å; Q296-Y300 VanDerWaalsContact O-CD2 3.22Å; Q296-Y300 WeakPolarHBondContact O-CD2 3.42Å; Q296-Y300 PolarHBondContact O-N 3.39Å; Q296-Y300 VanDerWaalsContact O-N 3.08Å; Q296-L312 HydrophobicContact CB-CD1 4.09Å
297	A	96.1	Very high	93.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.9	-37	174.8	0	0	0	0	0	112.2	M293 S294 N295 V299 Y300 F301 C309 L312 C313	M293-A297 WeakPolarHBondContact O-CB 3.33Å; M293-A297 PolarHBondContact O-N 3.36Å; S294-A297 WeakPolarHBondContact O-CB 3.37Å; S294-A297 PolarHBondContact O-N 3.24Å; N295-A297 VanDerWaalsContact C-N 3.31Å; N295-A297 PolarHBondContact O-N 3.45Å; A297-V299 VanDerWaalsContact C-N 3.32Å; A297-V299 PolarHBondContact O-N 3.17Å; A297-Y300 PolarHBondContact O-N 3.07Å; A297-F301 WeakPolarHBondContact O-CB 3.48Å; A297-F301 PolarHBondContact O-N 3.22Å; A297-C309 PolarHBondContact O-SG 3.47Å; A297-C309 VanDerWaalsContact O-SG 3.33Å; A297-L312 HydrophobicContact CB-CB 3.84Å; A297-C313 WeakPolarHBondContact CB-SG 3.43Å
298	A	95.4	Very high	93.7	Very high	11 Å²	11	38 Å²	38	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-62	-38.8	173.2	0	0	0	0	0	112.2	Y267 S294 N295 Q296 F301 E302	Y267-A298 HydrophobicContact CE2-CB 4.3Å; S294-A298 PolarHBondContact O-N 3.45Å; S294-A298 VanDerWaalsContact O-N 3.1Å; N295-A298 VanDerWaalsContact O-CB 3.31Å; N295-A298 WeakPolarHBondContact O-CB 3.48Å; N295-A298 PolarHBondContact O-N 2.88Å; N295-A298 VanDerWaalsContact O-N 3.12Å; Q296-A298 PolarHBondContact O-N 3.43Å; A298-F301 WeakPolarHBondContact O-CB 3.49Å; A298-F301 PolarHBondContact O-N 3.4Å; A298-E302 WeakPolarHBondContact O-CG 3.3Å; A298-E302 PolarHBondContact O-N 3.36Å; A298-E302 VanDerWaalsContact O-N 3.1Å
299	V	96	Very high	94.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.3	-50.9	173.5	-172.7	0	0	0	0	111.4	Y267 F272 A275 L276 Y279 N295 Q296 A297 F301 E302 K303	Y267-V299 HydrophobicContact CD2-CG2 3.79Å; Y267-V299 HydrophobicContact CE2-CG2 4.12Å; F272-V299 HydrophobicContact CB-CG1 3.51Å; F272-V299 HydrophobicContact CD1-CG1 3.68Å; F272-V299 HydrophobicContact CG-CG1 3.78Å; A275-V299 HydrophobicContact CB-CG2 4.39Å; L276-V299 HydrophobicContact CD1-CG1 4.1Å; L276-V299 HydrophobicContact CD2-CB 3.94Å; L276-V299 HydrophobicContact CD2-CG1 4.16Å; L276-V299 HydrophobicContact CD2-CG2 4.03Å; L276-V299 HydrophobicContact CG-CB 4.24Å; L276-V299 HydrophobicContact CG-CG1 3.93Å; L276-V299 HydrophobicContact CG-CG2 4.33Å; Y279-V299 HydrophobicContact CD2-CG2 4.28Å; Y279-V299 HydrophobicContact CE2-CG2 3.89Å; N295-V299 WeakPolarHBondContact O-CG2 3.48Å; N295-V299 PolarHBondContact O-N 3.39Å; N295-V299 VanDerWaalsContact O-N 3.15Å; Q296-V299 WeakPolarHBondContact O-CA 3.36Å; Q296-V299 VanDerWaalsContact O-CB 3.3Å; Q296-V299 WeakPolarHBondContact O-CB 3.14Å; Q296-V299 PolarHBondContact O-N 3.28Å; A297-V299 VanDerWaalsContact C-N 3.32Å; A297-V299 PolarHBondContact O-N 3.17Å; V299-F301 VanDerWaalsContact C-N 3.26Å; V299-F301 PolarHBondContact O-N 2.92Å; V299-E302 PolarHBondContact O-N 3Å; V299-K303 HydrophobicContact CG1-CD 4.22Å; V299-K303 HydrophobicContact CG1-CG 4.5Å; V299-K303 WeakPolarHBondContact O-CG 3.37Å; V299-K303 PolarHBondContact O-N 3.42Å
300	Y	96.4	Very high	94.7	Very high	49 Å²	49	35.3 Å²	35.3	19%	0.192	17%	0.173	C	C	.	.	H	α-helix	trans	-65.5	-31.4	-179.6	-72.8	-73	0	0	0	112.6	L276 Q296 A297 K303 G304 E305 K308 L312	L276-Y300 HydrophobicContact CD1-CE1 4.43Å; L276-Y300 HydrophobicContact CD1-CE2 4.24Å; L276-Y300 HydrophobicContact CD2-CD2 4.3Å; L276-Y300 HydrophobicContact CD2-CE2 3.7Å; Q296-Y300 VanDerWaalsContact O-CD2 3.22Å; Q296-Y300 WeakPolarHBondContact O-CD2 3.42Å; Q296-Y300 PolarHBondContact O-N 3.39Å; Q296-Y300 VanDerWaalsContact O-N 3.08Å; A297-Y300 PolarHBondContact O-N 3.07Å; Y300-K303 PolarHBondContact O-N 2.85Å; Y300-G304 PolarHBondContact O-N 2.8Å; Y300-E305 HydrophobicContact CD1-CB 3.97Å; Y300-E305 HydrophobicContact CD1-CG 4.47Å; Y300-E305 PolarHBondContact O-N 3.35Å; Y300-K308 HydrophobicContact CD1-CB 4.16Å; Y300-K308 HydrophobicContact CD1-CD 4.13Å; Y300-K308 HydrophobicContact CE1-CD 3.95Å; Y300-K308 HydrophobicContact CG-CB 4.18Å; Y300-L312 HydrophobicContact CD2-CD1 3.29Å; Y300-L312 HydrophobicContact CE2-CD1 3.44Å; Y300-L312 VanDerWaalsContact CE2-CD1 3.44Å; Y300-L312 HydrophobicContact CG-CD1 4.37Å
301	F	96.4	Very high	95	Very high	37 Å²	37	40.4 Å²	40.4	16%	0.162	20%	0.196	C	C	.	.	H	α-helix	trans	-60	-48.4	171	-179.2	-93.8	0	0	0	112	A297 A298 V299 K303 G304 F306 C309 N339 K343	A297-F301 WeakPolarHBondContact O-CB 3.48Å; A297-F301 PolarHBondContact O-N 3.22Å; A298-F301 WeakPolarHBondContact O-CB 3.49Å; A298-F301 PolarHBondContact O-N 3.4Å; V299-F301 VanDerWaalsContact C-N 3.26Å; V299-F301 PolarHBondContact O-N 2.92Å; F301-K303 VanDerWaalsContact C-N 3.32Å; F301-K303 PolarHBondContact O-N 3.12Å; F301-G304 PolarHBondContact O-N 3.11Å; F301-G304 VanDerWaalsContact O-N 3.1Å; F301-F306 HydrophobicContact CD2-CD1 4.11Å; F301-F306 AromaticContact CD2-CE1 3.96Å; F301-F306 HydrophobicContact CD2-CE1 3.96Å; F301-F306 HydrophobicContact CE2-CD1 4.37Å; F301-F306 AromaticContact CE2-CE1 3.96Å; F301-F306 HydrophobicContact CE2-CE1 3.96Å; F301-C309 HydrophobicContact CB-CB 4.36Å; F301-N339 HydrophobicContact CE2-CB 3.83Å; F301-N339 HydrophobicContact CZ-CB 3.98Å; F301-K343 HydrophobicContact CE2-CG 4.17Å; F301-K343 HydrophobicContact CZ-CG 3.91Å
302	E	94.9	Very high	95.3	Very high	107 Å²	107	40.4 Å²	40.4	50%	0.5	20%	0.195	S	C	.	.	H	α-helix	trans	-67.6	-31.6	178.4	-67.1	-60.3	148.5	0	0	112.8	Y267 F272 A298 V299 G304	Y267-E302 HydrophobicContact CE2-CG 4.1Å; Y267-E302 WeakPolarHBondContact OH-CG 3.37Å; F272-E302 HydrophobicContact CE1-CB 4.06Å; F272-E302 HydrophobicContact CE2-CB 4.4Å; F272-E302 HydrophobicContact CZ-CB 3.71Å; F272-E302 HydrophobicContact CZ-CG 4.44Å; A298-E302 WeakPolarHBondContact O-CG 3.3Å; A298-E302 PolarHBondContact O-N 3.36Å; A298-E302 VanDerWaalsContact O-N 3.1Å; V299-E302 PolarHBondContact O-N 3Å; E302-G304 PolarHBondContact O-N 3.14Å
303	K	94.7	Very high	95.5	Very high	96 Å²	96	40.3 Å²	40.3	42%	0.417	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.4	172.7	-67.5	-178.7	77.6	-155.3	0	113.6	F272 V299 Y300 F301 E305	F272-K303 HydrophobicContact CB-CD 4.37Å; F272-K303 HydrophobicContact CD2-CG 3.92Å; F272-K303 HydrophobicContact CE2-CG 4.43Å; F272-K303 HydrophobicContact CG-CG 4.34Å; V299-K303 HydrophobicContact CG1-CD 4.22Å; V299-K303 HydrophobicContact CG1-CG 4.5Å; V299-K303 WeakPolarHBondContact O-CG 3.37Å; V299-K303 PolarHBondContact O-N 3.42Å; Y300-K303 PolarHBondContact O-N 2.85Å; F301-K303 VanDerWaalsContact C-N 3.32Å; F301-K303 PolarHBondContact O-N 3.12Å; K303-E305 VanDerWaalsContact C-N 3.26Å; K303-E305 HydrophobicContact CB-CG 4.4Å; K303-E305 WeakPolarHBondContact CE-OE1 3.36Å; K303-E305 IonicContact NZ-OE1 3.7Å; K303-E305 PolarHBondContact NZ-OE1 3.39Å; K303-E305 PolarHBondContact O-N 2.91Å
304	G	93.9	Very high	95.7	Very high	35 Å²	35	42.9 Å²	42.9	36%	0.361	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	7.4	-173.9	0	0	0	0	0	114.5	Y300 F301 E302 F306	Y300-G304 PolarHBondContact O-N 2.8Å; F301-G304 PolarHBondContact O-N 3.11Å; F301-G304 VanDerWaalsContact O-N 3.1Å; E302-G304 PolarHBondContact O-N 3.14Å; G304-F306 VanDerWaalsContact O-CD2 3.3Å; G304-F306 WeakPolarHBondContact O-CD2 3.49Å; G304-F306 PolarHBondContact O-N 2.94Å
305	E	96.1	Very high	95.8	Very high	52 Å²	52	48 Å²	48	24%	0.243	23%	0.229	C	C	.	.			trans	-82.9	69.4	175.8	-67.6	-176.1	-126.7	0	0	109.9	Y300 K303 E307 K308 C309	Y300-E305 HydrophobicContact CD1-CB 3.97Å; Y300-E305 HydrophobicContact CD1-CG 4.47Å; Y300-E305 PolarHBondContact O-N 3.35Å; K303-E305 VanDerWaalsContact C-N 3.26Å; K303-E305 HydrophobicContact CB-CG 4.4Å; K303-E305 WeakPolarHBondContact CE-OE1 3.36Å; K303-E305 IonicContact NZ-OE1 3.7Å; K303-E305 PolarHBondContact NZ-OE1 3.39Å; K303-E305 PolarHBondContact O-N 2.91Å; E305-E307 PolarHBondContact O-N 2.96Å; E305-K308 PolarHBondContact O-N 3.44Å; E305-K308 VanDerWaalsContact OE2-CD 3.26Å; E305-K308 WeakPolarHBondContact OE2-CD 3.28Å; E305-K308 VanDerWaalsContact OE2-CE 3.3Å; E305-K308 WeakPolarHBondContact OE2-CE 3.48Å; E305-K308 IonicContact OE2-NZ 3.66Å; E305-K308 PolarHBondContact OE2-NZ 3.21Å; E305-C309 PolarHBondContact O-N 3.38Å
306	F	96.4	Very high	95.8	Very high	38 Å²	38	46.7 Å²	46.7	17%	0.167	22%	0.221	C	C	.	.	H	α-helix	trans	-65.3	-34.7	-170.7	-67.7	-51.6	0	0	0	114.5	F301 G304 R310 S340 K343 Q344	F301-F306 HydrophobicContact CD2-CD1 4.11Å; F301-F306 AromaticContact CD2-CE1 3.96Å; F301-F306 HydrophobicContact CD2-CE1 3.96Å; F301-F306 HydrophobicContact CE2-CD1 4.37Å; F301-F306 AromaticContact CE2-CE1 3.96Å; F301-F306 HydrophobicContact CE2-CE1 3.96Å; G304-F306 VanDerWaalsContact O-CD2 3.3Å; G304-F306 WeakPolarHBondContact O-CD2 3.49Å; G304-F306 PolarHBondContact O-N 2.94Å; F306-R310 VanDerWaalsContact O-CG 3.3Å; F306-R310 WeakPolarHBondContact O-CG 3.39Å; F306-R310 PolarHBondContact O-N 3.39Å; F306-R310 VanDerWaalsContact O-N 3.09Å; F306-R310 PolarHBondContact O-NE 3.19Å; F306-S340 VanDerWaalsContact CB-OG 3.27Å; F306-S340 WeakPolarHBondContact CB-OG 3.47Å; F306-S340 WeakPolarHBondContact CD1-OG 3.33Å; F306-S340 PolarHBondContact O-OG 3.32Å; F306-K343 HydrophobicContact CE1-CB 3.86Å; F306-K343 HydrophobicContact CE1-CG 4.3Å; F306-K343 HydrophobicContact CE2-CB 4.3Å; F306-K343 HydrophobicContact CZ-CB 3.62Å; F306-K343 HydrophobicContact CZ-CG 4.27Å; F306-Q344 HydrophobicContact CB-CG 4.36Å; F306-Q344 VanDerWaalsContact CB-NE2 3.29Å; F306-Q344 HydrophobicContact CD2-CG 3.69Å; F306-Q344 HydrophobicContact CE2-CG 4.26Å; F306-Q344 HydrophobicContact CG-CG 4.14Å
307	E	95.3	Very high	95.7	Very high	91 Å²	91	46.5 Å²	46.5	43%	0.425	22%	0.221	S	C	.	.	H	α-helix	trans	-61.5	-52.4	175.1	-70.9	61.4	-134.9	0	0	110.5	E305 C309 R310 E311 Q344	E305-E307 PolarHBondContact O-N 2.96Å; E307-C309 VanDerWaalsContact C-N 3.33Å; E307-C309 PolarHBondContact O-N 3.45Å; E307-R310 PolarHBondContact O-N 3.38Å; E307-R310 IonicContact OE1-NH2 3.26Å; E307-R310 PolarHBondContact OE1-NH2 3.43Å; E307-E311 PolarHBondContact O-N 3.44Å; E307-Q344 PolarHBondContact OE1-NE2 3Å
308	K	94.8	Very high	95.6	Very high	100 Å²	100	50.7 Å²	50.7	44%	0.435	24%	0.243	S	C	.	.	H	α-helix	trans	-64.2	-36.9	178.6	-65.7	-171	-167.2	159.4	0	112.7	Y300 E305 R310 E311 L312	Y300-K308 HydrophobicContact CD1-CB 4.16Å; Y300-K308 HydrophobicContact CD1-CD 4.13Å; Y300-K308 HydrophobicContact CE1-CD 3.95Å; Y300-K308 HydrophobicContact CG-CB 4.18Å; E305-K308 PolarHBondContact O-N 3.44Å; E305-K308 VanDerWaalsContact OE2-CD 3.26Å; E305-K308 WeakPolarHBondContact OE2-CD 3.28Å; E305-K308 VanDerWaalsContact OE2-CE 3.3Å; E305-K308 WeakPolarHBondContact OE2-CE 3.48Å; E305-K308 IonicContact OE2-NZ 3.66Å; E305-K308 PolarHBondContact OE2-NZ 3.21Å; K308-R310 VanDerWaalsContact C-N 3.3Å; K308-R310 PolarHBondContact O-N 3.08Å; K308-E311 PolarHBondContact O-N 3.31Å; K308-L312 WeakPolarHBondContact O-CB 3.36Å; K308-L312 WeakPolarHBondContact O-CG 3.2Å; K308-L312 PolarHBondContact O-N 2.76Å
309	C	96.9	Very high	95.4	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-56.1	-45.8	171.8	172.4	0	0	0	0	111.3	A297 F301 E305 E307 C313	A297-C309 PolarHBondContact O-SG 3.47Å; A297-C309 VanDerWaalsContact O-SG 3.33Å; F301-C309 HydrophobicContact CB-CB 4.36Å; E305-C309 PolarHBondContact O-N 3.38Å; E307-C309 VanDerWaalsContact C-N 3.33Å; E307-C309 PolarHBondContact O-N 3.45Å; C309-C313 WeakPolarHBondContact O-CB 3.43Å; C309-C313 PolarHBondContact O-N 3.3Å; C309-C313 PolarHBondContact O-SG 3Å; C309-C313 VanDerWaalsContact O-SG 3.4Å
310	R	97.2	Very high	95.1	Very high	31 Å²	31	51.5 Å²	51.5	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-67.9	-46.7	-178.4	-71.2	-179.9	-76	153.4	-3.6	111.5	F306 E307 K308 L312 C313 E314 I337 Y341	F306-R310 VanDerWaalsContact O-CG 3.3Å; F306-R310 WeakPolarHBondContact O-CG 3.39Å; F306-R310 PolarHBondContact O-N 3.39Å; F306-R310 VanDerWaalsContact O-N 3.09Å; F306-R310 PolarHBondContact O-NE 3.19Å; E307-R310 PolarHBondContact O-N 3.38Å; E307-R310 IonicContact OE1-NH2 3.26Å; E307-R310 PolarHBondContact OE1-NH2 3.43Å; K308-R310 VanDerWaalsContact C-N 3.3Å; K308-R310 PolarHBondContact O-N 3.08Å; R310-L312 VanDerWaalsContact C-N 3.32Å; R310-L312 PolarHBondContact O-N 3.17Å; R310-C313 PolarHBondContact O-N 2.89Å; R310-E314 WeakPolarHBondContact O-CG 3.27Å; R310-E314 PolarHBondContact O-N 3.39Å; R310-I337 HydrophobicContact CG-CB 4.49Å; R310-I337 HydrophobicContact CG-CG1 4.41Å; R310-I337 HydrophobicContact CG-CG2 3.97Å; R310-Y341 PolarHBondContact NH1-OH 3.39Å
311	E	96.7	Very high	94.7	Very high	107 Å²	107	55.7 Å²	55.7	50%	0.5	26%	0.262	S	S	.	.	H	α-helix	trans	-57.1	-44	176.3	-70.6	176.7	-169.6	0	0	112.3	E307 K308 E314 K315	E307-E311 PolarHBondContact O-N 3.44Å; K308-E311 PolarHBondContact O-N 3.31Å; E311-E314 PolarHBondContact O-N 2.77Å; E311-K315 VanDerWaalsContact O-CG 3.32Å; E311-K315 WeakPolarHBondContact O-CG 3.39Å; E311-K315 PolarHBondContact O-N 3.15Å
312	L	95.9	Very high	94.4	Very high	29 Å²	29	61.2 Å²	61.2	15%	0.152	29%	0.288	C	S	.	.	H	α-helix	trans	-69	-37.9	177.7	-76.3	169.1	0	0	0	112.5	Q296 A297 Y300 K308 R310 A316	Q296-L312 HydrophobicContact CB-CD1 4.09Å; A297-L312 HydrophobicContact CB-CB 3.84Å; Y300-L312 HydrophobicContact CD2-CD1 3.29Å; Y300-L312 HydrophobicContact CE2-CD1 3.44Å; Y300-L312 VanDerWaalsContact CE2-CD1 3.44Å; Y300-L312 HydrophobicContact CG-CD1 4.37Å; K308-L312 WeakPolarHBondContact O-CB 3.36Å; K308-L312 WeakPolarHBondContact O-CG 3.2Å; K308-L312 PolarHBondContact O-N 2.76Å; R310-L312 VanDerWaalsContact C-N 3.32Å; R310-L312 PolarHBondContact O-N 3.17Å; L312-A316 VanDerWaalsContact O-CB 3.26Å; L312-A316 WeakPolarHBondContact O-CB 3.3Å; L312-A316 PolarHBondContact O-N 3.16Å
313	C	96.9	Very high	94	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-41.5	173.3	-80.5	0	0	0	0	112.1	A297 C309 R310 A316 I317 A333 I337	A297-C313 WeakPolarHBondContact CB-SG 3.43Å; C309-C313 WeakPolarHBondContact O-CB 3.43Å; C309-C313 PolarHBondContact O-N 3.3Å; C309-C313 PolarHBondContact O-SG 3Å; C309-C313 VanDerWaalsContact O-SG 3.4Å; R310-C313 PolarHBondContact O-N 2.89Å; C313-A316 WeakPolarHBondContact O-CB 3.3Å; C313-A316 PolarHBondContact O-N 3.22Å; C313-I317 WeakPolarHBondContact O-CD1 3.46Å; C313-I317 WeakPolarHBondContact O-CG1 3.43Å; C313-I317 PolarHBondContact O-N 3.1Å; C313-A333 HydrophobicContact CB-CB 4.43Å; C313-I337 HydrophobicContact CB-CD1 3.66Å; C313-I337 HydrophobicContact CB-CG1 3.45Å; C313-I337 VanDerWaalsContact CB-CG1 3.45Å
314	E	96.1	Very high	93.4	Very high	75 Å²	75	66.2 Å²	66.2	35%	0.35	31%	0.306	S	S	.	.	H	α-helix	trans	-63.6	-48.4	177.7	-73.3	177.8	165.2	0	0	110.8	R310 E311 A316 I317 D318 I337 Y353	R310-E314 WeakPolarHBondContact O-CG 3.27Å; R310-E314 PolarHBondContact O-N 3.39Å; E311-E314 PolarHBondContact O-N 2.77Å; E314-A316 VanDerWaalsContact C-N 3.3Å; E314-A316 PolarHBondContact O-N 2.95Å; E314-I317 WeakPolarHBondContact O-CB 3.46Å; E314-I317 PolarHBondContact O-N 3.47Å; E314-I317 VanDerWaalsContact O-N 3.08Å; E314-D318 PolarHBondContact O-N 3.18Å; E314-I337 HydrophobicContact CG-CD1 3.83Å; E314-Y353 PolarHBondContact OE1-OH 2.89Å
315	K	95.4	Very high	92.7	Very high	111 Å²	111	66.8 Å²	66.8	48%	0.483	30%	0.299	S	S	.	.	H	α-helix	trans	-58.8	-40.3	173.2	-69	173.7	-179.4	173.5	0	112.6	M293 E311 I317 D318 V319	M293-K315 HydrophobicContact CE-CB 3.43Å; M293-K315 VanDerWaalsContact CE-CB 3.43Å; M293-K315 HydrophobicContact CE-CD 4.25Å; M293-K315 HydrophobicContact CE-CG 4.46Å; E311-K315 VanDerWaalsContact O-CG 3.32Å; E311-K315 WeakPolarHBondContact O-CG 3.39Å; E311-K315 PolarHBondContact O-N 3.15Å; K315-I317 VanDerWaalsContact C-N 3.33Å; K315-I317 PolarHBondContact O-N 3.31Å; K315-D318 PolarHBondContact O-N 2.93Å; K315-V319 WeakPolarHBondContact O-CG2 3.3Å; K315-V319 PolarHBondContact O-N 3.01Å
316	A	94.4	Very high	92.1	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-41.4	175.8	0	0	0	0	0	111.4	M290 M293 L312 C313 E314 G320	M290-A316 HydrophobicContact CB-CB 4.21Å; M290-A316 WeakPolarHBondContact CB-O 3.42Å; M290-A316 HydrophobicContact CE-CB 4.17Å; M290-A316 WeakPolarHBondContact CE-O 3.47Å; M293-A316 HydrophobicContact CB-CB 3.72Å; L312-A316 VanDerWaalsContact O-CB 3.26Å; L312-A316 WeakPolarHBondContact O-CB 3.3Å; L312-A316 PolarHBondContact O-N 3.16Å; C313-A316 WeakPolarHBondContact O-CB 3.3Å; C313-A316 PolarHBondContact O-N 3.22Å; E314-A316 VanDerWaalsContact C-N 3.3Å; E314-A316 PolarHBondContact O-N 2.95Å; A316-G320 PolarHBondContact O-N 3.25Å
317	I	94.4	Very high	91.6	Very high	8 Å²	8	71.4 Å²	71.4	4%	0.041	32%	0.319	C	S	.	.	H	α-helix	trans	-64.4	-42	177.6	-69.6	157.8	0	0	0	110.8	M290 C313 E314 K315 G320 R321 I330 A333 L334 I337	M290-I317 HydrophobicContact CE-CG1 4.44Å; C313-I317 WeakPolarHBondContact O-CD1 3.46Å; C313-I317 WeakPolarHBondContact O-CG1 3.43Å; C313-I317 PolarHBondContact O-N 3.1Å; E314-I317 WeakPolarHBondContact O-CB 3.46Å; E314-I317 PolarHBondContact O-N 3.47Å; E314-I317 VanDerWaalsContact O-N 3.08Å; K315-I317 VanDerWaalsContact C-N 3.33Å; K315-I317 PolarHBondContact O-N 3.31Å; I317-G320 PolarHBondContact O-N 3.43Å; I317-R321 HydrophobicContact CG2-CG 4.36Å; I317-R321 WeakPolarHBondContact O-CB 3.42Å; I317-R321 VanDerWaalsContact O-CG 3.32Å; I317-R321 WeakPolarHBondContact O-CG 3.45Å; I317-R321 PolarHBondContact O-N 3.35Å; I317-I330 HydrophobicContact CG1-CG2 4.34Å; I317-I330 HydrophobicContact CG2-CG2 4.09Å; I317-A333 HydrophobicContact CD1-CB 4.01Å; I317-A333 HydrophobicContact CG1-CB 3.71Å; I317-L334 HydrophobicContact CD1-CD2 3.6Å; I317-L334 HydrophobicContact CD1-CG 3.7Å; I317-I337 HydrophobicContact CD1-CD1 3.98Å
318	D	93.3	Very high	91.4	Very high	88 Å²	88	73 Å²	73	47%	0.471	32%	0.321	S	S	.	.	H	α-helix	trans	-61.5	-50.6	177.8	-66.5	-23.9	0	0	0	110.9	E314 K315 G320 R321 E322	E314-D318 PolarHBondContact O-N 3.18Å; K315-D318 PolarHBondContact O-N 2.93Å; D318-G320 VanDerWaalsContact C-N 3.31Å; D318-G320 PolarHBondContact O-N 2.89Å; D318-R321 PolarHBondContact O-N 3.37Å; D318-E322 WeakPolarHBondContact O-CG 3.28Å; D318-E322 PolarHBondContact O-N 3.38Å
319	V	91.1	Very high	91.1	Very high	27 Å²	27	70.4 Å²	70.4	16%	0.164	31%	0.311	C	S	.	.	H	α-helix	trans	-58	-43.7	175	173.1	0	0	0	0	111.2	M293 K315 R321 E322 N323	M293-V319 HydrophobicContact SD-CG2 4.02Å; K315-V319 WeakPolarHBondContact O-CG2 3.3Å; K315-V319 PolarHBondContact O-N 3.01Å; V319-R321 PolarHBondContact O-N 3.39Å; V319-E322 PolarHBondContact O-N 2.9Å; V319-N323 WeakPolarHBondContact O-CB 3.32Å; V319-N323 PolarHBondContact O-N 3.32Å; V319-N323 PolarHBondContact O-ND2 3.03Å
320	G	89.8	Confident	90.8	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.3	-37.8	178.8	0	0	0	0	0	113.1	A316 I317 D318 R324 E325	A316-G320 PolarHBondContact O-N 3.25Å; I317-G320 PolarHBondContact O-N 3.43Å; D318-G320 VanDerWaalsContact C-N 3.31Å; D318-G320 PolarHBondContact O-N 2.89Å; G320-R324 PolarHBondContact O-N 2.91Å; G320-R324 VanDerWaalsContact O-N 3.09Å; G320-E325 PolarHBondContact O-N 3.38Å
321	R	89	Confident	90.6	Very high	137 Å²	137	69.6 Å²	69.6	52%	0.517	31%	0.309	S	S	.	.	H	α-helix	trans	-71.9	-42.3	177.1	-75.6	176.1	170.8	179.5	-3.7	112.1	I317 D318 V319 N323 R324 I330 E360	I317-R321 HydrophobicContact CG2-CG 4.36Å; I317-R321 WeakPolarHBondContact O-CB 3.42Å; I317-R321 VanDerWaalsContact O-CG 3.32Å; I317-R321 WeakPolarHBondContact O-CG 3.45Å; I317-R321 PolarHBondContact O-N 3.35Å; D318-R321 PolarHBondContact O-N 3.37Å; V319-R321 PolarHBondContact O-N 3.39Å; R321-N323 VanDerWaalsContact C-N 3.32Å; R321-N323 PolarHBondContact O-N 2.91Å; R321-R324 PolarHBondContact O-N 2.89Å; R321-I330 HydrophobicContact CG-CD1 3.91Å; R321-E360 IonicContact NH2-OE1 2.86Å; R321-E360 PolarHBondContact NH2-OE1 2.92Å
322	E	90.1	Very high	90.5	Very high	153 Å²	153	70 Å²	70	72%	0.715	31%	0.309	S	S	*	.	H	α-helix	trans	-61.5	-40.9	176.5	-73.7	179.7	179.9	0	0	111.7	D318 V319	D318-E322 WeakPolarHBondContact O-CG 3.28Å; D318-E322 PolarHBondContact O-N 3.38Å; V319-E322 PolarHBondContact O-N 2.9Å
323	N	85.6	Confident	90.4	Very high	75 Å²	75	68.6 Å²	68.6	40%	0.401	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	5.4	-178.3	-64.1	-69.8	0	0	0	114.1	T288 V319 R321 E325	T288-N323 PolarHBondContact O-ND2 3.44Å; V319-N323 WeakPolarHBondContact O-CB 3.32Å; V319-N323 PolarHBondContact O-N 3.32Å; V319-N323 PolarHBondContact O-ND2 3.03Å; R321-N323 VanDerWaalsContact C-N 3.32Å; R321-N323 PolarHBondContact O-N 2.91Å; N323-E325 VanDerWaalsContact C-N 3.3Å; N323-E325 PolarHBondContact O-N 2.81Å
324	R	82.4	Confident	90.4	Very high	233 Å²	233	69 Å²	69	88%	0.879	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	43.7	179.9	-56.3	-179.1	-178.9	-175	0.1	113.5	G320 R321	G320-R324 PolarHBondContact O-N 2.91Å; G320-R324 VanDerWaalsContact O-N 3.09Å; R321-R324 PolarHBondContact O-N 2.89Å
325	E	79.9	Confident	90.5	Very high	48 Å²	48	65.9 Å²	65.9	22%	0.224	29%	0.291	C	S	.	.			trans	-68.6	167.6	176.4	-82.1	-159.9	-123.3	0	0	113.5	T288 N289 M290 G320 N323 Y327	T288-E325 VanDerWaalsContact O-OE1 3.14Å; N289-E325 WeakPolarHBondContact CA-OE1 3.46Å; M290-E325 WeakPolarHBondContact CG-OE2 3.45Å; M290-E325 PolarHBondContact N-OE1 3.25Å; M290-E325 HydrophobicContact SD-CB 4.4Å; G320-E325 PolarHBondContact O-N 3.38Å; N323-E325 VanDerWaalsContact C-N 3.3Å; N323-E325 PolarHBondContact O-N 2.81Å; E325-Y327 PolarHBondContact O-N 2.83Å
326	D	83.3	Confident	90.5	Very high	71 Å²	71	62.6 Å²	62.6	38%	0.38	28%	0.276	S	S	.	.			trans	-56.7	121	178.2	-175.1	-10.5	0	0	0	110.6	R328 Q329	D326-R328 PolarHBondContact O-N 3.17Å; D326-R328 WeakPolarHBondContact OD1-CB 3.36Å; D326-R328 VanDerWaalsContact OD1-CG 3.25Å; D326-R328 WeakPolarHBondContact OD1-CG 3.36Å; D326-R328 PolarHBondContact OD1-N 3.06Å; D326-Q329 HydrophobicContact CB-CG 4.45Å; D326-Q329 WeakPolarHBondContact O-CB 3.34Å; D326-Q329 PolarHBondContact O-N 2.84Å
327	Y	85.6	Confident	90.7	Very high	115 Å²	115	62.6 Å²	62.6	45%	0.451	28%	0.276	S	S	.	.	H	α-helix	trans	-52.4	-24.1	176.4	61	-88.5	0	0	0	112.9	E325 Q329 I330 A331 E360 H361	E325-Y327 PolarHBondContact O-N 2.83Å; Y327-Q329 VanDerWaalsContact C-N 3.33Å; Y327-Q329 PolarHBondContact O-N 2.79Å; Y327-I330 PolarHBondContact O-N 2.83Å; Y327-A331 WeakPolarHBondContact O-CB 3.2Å; Y327-A331 PolarHBondContact O-N 3.4Å; Y327-E360 VanDerWaalsContact CD2-O 3.22Å; Y327-E360 WeakPolarHBondContact CD2-O 3.43Å; Y327-H361 HydrophobicContact CD2-CB 4.06Å; Y327-H361 HydrophobicContact CE2-CB 4.25Å; Y327-H361 AromaticContact CE2-CD2 3.77Å
328	R	89.8	Confident	90.8	Very high	124 Å²	124	62.2 Å²	62.2	47%	0.468	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-35.4	172.2	-63.5	176.3	-171.2	-168.1	2	113	D326 K332	D326-R328 PolarHBondContact O-N 3.17Å; D326-R328 WeakPolarHBondContact OD1-CB 3.36Å; D326-R328 VanDerWaalsContact OD1-CG 3.25Å; D326-R328 WeakPolarHBondContact OD1-CG 3.36Å; D326-R328 PolarHBondContact OD1-N 3.06Å; R328-K332 WeakPolarHBondContact O-CG 3.35Å; R328-K332 PolarHBondContact O-N 3.23Å
329	Q	88.7	Confident	91	Very high	47 Å²	47	59.5 Å²	59.5	22%	0.22	26%	0.259	C	S	.	.	H	α-helix	trans	-75.2	-37.7	178.5	-58.3	-61.1	-7.7	0	0	111.3	M290 D326 Y327 K332 A333	M290-Q329 HydrophobicContact CE-CB 4.36Å; M290-Q329 HydrophobicContact CG-CB 4.22Å; M290-Q329 HydrophobicContact SD-CB 3.69Å; D326-Q329 HydrophobicContact CB-CG 4.45Å; D326-Q329 WeakPolarHBondContact O-CB 3.34Å; D326-Q329 PolarHBondContact O-N 2.84Å; Y327-Q329 VanDerWaalsContact C-N 3.33Å; Y327-Q329 PolarHBondContact O-N 2.79Å; Q329-K332 PolarHBondContact O-N 3.36Å; Q329-A333 PolarHBondContact O-N 3.15Å
330	I	90.6	Very high	91.3	Very high	10 Å²	10	58.2 Å²	58.2	5%	0.051	25%	0.251	C	S	.	.	H	α-helix	trans	-59.6	-47.9	171	-61.8	174.3	0	0	0	110.1	M290 I317 R321 Y327 K332 A333 L334 E360	M290-I330 HydrophobicContact CE-CG1 4.13Å; M290-I330 HydrophobicContact SD-CG1 3.75Å; I317-I330 HydrophobicContact CG1-CG2 4.34Å; I317-I330 HydrophobicContact CG2-CG2 4.09Å; R321-I330 HydrophobicContact CG-CD1 3.91Å; Y327-I330 PolarHBondContact O-N 2.83Å; I330-K332 VanDerWaalsContact C-N 3.33Å; I330-K332 PolarHBondContact O-N 3.16Å; I330-A333 PolarHBondContact O-N 3.29Å; I330-L334 HydrophobicContact CG2-CD1 4.08Å; I330-L334 WeakPolarHBondContact O-CG 3.32Å; I330-L334 PolarHBondContact O-N 3.19Å; I330-E360 HydrophobicContact CG2-CG 4.14Å
331	A	92.9	Very high	91.7	Very high	3 Å²	3	59.6 Å²	59.6	3%	0.025	26%	0.257	C	S	.	.	H	α-helix	trans	-57.5	-44	175.3	0	0	0	0	0	112.1	Y327 A333 L334 A335 S357 E360 H361	Y327-A331 WeakPolarHBondContact O-CB 3.2Å; Y327-A331 PolarHBondContact O-N 3.4Å; A331-A333 PolarHBondContact O-N 3.04Å; A331-L334 PolarHBondContact O-N 2.8Å; A331-A335 WeakPolarHBondContact O-CB 3.23Å; A331-A335 PolarHBondContact O-N 3.37Å; A331-S357 PolarHBondContact O-OG 3.36Å; A331-E360 HydrophobicContact CB-CB 3.89Å; A331-H361 HydrophobicContact CB-CB 3.59Å
332	K	94.9	Very high	92	Very high	116 Å²	116	54.9 Å²	54.9	50%	0.504	24%	0.24	S	C	.	.	H	α-helix	trans	-61.9	-40.7	176.8	-75.9	173.2	-177.4	176.2	0	112.9	R328 Q329 I330 A335 R336	R328-K332 WeakPolarHBondContact O-CG 3.35Å; R328-K332 PolarHBondContact O-N 3.23Å; Q329-K332 PolarHBondContact O-N 3.36Å; I330-K332 VanDerWaalsContact C-N 3.33Å; I330-K332 PolarHBondContact O-N 3.16Å; K332-A335 PolarHBondContact O-N 2.88Å; K332-R336 PolarHBondContact O-N 2.96Å
333	A	95.4	Very high	92.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.1	-44.2	176.6	0	0	0	0	0	111.5	M290 C313 I317 Q329 I330 A331 A335 R336 I337	M290-A333 HydrophobicContact CE-CB 3.94Å; C313-A333 HydrophobicContact CB-CB 4.43Å; I317-A333 HydrophobicContact CD1-CB 4.01Å; I317-A333 HydrophobicContact CG1-CB 3.71Å; Q329-A333 PolarHBondContact O-N 3.15Å; I330-A333 PolarHBondContact O-N 3.29Å; A331-A333 PolarHBondContact O-N 3.04Å; A333-A335 PolarHBondContact O-N 3.5Å; A333-R336 WeakPolarHBondContact O-CB 3.25Å; A333-R336 PolarHBondContact O-N 3.27Å; A333-R336 VanDerWaalsContact O-N 3.15Å; A333-I337 PolarHBondContact O-N 2.96Å; A333-I337 VanDerWaalsContact O-N 3.07Å
334	L	96.4	Very high	92.8	Very high	9 Å²	9	52.9 Å²	52.9	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-61.3	-43.3	174	-72.4	166.7	0	0	0	112.2	I317 I330 A331 R336 I337 G338 Y353 K356 E360	I317-L334 HydrophobicContact CD1-CD2 3.6Å; I317-L334 HydrophobicContact CD1-CG 3.7Å; I330-L334 HydrophobicContact CG2-CD1 4.08Å; I330-L334 WeakPolarHBondContact O-CG 3.32Å; I330-L334 PolarHBondContact O-N 3.19Å; A331-L334 PolarHBondContact O-N 2.8Å; L334-R336 VanDerWaalsContact C-N 3.26Å; L334-R336 PolarHBondContact O-N 3.43Å; L334-I337 WeakPolarHBondContact O-CB 3.26Å; L334-I337 PolarHBondContact O-N 3.26Å; L334-G338 PolarHBondContact O-N 3.03Å; L334-Y353 HydrophobicContact CD2-CD1 3.99Å; L334-Y353 HydrophobicContact CD2-CE1 4.41Å; L334-K356 HydrophobicContact CD1-CB 4.21Å; L334-K356 HydrophobicContact CD2-CB 4.21Å; L334-E360 HydrophobicContact CD1-CG 3.6Å
335	A	97	Very high	93.4	Very high	9 Å²	9	48 Å²	48	7%	0.074	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-36.7	175	0	0	0	0	0	111.7	A331 K332 A333 G338 N339 V366	A331-A335 WeakPolarHBondContact O-CB 3.23Å; A331-A335 PolarHBondContact O-N 3.37Å; K332-A335 PolarHBondContact O-N 2.88Å; A333-A335 PolarHBondContact O-N 3.5Å; A335-G338 PolarHBondContact O-N 2.73Å; A335-N339 WeakPolarHBondContact O-CB 3.39Å; A335-N339 PolarHBondContact O-N 2.87Å; A335-N339 PolarHBondContact O-ND2 3.07Å; A335-V366 HydrophobicContact CB-CG2 3.63Å
336	R	96.7	Very high	94.1	Very high	42 Å²	42	49.9 Å²	49.9	16%	0.158	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-39.2	175.3	-168.9	177.7	-61.9	104.3	-6.9	112.1	S294 K332 A333 L334 N339 S340	S294-R336 PolarHBondContact O-NH1 3.42Å; S294-R336 VanDerWaalsContact O-NH1 3.1Å; S294-R336 PolarHBondContact O-NH2 2.98Å; S294-R336 PolarHBondContact OG-NH1 3.24Å; K332-R336 PolarHBondContact O-N 2.96Å; A333-R336 WeakPolarHBondContact O-CB 3.25Å; A333-R336 PolarHBondContact O-N 3.27Å; A333-R336 VanDerWaalsContact O-N 3.15Å; L334-R336 VanDerWaalsContact C-N 3.26Å; L334-R336 PolarHBondContact O-N 3.43Å; R336-N339 PolarHBondContact O-N 3.09Å; R336-S340 PolarHBondContact O-N 3.01Å
337	I	97.4	Very high	94.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-46.6	171.5	-62.5	168.3	0	0	0	110.4	R310 C313 E314 I317 A333 L334 N339 S340 Y341 Y353	R310-I337 HydrophobicContact CG-CB 4.49Å; R310-I337 HydrophobicContact CG-CG1 4.41Å; R310-I337 HydrophobicContact CG-CG2 3.97Å; C313-I337 HydrophobicContact CB-CD1 3.66Å; C313-I337 HydrophobicContact CB-CG1 3.45Å; C313-I337 VanDerWaalsContact CB-CG1 3.45Å; E314-I337 HydrophobicContact CG-CD1 3.83Å; I317-I337 HydrophobicContact CD1-CD1 3.98Å; A333-I337 PolarHBondContact O-N 2.96Å; A333-I337 VanDerWaalsContact O-N 3.07Å; L334-I337 WeakPolarHBondContact O-CB 3.26Å; L334-I337 PolarHBondContact O-N 3.26Å; I337-N339 VanDerWaalsContact C-N 3.34Å; I337-N339 PolarHBondContact O-N 3.4Å; I337-S340 WeakPolarHBondContact O-CB 3.44Å; I337-S340 PolarHBondContact O-N 3.03Å; I337-S340 VanDerWaalsContact O-N 3.12Å; I337-Y341 HydrophobicContact CG2-CD2 3.86Å; I337-Y341 HydrophobicContact CG2-CE2 3.6Å; I337-Y341 WeakPolarHBondContact O-CD2 3.29Å; I337-Y341 PolarHBondContact O-N 3.45Å; I337-Y341 VanDerWaalsContact O-N 3.11Å; I337-Y353 HydrophobicContact CB-CD1 3.77Å; I337-Y353 HydrophobicContact CB-CE1 4.14Å; I337-Y353 HydrophobicContact CB-CG 4.14Å; I337-Y353 HydrophobicContact CD1-CD1 4.02Å; I337-Y353 HydrophobicContact CD1-CE1 3.77Å; I337-Y353 HydrophobicContact CG2-CD1 3.35Å; I337-Y353 HydrophobicContact CG2-CD2 3.8Å; I337-Y353 HydrophobicContact CG2-CE1 3.46Å; I337-Y353 VanDerWaalsContact CG2-CE1 3.46Å; I337-Y353 HydrophobicContact CG2-CE2 3.93Å; I337-Y353 HydrophobicContact CG2-CG 3.5Å; I337-Y353 VanDerWaalsContact CG2-CG 3.5Å
338	G	96.9	Very high	95.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.3	-43.5	175.4	0	0	0	0	0	112.7	L334 A335 S340 Y341 F342 A350 F354	L334-G338 PolarHBondContact O-N 3.03Å; A335-G338 PolarHBondContact O-N 2.73Å; G338-S340 VanDerWaalsContact C-N 3.3Å; G338-S340 PolarHBondContact O-N 3Å; G338-Y341 PolarHBondContact O-N 2.87Å; G338-F342 WeakPolarHBondContact O-CB 3.42Å; G338-F342 PolarHBondContact O-N 3.24Å; G338-A350 WeakPolarHBondContact O-CB 3.35Å; G338-F354 VanDerWaalsContact C-CE1 3.43Å; G338-F354 VanDerWaalsContact C-CZ 3.44Å
339	N	97.1	Very high	95.6	Very high	30 Å²	30	45.1 Å²	45.1	16%	0.16	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-36.7	175.3	-71.6	-45.1	0	0	0	112.3	F301 A335 R336 I337 F342 K343 K369	F301-N339 HydrophobicContact CE2-CB 3.83Å; F301-N339 HydrophobicContact CZ-CB 3.98Å; A335-N339 WeakPolarHBondContact O-CB 3.39Å; A335-N339 PolarHBondContact O-N 2.87Å; A335-N339 PolarHBondContact O-ND2 3.07Å; R336-N339 PolarHBondContact O-N 3.09Å; I337-N339 VanDerWaalsContact C-N 3.34Å; I337-N339 PolarHBondContact O-N 3.4Å; N339-F342 PolarHBondContact O-N 3.18Å; N339-K343 WeakPolarHBondContact O-CG 3.42Å; N339-K343 PolarHBondContact O-N 3.11Å; N339-K369 VanDerWaalsContact OD1-CD 3.22Å; N339-K369 WeakPolarHBondContact OD1-CD 3.3Å; N339-K369 PolarHBondContact OD1-NZ 3.04Å
340	S	97.2	Very high	96	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-48.2	177.1	170.8	0	0	0	0	111.4	F306 R336 I337 G338 F342 K343 Q344	F306-S340 VanDerWaalsContact CB-OG 3.27Å; F306-S340 WeakPolarHBondContact CB-OG 3.47Å; F306-S340 WeakPolarHBondContact CD1-OG 3.33Å; F306-S340 PolarHBondContact O-OG 3.32Å; R336-S340 PolarHBondContact O-N 3.01Å; I337-S340 WeakPolarHBondContact O-CB 3.44Å; I337-S340 PolarHBondContact O-N 3.03Å; I337-S340 VanDerWaalsContact O-N 3.12Å; G338-S340 VanDerWaalsContact C-N 3.3Å; G338-S340 PolarHBondContact O-N 3Å; S340-F342 VanDerWaalsContact C-N 3.33Å; S340-F342 PolarHBondContact O-N 3.3Å; S340-K343 PolarHBondContact O-N 3.37Å; S340-Q344 PolarHBondContact O-N 3.34Å
341	Y	97.8	Very high	96.3	Very high	30 Å²	30	43.3 Å²	43.3	12%	0.118	20%	0.195	C	C	.	.	H	α-helix	trans	-63.3	-39	174	-76.2	-63.3	0	0	0	112.7	R310 I337 G338 K343 Q344 E345 K346 E349 Y353	R310-Y341 PolarHBondContact NH1-OH 3.39Å; I337-Y341 HydrophobicContact CG2-CD2 3.86Å; I337-Y341 HydrophobicContact CG2-CE2 3.6Å; I337-Y341 WeakPolarHBondContact O-CD2 3.29Å; I337-Y341 PolarHBondContact O-N 3.45Å; I337-Y341 VanDerWaalsContact O-N 3.11Å; G338-Y341 PolarHBondContact O-N 2.87Å; Y341-K343 VanDerWaalsContact C-N 3.29Å; Y341-K343 PolarHBondContact O-N 3.45Å; Y341-Q344 CarbonylContact O-C 3.24Å; Y341-Q344 PolarHBondContact O-N 3.12Å; Y341-Q344 VanDerWaalsContact O-N 3.08Å; Y341-E345 PolarHBondContact O-N 3.03Å; Y341-K346 HydrophobicContact CD1-CB 3.92Å; Y341-K346 HydrophobicContact CD1-CD 3.99Å; Y341-K346 HydrophobicContact CE1-CD 4.34Å; Y341-K346 PolarHBondContact O-N 3.18Å; Y341-E349 HydrophobicContact CD1-CB 3.61Å; Y341-E349 HydrophobicContact CD1-CG 4.31Å; Y341-E349 HydrophobicContact CD2-CB 3.88Å; Y341-E349 HydrophobicContact CE1-CB 3.79Å; Y341-E349 HydrophobicContact CE1-CG 4.13Å; Y341-E349 HydrophobicContact CE2-CB 4.06Å; Y341-E349 HydrophobicContact CG-CB 3.65Å; Y341-Y353 AromaticContact CD2-CD2 3.93Å; Y341-Y353 HydrophobicContact CD2-CD2 3.93Å; Y341-Y353 HydrophobicContact CD2-CE2 4.27Å; Y341-Y353 AromaticContact CE2-CD2 3.62Å; Y341-Y353 HydrophobicContact CE2-CD2 3.62Å; Y341-Y353 AromaticContact CE2-CE2 3.49Å; Y341-Y353 HydrophobicContact CE2-CE2 3.49Å; Y341-Y353 VanDerWaalsContact CE2-CE2 3.49Å
342	F	96.8	Very high	96.5	Very high	38 Å²	38	48.4 Å²	48.4	17%	0.167	22%	0.218	C	C	.	.	H	α-helix	trans	-59.8	-40.2	176.9	-172	-85.8	0	0	0	112	G338 N339 S340 Q344 E345 Y347 A350 F354 Q372 A373 I376	G338-F342 WeakPolarHBondContact O-CB 3.42Å; G338-F342 PolarHBondContact O-N 3.24Å; N339-F342 PolarHBondContact O-N 3.18Å; S340-F342 VanDerWaalsContact C-N 3.33Å; S340-F342 PolarHBondContact O-N 3.3Å; F342-Q344 VanDerWaalsContact C-N 3.32Å; F342-E345 PolarHBondContact O-N 3.42Å; F342-Y347 HydrophobicContact CD2-CD1 4.03Å; F342-Y347 HydrophobicContact CD2-CE1 4.06Å; F342-Y347 HydrophobicContact CE2-CD1 4.17Å; F342-Y347 AromaticContact CE2-CE1 3.99Å; F342-Y347 HydrophobicContact CE2-CE1 3.99Å; F342-Y347 HydrophobicContact CZ-CE1 4.38Å; F342-A350 HydrophobicContact CB-CB 4.1Å; F342-F354 HydrophobicContact CB-CE2 4.38Å; F342-F354 HydrophobicContact CB-CZ 4.21Å; F342-F354 HydrophobicContact CD2-CE2 4.11Å; F342-Q372 HydrophobicContact CE2-CG 4.37Å; F342-Q372 HydrophobicContact CZ-CG 4.14Å; F342-A373 HydrophobicContact CD2-CB 3.84Å; F342-A373 HydrophobicContact CE2-CB 3.85Å; F342-I376 HydrophobicContact CE2-CD1 4.34Å; F342-I376 HydrophobicContact CZ-CD1 4.17Å
343	K	95.7	Very high	96.6	Very high	138 Å²	138	44.3 Å²	44.3	60%	0.6	20%	0.2	S	C	*	.	H	α-helix	trans	-69.6	-26.3	175.3	-74.5	-69.3	-172	175	0	113.6	F301 F306 N339 S340 Y341 E345	F301-K343 HydrophobicContact CE2-CG 4.17Å; F301-K343 HydrophobicContact CZ-CG 3.91Å; F306-K343 HydrophobicContact CE1-CB 3.86Å; F306-K343 HydrophobicContact CE1-CG 4.3Å; F306-K343 HydrophobicContact CE2-CB 4.3Å; F306-K343 HydrophobicContact CZ-CB 3.62Å; F306-K343 HydrophobicContact CZ-CG 4.27Å; N339-K343 WeakPolarHBondContact O-CG 3.42Å; N339-K343 PolarHBondContact O-N 3.11Å; S340-K343 PolarHBondContact O-N 3.37Å; Y341-K343 VanDerWaalsContact C-N 3.29Å; Y341-K343 PolarHBondContact O-N 3.45Å; K343-E345 VanDerWaalsContact C-N 3.28Å
344	Q	95.6	Very high	96.7	Very high	47 Å²	47	44.3 Å²	44.3	22%	0.22	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	7.8	173.2	-67.5	-169.5	-16.4	0	0	113.2	F306 E307 S340 Y341 F342 K346	F306-Q344 HydrophobicContact CB-CG 4.36Å; F306-Q344 VanDerWaalsContact CB-NE2 3.29Å; F306-Q344 HydrophobicContact CD2-CG 3.69Å; F306-Q344 HydrophobicContact CE2-CG 4.26Å; F306-Q344 HydrophobicContact CG-CG 4.14Å; E307-Q344 PolarHBondContact OE1-NE2 3Å; S340-Q344 PolarHBondContact O-N 3.34Å; Y341-Q344 CarbonylContact O-C 3.24Å; Y341-Q344 PolarHBondContact O-N 3.12Å; Y341-Q344 VanDerWaalsContact O-N 3.08Å; F342-Q344 VanDerWaalsContact C-N 3.32Å; Q344-K346 HydrophobicContact CB-CD 4.28Å; Q344-K346 HydrophobicContact CB-CG 4.28Å; Q344-K346 PolarHBondContact O-N 3.3Å; Q344-K346 VanDerWaalsContact O-N 3.08Å
345	E	95.1	Very high	96.6	Very high	132 Å²	132	47.2 Å²	47.2	62%	0.617	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	17.8	-175.2	-52.7	-175.4	172	0	0	114.3	Y341 F342 K343 Y347	Y341-E345 PolarHBondContact O-N 3.03Å; F342-E345 PolarHBondContact O-N 3.42Å; K343-E345 VanDerWaalsContact C-N 3.28Å; E345-Y347 VanDerWaalsContact C-N 3.31Å; E345-Y347 HydrophobicContact CB-CE2 3.87Å; E345-Y347 WeakPolarHBondContact O-CD2 3.47Å; E345-Y347 WeakPolarHBondContact O-CE2 3.42Å; E345-Y347 PolarHBondContact O-N 2.87Å; E345-Y347 VanDerWaalsContact O-N 3.11Å
346	K	96.1	Very high	96.6	Very high	87 Å²	87	51.5 Å²	51.5	38%	0.378	23%	0.232	S	C	.	.			trans	-88.2	70.5	175.7	-71.1	178.1	-174.1	162.4	0	109.7	Y341 Q344 K348 E349 A350	Y341-K346 HydrophobicContact CD1-CB 3.92Å; Y341-K346 HydrophobicContact CD1-CD 3.99Å; Y341-K346 HydrophobicContact CE1-CD 4.34Å; Y341-K346 PolarHBondContact O-N 3.18Å; Q344-K346 HydrophobicContact CB-CD 4.28Å; Q344-K346 HydrophobicContact CB-CG 4.28Å; Q344-K346 PolarHBondContact O-N 3.3Å; Q344-K346 VanDerWaalsContact O-N 3.08Å; K346-K348 VanDerWaalsContact C-N 3.34Å; K346-K348 PolarHBondContact O-N 3.34Å; K346-E349 PolarHBondContact O-N 2.95Å; K346-A350 WeakPolarHBondContact O-CB 3.34Å; K346-A350 PolarHBondContact O-N 3.3Å
347	Y	96.1	Very high	96.5	Very high	24 Å²	24	49.6 Å²	49.6	9%	0.094	23%	0.225	C	C	.	.	H	α-helix	trans	-67.1	-31.4	-169	-58.5	-68.3	0	0	0	113.6	F342 E345 A350 I351 A373 I376	F342-Y347 HydrophobicContact CD2-CD1 4.03Å; F342-Y347 HydrophobicContact CD2-CE1 4.06Å; F342-Y347 HydrophobicContact CE2-CD1 4.17Å; F342-Y347 AromaticContact CE2-CE1 3.99Å; F342-Y347 HydrophobicContact CE2-CE1 3.99Å; F342-Y347 HydrophobicContact CZ-CE1 4.38Å; E345-Y347 VanDerWaalsContact C-N 3.31Å; E345-Y347 HydrophobicContact CB-CE2 3.87Å; E345-Y347 WeakPolarHBondContact O-CD2 3.47Å; E345-Y347 WeakPolarHBondContact O-CE2 3.42Å; E345-Y347 PolarHBondContact O-N 2.87Å; E345-Y347 VanDerWaalsContact O-N 3.11Å; Y347-A350 PolarHBondContact O-N 3.06Å; Y347-I351 WeakPolarHBondContact O-CB 3.12Å; Y347-I351 VanDerWaalsContact O-CD1 3.29Å; Y347-I351 WeakPolarHBondContact O-CD1 3.38Å; Y347-I351 WeakPolarHBondContact O-CG1 3.35Å; Y347-I351 PolarHBondContact O-N 3.26Å; Y347-A373 HydrophobicContact CD1-CB 4.22Å; Y347-I376 HydrophobicContact CD1-CG2 4.43Å; Y347-I376 HydrophobicContact CD2-CG2 3.84Å; Y347-I376 HydrophobicContact CE1-CB 4.36Å; Y347-I376 HydrophobicContact CE1-CD1 3.94Å; Y347-I376 HydrophobicContact CE1-CG2 4.06Å; Y347-I376 HydrophobicContact CE2-CB 4.41Å; Y347-I376 HydrophobicContact CE2-CG2 3.4Å; Y347-I376 HydrophobicContact CG-CG2 4.34Å
348	K	95.4	Very high	96.3	Very high	111 Å²	111	50.7 Å²	50.7	48%	0.483	23%	0.231	S	C	.	.	H	α-helix	trans	-61.1	-50.2	178.1	-70	-173.9	-179.2	-165.9	0	111.1	K346 I351 Q352 L377 E381	K346-K348 VanDerWaalsContact C-N 3.34Å; K346-K348 PolarHBondContact O-N 3.34Å; K348-I351 PolarHBondContact O-N 3.45Å; K348-Q352 WeakPolarHBondContact O-CG 3.3Å; K348-Q352 PolarHBondContact O-N 3.44Å; K348-L377 HydrophobicContact CD-CD1 4.4Å; K348-L377 HydrophobicContact CG-CD1 3.76Å; K348-L377 HydrophobicContact CG-CD2 3.61Å; K348-L377 HydrophobicContact CG-CG 4.35Å; K348-E381 WeakPolarHBondContact CE-OE1 3.33Å; K348-E381 IonicContact NZ-OE1 2.73Å; K348-E381 PolarHBondContact NZ-OE1 3Å
349	E	96.6	Very high	96.1	Very high	74 Å²	74	56.6 Å²	56.6	35%	0.346	27%	0.267	S	S	.	.	H	α-helix	trans	-67.3	-40	177.7	-62.9	85.6	164.1	0	0	110.9	Y341 K346 I351 Q352 Y353	Y341-E349 HydrophobicContact CD1-CB 3.61Å; Y341-E349 HydrophobicContact CD1-CG 4.31Å; Y341-E349 HydrophobicContact CD2-CB 3.88Å; Y341-E349 HydrophobicContact CE1-CB 3.79Å; Y341-E349 HydrophobicContact CE1-CG 4.13Å; Y341-E349 HydrophobicContact CE2-CB 4.06Å; Y341-E349 HydrophobicContact CG-CB 3.65Å; K346-E349 PolarHBondContact O-N 2.95Å; E349-I351 PolarHBondContact O-N 3.13Å; E349-Q352 WeakPolarHBondContact O-CB 3.43Å; E349-Q352 PolarHBondContact O-N 3.37Å; E349-Y353 WeakPolarHBondContact O-CD2 3.48Å; E349-Y353 PolarHBondContact O-N 3.43Å; E349-Y353 VanDerWaalsContact O-N 3.11Å
350	A	97.3	Very high	95.7	Very high	0 Å²	0	58 Å²	58	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.1	-48.2	175.5	0	0	0	0	0	112	G338 F342 K346 Y347 Q352 Y353 F354	G338-A350 WeakPolarHBondContact O-CB 3.35Å; F342-A350 HydrophobicContact CB-CB 4.1Å; K346-A350 WeakPolarHBondContact O-CB 3.34Å; K346-A350 PolarHBondContact O-N 3.3Å; Y347-A350 PolarHBondContact O-N 3.06Å; A350-Q352 VanDerWaalsContact C-N 3.34Å; A350-Q352 PolarHBondContact O-N 2.95Å; A350-Y353 PolarHBondContact O-N 3.2Å; A350-F354 HydrophobicContact CB-CD2 4.41Å; A350-F354 HydrophobicContact CB-CE2 4.08Å; A350-F354 WeakPolarHBondContact O-CB 3.32Å; A350-F354 WeakPolarHBondContact O-CD2 3.48Å; A350-F354 VanDerWaalsContact O-CG 3.28Å; A350-F354 WeakPolarHBondContact O-CG 3.3Å; A350-F354 PolarHBondContact O-N 2.87Å
351	I	97.3	Very high	95.4	Very high	19 Å²	19	60.9 Å²	60.9	10%	0.097	29%	0.286	C	S	.	.	H	α-helix	trans	-60.8	-42.7	178.1	-67.9	159.8	0	0	0	110.9	Y347 K348 E349 Y353 F354 N355 A373 E374 L377	Y347-I351 WeakPolarHBondContact O-CB 3.12Å; Y347-I351 VanDerWaalsContact O-CD1 3.29Å; Y347-I351 WeakPolarHBondContact O-CD1 3.38Å; Y347-I351 WeakPolarHBondContact O-CG1 3.35Å; Y347-I351 PolarHBondContact O-N 3.26Å; K348-I351 PolarHBondContact O-N 3.45Å; E349-I351 PolarHBondContact O-N 3.13Å; I351-Y353 PolarHBondContact O-N 2.9Å; I351-F354 PolarHBondContact O-N 2.87Å; I351-N355 WeakPolarHBondContact CG2-ND2 3.26Å; I351-N355 WeakPolarHBondContact O-CB 3.39Å; I351-N355 PolarHBondContact O-N 3.01Å; I351-N355 PolarHBondContact O-ND2 3.36Å; I351-N355 VanDerWaalsContact O-ND2 3.17Å; I351-A373 HydrophobicContact CD1-CB 4.22Å; I351-A373 HydrophobicContact CG1-CB 3.66Å; I351-E374 HydrophobicContact CD1-CB 4.31Å; I351-E374 HydrophobicContact CD1-CG 3.69Å; I351-E374 HydrophobicContact CG1-CG 3.95Å; I351-E374 HydrophobicContact CG2-CG 4.21Å; I351-L377 HydrophobicContact CD1-CB 4.32Å; I351-L377 HydrophobicContact CD1-CD2 3.7Å
352	Q	97.2	Very high	95	Very high	111 Å²	111	67.8 Å²	67.8	52%	0.519	31%	0.312	S	S	.	.	H	α-helix	trans	-58	-47.2	177.2	-71.4	176.4	9.2	0	0	111.8	K348 E349 A350 N355 K356	K348-Q352 WeakPolarHBondContact O-CG 3.3Å; K348-Q352 PolarHBondContact O-N 3.44Å; E349-Q352 WeakPolarHBondContact O-CB 3.43Å; E349-Q352 PolarHBondContact O-N 3.37Å; A350-Q352 VanDerWaalsContact C-N 3.34Å; A350-Q352 PolarHBondContact O-N 2.95Å; Q352-N355 PolarHBondContact O-N 3.17Å; Q352-K356 WeakPolarHBondContact O-CG 3.47Å; Q352-K356 PolarHBondContact O-N 3.44Å
353	Y	96.9	Very high	94.7	Very high	30 Å²	30	67.7 Å²	67.7	12%	0.118	32%	0.315	C	S	.	.	H	α-helix	trans	-75.5	-31.4	-179.6	-80.7	-90.3	0	0	0	113.4	E314 L334 I337 Y341 E349 A350 I351 K356 S357	E314-Y353 PolarHBondContact OE1-OH 2.89Å; L334-Y353 HydrophobicContact CD2-CD1 3.99Å; L334-Y353 HydrophobicContact CD2-CE1 4.41Å; I337-Y353 HydrophobicContact CB-CD1 3.77Å; I337-Y353 HydrophobicContact CB-CE1 4.14Å; I337-Y353 HydrophobicContact CB-CG 4.14Å; I337-Y353 HydrophobicContact CD1-CD1 4.02Å; I337-Y353 HydrophobicContact CD1-CE1 3.77Å; I337-Y353 HydrophobicContact CG2-CD1 3.35Å; I337-Y353 HydrophobicContact CG2-CD2 3.8Å; I337-Y353 HydrophobicContact CG2-CE1 3.46Å; I337-Y353 VanDerWaalsContact CG2-CE1 3.46Å; I337-Y353 HydrophobicContact CG2-CE2 3.93Å; I337-Y353 HydrophobicContact CG2-CG 3.5Å; I337-Y353 VanDerWaalsContact CG2-CG 3.5Å; Y341-Y353 AromaticContact CD2-CD2 3.93Å; Y341-Y353 HydrophobicContact CD2-CD2 3.93Å; Y341-Y353 HydrophobicContact CD2-CE2 4.27Å; Y341-Y353 AromaticContact CE2-CD2 3.62Å; Y341-Y353 HydrophobicContact CE2-CD2 3.62Å; Y341-Y353 AromaticContact CE2-CE2 3.49Å; Y341-Y353 HydrophobicContact CE2-CE2 3.49Å; Y341-Y353 VanDerWaalsContact CE2-CE2 3.49Å; E349-Y353 WeakPolarHBondContact O-CD2 3.48Å; E349-Y353 PolarHBondContact O-N 3.43Å; E349-Y353 VanDerWaalsContact O-N 3.11Å; A350-Y353 PolarHBondContact O-N 3.2Å; I351-Y353 PolarHBondContact O-N 2.9Å; Y353-K356 HydrophobicContact CD1-CD 4.2Å; Y353-K356 PolarHBondContact O-N 3.09Å; Y353-S357 WeakPolarHBondContact O-CB 3.33Å; Y353-S357 PolarHBondContact O-N 2.85Å
354	F	97.4	Very high	94.5	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-43.7	169.7	-69.1	-37.6	0	0	0	111.6	G338 F342 A350 I351 S357 L358 V366 K369 C370 A373	G338-F354 VanDerWaalsContact C-CE1 3.43Å; G338-F354 VanDerWaalsContact C-CZ 3.44Å; F342-F354 HydrophobicContact CB-CE2 4.38Å; F342-F354 HydrophobicContact CB-CZ 4.21Å; F342-F354 HydrophobicContact CD2-CE2 4.11Å; A350-F354 HydrophobicContact CB-CD2 4.41Å; A350-F354 HydrophobicContact CB-CE2 4.08Å; A350-F354 WeakPolarHBondContact O-CB 3.32Å; A350-F354 WeakPolarHBondContact O-CD2 3.48Å; A350-F354 VanDerWaalsContact O-CG 3.28Å; A350-F354 WeakPolarHBondContact O-CG 3.3Å; A350-F354 PolarHBondContact O-N 2.87Å; I351-F354 PolarHBondContact O-N 2.87Å; F354-S357 WeakPolarHBondContact O-CB 3.42Å; F354-S357 PolarHBondContact O-N 3.33Å; F354-L358 VanDerWaalsContact O-CG 3.26Å; F354-L358 WeakPolarHBondContact O-CG 3.47Å; F354-L358 PolarHBondContact O-N 3.37Å; F354-V366 HydrophobicContact CB-CG1 4.01Å; F354-V366 HydrophobicContact CD1-CG1 3.73Å; F354-V366 HydrophobicContact CG-CG1 4.16Å; F354-K369 HydrophobicContact CE1-CB 4.42Å; F354-K369 HydrophobicContact CE2-CB 4.05Å; F354-K369 HydrophobicContact CZ-CB 3.94Å; F354-K369 HydrophobicContact CZ-CD 4.4Å; F354-C370 HydrophobicContact CB-CB 3.86Å; F354-C370 HydrophobicContact CD2-CB 4.19Å; F354-C370 HydrophobicContact CG-CB 4.34Å; F354-A373 HydrophobicContact CE2-CB 4.43Å
355	N	95.4	Very high	94.3	Very high	70 Å²	70	68.6 Å²	68.6	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-44.9	174.8	-78.4	-40.8	0	0	0	111.7	I351 Q352 S357 L358 T359	I351-N355 WeakPolarHBondContact CG2-ND2 3.26Å; I351-N355 WeakPolarHBondContact O-CB 3.39Å; I351-N355 PolarHBondContact O-N 3.01Å; I351-N355 PolarHBondContact O-ND2 3.36Å; I351-N355 VanDerWaalsContact O-ND2 3.17Å; Q352-N355 PolarHBondContact O-N 3.17Å; N355-S357 VanDerWaalsContact C-N 3.31Å; N355-S357 PolarHBondContact O-N 3Å; N355-L358 PolarHBondContact O-N 3.5Å; N355-L358 VanDerWaalsContact O-N 3.13Å; N355-T359 PolarHBondContact O-N 3.17Å; N355-T359 PolarHBondContact O-OG1 3.07Å; N355-T359 VanDerWaalsContact O-OG1 3.06Å
356	K	95.6	Very high	94.2	Very high	99 Å²	99	62.9 Å²	62.9	43%	0.43	31%	0.306	S	S	.	.	H	α-helix	trans	-54.8	-46.4	172.2	-72.1	174	-177.4	178.2	0	111.5	L334 Q352 Y353 L358 T359 E360	L334-K356 HydrophobicContact CD1-CB 4.21Å; L334-K356 HydrophobicContact CD2-CB 4.21Å; Q352-K356 WeakPolarHBondContact O-CG 3.47Å; Q352-K356 PolarHBondContact O-N 3.44Å; Y353-K356 HydrophobicContact CD1-CD 4.2Å; Y353-K356 PolarHBondContact O-N 3.09Å; K356-L358 VanDerWaalsContact C-N 3.35Å; K356-L358 PolarHBondContact O-N 3.4Å; K356-T359 PolarHBondContact O-N 3Å; K356-E360 WeakPolarHBondContact O-CG 3.48Å; K356-E360 PolarHBondContact O-N 3.31Å
357	S	95.1	Very high	94.1	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.007	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-42.3	176.4	172.1	0	0	0	0	112.7	A331 Y353 F354 N355 T359 E360 H361	A331-S357 PolarHBondContact O-OG 3.36Å; Y353-S357 WeakPolarHBondContact O-CB 3.33Å; Y353-S357 PolarHBondContact O-N 2.85Å; F354-S357 WeakPolarHBondContact O-CB 3.42Å; F354-S357 PolarHBondContact O-N 3.33Å; N355-S357 VanDerWaalsContact C-N 3.31Å; N355-S357 PolarHBondContact O-N 3Å; S357-T359 VanDerWaalsContact C-N 3.32Å; S357-E360 PolarHBondContact O-N 2.95Å; S357-H361 PolarHBondContact O-N 3.01Å
358	L	92.9	Very high	94	Very high	24 Å²	24	66.2 Å²	66.2	13%	0.126	32%	0.323	C	S	.	.	H	α-helix	trans	-71.2	-27.8	-178.3	-69.3	169.8	0	0	0	112.4	F354 N355 K356 R362 V366 L367 C370	F354-L358 VanDerWaalsContact O-CG 3.26Å; F354-L358 WeakPolarHBondContact O-CG 3.47Å; F354-L358 PolarHBondContact O-N 3.37Å; N355-L358 PolarHBondContact O-N 3.5Å; N355-L358 VanDerWaalsContact O-N 3.13Å; K356-L358 VanDerWaalsContact C-N 3.35Å; K356-L358 PolarHBondContact O-N 3.4Å; L358-R362 HydrophobicContact CD2-CG 4.2Å; L358-V366 HydrophobicContact CD1-CG1 4.38Å; L358-V366 HydrophobicContact CD2-CB 4.01Å; L358-V366 HydrophobicContact CD2-CG1 3.95Å; L358-V366 HydrophobicContact CG-CG1 3.89Å; L358-L367 HydrophobicContact CD1-CB 4.49Å; L358-L367 HydrophobicContact CD1-CD1 4.17Å; L358-L367 HydrophobicContact CD2-CB 4.27Å; L358-C370 HydrophobicContact CD1-CB 4.36Å
359	T	93.3	Very high	94	Very high	124 Å²	124	64.7 Å²	64.7	76%	0.761	32%	0.317	S	S	*	.	H	α-helix	trans	-66.1	-40.9	170.5	-56.5	0	0	0	0	111.5	N355 K356 S357	N355-T359 PolarHBondContact O-N 3.17Å; N355-T359 PolarHBondContact O-OG1 3.07Å; N355-T359 VanDerWaalsContact O-OG1 3.06Å; K356-T359 PolarHBondContact O-N 3Å; S357-T359 VanDerWaalsContact C-N 3.32Å
360	E	89.6	Confident	93.9	Very high	60 Å²	60	61.3 Å²	61.3	28%	0.28	30%	0.301	S	S	.	.	H	α-helix	trans	-72.1	-50.2	177.3	-59.8	-71.7	-175.1	0	0	111.1	R321 Y327 I330 A331 L334 K356 S357	R321-E360 IonicContact NH2-OE1 2.86Å; R321-E360 PolarHBondContact NH2-OE1 2.92Å; Y327-E360 VanDerWaalsContact CD2-O 3.22Å; Y327-E360 WeakPolarHBondContact CD2-O 3.43Å; I330-E360 HydrophobicContact CG2-CG 4.14Å; A331-E360 HydrophobicContact CB-CB 3.89Å; L334-E360 HydrophobicContact CD1-CG 3.6Å; K356-E360 WeakPolarHBondContact O-CG 3.48Å; K356-E360 PolarHBondContact O-N 3.31Å; S357-E360 PolarHBondContact O-N 2.95Å
361	H	90.1	Very high	93.9	Very high	59 Å²	59	66.4 Å²	66.4	27%	0.273	33%	0.325	S	S	.	.			trans	-153.5	119.3	175.3	-179.2	-105.7	0	0	0	111.7	Y327 A331 S357 T363	Y327-H361 HydrophobicContact CD2-CB 4.06Å; Y327-H361 HydrophobicContact CE2-CB 4.25Å; Y327-H361 AromaticContact CE2-CD2 3.77Å; A331-H361 HydrophobicContact CB-CB 3.59Å; S357-H361 PolarHBondContact O-N 3.01Å; H361-T363 VanDerWaalsContact ND1-CG2 3.27Å; H361-T363 WeakPolarHBondContact ND1-CG2 3.41Å; H361-T363 PolarHBondContact O-N 2.84Å; H361-T363 VanDerWaalsContact O-N 3.14Å
362	R	89.7	Confident	93.8	Very high	175 Å²	175	70.3 Å²	70.3	66%	0.66	34%	0.343	S	S	*	.			trans	-74.2	106.2	-179.2	-169.6	179.6	-176.5	110.7	-3.2	111.4	L358	L358-R362 HydrophobicContact CD2-CG 4.2Å
363	T	89.8	Confident	93.7	Very high	37 Å²	37	65 Å²	65	23%	0.227	32%	0.318	C	S	.	.			trans	-108.8	133.3	172.6	54.1	0	0	0	0	111.4	H361 D365 V366 L367	H361-T363 VanDerWaalsContact ND1-CG2 3.27Å; H361-T363 WeakPolarHBondContact ND1-CG2 3.41Å; H361-T363 PolarHBondContact O-N 2.84Å; H361-T363 VanDerWaalsContact O-N 3.14Å; T363-D365 VanDerWaalsContact C-N 3.27Å; T363-D365 PolarHBondContact O-N 3.21Å; T363-V366 PolarHBondContact O-N 3.29Å; T363-V366 VanDerWaalsContact OG1-CB 3.26Å; T363-V366 WeakPolarHBondContact OG1-CB 3.4Å; T363-V366 WeakPolarHBondContact OG1-CG2 3.47Å; T363-L367 PolarHBondContact O-N 3.12Å; T363-L367 VanDerWaalsContact O-N 3.11Å
364	P	91.6	Very high	93.7	Very high	91 Å²	91	67.8 Å²	67.8	59%	0.591	33%	0.332	S	S	*	.	H	α-helix	trans	-55.3	-37.4	179.3	-27.7	35.5	0	0	0	114.2	L367 K368	P364-L367 PolarHBondContact O-N 3.41Å; P364-K368 WeakPolarHBondContact O-CG 3.43Å; P364-K368 PolarHBondContact O-N 3.11Å
365	D	91.3	Very high	93.6	Very high	112 Å²	112	75.6 Å²	75.6	60%	0.599	37%	0.366	S	S	*	.	H	α-helix	trans	-66.4	-42	-178.2	-58.9	-35.7	0	0	0	112.4	T363 K368 K369	T363-D365 VanDerWaalsContact C-N 3.27Å; T363-D365 PolarHBondContact O-N 3.21Å; D365-K368 PolarHBondContact O-N 3.32Å; D365-K369 WeakPolarHBondContact O-CG 3.49Å; D365-K369 PolarHBondContact O-N 2.98Å; D365-K369 VanDerWaalsContact O-N 3.12Å
366	V	93.3	Very high	93.6	Very high	12 Å²	12	74.5 Å²	74.5	7%	0.073	36%	0.36	C	S	.	.	H	α-helix	trans	-68.5	-37.7	176	177.8	0	0	0	0	110.7	A335 F354 L358 T363 K369 C370	A335-V366 HydrophobicContact CB-CG2 3.63Å; F354-V366 HydrophobicContact CB-CG1 4.01Å; F354-V366 HydrophobicContact CD1-CG1 3.73Å; F354-V366 HydrophobicContact CG-CG1 4.16Å; L358-V366 HydrophobicContact CD1-CG1 4.38Å; L358-V366 HydrophobicContact CD2-CB 4.01Å; L358-V366 HydrophobicContact CD2-CG1 3.95Å; L358-V366 HydrophobicContact CG-CG1 3.89Å; T363-V366 PolarHBondContact O-N 3.29Å; T363-V366 VanDerWaalsContact OG1-CB 3.26Å; T363-V366 WeakPolarHBondContact OG1-CB 3.4Å; T363-V366 WeakPolarHBondContact OG1-CG2 3.47Å; V366-K369 PolarHBondContact O-N 3.49Å; V366-C370 WeakPolarHBondContact O-CB 3.26Å; V366-C370 PolarHBondContact O-N 2.9Å
367	L	93.2	Very high	93.5	Very high	43 Å²	43	71 Å²	71	23%	0.225	35%	0.346	C	S	.	.	H	α-helix	trans	-61.2	-47	175.9	178.9	64.2	0	0	0	111.5	L358 T363 P364 K369 C370 Q371	L358-L367 HydrophobicContact CD1-CB 4.49Å; L358-L367 HydrophobicContact CD1-CD1 4.17Å; L358-L367 HydrophobicContact CD2-CB 4.27Å; T363-L367 PolarHBondContact O-N 3.12Å; T363-L367 VanDerWaalsContact O-N 3.11Å; P364-L367 PolarHBondContact O-N 3.41Å; L367-K369 VanDerWaalsContact C-N 3.31Å; L367-K369 PolarHBondContact O-N 2.72Å; L367-C370 WeakPolarHBondContact O-CB 3.4Å; L367-C370 PolarHBondContact O-N 3.37Å; L367-Q371 HydrophobicContact CD1-CG 4.46Å; L367-Q371 WeakPolarHBondContact O-CG 3.41Å; L367-Q371 PolarHBondContact O-N 2.66Å
368	K	95.9	Very high	93.4	Very high	138 Å²	138	78.6 Å²	78.6	60%	0.6	38%	0.378	S	S	*	.	H	α-helix	trans	-58.1	-44.1	176.1	-73.1	175.5	-179	176.6	0	111.5	P364 D365 Q371 Q372	P364-K368 WeakPolarHBondContact O-CG 3.43Å; P364-K368 PolarHBondContact O-N 3.11Å; D365-K368 PolarHBondContact O-N 3.32Å; K368-Q371 PolarHBondContact O-N 2.72Å; K368-Q372 WeakPolarHBondContact O-CB 3.22Å; K368-Q372 PolarHBondContact O-N 2.91Å
369	K	94.5	Very high	93.3	Very high	80 Å²	80	81.8 Å²	81.8	35%	0.348	39%	0.393	S	S	.	.	H	α-helix	trans	-65.8	-38.1	176.9	-73.5	-179	173.6	-177.9	0	113.1	N339 F354 D365 V366 L367 Q372 A373	N339-K369 VanDerWaalsContact OD1-CD 3.22Å; N339-K369 WeakPolarHBondContact OD1-CD 3.3Å; N339-K369 PolarHBondContact OD1-NZ 3.04Å; F354-K369 HydrophobicContact CE1-CB 4.42Å; F354-K369 HydrophobicContact CE2-CB 4.05Å; F354-K369 HydrophobicContact CZ-CB 3.94Å; F354-K369 HydrophobicContact CZ-CD 4.4Å; D365-K369 WeakPolarHBondContact O-CG 3.49Å; D365-K369 PolarHBondContact O-N 2.98Å; D365-K369 VanDerWaalsContact O-N 3.12Å; V366-K369 PolarHBondContact O-N 3.49Å; L367-K369 VanDerWaalsContact C-N 3.31Å; L367-K369 PolarHBondContact O-N 2.72Å; K369-Q372 PolarHBondContact O-N 3.02Å; K369-A373 WeakPolarHBondContact O-CB 3.37Å; K369-A373 PolarHBondContact O-N 3.33Å
370	C	95.6	Very high	93.1	Very high	3 Å²	3	79.7 Å²	79.7	2%	0.02	37%	0.374	C	S	.	.	H	α-helix	trans	-62	-50.1	174.8	-164.7	0	0	0	0	111.1	F354 L358 V366 L367 Q372 A373 E374	F354-C370 HydrophobicContact CB-CB 3.86Å; F354-C370 HydrophobicContact CD2-CB 4.19Å; F354-C370 HydrophobicContact CG-CB 4.34Å; L358-C370 HydrophobicContact CD1-CB 4.36Å; V366-C370 WeakPolarHBondContact O-CB 3.26Å; V366-C370 PolarHBondContact O-N 2.9Å; L367-C370 WeakPolarHBondContact O-CB 3.4Å; L367-C370 PolarHBondContact O-N 3.37Å; C370-Q372 VanDerWaalsContact C-N 3.29Å; C370-Q372 PolarHBondContact O-N 3.36Å; C370-A373 WeakPolarHBondContact O-CB 3.32Å; C370-A373 PolarHBondContact O-N 2.86Å; C370-A373 VanDerWaalsContact O-N 3.14Å; C370-E374 WeakPolarHBondContact O-CG 3.4Å; C370-E374 PolarHBondContact O-N 3.41Å
371	Q	95.6	Very high	93.2	Very high	107 Å²	107	81.2 Å²	81.2	50%	0.5	38%	0.381	S	S	.	.	H	α-helix	trans	-60.4	-38.8	176.7	-70.4	174.9	-15.3	0	0	112.2	L367 K368 E374 K375	L367-Q371 HydrophobicContact CD1-CG 4.46Å; L367-Q371 WeakPolarHBondContact O-CG 3.41Å; L367-Q371 PolarHBondContact O-N 2.66Å; K368-Q371 PolarHBondContact O-N 2.72Å; Q371-E374 PolarHBondContact O-N 3.1Å; Q371-K375 WeakPolarHBondContact O-CB 3.43Å; Q371-K375 PolarHBondContact O-N 3.47Å
372	Q	96.3	Very high	93.2	Very high	100 Å²	100	83.4 Å²	83.4	47%	0.467	39%	0.39	S	S	.	.	H	α-helix	trans	-63.3	-46.1	174.5	-175.6	179.5	7.3	0	0	111.5	F342 K368 K369 C370 K375 I376	F342-Q372 HydrophobicContact CE2-CG 4.37Å; F342-Q372 HydrophobicContact CZ-CG 4.14Å; K368-Q372 WeakPolarHBondContact O-CB 3.22Å; K368-Q372 PolarHBondContact O-N 2.91Å; K369-Q372 PolarHBondContact O-N 3.02Å; C370-Q372 VanDerWaalsContact C-N 3.29Å; C370-Q372 PolarHBondContact O-N 3.36Å; Q372-K375 PolarHBondContact O-N 3Å; Q372-I376 HydrophobicContact CG-CD1 3.98Å; Q372-I376 VanDerWaalsContact O-CG1 3.3Å; Q372-I376 WeakPolarHBondContact O-CG1 3.28Å; Q372-I376 PolarHBondContact O-N 3.4Å
373	A	95.4	Very high	93.2	Very high	0 Å²	0	79.8 Å²	79.8	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-62	-42.5	177.4	0	0	0	0	0	111.8	F342 Y347 I351 F354 K369 C370 I376 L377	F342-A373 HydrophobicContact CD2-CB 3.84Å; F342-A373 HydrophobicContact CE2-CB 3.85Å; Y347-A373 HydrophobicContact CD1-CB 4.22Å; I351-A373 HydrophobicContact CD1-CB 4.22Å; I351-A373 HydrophobicContact CG1-CB 3.66Å; F354-A373 HydrophobicContact CE2-CB 4.43Å; K369-A373 WeakPolarHBondContact O-CB 3.37Å; K369-A373 PolarHBondContact O-N 3.33Å; C370-A373 WeakPolarHBondContact O-CB 3.32Å; C370-A373 PolarHBondContact O-N 2.86Å; C370-A373 VanDerWaalsContact O-N 3.14Å; A373-I376 PolarHBondContact O-N 3.47Å; A373-L377 VanDerWaalsContact O-CB 3.29Å; A373-L377 WeakPolarHBondContact O-CB 3.48Å; A373-L377 PolarHBondContact O-N 3.25Å
374	E	95.4	Very high	93.2	Very high	88 Å²	88	82.3 Å²	82.3	41%	0.411	41%	0.408	S	S	.	.	H	α-helix	trans	-61	-43.6	175.4	-74.2	171	-177.5	0	0	112	I351 C370 Q371 L377 K378	I351-E374 HydrophobicContact CD1-CB 4.31Å; I351-E374 HydrophobicContact CD1-CG 3.69Å; I351-E374 HydrophobicContact CG1-CG 3.95Å; I351-E374 HydrophobicContact CG2-CG 4.21Å; C370-E374 WeakPolarHBondContact O-CG 3.4Å; C370-E374 PolarHBondContact O-N 3.41Å; Q371-E374 PolarHBondContact O-N 3.1Å; E374-L377 PolarHBondContact O-N 3.32Å; E374-K378 VanDerWaalsContact O-CB 3.28Å; E374-K378 WeakPolarHBondContact O-CB 3.38Å; E374-K378 PolarHBondContact O-N 3.48Å
375	K	95.8	Very high	93.1	Very high	164 Å²	164	82.8 Å²	82.8	71%	0.713	40%	0.399	S	S	*	.	H	α-helix	trans	-62.6	-46.3	177.4	-175.1	-179.1	178.2	-177.1	0	111.5	Q371 Q372 K378 E379	Q371-K375 WeakPolarHBondContact O-CB 3.43Å; Q371-K375 PolarHBondContact O-N 3.47Å; Q372-K375 PolarHBondContact O-N 3Å; K375-K378 PolarHBondContact O-N 3.23Å; K375-E379 PolarHBondContact O-N 3.08Å; K375-E379 VanDerWaalsContact O-N 3.11Å
376	I	94.6	Very high	93.2	Very high	47 Å²	47	80.4 Å²	80.4	24%	0.241	39%	0.385	C	S	.	.	H	α-helix	trans	-64.2	-47.1	179.4	-64.4	164.2	0	0	0	110.1	F342 Y347 Q372 A373 K378 E379 Q380	F342-I376 HydrophobicContact CE2-CD1 4.34Å; F342-I376 HydrophobicContact CZ-CD1 4.17Å; Y347-I376 HydrophobicContact CD1-CG2 4.43Å; Y347-I376 HydrophobicContact CD2-CG2 3.84Å; Y347-I376 HydrophobicContact CE1-CB 4.36Å; Y347-I376 HydrophobicContact CE1-CD1 3.94Å; Y347-I376 HydrophobicContact CE1-CG2 4.06Å; Y347-I376 HydrophobicContact CE2-CB 4.41Å; Y347-I376 HydrophobicContact CE2-CG2 3.4Å; Y347-I376 HydrophobicContact CG-CG2 4.34Å; Q372-I376 HydrophobicContact CG-CD1 3.98Å; Q372-I376 VanDerWaalsContact O-CG1 3.3Å; Q372-I376 WeakPolarHBondContact O-CG1 3.28Å; Q372-I376 PolarHBondContact O-N 3.4Å; A373-I376 PolarHBondContact O-N 3.47Å; I376-K378 VanDerWaalsContact C-N 3.32Å; I376-K378 PolarHBondContact O-N 3.37Å; I376-E379 PolarHBondContact O-N 3.01Å; I376-Q380 HydrophobicContact CG2-CG 4.36Å; I376-Q380 WeakPolarHBondContact O-CG 3.18Å; I376-Q380 PolarHBondContact O-N 3.39Å
377	L	93.8	Very high	93.2	Very high	26 Å²	26	82.6 Å²	82.6	14%	0.136	40%	0.397	C	S	.	.	H	α-helix	trans	-58.5	-45.7	179	178	62.2	0	0	0	111.5	K348 I351 A373 E374 E379 Q380 E381	K348-L377 HydrophobicContact CD-CD1 4.4Å; K348-L377 HydrophobicContact CG-CD1 3.76Å; K348-L377 HydrophobicContact CG-CD2 3.61Å; K348-L377 HydrophobicContact CG-CG 4.35Å; I351-L377 HydrophobicContact CD1-CB 4.32Å; I351-L377 HydrophobicContact CD1-CD2 3.7Å; A373-L377 VanDerWaalsContact O-CB 3.29Å; A373-L377 WeakPolarHBondContact O-CB 3.48Å; A373-L377 PolarHBondContact O-N 3.25Å; E374-L377 PolarHBondContact O-N 3.32Å; L377-E379 VanDerWaalsContact C-N 3.31Å; L377-E379 PolarHBondContact O-N 3.01Å; L377-Q380 PolarHBondContact O-N 2.89Å; L377-E381 HydrophobicContact CD1-CG 4.14Å; L377-E381 HydrophobicContact CG-CG 4.44Å; L377-E381 WeakPolarHBondContact O-CB 3.24Å; L377-E381 WeakPolarHBondContact O-CG 3.28Å; L377-E381 PolarHBondContact O-N 2.84Å
378	K	92.9	Very high	93.2	Very high	160 Å²	160	84.1 Å²	84.1	70%	0.696	41%	0.409	S	S	*	.	H	α-helix	trans	-61.3	-39.7	178.6	-175.7	178.1	180	179.9	0	112.2	E374 K375 I376 K382	E374-K378 VanDerWaalsContact O-CB 3.28Å; E374-K378 WeakPolarHBondContact O-CB 3.38Å; E374-K378 PolarHBondContact O-N 3.48Å; K375-K378 PolarHBondContact O-N 3.23Å; I376-K378 VanDerWaalsContact C-N 3.32Å; I376-K378 PolarHBondContact O-N 3.37Å; K378-K382 VanDerWaalsContact O-CB 3.3Å; K378-K382 WeakPolarHBondContact O-CB 3.33Å; K378-K382 PolarHBondContact O-N 3.07Å
379	E	91	Very high	93.1	Very high	91 Å²	91	85.1 Å²	85.1	43%	0.425	42%	0.416	S	S	.	.	H	α-helix	trans	-68.8	-42.3	176.6	-168.3	61.7	-148.6	0	0	111.4	K375 I376 L377 E381 K382 L383	K375-E379 PolarHBondContact O-N 3.08Å; K375-E379 VanDerWaalsContact O-N 3.11Å; I376-E379 PolarHBondContact O-N 3.01Å; L377-E379 VanDerWaalsContact C-N 3.31Å; L377-E379 PolarHBondContact O-N 3.01Å; E379-E381 PolarHBondContact O-N 3.08Å; E379-K382 PolarHBondContact O-N 2.89Å; E379-L383 HydrophobicContact CG-CD1 4.25Å; E379-L383 WeakPolarHBondContact O-CB 2.97Å; E379-L383 VanDerWaalsContact O-CG 3.32Å; E379-L383 WeakPolarHBondContact O-CG 3.32Å; E379-L383 PolarHBondContact O-N 3.43Å
380	Q	90.4	Very high	93.1	Very high	80 Å²	80	84.7 Å²	84.7	37%	0.374	42%	0.417	S	S	.	.	H	α-helix	trans	-60.2	-45.6	174.7	-74.1	-175.9	-21.7	0	0	112	I376 L377 K382 L383 A384	I376-Q380 HydrophobicContact CG2-CG 4.36Å; I376-Q380 WeakPolarHBondContact O-CG 3.18Å; I376-Q380 PolarHBondContact O-N 3.39Å; L377-Q380 PolarHBondContact O-N 2.89Å; Q380-K382 VanDerWaalsContact C-N 3.34Å; Q380-L383 PolarHBondContact O-N 3.07Å; Q380-A384 VanDerWaalsContact O-CB 3.26Å; Q380-A384 WeakPolarHBondContact O-CB 3.05Å; Q380-A384 PolarHBondContact O-N 3.44Å
381	E	90.6	Very high	93.1	Very high	92 Å²	92	84.6 Å²	84.6	43%	0.43	42%	0.416	S	S	.	.	H	α-helix	trans	-64.4	-40.1	177.2	-72.8	-177.1	156.2	0	0	111.4	K348 L377 E379 Y385	K348-E381 WeakPolarHBondContact CE-OE1 3.33Å; K348-E381 IonicContact NZ-OE1 2.73Å; K348-E381 PolarHBondContact NZ-OE1 3Å; L377-E381 HydrophobicContact CD1-CG 4.14Å; L377-E381 HydrophobicContact CG-CG 4.44Å; L377-E381 WeakPolarHBondContact O-CB 3.24Å; L377-E381 WeakPolarHBondContact O-CG 3.28Å; L377-E381 PolarHBondContact O-N 2.84Å; E379-E381 PolarHBondContact O-N 3.08Å; E381-Y385 WeakPolarHBondContact O-CB 3.44Å; E381-Y385 PolarHBondContact O-N 2.96Å; E381-Y385 VanDerWaalsContact O-N 3.08Å
382	K	89.4	Confident	93.1	Very high	105 Å²	105	83.5 Å²	83.5	46%	0.457	41%	0.414	S	S	.	.	H	α-helix	trans	-61.4	-49.4	174.5	-178.2	-172.4	172.9	-163.2	0	111.3	K378 E379 Q380 Y385 I386	K378-K382 VanDerWaalsContact O-CB 3.3Å; K378-K382 WeakPolarHBondContact O-CB 3.33Å; K378-K382 PolarHBondContact O-N 3.07Å; E379-K382 PolarHBondContact O-N 2.89Å; Q380-K382 VanDerWaalsContact C-N 3.34Å; K382-Y385 WeakPolarHBondContact O-CB 3.33Å; K382-Y385 PolarHBondContact O-N 3.01Å; K382-Y385 VanDerWaalsContact O-N 3.14Å; K382-I386 WeakPolarHBondContact O-CG1 3.15Å; K382-I386 PolarHBondContact O-N 3.1Å
383	L	89.7	Confident	93.1	Very high	100 Å²	100	83 Å²	83	52%	0.524	41%	0.411	S	S	.	.	H	α-helix	trans	-63.6	-41.9	179.6	-70.5	172.8	0	0	0	111.8	E379 Q380 Y385 I386	E379-L383 HydrophobicContact CG-CD1 4.25Å; E379-L383 WeakPolarHBondContact O-CB 2.97Å; E379-L383 VanDerWaalsContact O-CG 3.32Å; E379-L383 WeakPolarHBondContact O-CG 3.32Å; E379-L383 PolarHBondContact O-N 3.43Å; Q380-L383 PolarHBondContact O-N 3.07Å; L383-Y385 PolarHBondContact O-N 3.29Å; L383-I386 HydrophobicContact CD2-CD1 3.97Å; L383-I386 WeakPolarHBondContact O-CB 3.35Å; L383-I386 PolarHBondContact O-N 3.39Å; L383-I386 VanDerWaalsContact O-N 3.14Å
384	A	90.1	Very high	93.2	Very high	90 Å²	90	84 Å²	84	74%	0.744	42%	0.416	S	S	*	.	H	α-helix	trans	-64.3	-22.8	175.6	0	0	0	0	0	112.9	Q380	Q380-A384 VanDerWaalsContact O-CB 3.26Å; Q380-A384 WeakPolarHBondContact O-CB 3.05Å; Q380-A384 PolarHBondContact O-N 3.44Å
385	Y	90.8	Very high	93.2	Very high	101 Å²	101	81.4 Å²	81.4	40%	0.396	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-11.8	177.4	-155.5	-108	0	0	0	114	E381 K382 L383 N387 E416 K419 R420	E381-Y385 WeakPolarHBondContact O-CB 3.44Å; E381-Y385 PolarHBondContact O-N 2.96Å; E381-Y385 VanDerWaalsContact O-N 3.08Å; K382-Y385 WeakPolarHBondContact O-CB 3.33Å; K382-Y385 PolarHBondContact O-N 3.01Å; K382-Y385 VanDerWaalsContact O-N 3.14Å; L383-Y385 PolarHBondContact O-N 3.29Å; Y385-N387 PolarHBondContact O-N 3.49Å; Y385-E416 WeakPolarHBondContact CE1-OE1 3.5Å; Y385-E416 VanDerWaalsContact CZ-OE1 3.29Å; Y385-E416 PolarHBondContact OH-OE1 3.25Å; Y385-K419 HydrophobicContact CD1-CB 3.85Å; Y385-K419 HydrophobicContact CE1-CB 3.69Å; Y385-K419 HydrophobicContact CE1-CD 4.18Å; Y385-R420 HydrophobicContact CD1-CG 3.93Å; Y385-R420 HydrophobicContact CE1-CG 3.77Å
386	I	92.7	Very high	93.3	Very high	61 Å²	61	77.6 Å²	77.6	31%	0.313	39%	0.391	S	S	.	.			trans	-71.8	117.4	-179.6	-64.3	175.4	0	0	0	109	K382 L383 R420 P422	K382-I386 WeakPolarHBondContact O-CG1 3.15Å; K382-I386 PolarHBondContact O-N 3.1Å; L383-I386 HydrophobicContact CD2-CD1 3.97Å; L383-I386 WeakPolarHBondContact O-CB 3.35Å; L383-I386 PolarHBondContact O-N 3.39Å; L383-I386 VanDerWaalsContact O-N 3.14Å; I386-R420 CarbonylContact C-O 3.44Å; I386-R420 VanDerWaalsContact CA-O 3.25Å; I386-R420 WeakPolarHBondContact CA-O 3.4Å; I386-R420 WeakPolarHBondContact CG2-O 3.49Å; I386-P422 HydrophobicContact CD1-CG 4.31Å
387	N	93.6	Very high	93.4	Very high	58 Å²	58	79 Å²	79	31%	0.31	40%	0.395	S	S	.	.			trans	-146	100.8	173.8	-175	-39.2	0	0	0	109.1	Y385 E389 L390 A391 R420	Y385-N387 PolarHBondContact O-N 3.49Å; N387-E389 VanDerWaalsContact C-N 3.29Å; N387-E389 PolarHBondContact O-N 2.83Å; N387-E389 PolarHBondContact OD1-N 3.04Å; N387-E389 VanDerWaalsContact OD1-N 3.09Å; N387-L390 HydrophobicContact CB-CB 4.12Å; N387-L390 HydrophobicContact CB-CD1 4.15Å; N387-L390 HydrophobicContact CB-CG 4.35Å; N387-L390 PolarHBondContact O-N 3.12Å; N387-L390 PolarHBondContact OD1-N 3.26Å; N387-A391 WeakPolarHBondContact O-CB 3.43Å; N387-A391 PolarHBondContact O-N 2.91Å; N387-R420 CarbonylContact C-O 3.59Å; N387-R420 PolarHBondContact N-O 3.44Å
388	P	93.3	Very high	93.6	Very high	75 Å²	75	77.8 Å²	77.8	49%	0.487	39%	0.389	S	S	.	.	H	α-helix	trans	-60.7	-31.3	-177.8	-27.1	36.3	0	0	0	114.8	A391 L392	P388-A391 WeakPolarHBondContact O-CB 3.32Å; P388-A391 PolarHBondContact O-N 3.14Å; P388-L392 PolarHBondContact O-N 3.16Å
389	E	93.9	Very high	93.8	Very high	160 Å²	160	72.4 Å²	72.4	75%	0.748	37%	0.368	S	S	*	.	H	α-helix	trans	-71.4	-47.7	179.9	-63.1	-178.9	171.2	0	0	111	N387 A391 L392 E393	N387-E389 VanDerWaalsContact C-N 3.29Å; N387-E389 PolarHBondContact O-N 2.83Å; N387-E389 PolarHBondContact OD1-N 3.04Å; N387-E389 VanDerWaalsContact OD1-N 3.09Å; E389-A391 PolarHBondContact O-N 3.26Å; E389-L392 WeakPolarHBondContact O-CB 3.44Å; E389-L392 PolarHBondContact O-N 3.27Å; E389-L392 VanDerWaalsContact O-N 3.12Å; E389-E393 PolarHBondContact O-N 2.93Å
390	L	94.1	Very high	94.1	Very high	70 Å²	70	71.6 Å²	71.6	37%	0.366	37%	0.366	S	S	.	.	H	α-helix	trans	-66	-28.9	174.1	-69.6	179.4	0	0	0	112	N387 E394 R420	N387-L390 HydrophobicContact CB-CB 4.12Å; N387-L390 HydrophobicContact CB-CD1 4.15Å; N387-L390 HydrophobicContact CB-CG 4.35Å; N387-L390 PolarHBondContact O-N 3.12Å; N387-L390 PolarHBondContact OD1-N 3.26Å; L390-E394 WeakPolarHBondContact O-CG 3.4Å; L390-E394 PolarHBondContact O-N 3.33Å; L390-E394 VanDerWaalsContact O-N 3.13Å; L390-R420 PolarHBondContact O-NH1 3.46Å
391	A	95.8	Very high	94.5	Very high	1 Å²	1	68 Å²	68	1%	0.008	35%	0.35	C	S	.	.	H	α-helix	trans	-66.1	-41.5	171.4	0	0	0	0	0	111.5	N387 P388 E389 E394 K395 A417 R420 N421	N387-A391 WeakPolarHBondContact O-CB 3.43Å; N387-A391 PolarHBondContact O-N 2.91Å; P388-A391 WeakPolarHBondContact O-CB 3.32Å; P388-A391 PolarHBondContact O-N 3.14Å; E389-A391 PolarHBondContact O-N 3.26Å; A391-E394 PolarHBondContact O-N 3.32Å; A391-K395 WeakPolarHBondContact O-CB 3.43Å; A391-K395 PolarHBondContact O-N 2.98Å; A391-A417 WeakPolarHBondContact CB-O 3.43Å; A391-A417 WeakPolarHBondContact O-CB 3.46Å; A391-R420 HydrophobicContact CB-CB 3.75Å; A391-N421 HydrophobicContact CB-CB 3.49Å; A391-N421 VanDerWaalsContact CB-CB 3.49Å
392	L	95.5	Very high	94.8	Very high	85 Å²	85	66 Å²	66	45%	0.445	34%	0.34	S	S	.	.	H	α-helix	trans	-63.7	-41.2	176.5	178.4	60.1	0	0	0	111.6	P388 E389 K395 N396	P388-L392 PolarHBondContact O-N 3.16Å; E389-L392 WeakPolarHBondContact O-CB 3.44Å; E389-L392 PolarHBondContact O-N 3.27Å; E389-L392 VanDerWaalsContact O-N 3.12Å; L392-K395 VanDerWaalsContact CD1-CE 3.47Å; L392-K395 WeakPolarHBondContact O-CB 3.4Å; L392-K395 PolarHBondContact O-N 3.13Å; L392-N396 VanDerWaalsContact O-CG 3.25Å; L392-N396 PolarHBondContact O-N 3.33Å; L392-N396 PolarHBondContact O-ND2 3.05Å
393	E	95.9	Very high	95.1	Very high	89 Å²	89	68.8 Å²	68.8	42%	0.416	36%	0.355	S	S	.	.	H	α-helix	trans	-61.2	-49.4	175.5	-166.7	-165.4	146.1	0	0	111.7	E389 K395 N396 K397	E389-E393 PolarHBondContact O-N 2.93Å; E393-K395 VanDerWaalsContact C-N 3.32Å; E393-K395 PolarHBondContact O-N 2.89Å; E393-N396 PolarHBondContact O-N 2.94Å; E393-N396 VanDerWaalsContact O-N 3.14Å; E393-K397 PolarHBondContact O-N 2.7Å; E393-K397 WeakPolarHBondContact OE1-CE 3.44Å; E393-K397 IonicContact OE1-NZ 2.72Å; E393-K397 PolarHBondContact OE1-NZ 2.67Å
394	E	97.1	Very high	95.4	Very high	20 Å²	20	71 Å²	71	9%	0.093	36%	0.36	C	S	.	.	H	α-helix	trans	-64.2	-37.2	176.9	-70.1	-59.9	133.7	0	0	112.2	L390 A391 N396 K397 G398 H413 E416 A417 R420	L390-E394 WeakPolarHBondContact O-CG 3.4Å; L390-E394 PolarHBondContact O-N 3.33Å; L390-E394 VanDerWaalsContact O-N 3.13Å; A391-E394 PolarHBondContact O-N 3.32Å; E394-N396 VanDerWaalsContact C-N 3.29Å; E394-N396 PolarHBondContact O-N 3.09Å; E394-K397 PolarHBondContact O-N 2.86Å; E394-K397 IonicContact OE1-NZ 2.9Å; E394-K397 PolarHBondContact OE1-NZ 2.96Å; E394-G398 PolarHBondContact O-N 2.99Å; E394-H413 IonicContact OE2-CE1 2.63Å; E394-H413 IonicContact OE2-CG 3.74Å; E394-H413 IonicContact OE2-ND1 3.6Å; E394-H413 PolarHBondContact OE2-ND1 3.5Å; E394-E416 HydrophobicContact CG-CG 4.04Å; E394-A417 HydrophobicContact CB-CB 3.96Å; E394-R420 IonicContact OE1-NH1 2.66Å
395	K	97.3	Very high	95.6	Very high	34 Å²	34	68.3 Å²	68.3	15%	0.148	34%	0.341	C	S	.	.	H	α-helix	trans	-57.8	-43.7	172.2	-175.6	-170.7	74.3	-171	0	111.1	A391 L392 E393 G398 N399 Y414 A417 L427	A391-K395 WeakPolarHBondContact O-CB 3.43Å; A391-K395 PolarHBondContact O-N 2.98Å; L392-K395 VanDerWaalsContact CD1-CE 3.47Å; L392-K395 WeakPolarHBondContact O-CB 3.4Å; L392-K395 PolarHBondContact O-N 3.13Å; E393-K395 VanDerWaalsContact C-N 3.32Å; E393-K395 PolarHBondContact O-N 2.89Å; K395-G398 PolarHBondContact O-N 3.46Å; K395-N399 PolarHBondContact O-N 3.37Å; K395-N399 PolarHBondContact O-OD1 3.16Å; K395-Y414 HydrophobicContact CG-CE1 4.3Å; K395-A417 HydrophobicContact CB-CB 4.46Å; K395-L427 HydrophobicContact CB-CD2 3.66Å; K395-L427 HydrophobicContact CD-CD2 3.54Å; K395-L427 HydrophobicContact CG-CD2 3.5Å
396	N	97.4	Very high	95.9	Very high	85 Å²	85	66.8 Å²	66.8	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-66.6	-39.7	179.8	-67.9	-21.5	0	0	0	111.9	L392 E393 E394 G398 N399 D400	L392-N396 VanDerWaalsContact O-CG 3.25Å; L392-N396 PolarHBondContact O-N 3.33Å; L392-N396 PolarHBondContact O-ND2 3.05Å; E393-N396 PolarHBondContact O-N 2.94Å; E393-N396 VanDerWaalsContact O-N 3.14Å; E394-N396 VanDerWaalsContact C-N 3.29Å; E394-N396 PolarHBondContact O-N 3.09Å; N396-G398 VanDerWaalsContact C-N 3.33Å; N396-N399 WeakPolarHBondContact O-CB 3.22Å; N396-N399 PolarHBondContact O-N 2.96Å; N396-D400 PolarHBondContact O-N 3.29Å
397	K	97.1	Very high	96	Very high	77 Å²	77	66.9 Å²	66.9	34%	0.335	34%	0.337	S	S	.	.	H	α-helix	trans	-61.5	-42	171.4	-66.1	173.8	-170.1	161.2	0	111.8	E393 E394 N399 D400 A401 H413	E393-K397 PolarHBondContact O-N 2.7Å; E393-K397 WeakPolarHBondContact OE1-CE 3.44Å; E393-K397 IonicContact OE1-NZ 2.72Å; E393-K397 PolarHBondContact OE1-NZ 2.67Å; E394-K397 PolarHBondContact O-N 2.86Å; E394-K397 IonicContact OE1-NZ 2.9Å; E394-K397 PolarHBondContact OE1-NZ 2.96Å; K397-N399 VanDerWaalsContact C-N 3.35Å; K397-D400 PolarHBondContact O-N 3.47Å; K397-A401 PolarHBondContact O-N 3.04Å; K397-H413 HydrophobicContact CB-CB 4.49Å
398	G	97.4	Very high	96.1	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.2	-41.8	174.4	0	0	0	0	0	112.6	E394 K395 N396 A401 F402 A410 Y414	E394-G398 PolarHBondContact O-N 2.99Å; K395-G398 PolarHBondContact O-N 3.46Å; N396-G398 VanDerWaalsContact C-N 3.33Å; G398-A401 PolarHBondContact O-N 3.24Å; G398-F402 VanDerWaalsContact O-CB 3.31Å; G398-F402 WeakPolarHBondContact O-CB 3.34Å; G398-F402 PolarHBondContact O-N 2.95Å; G398-A410 WeakPolarHBondContact O-CB 3.31Å; G398-Y414 VanDerWaalsContact C-CZ 3.43Å; G398-Y414 VanDerWaalsContact C-OH 3.27Å; G398-Y414 PolarHBondContact O-OH 3.4Å
399	N	97.1	Very high	96.2	Very high	47 Å²	47	67.1 Å²	67.1	25%	0.251	34%	0.338	S	S	.	.	H	α-helix	trans	-62.7	-44.3	176.1	-68.9	-15.7	0	0	0	111.6	K395 N396 K397 F402 Q403 Y414 N430	K395-N399 PolarHBondContact O-N 3.37Å; K395-N399 PolarHBondContact O-OD1 3.16Å; N396-N399 WeakPolarHBondContact O-CB 3.22Å; N396-N399 PolarHBondContact O-N 2.96Å; K397-N399 VanDerWaalsContact C-N 3.35Å; N399-F402 PolarHBondContact O-N 3.3Å; N399-Q403 WeakPolarHBondContact O-CG 3.41Å; N399-Q403 PolarHBondContact O-N 2.69Å; N399-Y414 VanDerWaalsContact CA-OH 3.28Å; N399-Y414 WeakPolarHBondContact CA-OH 3.42Å; N399-Y414 PolarHBondContact N-OH 3.49Å; N399-Y414 WeakPolarHBondContact OD1-CE1 3.45Å; N399-Y414 PolarHBondContact OD1-OH 3.37Å; N399-N430 PolarHBondContact OD1-ND2 3.07Å; N399-N430 VanDerWaalsContact OD1-ND2 3.15Å
400	D	97.6	Very high	96.3	Very high	73 Å²	73	59.5 Å²	59.5	39%	0.39	30%	0.302	S	S	.	.	H	α-helix	trans	-62.8	-46.4	177.2	176.3	59.5	0	0	0	111.8	N396 K397 F402 Q403 K404	N396-D400 PolarHBondContact O-N 3.29Å; K397-D400 PolarHBondContact O-N 3.47Å; D400-F402 VanDerWaalsContact C-N 3.32Å; D400-F402 PolarHBondContact O-N 3.08Å; D400-Q403 PolarHBondContact O-N 2.93Å; D400-K404 VanDerWaalsContact CG-NZ 3.32Å; D400-K404 WeakPolarHBondContact O-CG 3.32Å; D400-K404 PolarHBondContact O-N 2.92Å; D400-K404 VanDerWaalsContact O-N 3.07Å; D400-K404 WeakPolarHBondContact OD1-CE 3.42Å; D400-K404 IonicContact OD1-NZ 3.23Å; D400-K404 PolarHBondContact OD1-NZ 3.49Å; D400-K404 WeakPolarHBondContact OD2-CE 3.39Å; D400-K404 IonicContact OD2-NZ 2.66Å; D400-K404 PolarHBondContact OD2-NZ 3.26Å
401	A	97.2	Very high	96.4	Very high	4 Å²	4	58.5 Å²	58.5	3%	0.033	30%	0.296	C	S	.	.	H	α-helix	trans	-61.1	-40.2	174.6	0	0	0	0	0	112.2	K397 G398 K404 G405 D406 L409 A410	K397-A401 PolarHBondContact O-N 3.04Å; G398-A401 PolarHBondContact O-N 3.24Å; A401-K404 PolarHBondContact O-N 3.46Å; A401-G405 PolarHBondContact O-N 3.07Å; A401-D406 PolarHBondContact O-N 3.36Å; A401-L409 HydrophobicContact CB-CB 4.26Å; A401-L409 HydrophobicContact CB-CD2 4.18Å; A401-L409 HydrophobicContact CB-CG 4.12Å; A401-A410 HydrophobicContact CB-CB 3.91Å
402	F	97.2	Very high	96.4	Very high	52 Å²	52	65.6 Å²	65.6	23%	0.228	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-42.9	177.1	-171.3	-85.1	0	0	0	111.8	G398 N399 D400 K404 G405 Y407 A410 A433 C434 K437	G398-F402 VanDerWaalsContact O-CB 3.31Å; G398-F402 WeakPolarHBondContact O-CB 3.34Å; G398-F402 PolarHBondContact O-N 2.95Å; N399-F402 PolarHBondContact O-N 3.3Å; D400-F402 VanDerWaalsContact C-N 3.32Å; D400-F402 PolarHBondContact O-N 3.08Å; F402-K404 VanDerWaalsContact C-N 3.28Å; F402-K404 PolarHBondContact O-N 3.42Å; F402-G405 PolarHBondContact O-N 2.86Å; F402-Y407 AromaticContact CD2-CD1 3.79Å; F402-Y407 HydrophobicContact CD2-CD1 3.79Å; F402-Y407 HydrophobicContact CD2-CE1 4.07Å; F402-Y407 HydrophobicContact CE1-CE1 4.5Å; F402-Y407 AromaticContact CE2-CD1 3.8Å; F402-Y407 HydrophobicContact CE2-CD1 3.8Å; F402-Y407 AromaticContact CE2-CE1 3.89Å; F402-Y407 HydrophobicContact CE2-CE1 3.89Å; F402-Y407 HydrophobicContact CG-CD1 4.47Å; F402-Y407 HydrophobicContact CG-CE1 4.48Å; F402-Y407 HydrophobicContact CZ-CD1 4.48Å; F402-Y407 HydrophobicContact CZ-CE1 4.11Å; F402-A410 HydrophobicContact CB-CB 3.99Å; F402-A410 HydrophobicContact CD2-CB 4.5Å; F402-A433 HydrophobicContact CE2-CB 3.96Å; F402-A433 HydrophobicContact CZ-CB 4.06Å; F402-C434 VanDerWaalsContact CD2-SG 3.58Å; F402-K437 HydrophobicContact CE2-CG 4.47Å; F402-K437 HydrophobicContact CZ-CG 4.43Å
403	Q	96.8	Very high	96.6	Very high	163 Å²	163	63.3 Å²	63.3	76%	0.762	31%	0.313	S	S	*	.	H	α-helix	trans	-64.2	-33.9	176.6	-73.3	176.6	9.3	0	0	112.3	N399 D400 G405	N399-Q403 WeakPolarHBondContact O-CG 3.41Å; N399-Q403 PolarHBondContact O-N 2.69Å; D400-Q403 PolarHBondContact O-N 2.93Å; Q403-G405 PolarHBondContact O-N 2.99Å
404	K	96.5	Very high	96.6	Very high	146 Å²	146	59.2 Å²	59.2	64%	0.635	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.9	173.7	-69.4	168.3	-179.7	168.6	0	113.6	D400 A401 F402 D406	D400-K404 VanDerWaalsContact CG-NZ 3.32Å; D400-K404 WeakPolarHBondContact O-CG 3.32Å; D400-K404 PolarHBondContact O-N 2.92Å; D400-K404 VanDerWaalsContact O-N 3.07Å; D400-K404 WeakPolarHBondContact OD1-CE 3.42Å; D400-K404 IonicContact OD1-NZ 3.23Å; D400-K404 PolarHBondContact OD1-NZ 3.49Å; D400-K404 WeakPolarHBondContact OD2-CE 3.39Å; D400-K404 IonicContact OD2-NZ 2.66Å; D400-K404 PolarHBondContact OD2-NZ 3.26Å; A401-K404 PolarHBondContact O-N 3.46Å; F402-K404 VanDerWaalsContact C-N 3.28Å; F402-K404 PolarHBondContact O-N 3.42Å; K404-D406 VanDerWaalsContact C-N 3.3Å
405	G	94.4	Very high	96.6	Very high	33 Å²	33	60.2 Å²	60.2	34%	0.34	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	6.5	-177.3	0	0	0	0	0	114.5	A401 F402 Q403 Y407	A401-G405 PolarHBondContact O-N 3.07Å; F402-G405 PolarHBondContact O-N 2.86Å; Q403-G405 PolarHBondContact O-N 2.99Å; G405-Y407 VanDerWaalsContact C-N 3.32Å; G405-Y407 VanDerWaalsContact O-CD2 3.3Å; G405-Y407 WeakPolarHBondContact O-CD2 3.39Å; G405-Y407 WeakPolarHBondContact O-CE2 3.33Å; G405-Y407 PolarHBondContact O-N 3.04Å; G405-Y407 VanDerWaalsContact O-N 3.09Å
406	D	96.1	Very high	96.6	Very high	69 Å²	69	60 Å²	60	37%	0.369	30%	0.301	S	S	.	.			trans	-84.8	77	174.3	-169.7	-16.2	0	0	0	110	A401 K404 P408 L409 A410	A401-D406 PolarHBondContact O-N 3.36Å; K404-D406 VanDerWaalsContact C-N 3.3Å; D406-P408 WeakPolarHBondContact OD1-CD 3.47Å; D406-L409 HydrophobicContact CB-CB 4.2Å; D406-L409 PolarHBondContact O-N 3.33Å; D406-L409 VanDerWaalsContact OD1-CB 3.23Å; D406-L409 WeakPolarHBondContact OD1-CB 3.43Å; D406-L409 PolarHBondContact OD1-N 3.18Å; D406-L409 WeakPolarHBondContact OD2-CB 3.44Å; D406-A410 WeakPolarHBondContact O-CB 3.45Å; D406-A410 PolarHBondContact O-N 2.93Å
407	Y	94.3	Very high	96.5	Very high	63 Å²	63	55.9 Å²	55.9	25%	0.247	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-37.9	-178.3	-49.7	-63.6	0	0	0	114.1	F402 G405 A410 M411 K437	F402-Y407 AromaticContact CD2-CD1 3.79Å; F402-Y407 HydrophobicContact CD2-CD1 3.79Å; F402-Y407 HydrophobicContact CD2-CE1 4.07Å; F402-Y407 HydrophobicContact CE1-CE1 4.5Å; F402-Y407 AromaticContact CE2-CD1 3.8Å; F402-Y407 HydrophobicContact CE2-CD1 3.8Å; F402-Y407 AromaticContact CE2-CE1 3.89Å; F402-Y407 HydrophobicContact CE2-CE1 3.89Å; F402-Y407 HydrophobicContact CG-CD1 4.47Å; F402-Y407 HydrophobicContact CG-CE1 4.48Å; F402-Y407 HydrophobicContact CZ-CD1 4.48Å; F402-Y407 HydrophobicContact CZ-CE1 4.11Å; G405-Y407 VanDerWaalsContact C-N 3.32Å; G405-Y407 VanDerWaalsContact O-CD2 3.3Å; G405-Y407 WeakPolarHBondContact O-CD2 3.39Å; G405-Y407 WeakPolarHBondContact O-CE2 3.33Å; G405-Y407 PolarHBondContact O-N 3.04Å; G405-Y407 VanDerWaalsContact O-N 3.09Å; Y407-A410 PolarHBondContact O-N 3.3Å; Y407-M411 VanDerWaalsContact O-CB 3.28Å; Y407-M411 WeakPolarHBondContact O-CB 3.26Å; Y407-M411 PolarHBondContact O-N 2.98Å; Y407-K437 HydrophobicContact CD1-CB 3.91Å; Y407-K437 HydrophobicContact CD1-CG 4.07Å; Y407-K437 HydrophobicContact CD2-CB 3.88Å; Y407-K437 HydrophobicContact CE1-CB 3.99Å; Y407-K437 HydrophobicContact CE1-CD 4.34Å; Y407-K437 HydrophobicContact CE1-CG 3.74Å; Y407-K437 HydrophobicContact CE2-CB 3.96Å; Y407-K437 HydrophobicContact CE2-CG 4.35Å; Y407-K437 HydrophobicContact CG-CB 3.86Å; Y407-K437 HydrophobicContact CG-CG 4.5Å
408	P	95.3	Very high	96.5	Very high	72 Å²	72	52.9 Å²	52.9	47%	0.468	27%	0.267	S	S	.	.	H	α-helix	trans	-61.4	-43.4	174	-25	35.8	0	0	0	113.1	D406 M411 K412 L438	D406-P408 WeakPolarHBondContact OD1-CD 3.47Å; P408-M411 PolarHBondContact O-N 3.35Å; P408-K412 PolarHBondContact O-N 3.34Å; P408-K412 VanDerWaalsContact O-N 3.09Å; P408-L438 HydrophobicContact CG-CD2 4.17Å
409	L	95.3	Very high	96.3	Very high	67 Å²	67	58.1 Å²	58.1	35%	0.351	29%	0.29	S	S	.	.	H	α-helix	trans	-67.7	-42.9	176.5	-176.2	60.8	0	0	0	111.4	A401 D406 M411 K412 H413	A401-L409 HydrophobicContact CB-CB 4.26Å; A401-L409 HydrophobicContact CB-CD2 4.18Å; A401-L409 HydrophobicContact CB-CG 4.12Å; D406-L409 HydrophobicContact CB-CB 4.2Å; D406-L409 PolarHBondContact O-N 3.33Å; D406-L409 VanDerWaalsContact OD1-CB 3.23Å; D406-L409 WeakPolarHBondContact OD1-CB 3.43Å; D406-L409 PolarHBondContact OD1-N 3.18Å; D406-L409 WeakPolarHBondContact OD2-CB 3.44Å; L409-M411 VanDerWaalsContact C-N 3.31Å; L409-M411 PolarHBondContact O-N 3.08Å; L409-K412 WeakPolarHBondContact O-CB 3.34Å; L409-K412 PolarHBondContact O-N 2.87Å; L409-K412 VanDerWaalsContact O-N 3.14Å; L409-H413 PolarHBondContact O-CD2 2.84Å; L409-H413 VanDerWaalsContact O-CD2 3.25Å; L409-H413 PolarHBondContact O-N 3.32Å; L409-H413 VanDerWaalsContact O-N 3.07Å
410	A	97.1	Very high	96.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-57.4	-45.1	175	0	0	0	0	0	111.8	G398 A401 F402 D406 Y407 K412 H413 Y414	G398-A410 WeakPolarHBondContact O-CB 3.31Å; A401-A410 HydrophobicContact CB-CB 3.91Å; F402-A410 HydrophobicContact CB-CB 3.99Å; F402-A410 HydrophobicContact CD2-CB 4.5Å; D406-A410 WeakPolarHBondContact O-CB 3.45Å; D406-A410 PolarHBondContact O-N 2.93Å; Y407-A410 PolarHBondContact O-N 3.3Å; A410-K412 VanDerWaalsContact C-N 3.32Å; A410-K412 PolarHBondContact O-N 2.89Å; A410-H413 PolarHBondContact O-N 2.98Å; A410-Y414 HydrophobicContact CB-CD2 4.43Å; A410-Y414 HydrophobicContact CB-CE2 4.02Å; A410-Y414 WeakPolarHBondContact O-CD2 3.21Å; A410-Y414 PolarHBondContact O-N 3.41Å
411	M	96.2	Very high	96.1	Very high	49 Å²	49	56 Å²	56	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-38.7	176.3	-179.5	-177.6	67.5	0	0	112.5	Y407 P408 L409 T415 R431 C434 Y435 L438	Y407-M411 VanDerWaalsContact O-CB 3.28Å; Y407-M411 WeakPolarHBondContact O-CB 3.26Å; Y407-M411 PolarHBondContact O-N 2.98Å; P408-M411 PolarHBondContact O-N 3.35Å; L409-M411 VanDerWaalsContact C-N 3.31Å; L409-M411 PolarHBondContact O-N 3.08Å; M411-T415 VanDerWaalsContact O-CB 3.27Å; M411-T415 WeakPolarHBondContact O-CB 3.36Å; M411-T415 PolarHBondContact O-N 3.45Å; M411-T415 PolarHBondContact O-OG1 2.85Å; M411-R431 HydrophobicContact CG-CG 4.14Å; M411-C434 HydrophobicContact CB-CB 4.15Å; M411-Y435 HydrophobicContact CG-CE1 4.33Å; M411-Y435 HydrophobicContact SD-CD1 3.89Å; M411-Y435 HydrophobicContact SD-CE1 3.28Å; M411-Y435 WeakPolarHBondContact SD-CE1 3.48Å; M411-L438 HydrophobicContact CE-CD1 4.44Å; M411-L438 HydrophobicContact SD-CD1 4.16Å
412	K	96.6	Very high	96	Very high	149 Å²	149	56.7 Å²	56.7	65%	0.648	28%	0.279	S	S	*	.	H	α-helix	trans	-61.4	-48.3	175.1	-175.4	-177.1	176.7	-175.7	0	111	P408 L409 A410 T415 E416	P408-K412 PolarHBondContact O-N 3.34Å; P408-K412 VanDerWaalsContact O-N 3.09Å; L409-K412 WeakPolarHBondContact O-CB 3.34Å; L409-K412 PolarHBondContact O-N 2.87Å; L409-K412 VanDerWaalsContact O-N 3.14Å; A410-K412 VanDerWaalsContact C-N 3.32Å; A410-K412 PolarHBondContact O-N 2.89Å; K412-T415 PolarHBondContact O-N 3.31Å; K412-E416 PolarHBondContact O-N 2.98Å
413	H	97.8	Very high	95.8	Very high	37 Å²	37	60 Å²	60	17%	0.171	30%	0.299	C	S	.	.	H	α-helix	trans	-65.2	-43.3	178.2	-73.1	-59.3	0	0	0	112.7	E394 K397 L409 A410 T415 E416 A417	E394-H413 IonicContact OE2-CE1 2.63Å; E394-H413 IonicContact OE2-CG 3.74Å; E394-H413 IonicContact OE2-ND1 3.6Å; E394-H413 PolarHBondContact OE2-ND1 3.5Å; K397-H413 HydrophobicContact CB-CB 4.49Å; L409-H413 PolarHBondContact O-CD2 2.84Å; L409-H413 VanDerWaalsContact O-CD2 3.25Å; L409-H413 PolarHBondContact O-N 3.32Å; L409-H413 VanDerWaalsContact O-N 3.07Å; A410-H413 PolarHBondContact O-N 2.98Å; H413-T415 VanDerWaalsContact C-N 3.35Å; H413-T415 PolarHBondContact O-N 3.49Å; H413-E416 PolarHBondContact O-N 3.45Å; H413-A417 WeakPolarHBondContact O-CB 3.44Å; H413-A417 PolarHBondContact O-N 2.92Å
414	Y	97.4	Very high	95.7	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-65.7	-37.2	175.5	-63.5	-44.3	0	0	0	112.6	K395 G398 N399 A410 E416 A417 I418 N430 R431 C434	K395-Y414 HydrophobicContact CG-CE1 4.3Å; G398-Y414 VanDerWaalsContact C-CZ 3.43Å; G398-Y414 VanDerWaalsContact C-OH 3.27Å; G398-Y414 PolarHBondContact O-OH 3.4Å; N399-Y414 VanDerWaalsContact CA-OH 3.28Å; N399-Y414 WeakPolarHBondContact CA-OH 3.42Å; N399-Y414 PolarHBondContact N-OH 3.49Å; N399-Y414 WeakPolarHBondContact OD1-CE1 3.45Å; N399-Y414 PolarHBondContact OD1-OH 3.37Å; A410-Y414 HydrophobicContact CB-CD2 4.43Å; A410-Y414 HydrophobicContact CB-CE2 4.02Å; A410-Y414 WeakPolarHBondContact O-CD2 3.21Å; A410-Y414 PolarHBondContact O-N 3.41Å; Y414-E416 VanDerWaalsContact C-N 3.28Å; Y414-E416 PolarHBondContact O-N 3.2Å; Y414-A417 PolarHBondContact O-N 2.93Å; Y414-I418 VanDerWaalsContact O-CG1 3.24Å; Y414-I418 WeakPolarHBondContact O-CG1 3.08Å; Y414-I418 PolarHBondContact O-N 2.87Å; Y414-N430 HydrophobicContact CD1-CB 4.05Å; Y414-N430 HydrophobicContact CD2-CB 4.15Å; Y414-N430 HydrophobicContact CE1-CB 3.75Å; Y414-N430 HydrophobicContact CE2-CB 3.85Å; Y414-N430 HydrophobicContact CG-CB 4.25Å; Y414-R431 HydrophobicContact CD2-CB 4.42Å; Y414-C434 VanDerWaalsContact CE2-SG 3.55Å
415	T	97.1	Very high	95.7	Very high	40 Å²	40	46.9 Å²	46.9	25%	0.245	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-39.6	175.3	-63.6	0	0	0	0	111.5	M411 K412 H413 I418 K419 R431	M411-T415 VanDerWaalsContact O-CB 3.27Å; M411-T415 WeakPolarHBondContact O-CB 3.36Å; M411-T415 PolarHBondContact O-N 3.45Å; M411-T415 PolarHBondContact O-OG1 2.85Å; K412-T415 PolarHBondContact O-N 3.31Å; H413-T415 VanDerWaalsContact C-N 3.35Å; H413-T415 PolarHBondContact O-N 3.49Å; T415-I418 PolarHBondContact O-N 3.18Å; T415-K419 WeakPolarHBondContact O-CG 3.42Å; T415-K419 PolarHBondContact O-N 3.3Å; T415-R431 VanDerWaalsContact OG1-CD 3.28Å; T415-R431 WeakPolarHBondContact OG1-CD 2.88Å; T415-R431 PolarHBondContact OG1-NH1 3.33Å
416	E	96.1	Very high	95.8	Very high	29 Å²	29	49.5 Å²	49.5	14%	0.136	24%	0.244	C	C	.	.	H	α-helix	trans	-67.4	-43.2	174.9	-174.6	56.4	-158.5	0	0	112.1	Y385 E394 K412 H413 Y414 I418 K419 R420	Y385-E416 WeakPolarHBondContact CE1-OE1 3.5Å; Y385-E416 VanDerWaalsContact CZ-OE1 3.29Å; Y385-E416 PolarHBondContact OH-OE1 3.25Å; E394-E416 HydrophobicContact CG-CG 4.04Å; K412-E416 PolarHBondContact O-N 2.98Å; H413-E416 PolarHBondContact O-N 3.45Å; Y414-E416 VanDerWaalsContact C-N 3.28Å; Y414-E416 PolarHBondContact O-N 3.2Å; E416-I418 VanDerWaalsContact C-N 3.31Å; E416-I418 PolarHBondContact O-N 3.39Å; E416-K419 PolarHBondContact O-N 3.01Å; E416-K419 IonicContact OE2-NZ 2.67Å; E416-R420 PolarHBondContact O-N 3.38Å; E416-R420 IonicContact OE1-CZ 3.53Å; E416-R420 IonicContact OE1-NE 3.23Å; E416-R420 PolarHBondContact OE1-NE 3.06Å; E416-R420 IonicContact OE1-NH2 3.7Å; E416-R420 PolarHBondContact OE1-NH2 2.82Å
417	A	96.2	Very high	95.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.2	-42.6	173.8	0	0	0	0	0	111.9	A391 E394 K395 H413 Y414 K419 R420 N421 L427	A391-A417 WeakPolarHBondContact CB-O 3.43Å; A391-A417 WeakPolarHBondContact O-CB 3.46Å; E394-A417 HydrophobicContact CB-CB 3.96Å; K395-A417 HydrophobicContact CB-CB 4.46Å; H413-A417 WeakPolarHBondContact O-CB 3.44Å; H413-A417 PolarHBondContact O-N 2.92Å; Y414-A417 PolarHBondContact O-N 2.93Å; A417-K419 VanDerWaalsContact C-N 3.34Å; A417-K419 PolarHBondContact O-N 3.14Å; A417-R420 CarbonylContact O-C 3.26Å; A417-R420 PolarHBondContact O-N 3.15Å; A417-R420 VanDerWaalsContact O-N 3.16Å; A417-N421 PolarHBondContact O-N 3.44Å; A417-L427 HydrophobicContact CB-CD1 3.9Å; A417-L427 HydrophobicContact CB-CD2 3.84Å; A417-L427 HydrophobicContact CB-CG 4.46Å
418	I	96.1	Very high	96	Very high	13 Å²	13	44.7 Å²	44.7	7%	0.067	22%	0.22	C	C	.	.	H	α-helix	trans	-63.3	-39.1	178	-71.2	164.8	0	0	0	111.3	Y414 T415 E416 R420 N421 P422 L427 Y428 R431	Y414-I418 VanDerWaalsContact O-CG1 3.24Å; Y414-I418 WeakPolarHBondContact O-CG1 3.08Å; Y414-I418 PolarHBondContact O-N 2.87Å; T415-I418 PolarHBondContact O-N 3.18Å; E416-I418 VanDerWaalsContact C-N 3.31Å; E416-I418 PolarHBondContact O-N 3.39Å; I418-R420 VanDerWaalsContact C-N 3.25Å; I418-R420 PolarHBondContact O-N 2.88Å; I418-N421 CarbonylContact O-C 3.36Å; I418-N421 PolarHBondContact O-N 3.1Å; I418-P422 WeakPolarHBondContact O-CA 3.3Å; I418-P422 WeakPolarHBondContact O-CB 3.48Å; I418-P422 WeakPolarHBondContact O-CD 3.22Å; I418-L427 HydrophobicContact CD1-CB 4.21Å; I418-L427 HydrophobicContact CG1-CB 3.5Å; I418-L427 HydrophobicContact CG1-CD1 4.19Å; I418-L427 HydrophobicContact CG1-CG 4.5Å; I418-Y428 HydrophobicContact CD1-CD1 4.05Å; I418-Y428 HydrophobicContact CD1-CE1 4.23Å; I418-Y428 HydrophobicContact CD1-CG 4.27Å; I418-Y428 HydrophobicContact CG1-CE2 4.41Å; I418-Y428 HydrophobicContact CG2-CE1 3.87Å; I418-Y428 HydrophobicContact CG2-CE2 4.21Å; I418-Y428 WeakPolarHBondContact CG2-OH 3.26Å; I418-R431 HydrophobicContact CD1-CB 4.34Å
419	K	94.6	Very high	96.1	Very high	111 Å²	111	41.4 Å²	41.4	48%	0.483	20%	0.199	S	C	.	.	H	α-helix	trans	-62.3	-36.3	175.7	-70	174.2	-173.3	170.1	0	112.1	Y385 T415 E416 A417	Y385-K419 HydrophobicContact CD1-CB 3.85Å; Y385-K419 HydrophobicContact CE1-CB 3.69Å; Y385-K419 HydrophobicContact CE1-CD 4.18Å; T415-K419 WeakPolarHBondContact O-CG 3.42Å; T415-K419 PolarHBondContact O-N 3.3Å; E416-K419 PolarHBondContact O-N 3.01Å; E416-K419 IonicContact OE2-NZ 2.67Å; A417-K419 VanDerWaalsContact C-N 3.34Å; A417-K419 PolarHBondContact O-N 3.14Å
420	R	94.8	Very high	96.2	Very high	40 Å²	40	40 Å²	40	15%	0.151	19%	0.192	C	C	.	.	H	α-helix	trans	-84.5	-23.7	-178.9	-64.6	-174.8	-169.5	155	2.9	113.4	Y385 I386 N387 L390 A391 E394 E416 A417 I418	Y385-R420 HydrophobicContact CD1-CG 3.93Å; Y385-R420 HydrophobicContact CE1-CG 3.77Å; I386-R420 CarbonylContact C-O 3.44Å; I386-R420 VanDerWaalsContact CA-O 3.25Å; I386-R420 WeakPolarHBondContact CA-O 3.4Å; I386-R420 WeakPolarHBondContact CG2-O 3.49Å; N387-R420 CarbonylContact C-O 3.59Å; N387-R420 PolarHBondContact N-O 3.44Å; L390-R420 PolarHBondContact O-NH1 3.46Å; A391-R420 HydrophobicContact CB-CB 3.75Å; E394-R420 IonicContact OE1-NH1 2.66Å; E416-R420 PolarHBondContact O-N 3.38Å; E416-R420 IonicContact OE1-CZ 3.53Å; E416-R420 IonicContact OE1-NE 3.23Å; E416-R420 PolarHBondContact OE1-NE 3.06Å; E416-R420 IonicContact OE1-NH2 3.7Å; E416-R420 PolarHBondContact OE1-NH2 2.82Å; A417-R420 CarbonylContact O-C 3.26Å; A417-R420 PolarHBondContact O-N 3.15Å; A417-R420 VanDerWaalsContact O-N 3.16Å; I418-R420 VanDerWaalsContact C-N 3.25Å; I418-R420 PolarHBondContact O-N 2.88Å
421	N	95	Very high	96.3	Very high	34 Å²	34	41.5 Å²	41.5	18%	0.182	20%	0.197	C	C	.	.			trans	-144.4	82.2	172.5	-172.3	3.4	0	0	0	110.5	A391 A417 I418 N423 D424 L427	A391-N421 HydrophobicContact CB-CB 3.49Å; A391-N421 VanDerWaalsContact CB-CB 3.49Å; A417-N421 PolarHBondContact O-N 3.44Å; I418-N421 CarbonylContact O-C 3.36Å; I418-N421 PolarHBondContact O-N 3.1Å; N421-N423 PolarHBondContact O-N 3.15Å; N421-N423 VanDerWaalsContact O-N 3.16Å; N421-D424 PolarHBondContact O-N 3Å; N421-L427 HydrophobicContact CB-CD1 4.31Å; N421-L427 WeakPolarHBondContact O-CD1 3.22Å
422	P	94.6	Very high	96.3	Very high	19 Å²	19	39.1 Å²	39.1	12%	0.123	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-8.1	-174.2	27.4	-35.2	0	0	0	114.1	I386 I418 Y428	I386-P422 HydrophobicContact CD1-CG 4.31Å; I418-P422 WeakPolarHBondContact O-CA 3.3Å; I418-P422 WeakPolarHBondContact O-CB 3.48Å; I418-P422 WeakPolarHBondContact O-CD 3.22Å; P422-Y428 WeakPolarHBondContact O-CE2 3.43Å; P422-Y428 PolarHBondContact O-OH 3.15Å
423	N	93.6	Very high	96.3	Very high	121 Å²	121	32.3 Å²	32.3	65%	0.647	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102	-0.1	-175.1	-62.2	-23.6	0	0	0	113.3	N421 A425	N421-N423 PolarHBondContact O-N 3.15Å; N421-N423 VanDerWaalsContact O-N 3.16Å; N423-A425 PolarHBondContact O-N 2.79Å
424	D	95	Very high	96.3	Very high	32 Å²	32	30.5 Å²	30.5	17%	0.171	15%	0.149	C	C	.	.			trans	-87.6	103.3	176.8	-176.4	2.7	0	0	0	111	N421 K426 L427 Y428	N421-D424 PolarHBondContact O-N 3Å; D424-K426 PolarHBondContact O-N 3.26Å; D424-K426 VanDerWaalsContact O-N 3.11Å; D424-K426 VanDerWaalsContact OD1-CB 3.29Å; D424-K426 WeakPolarHBondContact OD1-CB 3.5Å; D424-K426 WeakPolarHBondContact OD1-CG 3.41Å; D424-K426 PolarHBondContact OD1-N 3.35Å; D424-L427 HydrophobicContact CB-CD1 3.91Å; D424-L427 HydrophobicContact CB-CG 3.91Å; D424-L427 WeakPolarHBondContact O-CB 3.19Å; D424-L427 PolarHBondContact O-N 3.24Å; D424-L427 VanDerWaalsContact O-N 3.07Å; D424-Y428 WeakPolarHBondContact O-CD2 3.01Å
425	A	96.3	Very high	96.3	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	15%	0.154	C	C	.	.	H	α-helix	trans	-53.9	-30.7	178.6	0	0	0	0	0	113.2	N423 L427 Y428 S429 C451 L454 E455 F458	N423-A425 PolarHBondContact O-N 2.79Å; A425-L427 VanDerWaalsContact C-N 3.25Å; A425-L427 PolarHBondContact O-N 3.01Å; A425-Y428 PolarHBondContact O-N 3.32Å; A425-S429 PolarHBondContact O-N 3.12Å; A425-S429 VanDerWaalsContact O-N 3.09Å; A425-C451 PolarHBondContact O-SG 3.08Å; A425-C451 VanDerWaalsContact O-SG 3.34Å; A425-L454 HydrophobicContact CB-CB 3.95Å; A425-E455 HydrophobicContact CB-CB 3.54Å; A425-F458 HydrophobicContact CB-CD1 4.33Å
426	K	96.4	Very high	96.1	Very high	89 Å²	89	31.3 Å²	31.3	39%	0.387	15%	0.151	S	C	.	.	H	α-helix	trans	-63	-33.7	-179.5	-58.1	-178.5	-174.7	71.8	0	111.9	D424 S429 N430 F458	D424-K426 PolarHBondContact O-N 3.26Å; D424-K426 VanDerWaalsContact O-N 3.11Å; D424-K426 VanDerWaalsContact OD1-CB 3.29Å; D424-K426 WeakPolarHBondContact OD1-CB 3.5Å; D424-K426 WeakPolarHBondContact OD1-CG 3.41Å; D424-K426 PolarHBondContact OD1-N 3.35Å; K426-S429 PolarHBondContact O-N 3.46Å; K426-N430 WeakPolarHBondContact O-CB 3.3Å; K426-N430 VanDerWaalsContact O-CG 3.25Å; K426-N430 PolarHBondContact O-N 3.34Å; K426-N430 PolarHBondContact O-OD1 3.17Å; K426-F458 HydrophobicContact CG-CE1 4.2Å; K426-F458 HydrophobicContact CG-CZ 3.98Å
427	L	97.3	Very high	96.1	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-67.8	-41.2	-179.1	-58	179.3	0	0	0	111.6	K395 A417 I418 N421 D424 A425 N430 R431	K395-L427 HydrophobicContact CB-CD2 3.66Å; K395-L427 HydrophobicContact CD-CD2 3.54Å; K395-L427 HydrophobicContact CG-CD2 3.5Å; A417-L427 HydrophobicContact CB-CD1 3.9Å; A417-L427 HydrophobicContact CB-CD2 3.84Å; A417-L427 HydrophobicContact CB-CG 4.46Å; I418-L427 HydrophobicContact CD1-CB 4.21Å; I418-L427 HydrophobicContact CG1-CB 3.5Å; I418-L427 HydrophobicContact CG1-CD1 4.19Å; I418-L427 HydrophobicContact CG1-CG 4.5Å; N421-L427 HydrophobicContact CB-CD1 4.31Å; N421-L427 WeakPolarHBondContact O-CD1 3.22Å; D424-L427 HydrophobicContact CB-CD1 3.91Å; D424-L427 HydrophobicContact CB-CG 3.91Å; D424-L427 WeakPolarHBondContact O-CB 3.19Å; D424-L427 PolarHBondContact O-N 3.24Å; D424-L427 VanDerWaalsContact O-N 3.07Å; A425-L427 VanDerWaalsContact C-N 3.25Å; A425-L427 PolarHBondContact O-N 3.01Å; L427-N430 PolarHBondContact O-N 3.03Å; L427-R431 PolarHBondContact O-N 3.03Å
428	Y	98	Very high	96	Very high	30 Å²	30	38.5 Å²	38.5	12%	0.118	18%	0.184	C	C	.	.	H	α-helix	trans	-66.8	-43	175.1	-64.1	-91.6	0	0	0	111.2	I418 P422 D424 A425 N430 R431 A432 D447 E450 L454	I418-Y428 HydrophobicContact CD1-CD1 4.05Å; I418-Y428 HydrophobicContact CD1-CE1 4.23Å; I418-Y428 HydrophobicContact CD1-CG 4.27Å; I418-Y428 HydrophobicContact CG1-CE2 4.41Å; I418-Y428 HydrophobicContact CG2-CE1 3.87Å; I418-Y428 HydrophobicContact CG2-CE2 4.21Å; I418-Y428 WeakPolarHBondContact CG2-OH 3.26Å; P422-Y428 WeakPolarHBondContact O-CE2 3.43Å; P422-Y428 PolarHBondContact O-OH 3.15Å; D424-Y428 WeakPolarHBondContact O-CD2 3.01Å; A425-Y428 PolarHBondContact O-N 3.32Å; Y428-N430 VanDerWaalsContact C-N 3.32Å; Y428-N430 PolarHBondContact O-N 3.46Å; Y428-R431 PolarHBondContact O-N 3.18Å; Y428-A432 VanDerWaalsContact O-CB 3.31Å; Y428-A432 WeakPolarHBondContact O-CB 3.24Å; Y428-A432 PolarHBondContact O-N 3.47Å; Y428-D447 WeakPolarHBondContact CB-O 3.49Å; Y428-E450 HydrophobicContact CD1-CB 3.97Å; Y428-E450 HydrophobicContact CE1-CB 4.13Å; Y428-E450 HydrophobicContact CG-CB 4.41Å; Y428-L454 HydrophobicContact CD2-CD1 3.6Å; Y428-L454 HydrophobicContact CE2-CD1 3.32Å
429	S	97.6	Very high	95.8	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.014	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-41.3	174.6	-172	0	0	0	0	112.8	A425 K426 A433	A425-S429 PolarHBondContact O-N 3.12Å; A425-S429 VanDerWaalsContact O-N 3.09Å; K426-S429 PolarHBondContact O-N 3.46Å; S429-A433 PolarHBondContact O-N 2.82Å; S429-A433 VanDerWaalsContact O-N 3.08Å
430	N	97	Very high	95.8	Very high	38 Å²	38	43.4 Å²	43.4	20%	0.203	21%	0.211	C	C	.	.	H	α-helix	trans	-68	-40.8	178	-76.6	2.7	0	0	0	112.1	N399 Y414 K426 L427 Y428 A433 C434	N399-N430 PolarHBondContact OD1-ND2 3.07Å; N399-N430 VanDerWaalsContact OD1-ND2 3.15Å; Y414-N430 HydrophobicContact CD1-CB 4.05Å; Y414-N430 HydrophobicContact CD2-CB 4.15Å; Y414-N430 HydrophobicContact CE1-CB 3.75Å; Y414-N430 HydrophobicContact CE2-CB 3.85Å; Y414-N430 HydrophobicContact CG-CB 4.25Å; K426-N430 WeakPolarHBondContact O-CB 3.3Å; K426-N430 VanDerWaalsContact O-CG 3.25Å; K426-N430 PolarHBondContact O-N 3.34Å; K426-N430 PolarHBondContact O-OD1 3.17Å; L427-N430 PolarHBondContact O-N 3.03Å; Y428-N430 VanDerWaalsContact C-N 3.32Å; Y428-N430 PolarHBondContact O-N 3.46Å; N430-A433 WeakPolarHBondContact O-CB 3.44Å; N430-A433 PolarHBondContact O-N 3.07Å; N430-C434 PolarHBondContact O-N 3.29Å
431	R	98.1	Very high	95.7	Very high	31 Å²	31	43.5 Å²	43.5	12%	0.117	21%	0.213	C	C	.	.	H	α-helix	trans	-70.9	-36.8	175.8	-166.5	174.3	65.8	-173.3	-4.1	112.4	M411 Y414 T415 I418 L427 Y428 A433 C434 Y435 D447	M411-R431 HydrophobicContact CG-CG 4.14Å; Y414-R431 HydrophobicContact CD2-CB 4.42Å; T415-R431 VanDerWaalsContact OG1-CD 3.28Å; T415-R431 WeakPolarHBondContact OG1-CD 2.88Å; T415-R431 PolarHBondContact OG1-NH1 3.33Å; I418-R431 HydrophobicContact CD1-CB 4.34Å; L427-R431 PolarHBondContact O-N 3.03Å; Y428-R431 PolarHBondContact O-N 3.18Å; R431-A433 PolarHBondContact O-N 3.1Å; R431-C434 WeakPolarHBondContact O-CA 3.49Å; R431-C434 VanDerWaalsContact O-CB 3.32Å; R431-C434 WeakPolarHBondContact O-CB 3.38Å; R431-C434 PolarHBondContact O-N 3.33Å; R431-Y435 HydrophobicContact CG-CD2 4.15Å; R431-Y435 HydrophobicContact CG-CE2 3.74Å; R431-Y435 WeakPolarHBondContact O-CD2 3.37Å; R431-Y435 PolarHBondContact O-N 3.45Å; R431-D447 WeakPolarHBondContact CB-OD2 3.35Å; R431-D447 IonicContact CZ-OD1 3.03Å; R431-D447 IonicContact CZ-OD2 2.96Å; R431-D447 IonicContact NE-OD1 3.49Å; R431-D447 IonicContact NE-OD2 2.99Å; R431-D447 PolarHBondContact NE-OD2 3.48Å; R431-D447 IonicContact NH2-OD1 3.69Å; R431-D447 PolarHBondContact NH2-OD1 3.03Å; R431-D447 IonicContact NH2-OD2 2.69Å; R431-D447 PolarHBondContact NH2-OD2 3.47Å
432	A	97.6	Very high	95.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-41.4	170.7	0	0	0	0	0	111.3	Y428 C434 Y435 T436 A444 D447	Y428-A432 VanDerWaalsContact O-CB 3.31Å; Y428-A432 WeakPolarHBondContact O-CB 3.24Å; Y428-A432 PolarHBondContact O-N 3.47Å; A432-C434 VanDerWaalsContact C-N 3.33Å; A432-C434 PolarHBondContact O-N 3.21Å; A432-Y435 PolarHBondContact O-N 3.27Å; A432-T436 PolarHBondContact O-N 3.41Å; A432-T436 PolarHBondContact O-OG1 2.89Å; A432-T436 VanDerWaalsContact O-OG1 3.04Å; A432-A444 HydrophobicContact CB-CB 4.49Å; A432-D447 HydrophobicContact CB-CB 3.84Å
433	A	96.4	Very high	95.5	Very high	5 Å²	5	49.3 Å²	49.3	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-40.6	174.5	0	0	0	0	0	112.4	F402 S429 N430 R431 K437	F402-A433 HydrophobicContact CE2-CB 3.96Å; F402-A433 HydrophobicContact CZ-CB 4.06Å; S429-A433 PolarHBondContact O-N 2.82Å; S429-A433 VanDerWaalsContact O-N 3.08Å; N430-A433 WeakPolarHBondContact O-CB 3.44Å; N430-A433 PolarHBondContact O-N 3.07Å; R431-A433 PolarHBondContact O-N 3.1Å; A433-K437 WeakPolarHBondContact O-CG 3.33Å; A433-K437 PolarHBondContact O-N 2.85Å; A433-K437 VanDerWaalsContact O-N 3.13Å
434	C	96.9	Very high	95.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.4	-48.7	172.6	-64.6	0	0	0	0	111.4	F402 M411 Y414 N430 R431 A432 T436 K437 L438	F402-C434 VanDerWaalsContact CD2-SG 3.58Å; M411-C434 HydrophobicContact CB-CB 4.15Å; Y414-C434 VanDerWaalsContact CE2-SG 3.55Å; N430-C434 PolarHBondContact O-N 3.29Å; R431-C434 WeakPolarHBondContact O-CA 3.49Å; R431-C434 VanDerWaalsContact O-CB 3.32Å; R431-C434 WeakPolarHBondContact O-CB 3.38Å; R431-C434 PolarHBondContact O-N 3.33Å; A432-C434 VanDerWaalsContact C-N 3.33Å; A432-C434 PolarHBondContact O-N 3.21Å; C434-T436 VanDerWaalsContact C-N 3.32Å; C434-T436 PolarHBondContact O-N 3.41Å; C434-K437 WeakPolarHBondContact O-CB 3.47Å; C434-K437 PolarHBondContact O-N 3.2Å; C434-K437 VanDerWaalsContact O-N 3.08Å; C434-L438 WeakPolarHBondContact O-CG 3.48Å; C434-L438 PolarHBondContact O-N 3.34Å
435	Y	97	Very high	95.8	Very high	32 Å²	32	42.9 Å²	42.9	13%	0.125	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-41.8	179.3	-75	-50.1	0	0	0	112.2	M411 R431 A432 K437 L438 L439 E440 L443 D447	M411-Y435 HydrophobicContact CG-CE1 4.33Å; M411-Y435 HydrophobicContact SD-CD1 3.89Å; M411-Y435 HydrophobicContact SD-CE1 3.28Å; M411-Y435 WeakPolarHBondContact SD-CE1 3.48Å; R431-Y435 HydrophobicContact CG-CD2 4.15Å; R431-Y435 HydrophobicContact CG-CE2 3.74Å; R431-Y435 WeakPolarHBondContact O-CD2 3.37Å; R431-Y435 PolarHBondContact O-N 3.45Å; A432-Y435 PolarHBondContact O-N 3.27Å; Y435-K437 VanDerWaalsContact C-N 3.32Å; Y435-K437 PolarHBondContact O-N 3.08Å; Y435-L438 CarbonylContact O-C 3.49Å; Y435-L438 PolarHBondContact O-N 2.91Å; Y435-L438 VanDerWaalsContact O-N 3.16Å; Y435-L439 PolarHBondContact O-N 3.07Å; Y435-E440 HydrophobicContact CD1-CB 3.83Å; Y435-E440 HydrophobicContact CD1-CG 4.49Å; Y435-E440 HydrophobicContact CG-CB 4.4Å; Y435-E440 PolarHBondContact O-N 3.15Å; Y435-L443 HydrophobicContact CD1-CB 3.91Å; Y435-L443 HydrophobicContact CD1-CD1 4.11Å; Y435-L443 HydrophobicContact CD2-CB 3.84Å; Y435-L443 HydrophobicContact CE1-CB 3.96Å; Y435-L443 HydrophobicContact CE1-CD1 3.64Å; Y435-L443 HydrophobicContact CE1-CG 4.46Å; Y435-L443 HydrophobicContact CE2-CB 3.88Å; Y435-L443 HydrophobicContact CG-CB 3.87Å; Y435-D447 VanDerWaalsContact CE2-OD2 3.28Å; Y435-D447 WeakPolarHBondContact CE2-OD2 3.43Å
436	T	94.7	Very high	95.8	Very high	29 Å²	29	49 Å²	49	18%	0.178	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-39.9	174.3	-53.5	0	0	0	0	111.9	A432 C434 L438 L439 F441	A432-T436 PolarHBondContact O-N 3.41Å; A432-T436 PolarHBondContact O-OG1 2.89Å; A432-T436 VanDerWaalsContact O-OG1 3.04Å; C434-T436 VanDerWaalsContact C-N 3.32Å; C434-T436 PolarHBondContact O-N 3.41Å; T436-L438 VanDerWaalsContact C-N 3.32Å; T436-L439 PolarHBondContact O-N 3.44Å; T436-F441 HydrophobicContact CG2-CD1 4.43Å; T436-F441 HydrophobicContact CG2-CE1 4.23Å
437	K	94.2	Very high	95.9	Very high	121 Å²	121	45.3 Å²	45.3	53%	0.526	22%	0.215	S	C	.	.	H	α-helix	trans	-68.9	-30	175.9	-68.5	-66.7	-177.4	-175.5	0	113.1	F402 Y407 A433 C434 Y435 L439	F402-K437 HydrophobicContact CE2-CG 4.47Å; F402-K437 HydrophobicContact CZ-CG 4.43Å; Y407-K437 HydrophobicContact CD1-CB 3.91Å; Y407-K437 HydrophobicContact CD1-CG 4.07Å; Y407-K437 HydrophobicContact CD2-CB 3.88Å; Y407-K437 HydrophobicContact CE1-CB 3.99Å; Y407-K437 HydrophobicContact CE1-CD 4.34Å; Y407-K437 HydrophobicContact CE1-CG 3.74Å; Y407-K437 HydrophobicContact CE2-CB 3.96Å; Y407-K437 HydrophobicContact CE2-CG 4.35Å; Y407-K437 HydrophobicContact CG-CB 3.86Å; Y407-K437 HydrophobicContact CG-CG 4.5Å; A433-K437 WeakPolarHBondContact O-CG 3.33Å; A433-K437 PolarHBondContact O-N 2.85Å; A433-K437 VanDerWaalsContact O-N 3.13Å; C434-K437 WeakPolarHBondContact O-CB 3.47Å; C434-K437 PolarHBondContact O-N 3.2Å; C434-K437 VanDerWaalsContact O-N 3.08Å; Y435-K437 VanDerWaalsContact C-N 3.32Å; Y435-K437 PolarHBondContact O-N 3.08Å; K437-L439 VanDerWaalsContact C-N 3.29Å
438	L	93.9	Very high	95.9	Very high	58 Å²	58	45.2 Å²	45.2	30%	0.304	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	2.9	175.5	-65.8	173.3	0	0	0	113.3	P408 M411 C434 Y435 T436 E440	P408-L438 HydrophobicContact CG-CD2 4.17Å; M411-L438 HydrophobicContact CE-CD1 4.44Å; M411-L438 HydrophobicContact SD-CD1 4.16Å; C434-L438 WeakPolarHBondContact O-CG 3.48Å; C434-L438 PolarHBondContact O-N 3.34Å; Y435-L438 CarbonylContact O-C 3.49Å; Y435-L438 PolarHBondContact O-N 2.91Å; Y435-L438 VanDerWaalsContact O-N 3.16Å; T436-L438 VanDerWaalsContact C-N 3.32Å; L438-E440 HydrophobicContact CB-CG 4.43Å; L438-E440 PolarHBondContact O-N 3.04Å
439	L	93.3	Very high	95.8	Very high	125 Å²	125	48 Å²	48	65%	0.654	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	17.6	-177.7	-46.5	174.8	0	0	0	114.6	Y435 T436 K437 F441	Y435-L439 PolarHBondContact O-N 3.07Å; T436-L439 PolarHBondContact O-N 3.44Å; K437-L439 VanDerWaalsContact C-N 3.29Å; L439-F441 VanDerWaalsContact C-N 3.3Å; L439-F441 HydrophobicContact CB-CE2 4.09Å; L439-F441 HydrophobicContact CB-CZ 3.91Å; L439-F441 HydrophobicContact CD2-CE1 4.22Å; L439-F441 HydrophobicContact CD2-CE2 4.4Å; L439-F441 HydrophobicContact CD2-CZ 3.56Å; L439-F441 HydrophobicContact CG-CZ 4.36Å; L439-F441 WeakPolarHBondContact O-CD2 3.37Å; L439-F441 PolarHBondContact O-N 3.3Å; L439-F441 VanDerWaalsContact O-N 3.15Å
440	E	94.2	Very high	95.8	Very high	102 Å²	102	52.4 Å²	52.4	48%	0.477	25%	0.249	S	C	.	.			trans	-89.5	60.2	177.5	-69.8	-65.3	171.2	0	0	111.1	Y435 L438 Q442 L443 A444	Y435-E440 HydrophobicContact CD1-CB 3.83Å; Y435-E440 HydrophobicContact CD1-CG 4.49Å; Y435-E440 HydrophobicContact CG-CB 4.4Å; Y435-E440 PolarHBondContact O-N 3.15Å; L438-E440 HydrophobicContact CB-CG 4.43Å; L438-E440 PolarHBondContact O-N 3.04Å; E440-Q442 VanDerWaalsContact C-N 3.31Å; E440-Q442 PolarHBondContact O-N 2.97Å; E440-L443 HydrophobicContact CB-CD1 4.36Å; E440-L443 PolarHBondContact O-N 3.05Å; E440-L443 VanDerWaalsContact O-N 3.16Å; E440-A444 PolarHBondContact O-N 3.17Å; E440-A444 VanDerWaalsContact O-N 3.08Å
441	F	92.3	Very high	95.8	Very high	42 Å²	42	50.6 Å²	50.6	18%	0.184	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-33.5	-167.3	-52.2	-60.3	0	0	0	114.1	T436 L439 L443 A444 L445 A471 M472	T436-F441 HydrophobicContact CG2-CD1 4.43Å; T436-F441 HydrophobicContact CG2-CE1 4.23Å; L439-F441 VanDerWaalsContact C-N 3.3Å; L439-F441 HydrophobicContact CB-CE2 4.09Å; L439-F441 HydrophobicContact CB-CZ 3.91Å; L439-F441 HydrophobicContact CD2-CE1 4.22Å; L439-F441 HydrophobicContact CD2-CE2 4.4Å; L439-F441 HydrophobicContact CD2-CZ 3.56Å; L439-F441 HydrophobicContact CG-CZ 4.36Å; L439-F441 WeakPolarHBondContact O-CD2 3.37Å; L439-F441 PolarHBondContact O-N 3.3Å; L439-F441 VanDerWaalsContact O-N 3.15Å; F441-L443 PolarHBondContact O-N 3.35Å; F441-A444 WeakPolarHBondContact O-CB 3.39Å; F441-A444 PolarHBondContact O-N 2.94Å; F441-L445 WeakPolarHBondContact O-CG 3.37Å; F441-L445 PolarHBondContact O-N 3.49Å; F441-A471 HydrophobicContact CD1-CB 3.82Å; F441-A471 HydrophobicContact CE1-CB 3.3Å; F441-A471 HydrophobicContact CE2-CB 4.25Å; F441-A471 HydrophobicContact CG-CB 4.48Å; F441-A471 HydrophobicContact CZ-CB 3.54Å; F441-M472 HydrophobicContact CB-CG 3.54Å; F441-M472 HydrophobicContact CB-SD 3.67Å; F441-M472 HydrophobicContact CD2-CG 3.86Å; F441-M472 HydrophobicContact CG-CG 3.85Å
442	Q	92.4	Very high	95.8	Very high	110 Å²	110	50.2 Å²	50.2	51%	0.514	24%	0.24	S	C	.	.	H	α-helix	trans	-65.5	-38.8	178	-71	-62.3	-58	0	0	112.6	E440 L445 K446 M472	E440-Q442 VanDerWaalsContact C-N 3.31Å; E440-Q442 PolarHBondContact O-N 2.97Å; Q442-L445 PolarHBondContact O-N 3.27Å; Q442-K446 PolarHBondContact O-N 2.95Å; Q442-M472 PolarHBondContact NE2-SD 3.4Å
443	L	94.3	Very high	95.8	Very high	66 Å²	66	55.4 Å²	55.4	35%	0.346	27%	0.268	S	S	.	.	H	α-helix	trans	-71.3	-37.2	175.1	-64.5	177.5	0	0	0	110.8	Y435 E440 F441 L445 K446 D447	Y435-L443 HydrophobicContact CD1-CB 3.91Å; Y435-L443 HydrophobicContact CD1-CD1 4.11Å; Y435-L443 HydrophobicContact CD2-CB 3.84Å; Y435-L443 HydrophobicContact CE1-CB 3.96Å; Y435-L443 HydrophobicContact CE1-CD1 3.64Å; Y435-L443 HydrophobicContact CE1-CG 4.46Å; Y435-L443 HydrophobicContact CE2-CB 3.88Å; Y435-L443 HydrophobicContact CG-CB 3.87Å; E440-L443 HydrophobicContact CB-CD1 4.36Å; E440-L443 PolarHBondContact O-N 3.05Å; E440-L443 VanDerWaalsContact O-N 3.16Å; F441-L443 PolarHBondContact O-N 3.35Å; L443-L445 VanDerWaalsContact C-N 3.33Å; L443-L445 PolarHBondContact O-N 3.39Å; L443-K446 PolarHBondContact O-N 2.73Å; L443-D447 PolarHBondContact O-N 3.17Å; L443-D447 VanDerWaalsContact O-N 3.09Å
444	A	97	Very high	95.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-43.7	172.9	0	0	0	0	0	111.9	A432 E440 F441 D447 C448 A468	A432-A444 HydrophobicContact CB-CB 4.49Å; E440-A444 PolarHBondContact O-N 3.17Å; E440-A444 VanDerWaalsContact O-N 3.08Å; F441-A444 WeakPolarHBondContact O-CB 3.39Å; F441-A444 PolarHBondContact O-N 2.94Å; A444-D447 PolarHBondContact O-N 3.02Å; A444-C448 WeakPolarHBondContact O-CB 3.38Å; A444-C448 PolarHBondContact O-N 2.91Å; A444-C448 PolarHBondContact O-SG 2.84Å; A444-A468 HydrophobicContact CB-CB 4.16Å
445	L	96.4	Very high	95.7	Very high	18 Å²	18	61.3 Å²	61.3	9%	0.094	30%	0.296	C	S	.	.	H	α-helix	trans	-62.6	-42.8	178.4	-69.3	175.6	0	0	0	112.4	F441 Q442 L443 D447 C448 E449 K465 A468 L469 M472	F441-L445 WeakPolarHBondContact O-CG 3.37Å; F441-L445 PolarHBondContact O-N 3.49Å; Q442-L445 PolarHBondContact O-N 3.27Å; L443-L445 VanDerWaalsContact C-N 3.33Å; L443-L445 PolarHBondContact O-N 3.39Å; L445-D447 PolarHBondContact O-N 3.24Å; L445-C448 PolarHBondContact O-N 3.46Å; L445-E449 WeakPolarHBondContact O-CG 3.22Å; L445-E449 PolarHBondContact O-N 2.85Å; L445-K465 HydrophobicContact CD2-CG 3.92Å; L445-A468 HydrophobicContact CD2-CB 3.82Å; L445-A468 HydrophobicContact CG-CB 4.25Å; L445-L469 HydrophobicContact CD1-CD2 3.97Å; L445-L469 HydrophobicContact CD2-CD1 4.45Å; L445-L469 HydrophobicContact CD2-CD2 3.96Å; L445-L469 HydrophobicContact CD2-CG 3.79Å; L445-M472 HydrophobicContact CD1-SD 3.89Å
446	K	97.1	Very high	95.7	Very high	130 Å²	130	63.4 Å²	63.4	57%	0.565	31%	0.314	S	S	*	.	H	α-helix	trans	-59.8	-46.2	175.6	-71	-179.4	-179.8	-178.1	0	111.9	Q442 L443 C448 E449 E450	Q442-K446 PolarHBondContact O-N 2.95Å; L443-K446 PolarHBondContact O-N 2.73Å; K446-C448 VanDerWaalsContact C-N 3.32Å; K446-C448 PolarHBondContact O-N 2.93Å; K446-E449 PolarHBondContact O-N 2.83Å; K446-E450 PolarHBondContact O-N 3.47Å
447	D	97.4	Very high	95.7	Very high	11 Å²	11	65.7 Å²	65.7	6%	0.059	33%	0.331	C	S	.	.	H	α-helix	trans	-66.4	-34.6	176.8	-85.5	-1.7	0	0	0	112.1	Y428 R431 A432 Y435 L443 A444 L445 E449 C451	Y428-D447 WeakPolarHBondContact CB-O 3.49Å; R431-D447 WeakPolarHBondContact CB-OD2 3.35Å; R431-D447 IonicContact CZ-OD1 3.03Å; R431-D447 IonicContact CZ-OD2 2.96Å; R431-D447 IonicContact NE-OD1 3.49Å; R431-D447 IonicContact NE-OD2 2.99Å; R431-D447 PolarHBondContact NE-OD2 3.48Å; R431-D447 IonicContact NH2-OD1 3.69Å; R431-D447 PolarHBondContact NH2-OD1 3.03Å; R431-D447 IonicContact NH2-OD2 2.69Å; R431-D447 PolarHBondContact NH2-OD2 3.47Å; A432-D447 HydrophobicContact CB-CB 3.84Å; Y435-D447 VanDerWaalsContact CE2-OD2 3.28Å; Y435-D447 WeakPolarHBondContact CE2-OD2 3.43Å; L443-D447 PolarHBondContact O-N 3.17Å; L443-D447 VanDerWaalsContact O-N 3.09Å; A444-D447 PolarHBondContact O-N 3.02Å; L445-D447 PolarHBondContact O-N 3.24Å; D447-E449 VanDerWaalsContact C-N 3.34Å; D447-C451 WeakPolarHBondContact O-CB 3.39Å; D447-C451 PolarHBondContact O-N 3.46Å
448	C	97.4	Very high	95.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.1	-38.5	173.7	-65.8	0	0	0	0	111.8	A444 L445 K446 C451 I452 R464 K465	A444-C448 WeakPolarHBondContact O-CB 3.38Å; A444-C448 PolarHBondContact O-N 2.91Å; A444-C448 PolarHBondContact O-SG 2.84Å; L445-C448 PolarHBondContact O-N 3.46Å; K446-C448 VanDerWaalsContact C-N 3.32Å; K446-C448 PolarHBondContact O-N 2.93Å; C448-C451 WeakPolarHBondContact O-CB 3.48Å; C448-C451 PolarHBondContact O-N 2.89Å; C448-I452 WeakPolarHBondContact O-CB 3.47Å; C448-I452 WeakPolarHBondContact O-CD1 3.47Å; C448-I452 WeakPolarHBondContact O-CG1 3.36Å; C448-I452 PolarHBondContact O-N 3.34Å; C448-R464 VanDerWaalsContact SG-CB 3.51Å; C448-K465 HydrophobicContact CB-CB 3.85Å; C448-K465 HydrophobicContact CB-CG 4.48Å; C448-K465 PolarHBondContact SG-N 3.46Å; C448-K465 VanDerWaalsContact SG-N 3.43Å
449	E	97.1	Very high	95.8	Very high	87 Å²	87	61.1 Å²	61.1	41%	0.407	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-45.5	176	-75.1	172.2	177.1	0	0	111.4	L445 K446 D447 C451 I452 N453 K465	L445-E449 WeakPolarHBondContact O-CG 3.22Å; L445-E449 PolarHBondContact O-N 2.85Å; K446-E449 PolarHBondContact O-N 2.83Å; D447-E449 VanDerWaalsContact C-N 3.34Å; E449-C451 VanDerWaalsContact C-N 3.34Å; E449-C451 PolarHBondContact O-N 3.18Å; E449-I452 PolarHBondContact O-N 2.83Å; E449-N453 WeakPolarHBondContact O-CB 3.09Å; E449-N453 PolarHBondContact O-N 2.87Å; E449-N453 PolarHBondContact O-ND2 3.37Å; E449-N453 PolarHBondContact O-OD1 2.87Å; E449-K465 IonicContact OE1-NZ 2.73Å; E449-K465 PolarHBondContact OE1-NZ 3.28Å
450	E	97.4	Very high	95.9	Very high	95 Å²	95	59.1 Å²	59.1	44%	0.444	30%	0.296	S	S	.	.	H	α-helix	trans	-65.7	-37.8	175	-67.3	-63.1	-169	0	0	112.8	Y428 K446 I452 N453 L454	Y428-E450 HydrophobicContact CD1-CB 3.97Å; Y428-E450 HydrophobicContact CE1-CB 4.13Å; Y428-E450 HydrophobicContact CG-CB 4.41Å; K446-E450 PolarHBondContact O-N 3.47Å; E450-I452 VanDerWaalsContact C-N 3.3Å; E450-I452 PolarHBondContact O-N 2.99Å; E450-N453 PolarHBondContact O-N 2.89Å; E450-N453 PolarHBondContact OE2-ND2 3.42Å; E450-L454 WeakPolarHBondContact O-CB 3.27Å; E450-L454 VanDerWaalsContact O-CG 3.26Å; E450-L454 WeakPolarHBondContact O-CG 3.38Å; E450-L454 PolarHBondContact O-N 3.3Å
451	C	97.4	Very high	96	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.5	-44.8	171.6	179.2	0	0	0	0	111.9	A425 D447 C448 E449 E455 F458	A425-C451 PolarHBondContact O-SG 3.08Å; A425-C451 VanDerWaalsContact O-SG 3.34Å; D447-C451 WeakPolarHBondContact O-CB 3.39Å; D447-C451 PolarHBondContact O-N 3.46Å; C448-C451 WeakPolarHBondContact O-CB 3.48Å; C448-C451 PolarHBondContact O-N 2.89Å; E449-C451 VanDerWaalsContact C-N 3.34Å; E449-C451 PolarHBondContact O-N 3.18Å; C451-E455 PolarHBondContact O-N 2.91Å; C451-F458 VanDerWaalsContact SG-CD1 3.52Å
452	I	97	Very high	96.2	Very high	23 Å²	23	53.9 Å²	53.9	12%	0.118	27%	0.271	C	S	.	.	H	α-helix	trans	-71.2	-38.3	179.1	-69.2	162.1	0	0	0	111	C448 E449 E450 L454 E455 P456 Y462 K465	C448-I452 WeakPolarHBondContact O-CB 3.47Å; C448-I452 WeakPolarHBondContact O-CD1 3.47Å; C448-I452 WeakPolarHBondContact O-CG1 3.36Å; C448-I452 PolarHBondContact O-N 3.34Å; E449-I452 PolarHBondContact O-N 2.83Å; E450-I452 VanDerWaalsContact C-N 3.3Å; E450-I452 PolarHBondContact O-N 2.99Å; I452-L454 VanDerWaalsContact C-N 3.34Å; I452-E455 CarbonylContact O-C 3.57Å; I452-P456 VanDerWaalsContact O-CA 3.24Å; I452-P456 WeakPolarHBondContact O-CA 3.22Å; I452-P456 WeakPolarHBondContact O-CD 3.32Å; I452-P456 VanDerWaalsContact O-CG 3.29Å; I452-P456 WeakPolarHBondContact O-CG 3.35Å; I452-P456 VanDerWaalsContact O-N 3.09Å; I452-Y462 HydrophobicContact CD1-CD1 3.8Å; I452-Y462 HydrophobicContact CD1-CD2 4.49Å; I452-Y462 HydrophobicContact CD1-CE1 3.84Å; I452-Y462 HydrophobicContact CD1-CG 4.15Å; I452-Y462 HydrophobicContact CG1-CD1 4.37Å; I452-Y462 HydrophobicContact CG1-CD2 4.26Å; I452-Y462 HydrophobicContact CG1-CE1 4.19Å; I452-Y462 HydrophobicContact CG1-CE2 4.06Å; I452-Y462 HydrophobicContact CG1-CG 4.42Å; I452-Y462 HydrophobicContact CG2-CE1 4.07Å; I452-Y462 HydrophobicContact CG2-CE2 4.29Å; I452-Y462 WeakPolarHBondContact CG2-OH 3.35Å; I452-K465 HydrophobicContact CD1-CD 4.17Å
453	N	97.4	Very high	96.4	Very high	110 Å²	110	48.7 Å²	48.7	59%	0.588	25%	0.247	S	C	*	.	H	α-helix	trans	-63.3	-41.2	176.7	-68.8	-22	0	0	0	111.6	E449 E450	E449-N453 WeakPolarHBondContact O-CB 3.09Å; E449-N453 PolarHBondContact O-N 2.87Å; E449-N453 PolarHBondContact O-ND2 3.37Å; E449-N453 PolarHBondContact O-OD1 2.87Å; E450-N453 PolarHBondContact O-N 2.89Å; E450-N453 PolarHBondContact OE2-ND2 3.42Å
454	L	95.9	Very high	96.5	Very high	66 Å²	66	48.4 Å²	48.4	35%	0.346	24%	0.241	S	C	.	.	H	α-helix	trans	-72.4	-42.9	179	-71.3	172.3	0	0	0	112.3	A425 Y428 E450 I452	A425-L454 HydrophobicContact CB-CB 3.95Å; Y428-L454 HydrophobicContact CD2-CD1 3.6Å; Y428-L454 HydrophobicContact CE2-CD1 3.32Å; E450-L454 WeakPolarHBondContact O-CB 3.27Å; E450-L454 VanDerWaalsContact O-CG 3.26Å; E450-L454 WeakPolarHBondContact O-CG 3.38Å; E450-L454 PolarHBondContact O-N 3.3Å; I452-L454 VanDerWaalsContact C-N 3.34Å
455	E	96.3	Very high	96.6	Very high	63 Å²	63	50.7 Å²	50.7	29%	0.294	25%	0.251	S	S	.	.			trans	-139.1	86.5	-179.3	-163.7	-179.9	156.3	0	0	110.8	A425 C451 I452 S457 F458	A425-E455 HydrophobicContact CB-CB 3.54Å; C451-E455 PolarHBondContact O-N 2.91Å; I452-E455 CarbonylContact O-C 3.57Å; E455-S457 PolarHBondContact O-N 3.3Å; E455-S457 VanDerWaalsContact O-N 3.12Å; E455-F458 HydrophobicContact CB-CB 3.89Å; E455-F458 HydrophobicContact CG-CB 3.79Å; E455-F458 VanDerWaalsContact O-CB 3.31Å; E455-F458 WeakPolarHBondContact O-CB 3.44Å; E455-F458 PolarHBondContact O-N 2.81Å
456	P	96.2	Very high	96.5	Very high	76 Å²	76	49.9 Å²	49.9	49%	0.494	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.9	-176.9	-24.8	33	0	0	0	115.1	I452 F458 Y462	I452-P456 VanDerWaalsContact O-CA 3.24Å; I452-P456 WeakPolarHBondContact O-CA 3.22Å; I452-P456 WeakPolarHBondContact O-CD 3.32Å; I452-P456 VanDerWaalsContact O-CG 3.29Å; I452-P456 WeakPolarHBondContact O-CG 3.35Å; I452-P456 VanDerWaalsContact O-N 3.09Å; P456-F458 VanDerWaalsContact C-N 3.35Å; P456-Y462 VanDerWaalsContact O-CE2 3.25Å; P456-Y462 WeakPolarHBondContact O-CE2 3.41Å; P456-Y462 PolarHBondContact O-OH 3.32Å
457	S	95	Very high	96.5	Very high	76 Å²	76	44.8 Å²	44.8	53%	0.531	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-7.7	174.9	52.4	0	0	0	0	113.3	E455 I459	E455-S457 PolarHBondContact O-N 3.3Å; E455-S457 VanDerWaalsContact O-N 3.12Å; S457-I459 PolarHBondContact O-N 3.18Å; S457-I459 VanDerWaalsContact O-N 3.1Å
458	F	95.3	Very high	96.4	Very high	40 Å²	40	44.2 Å²	44.2	18%	0.175	23%	0.226	C	C	.	.			trans	-81.3	97.1	-174.8	-170.7	-135.9	0	0	0	111.5	A425 K426 C451 E455 P456 K460 G461	A425-F458 HydrophobicContact CB-CD1 4.33Å; K426-F458 HydrophobicContact CG-CE1 4.2Å; K426-F458 HydrophobicContact CG-CZ 3.98Å; C451-F458 VanDerWaalsContact SG-CD1 3.52Å; E455-F458 HydrophobicContact CB-CB 3.89Å; E455-F458 HydrophobicContact CG-CB 3.79Å; E455-F458 VanDerWaalsContact O-CB 3.31Å; E455-F458 WeakPolarHBondContact O-CB 3.44Å; E455-F458 PolarHBondContact O-N 2.81Å; P456-F458 VanDerWaalsContact C-N 3.35Å; F458-K460 HydrophobicContact CD1-CB 4.2Å; F458-K460 HydrophobicContact CD2-CB 4.43Å; F458-K460 HydrophobicContact CE1-CB 3.69Å; F458-K460 HydrophobicContact CE2-CB 3.93Å; F458-K460 HydrophobicContact CE2-CG 4.07Å; F458-K460 HydrophobicContact CZ-CB 3.53Å; F458-K460 HydrophobicContact CZ-CG 3.93Å; F458-K460 PolarHBondContact O-N 3.03Å; F458-G461 PolarHBondContact O-N 3.49Å
459	I	95.1	Very high	96.3	Very high	43 Å²	43	44.8 Å²	44.8	22%	0.221	23%	0.229	C	C	.	.	H	α-helix	trans	-51.9	-32.5	-176.5	-61.6	144.2	0	0	0	112.9	S457 G461 Y462 T463 A485 L488 D489	S457-I459 PolarHBondContact O-N 3.18Å; S457-I459 VanDerWaalsContact O-N 3.1Å; I459-G461 VanDerWaalsContact C-N 3.26Å; I459-G461 PolarHBondContact O-N 3.04Å; I459-Y462 PolarHBondContact O-N 3.02Å; I459-T463 HydrophobicContact CG2-CG2 4.11Å; I459-T463 PolarHBondContact O-N 3.41Å; I459-T463 PolarHBondContact O-OG1 3.18Å; I459-T463 VanDerWaalsContact O-OG1 3.06Å; I459-A485 HydrophobicContact CG2-CB 4.16Å; I459-L488 HydrophobicContact CG1-CB 3.77Å; I459-L488 HydrophobicContact CG1-CD1 4.4Å; I459-D489 HydrophobicContact CD1-CB 3.35Å; I459-D489 HydrophobicContact CG1-CB 4.01Å
460	K	94.9	Very high	96.1	Very high	83 Å²	83	42.3 Å²	42.3	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-63.4	-28.4	178	-73.4	-70.8	-178.9	-174.9	0	113.1	F458 T463 R464 E494	F458-K460 HydrophobicContact CD1-CB 4.2Å; F458-K460 HydrophobicContact CD2-CB 4.43Å; F458-K460 HydrophobicContact CE1-CB 3.69Å; F458-K460 HydrophobicContact CE2-CB 3.93Å; F458-K460 HydrophobicContact CE2-CG 4.07Å; F458-K460 HydrophobicContact CZ-CB 3.53Å; F458-K460 HydrophobicContact CZ-CG 3.93Å; F458-K460 PolarHBondContact O-N 3.03Å; K460-T463 VanDerWaalsContact CA-OG1 3.29Å; K460-T463 WeakPolarHBondContact CA-OG1 3.26Å; K460-T463 PolarHBondContact O-OG1 3.37Å; K460-R464 VanDerWaalsContact O-CB 3.24Å; K460-R464 WeakPolarHBondContact O-CB 3.49Å; K460-R464 WeakPolarHBondContact O-CG 3.4Å; K460-R464 PolarHBondContact O-N 2.87Å; K460-E494 IonicContact NZ-OE2 2.72Å; K460-E494 PolarHBondContact NZ-OE2 3.36Å
461	G	95.9	Very high	95.8	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62	-47.4	173.6	0	0	0	0	0	112.1	F458 I459 K465	F458-G461 PolarHBondContact O-N 3.49Å; I459-G461 VanDerWaalsContact C-N 3.26Å; I459-G461 PolarHBondContact O-N 3.04Å; G461-K465 WeakPolarHBondContact O-CB 3.43Å; G461-K465 PolarHBondContact O-N 3.2Å
462	Y	97.3	Very high	95.4	Very high	34 Å²	34	43.7 Å²	43.7	13%	0.133	23%	0.233	C	C	.	.	H	α-helix	trans	-71.2	-43.1	-179.3	-63.8	-84	0	0	0	113.2	I452 P456 I459 R464 K465 G466 K484 L488	I452-Y462 HydrophobicContact CD1-CD1 3.8Å; I452-Y462 HydrophobicContact CD1-CD2 4.49Å; I452-Y462 HydrophobicContact CD1-CE1 3.84Å; I452-Y462 HydrophobicContact CD1-CG 4.15Å; I452-Y462 HydrophobicContact CG1-CD1 4.37Å; I452-Y462 HydrophobicContact CG1-CD2 4.26Å; I452-Y462 HydrophobicContact CG1-CE1 4.19Å; I452-Y462 HydrophobicContact CG1-CE2 4.06Å; I452-Y462 HydrophobicContact CG1-CG 4.42Å; I452-Y462 HydrophobicContact CG2-CE1 4.07Å; I452-Y462 HydrophobicContact CG2-CE2 4.29Å; I452-Y462 WeakPolarHBondContact CG2-OH 3.35Å; P456-Y462 VanDerWaalsContact O-CE2 3.25Å; P456-Y462 WeakPolarHBondContact O-CE2 3.41Å; P456-Y462 PolarHBondContact O-OH 3.32Å; I459-Y462 PolarHBondContact O-N 3.02Å; Y462-R464 PolarHBondContact O-N 3.1Å; Y462-K465 WeakPolarHBondContact O-CB 3.25Å; Y462-K465 PolarHBondContact O-N 3.03Å; Y462-G466 PolarHBondContact O-N 3.49Å; Y462-K484 HydrophobicContact CD1-CB 3.72Å; Y462-K484 HydrophobicContact CD1-CD 4.22Å; Y462-K484 HydrophobicContact CE1-CB 3.96Å; Y462-K484 HydrophobicContact CE1-CD 3.9Å; Y462-K484 HydrophobicContact CG-CB 4.36Å; Y462-L488 HydrophobicContact CD2-CD1 3.7Å; Y462-L488 HydrophobicContact CE2-CD1 3.44Å; Y462-L488 VanDerWaalsContact CE2-CD1 3.44Å
463	T	96.7	Very high	94.9	Very high	1 Å²	1	49 Å²	49	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-38.4	177.3	49.4	0	0	0	0	112.1	I459 K460 G466 A467 A485 A495	I459-T463 HydrophobicContact CG2-CG2 4.11Å; I459-T463 PolarHBondContact O-N 3.41Å; I459-T463 PolarHBondContact O-OG1 3.18Å; I459-T463 VanDerWaalsContact O-OG1 3.06Å; K460-T463 VanDerWaalsContact CA-OG1 3.29Å; K460-T463 WeakPolarHBondContact CA-OG1 3.26Å; K460-T463 PolarHBondContact O-OG1 3.37Å; T463-G466 PolarHBondContact O-N 2.92Å; T463-A467 WeakPolarHBondContact O-CB 3.43Å; T463-A467 PolarHBondContact O-N 3.45Å; T463-A485 HydrophobicContact CG2-CB 3.73Å; T463-A495 HydrophobicContact CG2-CB 3.92Å
464	R	97.1	Very high	94.4	Very high	60 Å²	60	45.7 Å²	45.7	23%	0.226	24%	0.237	C	C	.	.	H	α-helix	trans	-66.2	-39.7	172.8	-67.3	-69.5	-174.4	-138.5	4.5	112.1	C448 K460 Y462 A467 A468 E494	C448-R464 VanDerWaalsContact SG-CB 3.51Å; K460-R464 VanDerWaalsContact O-CB 3.24Å; K460-R464 WeakPolarHBondContact O-CB 3.49Å; K460-R464 WeakPolarHBondContact O-CG 3.4Å; K460-R464 PolarHBondContact O-N 2.87Å; Y462-R464 PolarHBondContact O-N 3.1Å; R464-A467 PolarHBondContact O-N 3.49Å; R464-A468 PolarHBondContact O-N 3.39Å; R464-E494 IonicContact NH1-OE1 2.72Å
465	K	97.4	Very high	94	Very high	49 Å²	49	43.5 Å²	43.5	21%	0.213	23%	0.225	C	C	.	.	H	α-helix	trans	-60.4	-47.3	173.3	-174.5	164.4	177.8	155.7	0	111.1	L445 C448 E449 I452 G461 Y462 A467 A468 L469 A481	L445-K465 HydrophobicContact CD2-CG 3.92Å; C448-K465 HydrophobicContact CB-CB 3.85Å; C448-K465 HydrophobicContact CB-CG 4.48Å; C448-K465 PolarHBondContact SG-N 3.46Å; C448-K465 VanDerWaalsContact SG-N 3.43Å; E449-K465 IonicContact OE1-NZ 2.73Å; E449-K465 PolarHBondContact OE1-NZ 3.28Å; I452-K465 HydrophobicContact CD1-CD 4.17Å; G461-K465 WeakPolarHBondContact O-CB 3.43Å; G461-K465 PolarHBondContact O-N 3.2Å; Y462-K465 WeakPolarHBondContact O-CB 3.25Å; Y462-K465 PolarHBondContact O-N 3.03Å; K465-A467 PolarHBondContact O-N 3.36Å; K465-A468 PolarHBondContact O-N 2.89Å; K465-L469 HydrophobicContact CG-CD1 3.95Å; K465-L469 WeakPolarHBondContact O-CG 3.31Å; K465-L469 PolarHBondContact O-N 2.99Å; K465-A481 HydrophobicContact CB-CB 4.31Å; K465-A481 HydrophobicContact CG-CB 4.2Å
466	G	96.1	Very high	93.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.6	-48	175.1	0	0	0	0	0	112.1	Y462 T463 A468 L469 E470 A478 Y482	Y462-G466 PolarHBondContact O-N 3.49Å; T463-G466 PolarHBondContact O-N 2.92Å; G466-A468 PolarHBondContact O-N 3.47Å; G466-L469 PolarHBondContact O-N 2.97Å; G466-E470 VanDerWaalsContact O-CB 3.27Å; G466-E470 WeakPolarHBondContact O-CB 3.4Å; G466-E470 PolarHBondContact O-N 3.35Å; G466-A478 WeakPolarHBondContact O-CB 3.4Å; G466-Y482 VanDerWaalsContact C-CZ 3.46Å
467	A	95.9	Very high	93	Very high	23 Å²	23	41.8 Å²	41.8	19%	0.19	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-38.8	179	0	0	0	0	0	113.2	T463 R464 K465 A471 Y482	T463-A467 WeakPolarHBondContact O-CB 3.43Å; T463-A467 PolarHBondContact O-N 3.45Å; R464-A467 PolarHBondContact O-N 3.49Å; K465-A467 PolarHBondContact O-N 3.36Å; A467-A471 WeakPolarHBondContact O-CB 3.37Å; A467-A471 PolarHBondContact O-N 2.85Å; A467-Y482 VanDerWaalsContact CA-OH 3.25Å; A467-Y482 WeakPolarHBondContact CA-OH 3.49Å; A467-Y482 PolarHBondContact N-OH 3.36Å; A467-Y482 VanDerWaalsContact N-OH 3.14Å
468	A	96.3	Very high	92.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-66.7	-41.5	175.7	0	0	0	0	0	112	A444 L445 R464 K465 G466 A471 M472	A444-A468 HydrophobicContact CB-CB 4.16Å; L445-A468 HydrophobicContact CD2-CB 3.82Å; L445-A468 HydrophobicContact CG-CB 4.25Å; R464-A468 PolarHBondContact O-N 3.39Å; K465-A468 PolarHBondContact O-N 2.89Å; G466-A468 PolarHBondContact O-N 3.47Å; A468-A471 PolarHBondContact O-N 3.25Å; A468-M472 WeakPolarHBondContact O-CG 3.5Å; A468-M472 PolarHBondContact O-N 3.46Å; A468-M472 VanDerWaalsContact O-N 3.09Å
469	L	94.4	Very high	92.7	Very high	11 Å²	11	38 Å²	38	6%	0.058	19%	0.187	C	C	.	.	H	α-helix	trans	-68.6	-39.1	176.3	-69.3	166.8	0	0	0	112.2	L445 K465 G466 A471 M472 K473 D474 K477 A478 A481	L445-L469 HydrophobicContact CD1-CD2 3.97Å; L445-L469 HydrophobicContact CD2-CD1 4.45Å; L445-L469 HydrophobicContact CD2-CD2 3.96Å; L445-L469 HydrophobicContact CD2-CG 3.79Å; K465-L469 HydrophobicContact CG-CD1 3.95Å; K465-L469 WeakPolarHBondContact O-CG 3.31Å; K465-L469 PolarHBondContact O-N 2.99Å; G466-L469 PolarHBondContact O-N 2.97Å; L469-A471 VanDerWaalsContact C-N 3.34Å; L469-A471 PolarHBondContact O-N 3.44Å; L469-M472 CarbonylContact O-C 3.55Å; L469-M472 WeakPolarHBondContact O-CA 3.41Å; L469-M472 WeakPolarHBondContact O-CB 3.29Å; L469-M472 PolarHBondContact O-N 3.35Å; L469-M472 VanDerWaalsContact O-N 3.15Å; L469-K473 PolarHBondContact O-N 3.45Å; L469-K473 VanDerWaalsContact O-N 3.1Å; L469-D474 HydrophobicContact CD2-CB 4.29Å; L469-D474 PolarHBondContact O-N 3.03Å; L469-K477 HydrophobicContact CD1-CB 3.8Å; L469-K477 WeakPolarHBondContact CD1-O 3.39Å; L469-K477 HydrophobicContact CD2-CB 4.36Å; L469-A478 HydrophobicContact CB-CB 3.67Å; L469-A481 HydrophobicContact CD1-CB 4.45Å
470	E	92.9	Very high	92.6	Very high	35 Å²	35	40 Å²	40	16%	0.164	20%	0.198	C	C	.	.	H	α-helix	trans	-57.6	-47.5	173.1	-178.9	-176.9	169.5	0	0	110.2	G466 M472 K473 F475 A478 Y482 R501	G466-E470 VanDerWaalsContact O-CB 3.27Å; G466-E470 WeakPolarHBondContact O-CB 3.4Å; G466-E470 PolarHBondContact O-N 3.35Å; E470-M472 VanDerWaalsContact C-N 3.27Å; E470-M472 PolarHBondContact O-N 2.89Å; E470-K473 WeakPolarHBondContact O-CA 3.07Å; E470-K473 PolarHBondContact O-N 2.68Å; E470-F475 HydrophobicContact CG-CE1 4.4Å; E470-A478 HydrophobicContact CB-CB 4.26Å; E470-Y482 PolarHBondContact OE2-OH 3.03Å; E470-R501 IonicContact OE1-CZ 3.52Å; E470-R501 IonicContact OE1-NE 3.65Å; E470-R501 PolarHBondContact OE1-NE 3.05Å; E470-R501 IonicContact OE1-NH2 3.73Å; E470-R501 IonicContact OE2-NE 3.25Å; E470-R501 IonicContact OE2-NH2 2.72Å; E470-R501 PolarHBondContact OE2-NH2 3.47Å
471	A	91.4	Very high	92.6	Very high	47 Å²	47	36.4 Å²	36.4	39%	0.388	18%	0.183	S	C	.	.	H	α-helix	trans	-64.7	-30.7	176.9	0	0	0	0	0	113.1	F441 A467 A468 L469 K473	F441-A471 HydrophobicContact CD1-CB 3.82Å; F441-A471 HydrophobicContact CE1-CB 3.3Å; F441-A471 HydrophobicContact CE2-CB 4.25Å; F441-A471 HydrophobicContact CG-CB 4.48Å; F441-A471 HydrophobicContact CZ-CB 3.54Å; A467-A471 WeakPolarHBondContact O-CB 3.37Å; A467-A471 PolarHBondContact O-N 2.85Å; A468-A471 PolarHBondContact O-N 3.25Å; L469-A471 VanDerWaalsContact C-N 3.34Å; L469-A471 PolarHBondContact O-N 3.44Å; A471-K473 PolarHBondContact O-N 3.11Å
472	M	89	Confident	92.6	Very high	77 Å²	77	36.5 Å²	36.5	38%	0.379	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-2.4	171.6	-72.1	-176.1	61.5	0	0	114.2	F441 Q442 L445 A468 L469 E470 D474	F441-M472 HydrophobicContact CB-CG 3.54Å; F441-M472 HydrophobicContact CB-SD 3.67Å; F441-M472 HydrophobicContact CD2-CG 3.86Å; F441-M472 HydrophobicContact CG-CG 3.85Å; Q442-M472 PolarHBondContact NE2-SD 3.4Å; L445-M472 HydrophobicContact CD1-SD 3.89Å; A468-M472 WeakPolarHBondContact O-CG 3.5Å; A468-M472 PolarHBondContact O-N 3.46Å; A468-M472 VanDerWaalsContact O-N 3.09Å; L469-M472 CarbonylContact O-C 3.55Å; L469-M472 WeakPolarHBondContact O-CA 3.41Å; L469-M472 WeakPolarHBondContact O-CB 3.29Å; L469-M472 PolarHBondContact O-N 3.35Å; L469-M472 VanDerWaalsContact O-N 3.15Å; E470-M472 VanDerWaalsContact C-N 3.27Å; E470-M472 PolarHBondContact O-N 2.89Å; M472-D474 PolarHBondContact O-N 3.05Å
473	K	87.2	Confident	92.5	Very high	136 Å²	136	38.4 Å²	38.4	59%	0.591	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	22.8	-174.2	-50.2	-178.9	178.5	-176.8	0	114.3	L469 E470 A471 F475 R509	L469-K473 PolarHBondContact O-N 3.45Å; L469-K473 VanDerWaalsContact O-N 3.1Å; E470-K473 WeakPolarHBondContact O-CA 3.07Å; E470-K473 PolarHBondContact O-N 2.68Å; A471-K473 PolarHBondContact O-N 3.11Å; K473-F475 VanDerWaalsContact C-N 3.28Å; K473-F475 HydrophobicContact CB-CE2 4.04Å; K473-F475 HydrophobicContact CB-CZ 3.92Å; K473-F475 HydrophobicContact CG-CZ 4.12Å; K473-F475 PolarHBondContact O-N 2.99Å; K473-R509 PolarHBondContact O-NH1 3.48Å
474	D	86.3	Confident	92.4	Very high	39 Å²	39	43.6 Å²	43.6	21%	0.209	22%	0.216	C	C	.	.			trans	-90.2	66.8	169.6	-162.4	-15.4	0	0	0	109.1	L469 M472 S476 K477 A478	L469-D474 HydrophobicContact CD2-CB 4.29Å; L469-D474 PolarHBondContact O-N 3.03Å; M472-D474 PolarHBondContact O-N 3.05Å; D474-S476 VanDerWaalsContact C-N 3.31Å; D474-S476 PolarHBondContact O-N 3.17Å; D474-K477 PolarHBondContact O-N 3.21Å; D474-K477 VanDerWaalsContact OD2-CD 3.28Å; D474-K477 WeakPolarHBondContact OD2-CD 3.35Å; D474-K477 WeakPolarHBondContact OD2-CE 3.36Å; D474-K477 IonicContact OD2-NZ 3.36Å; D474-K477 PolarHBondContact OD2-NZ 2.96Å; D474-A478 WeakPolarHBondContact O-CB 3.33Å; D474-A478 PolarHBondContact O-N 3.26Å
475	F	87.1	Confident	92.4	Very high	20 Å²	20	40.8 Å²	40.8	9%	0.088	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-33.5	-169.9	-58.4	-57	0	0	0	113.4	E470 K473 A478 M479 C502 S505 Q506 R509	E470-F475 HydrophobicContact CG-CE1 4.4Å; K473-F475 VanDerWaalsContact C-N 3.28Å; K473-F475 HydrophobicContact CB-CE2 4.04Å; K473-F475 HydrophobicContact CB-CZ 3.92Å; K473-F475 HydrophobicContact CG-CZ 4.12Å; K473-F475 PolarHBondContact O-N 2.99Å; F475-A478 PolarHBondContact O-N 3.17Å; F475-M479 WeakPolarHBondContact O-CB 3.2Å; F475-M479 VanDerWaalsContact O-CG 3.27Å; F475-M479 WeakPolarHBondContact O-CG 3.49Å; F475-M479 PolarHBondContact O-N 3.02Å; F475-C502 HydrophobicContact CB-CB 4.25Å; F475-C502 HydrophobicContact CD1-CB 4.3Å; F475-S505 VanDerWaalsContact CZ-CB 3.49Å; F475-Q506 HydrophobicContact CB-CB 4.3Å; F475-Q506 HydrophobicContact CD2-CB 4.48Å; F475-R509 HydrophobicContact CE2-CG 4.31Å
476	S	83.8	Confident	92.2	Very high	24 Å²	24	39.7 Å²	39.7	17%	0.168	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-52.8	177.7	168.9	0	0	0	0	110.8	D474 A478 M479 D480	D474-S476 VanDerWaalsContact C-N 3.31Å; D474-S476 PolarHBondContact O-N 3.17Å; S476-A478 VanDerWaalsContact C-N 3.29Å; S476-A478 PolarHBondContact O-N 3.45Å; S476-M479 WeakPolarHBondContact O-CB 3.46Å; S476-M479 PolarHBondContact O-N 2.93Å; S476-D480 PolarHBondContact O-N 2.95Å
477	K	88.9	Confident	92.2	Very high	80 Å²	80	46.2 Å²	46.2	35%	0.348	23%	0.233	S	C	.	.	H	α-helix	trans	-68	-30.7	177.3	-61.5	-173	-163.5	135.5	0	112.6	L469 D474 M479 D480 A481	L469-K477 HydrophobicContact CD1-CB 3.8Å; L469-K477 WeakPolarHBondContact CD1-O 3.39Å; L469-K477 HydrophobicContact CD2-CB 4.36Å; D474-K477 PolarHBondContact O-N 3.21Å; D474-K477 VanDerWaalsContact OD2-CD 3.28Å; D474-K477 WeakPolarHBondContact OD2-CD 3.35Å; D474-K477 WeakPolarHBondContact OD2-CE 3.36Å; D474-K477 IonicContact OD2-NZ 3.36Å; D474-K477 PolarHBondContact OD2-NZ 2.96Å; K477-M479 VanDerWaalsContact C-N 3.34Å; K477-D480 PolarHBondContact O-N 3.23Å; K477-A481 PolarHBondContact O-N 3.32Å
478	A	93	Very high	92.1	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.5	-43.6	173.6	0	0	0	0	0	111.1	G466 L469 E470 D474 F475 S476 A481 Y482 C502	G466-A478 WeakPolarHBondContact O-CB 3.4Å; L469-A478 HydrophobicContact CB-CB 3.67Å; E470-A478 HydrophobicContact CB-CB 4.26Å; D474-A478 WeakPolarHBondContact O-CB 3.33Å; D474-A478 PolarHBondContact O-N 3.26Å; F475-A478 PolarHBondContact O-N 3.17Å; S476-A478 VanDerWaalsContact C-N 3.29Å; S476-A478 PolarHBondContact O-N 3.45Å; A478-A481 PolarHBondContact O-N 3.47Å; A478-Y482 HydrophobicContact CB-CE2 4.43Å; A478-Y482 WeakPolarHBondContact O-CD2 3.43Å; A478-Y482 PolarHBondContact O-N 3.35Å; A478-C502 VanDerWaalsContact CB-SG 3.58Å
479	M	91.1	Very high	91.9	Very high	37 Å²	37	51.3 Å²	51.3	18%	0.182	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-43.3	174.4	-73.2	172.8	62.7	0	0	111.7	F475 S476 K477 A481 Y482 Q483 M499 C502 Q506	F475-M479 WeakPolarHBondContact O-CB 3.2Å; F475-M479 VanDerWaalsContact O-CG 3.27Å; F475-M479 WeakPolarHBondContact O-CG 3.49Å; F475-M479 PolarHBondContact O-N 3.02Å; S476-M479 WeakPolarHBondContact O-CB 3.46Å; S476-M479 PolarHBondContact O-N 2.93Å; K477-M479 VanDerWaalsContact C-N 3.34Å; M479-A481 VanDerWaalsContact C-N 3.29Å; M479-A481 PolarHBondContact O-N 3.19Å; M479-Y482 PolarHBondContact O-N 3.44Å; M479-Q483 VanDerWaalsContact O-CB 3.28Å; M479-Q483 WeakPolarHBondContact O-CB 3.42Å; M479-Q483 PolarHBondContact O-N 3.15Å; M479-M499 HydrophobicContact CE-CE 4.36Å; M479-M499 HydrophobicContact CG-CG 4.47Å; M479-C502 HydrophobicContact CG-CB 3.51Å; M479-C502 HydrophobicContact SD-CB 4.13Å; M479-Q506 PolarHBondContact SD-OE1 3.13Å
480	D	91.6	Very high	91.7	Very high	85 Å²	85	56 Å²	56	46%	0.455	29%	0.29	S	S	.	.	H	α-helix	trans	-58.8	-41.9	175.4	-65.3	-21.8	0	0	0	111.8	S476 K477 Q483 K484	S476-D480 PolarHBondContact O-N 2.95Å; K477-D480 PolarHBondContact O-N 3.23Å; D480-Q483 PolarHBondContact O-N 2.65Å; D480-K484 WeakPolarHBondContact O-CG 3.15Å; D480-K484 PolarHBondContact O-N 2.75Å
481	A	95.2	Very high	91.7	Very high	6 Å²	6	58.6 Å²	58.6	5%	0.05	31%	0.312	C	S	.	.	H	α-helix	trans	-66.2	-43.5	177	0	0	0	0	0	112	K465 L469 K477 A478 M479 K484 A485	K465-A481 HydrophobicContact CB-CB 4.31Å; K465-A481 HydrophobicContact CG-CB 4.2Å; L469-A481 HydrophobicContact CD1-CB 4.45Å; K477-A481 PolarHBondContact O-N 3.32Å; A478-A481 PolarHBondContact O-N 3.47Å; M479-A481 VanDerWaalsContact C-N 3.29Å; M479-A481 PolarHBondContact O-N 3.19Å; A481-K484 PolarHBondContact O-N 3.37Å; A481-A485 PolarHBondContact O-N 2.88Å; A481-A485 VanDerWaalsContact O-N 3.09Å
482	Y	96.8	Very high	91.8	Very high	2 Å²	2	57 Å²	57	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-67.5	-35.5	175.6	-69.8	-52.4	0	0	0	112.6	G466 A467 E470 A478 M479 A485 L486 A495 G498	G466-Y482 VanDerWaalsContact C-CZ 3.46Å; A467-Y482 VanDerWaalsContact CA-OH 3.25Å; A467-Y482 WeakPolarHBondContact CA-OH 3.49Å; A467-Y482 PolarHBondContact N-OH 3.36Å; A467-Y482 VanDerWaalsContact N-OH 3.14Å; E470-Y482 PolarHBondContact OE2-OH 3.03Å; A478-Y482 HydrophobicContact CB-CE2 4.43Å; A478-Y482 WeakPolarHBondContact O-CD2 3.43Å; A478-Y482 PolarHBondContact O-N 3.35Å; M479-Y482 PolarHBondContact O-N 3.44Å; Y482-A485 WeakPolarHBondContact O-CA 3.43Å; Y482-A485 VanDerWaalsContact O-CB 3.31Å; Y482-A485 WeakPolarHBondContact O-CB 3.41Å; Y482-A485 PolarHBondContact O-N 3.09Å; Y482-A485 VanDerWaalsContact O-N 3.14Å; Y482-L486 WeakPolarHBondContact O-CG 3.41Å; Y482-L486 PolarHBondContact O-N 3.32Å; Y482-A495 HydrophobicContact CD1-CB 4.29Å; Y482-G498 VanDerWaalsContact CD2-C 3.48Å; Y482-G498 VanDerWaalsContact CE2-C 3.42Å
483	Q	94.8	Very high	92	Very high	75 Å²	75	61 Å²	61	35%	0.35	31%	0.313	S	S	.	.	H	α-helix	trans	-62.5	-46.8	175.6	-178.1	57.3	44.4	0	0	110.8	M479 D480 A485 L486 E487	M479-Q483 VanDerWaalsContact O-CB 3.28Å; M479-Q483 WeakPolarHBondContact O-CB 3.42Å; M479-Q483 PolarHBondContact O-N 3.15Å; D480-Q483 PolarHBondContact O-N 2.65Å; Q483-A485 VanDerWaalsContact C-N 3.25Å; Q483-A485 PolarHBondContact O-N 3.15Å; Q483-L486 CarbonylContact O-C 3.37Å; Q483-L486 WeakPolarHBondContact O-CB 3.48Å; Q483-L486 PolarHBondContact O-N 2.63Å; Q483-E487 WeakPolarHBondContact O-CG 3.48Å; Q483-E487 PolarHBondContact O-N 2.7Å
484	K	95.3	Very high	92.2	Very high	110 Å²	110	57.2 Å²	57.2	48%	0.478	30%	0.298	S	S	.	.	H	α-helix	trans	-59.6	-35.8	172.3	-72.6	-174.5	179.4	-174	0	112.8	Y462 D480 A481 L486 E487 L488	Y462-K484 HydrophobicContact CD1-CB 3.72Å; Y462-K484 HydrophobicContact CD1-CD 4.22Å; Y462-K484 HydrophobicContact CE1-CB 3.96Å; Y462-K484 HydrophobicContact CE1-CD 3.9Å; Y462-K484 HydrophobicContact CG-CB 4.36Å; D480-K484 WeakPolarHBondContact O-CG 3.15Å; D480-K484 PolarHBondContact O-N 2.75Å; A481-K484 PolarHBondContact O-N 3.37Å; K484-L486 VanDerWaalsContact C-N 3.34Å; K484-E487 PolarHBondContact O-N 3.18Å; K484-L488 WeakPolarHBondContact O-CG 3.17Å; K484-L488 PolarHBondContact O-N 3.15Å
485	A	95.4	Very high	92.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-38.8	173.8	0	0	0	0	0	112.2	I459 T463 A481 Y482 Q483 L488 D489 A495	I459-A485 HydrophobicContact CG2-CB 4.16Å; T463-A485 HydrophobicContact CG2-CB 3.73Å; A481-A485 PolarHBondContact O-N 2.88Å; A481-A485 VanDerWaalsContact O-N 3.09Å; Y482-A485 WeakPolarHBondContact O-CA 3.43Å; Y482-A485 VanDerWaalsContact O-CB 3.31Å; Y482-A485 WeakPolarHBondContact O-CB 3.41Å; Y482-A485 PolarHBondContact O-N 3.09Å; Y482-A485 VanDerWaalsContact O-N 3.14Å; Q483-A485 VanDerWaalsContact C-N 3.25Å; Q483-A485 PolarHBondContact O-N 3.15Å; A485-L488 PolarHBondContact O-N 3.5Å; A485-D489 PolarHBondContact O-N 2.92Å; A485-A495 HydrophobicContact CB-CB 3.83Å
486	L	94.6	Very high	93	Very high	26 Å²	26	57.6 Å²	57.6	14%	0.136	30%	0.303	C	S	.	.	H	α-helix	trans	-74.2	-28.9	178	-69.5	169.6	0	0	0	113.5	Y482 Q483 K484 L488 D489 S490 A495 T496 M499	Y482-L486 WeakPolarHBondContact O-CG 3.41Å; Y482-L486 PolarHBondContact O-N 3.32Å; Q483-L486 CarbonylContact O-C 3.37Å; Q483-L486 WeakPolarHBondContact O-CB 3.48Å; Q483-L486 PolarHBondContact O-N 2.63Å; K484-L486 VanDerWaalsContact C-N 3.34Å; L486-L488 VanDerWaalsContact C-N 3.27Å; L486-D489 WeakPolarHBondContact CA-O 3.25Å; L486-D489 CarbonylContact O-C 3.46Å; L486-D489 VanDerWaalsContact O-C 3.26Å; L486-S490 VanDerWaalsContact O-CA 3.29Å; L486-S490 WeakPolarHBondContact O-CA 3.35Å; L486-S490 PolarHBondContact O-N 2.91Å; L486-S490 VanDerWaalsContact O-N 3.09Å; L486-A495 HydrophobicContact CD2-CB 3.75Å; L486-A495 HydrophobicContact CG-CB 3.76Å; L486-T496 WeakPolarHBondContact CD2-OG1 3.4Å; L486-M499 HydrophobicContact CD1-SD 3.85Å
487	E	94.9	Very high	93.5	Very high	138 Å²	138	61.3 Å²	61.3	65%	0.645	32%	0.318	S	S	*	.	H	α-helix	trans	-64	-35.1	170.3	-73.5	168.3	-168.6	0	0	111.7	Q483 K484	Q483-E487 WeakPolarHBondContact O-CG 3.48Å; Q483-E487 PolarHBondContact O-N 2.7Å; K484-E487 PolarHBondContact O-N 3.18Å
488	L	93.3	Very high	93.7	Very high	81 Å²	81	57.5 Å²	57.5	42%	0.424	30%	0.301	S	S	.	.	H	α-helix	trans	-80	-39.7	176.1	-66.3	174.3	0	0	0	112.7	I459 Y462 K484 A485 L486	I459-L488 HydrophobicContact CG1-CB 3.77Å; I459-L488 HydrophobicContact CG1-CD1 4.4Å; Y462-L488 HydrophobicContact CD2-CD1 3.7Å; Y462-L488 HydrophobicContact CE2-CD1 3.44Å; Y462-L488 VanDerWaalsContact CE2-CD1 3.44Å; K484-L488 WeakPolarHBondContact O-CG 3.17Å; K484-L488 PolarHBondContact O-N 3.15Å; A485-L488 PolarHBondContact O-N 3.5Å; L486-L488 VanDerWaalsContact C-N 3.27Å
489	D	92.3	Very high	93.7	Very high	49 Å²	49	60 Å²	60	26%	0.262	31%	0.313	S	S	.	.			trans	-143.9	100.6	175.2	174.1	14.9	0	0	0	111	I459 A485 L486 S491 S492	I459-D489 HydrophobicContact CD1-CB 3.35Å; I459-D489 HydrophobicContact CG1-CB 4.01Å; A485-D489 PolarHBondContact O-N 2.92Å; L486-D489 WeakPolarHBondContact CA-O 3.25Å; L486-D489 CarbonylContact O-C 3.46Å; L486-D489 VanDerWaalsContact O-C 3.26Å; D489-S491 PolarHBondContact O-N 3.22Å; D489-S491 VanDerWaalsContact O-N 3.17Å; D489-S491 WeakPolarHBondContact OD1-CA 3.36Å; D489-S491 WeakPolarHBondContact OD1-CB 3.28Å; D489-S491 PolarHBondContact OD1-N 2.8Å; D489-S491 PolarHBondContact OD1-OG 2.61Å; D489-S492 VanDerWaalsContact O-CB 3.29Å; D489-S492 WeakPolarHBondContact O-CB 3.4Å; D489-S492 PolarHBondContact O-N 2.74Å
490	S	91.6	Very high	93.7	Very high	109 Å²	109	64.3 Å²	64.3	76%	0.762	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-13	-179.4	59.7	0	0	0	0	113.8	L486	L486-S490 VanDerWaalsContact O-CA 3.29Å; L486-S490 WeakPolarHBondContact O-CA 3.35Å; L486-S490 PolarHBondContact O-N 2.91Å; L486-S490 VanDerWaalsContact O-N 3.09Å
491	S	92.2	Very high	93.7	Very high	89 Å²	89	65.1 Å²	65.1	62%	0.622	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	0.2	178.1	75.7	0	0	0	0	113.7	D489 K493	D489-S491 PolarHBondContact O-N 3.22Å; D489-S491 VanDerWaalsContact O-N 3.17Å; D489-S491 WeakPolarHBondContact OD1-CA 3.36Å; D489-S491 WeakPolarHBondContact OD1-CB 3.28Å; D489-S491 PolarHBondContact OD1-N 2.8Å; D489-S491 PolarHBondContact OD1-OG 2.61Å; S491-K493 PolarHBondContact O-N 3.14Å
492	S	92.8	Very high	93.5	Very high	14 Å²	14	64.8 Å²	64.8	10%	0.098	33%	0.327	C	S	.	.			trans	-68.4	98.5	-176.5	-178.6	0	0	0	0	112.5	D489 E494 A495 T496	D489-S492 VanDerWaalsContact O-CB 3.29Å; D489-S492 WeakPolarHBondContact O-CB 3.4Å; D489-S492 PolarHBondContact O-N 2.74Å; S492-E494 VanDerWaalsContact C-N 3.29Å; S492-E494 PolarHBondContact O-N 3.07Å; S492-A495 PolarHBondContact O-N 2.96Å; S492-A495 VanDerWaalsContact O-N 3.17Å; S492-T496 PolarHBondContact O-N 3.3Å; S492-T496 PolarHBondContact O-OG1 2.72Å; S492-T496 VanDerWaalsContact O-OG1 3.14Å
493	K	93.3	Very high	93	Very high	161 Å²	161	70.2 Å²	70.2	70%	0.7	35%	0.354	S	S	*	.	H	α-helix	trans	-55.1	-42.2	176.6	-64.5	-173.7	-179.8	-177	0	112.9	S491 A495 T496 E497	S491-K493 PolarHBondContact O-N 3.14Å; K493-A495 VanDerWaalsContact C-N 3.3Å; K493-A495 PolarHBondContact O-N 3.29Å; K493-T496 PolarHBondContact O-N 3.08Å; K493-E497 VanDerWaalsContact O-CB 3.31Å; K493-E497 WeakPolarHBondContact O-CB 3.07Å; K493-E497 VanDerWaalsContact O-CG 3.25Å; K493-E497 WeakPolarHBondContact O-CG 3.36Å; K493-E497 PolarHBondContact O-N 3.43Å
494	E	93.2	Very high	92.6	Very high	57 Å²	57	69.6 Å²	69.6	27%	0.266	36%	0.355	S	S	.	.	H	α-helix	trans	-60.5	-40.6	-179.4	-176.1	174.7	-167	0	0	111.4	K460 R464 S492 G498	K460-E494 IonicContact NZ-OE2 2.72Å; K460-E494 PolarHBondContact NZ-OE2 3.36Å; R464-E494 IonicContact NH1-OE1 2.72Å; S492-E494 VanDerWaalsContact C-N 3.29Å; S492-E494 PolarHBondContact O-N 3.07Å; E494-G498 PolarHBondContact O-N 3.47Å
495	A	93.8	Very high	92.1	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-73	-43.7	177.8	0	0	0	0	0	112.2	T463 Y482 A485 L486 S492 K493 G498 M499	T463-A495 HydrophobicContact CG2-CB 3.92Å; Y482-A495 HydrophobicContact CD1-CB 4.29Å; A485-A495 HydrophobicContact CB-CB 3.83Å; L486-A495 HydrophobicContact CD2-CB 3.75Å; L486-A495 HydrophobicContact CG-CB 3.76Å; S492-A495 PolarHBondContact O-N 2.96Å; S492-A495 VanDerWaalsContact O-N 3.17Å; K493-A495 VanDerWaalsContact C-N 3.3Å; K493-A495 PolarHBondContact O-N 3.29Å; A495-G498 PolarHBondContact O-N 2.84Å; A495-M499 WeakPolarHBondContact O-CB 3.48Å; A495-M499 PolarHBondContact O-N 3.06Å
496	T	94.4	Very high	91.3	Very high	66 Å²	66	69.2 Å²	69.2	41%	0.405	36%	0.36	S	S	.	.	H	α-helix	trans	-61.1	-47.7	177	-52	0	0	0	0	111.6	L486 S492 K493 M499 Q500	L486-T496 WeakPolarHBondContact CD2-OG1 3.4Å; S492-T496 PolarHBondContact O-N 3.3Å; S492-T496 PolarHBondContact O-OG1 2.72Å; S492-T496 VanDerWaalsContact O-OG1 3.14Å; K493-T496 PolarHBondContact O-N 3.08Å; T496-M499 PolarHBondContact O-N 2.99Å; T496-Q500 PolarHBondContact O-N 2.9Å
497	E	94.6	Very high	90.3	Very high	103 Å²	103	73 Å²	73	48%	0.481	38%	0.384	S	S	.	.	H	α-helix	trans	-65.4	-40.9	178.2	-70.1	173.1	-173.3	0	0	111.5	K493 Q500 R501	K493-E497 VanDerWaalsContact O-CB 3.31Å; K493-E497 WeakPolarHBondContact O-CB 3.07Å; K493-E497 VanDerWaalsContact O-CG 3.25Å; K493-E497 WeakPolarHBondContact O-CG 3.36Å; K493-E497 PolarHBondContact O-N 3.43Å; E497-Q500 PolarHBondContact O-N 3.48Å; E497-R501 WeakPolarHBondContact O-CB 3.35Å; E497-R501 WeakPolarHBondContact O-CG 3.25Å; E497-R501 PolarHBondContact O-N 3.49Å
498	G	93.1	Very high	89.2	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-60.2	-45.1	174.8	0	0	0	0	0	112.7	Y482 E494 A495 R501 C502	Y482-G498 VanDerWaalsContact CD2-C 3.48Å; Y482-G498 VanDerWaalsContact CE2-C 3.42Å; E494-G498 PolarHBondContact O-N 3.47Å; A495-G498 PolarHBondContact O-N 2.84Å; G498-R501 PolarHBondContact O-N 3.48Å; G498-C502 WeakPolarHBondContact O-CB 3.43Å; G498-C502 PolarHBondContact O-N 3.32Å; G498-C502 PolarHBondContact O-SG 3.28Å; G498-C502 VanDerWaalsContact O-SG 3.34Å
499	M	92.8	Very high	88	Confident	52 Å²	52	73.2 Å²	73.2	26%	0.256	38%	0.382	S	S	.	.	H	α-helix	trans	-61.7	-45.3	175.5	-169.5	177.1	-172.7	0	0	111.7	M479 L486 A495 T496 C502 M503	M479-M499 HydrophobicContact CE-CE 4.36Å; M479-M499 HydrophobicContact CG-CG 4.47Å; L486-M499 HydrophobicContact CD1-SD 3.85Å; A495-M499 WeakPolarHBondContact O-CB 3.48Å; A495-M499 PolarHBondContact O-N 3.06Å; T496-M499 PolarHBondContact O-N 2.99Å; M499-C502 PolarHBondContact O-N 2.96Å; M499-M503 WeakPolarHBondContact O-CB 3.49Å; M499-M503 PolarHBondContact O-N 3.32Å
500	Q	91.5	Very high	86.7	Confident	127 Å²	127	78.9 Å²	78.9	59%	0.593	41%	0.412	S	S	*	.	H	α-helix	trans	-63	-43	177.3	-173.5	178.8	-8	0	0	112	T496 E497 M503 V504	T496-Q500 PolarHBondContact O-N 2.9Å; E497-Q500 PolarHBondContact O-N 3.48Å; Q500-M503 PolarHBondContact O-N 3.33Å; Q500-V504 WeakPolarHBondContact O-CG2 3.39Å; Q500-V504 PolarHBondContact O-N 3.1Å
501	R	92.8	Very high	85.6	Confident	102 Å²	102	75.9 Å²	75.9	39%	0.385	39%	0.388	S	S	.	.	H	α-helix	trans	-62.3	-43.1	176	-75.5	-167.8	-52.3	-87.3	-2.8	112.1	E470 E497 G498 V504 S505	E470-R501 IonicContact OE1-CZ 3.52Å; E470-R501 IonicContact OE1-NE 3.65Å; E470-R501 PolarHBondContact OE1-NE 3.05Å; E470-R501 IonicContact OE1-NH2 3.73Å; E470-R501 IonicContact OE2-NE 3.25Å; E470-R501 IonicContact OE2-NH2 2.72Å; E470-R501 PolarHBondContact OE2-NH2 3.47Å; E497-R501 WeakPolarHBondContact O-CB 3.35Å; E497-R501 WeakPolarHBondContact O-CG 3.25Å; E497-R501 PolarHBondContact O-N 3.49Å; G498-R501 PolarHBondContact O-N 3.48Å; R501-V504 PolarHBondContact O-N 3.25Å; R501-S505 VanDerWaalsContact O-CB 3.25Å; R501-S505 WeakPolarHBondContact O-CB 3.3Å; R501-S505 PolarHBondContact O-N 3.32Å; R501-S505 PolarHBondContact O-OG 3.02Å
502	C	90.9	Very high	84.6	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-62	-42.8	175.4	-73.1	0	0	0	0	111.6	F475 A478 M479 G498 M499 S505 Q506	F475-C502 HydrophobicContact CB-CB 4.25Å; F475-C502 HydrophobicContact CD1-CB 4.3Å; A478-C502 VanDerWaalsContact CB-SG 3.58Å; M479-C502 HydrophobicContact CG-CB 3.51Å; M479-C502 HydrophobicContact SD-CB 4.13Å; G498-C502 WeakPolarHBondContact O-CB 3.43Å; G498-C502 PolarHBondContact O-N 3.32Å; G498-C502 PolarHBondContact O-SG 3.28Å; G498-C502 VanDerWaalsContact O-SG 3.34Å; M499-C502 PolarHBondContact O-N 2.96Å; C502-S505 PolarHBondContact O-N 3.25Å; C502-Q506 VanDerWaalsContact O-CB 3.25Å; C502-Q506 WeakPolarHBondContact O-CB 3.47Å; C502-Q506 PolarHBondContact O-N 3.17Å
503	M	85.2	Confident	83.6	Confident	116 Å²	116	78.6 Å²	78.6	57%	0.571	40%	0.404	S	S	*	.	H	α-helix	trans	-63.4	-45.9	178.3	-170.6	-178.9	-172.7	0	0	112.2	M499 Q500 Q506 T507	M499-M503 WeakPolarHBondContact O-CB 3.49Å; M499-M503 PolarHBondContact O-N 3.32Å; Q500-M503 PolarHBondContact O-N 3.33Å; M503-Q506 PolarHBondContact O-N 3.43Å; M503-T507 WeakPolarHBondContact O-CG2 3.5Å; M503-T507 PolarHBondContact O-N 3.04Å; M503-T507 PolarHBondContact O-OG1 3.21Å
504	V	86.9	Confident	82.6	Confident	62 Å²	62	78.6 Å²	78.6	38%	0.376	41%	0.406	S	S	.	.	H	α-helix	trans	-63.2	-44.5	174.7	174.8	0	0	0	0	110.8	Q500 R501 Q506 T507 M508	Q500-V504 WeakPolarHBondContact O-CG2 3.39Å; Q500-V504 PolarHBondContact O-N 3.1Å; R501-V504 PolarHBondContact O-N 3.25Å; V504-Q506 VanDerWaalsContact C-N 3.32Å; V504-Q506 PolarHBondContact O-N 2.83Å; V504-T507 WeakPolarHBondContact CA-OG1 3.47Å; V504-T507 PolarHBondContact O-N 3.26Å; V504-T507 PolarHBondContact O-OG1 2.94Å; V504-M508 HydrophobicContact CG1-CE 3.71Å; V504-M508 HydrophobicContact CG1-CG 4.27Å; V504-M508 HydrophobicContact CG1-SD 3.8Å; V504-M508 WeakPolarHBondContact O-CB 3.46Å; V504-M508 VanDerWaalsContact O-CG 3.32Å; V504-M508 WeakPolarHBondContact O-CG 3.5Å; V504-M508 PolarHBondContact O-N 2.84Å
505	S	84.3	Confident	81.6	Confident	42 Å²	42	80.9 Å²	80.9	29%	0.294	42%	0.417	S	S	.	.	H	α-helix	trans	-65.3	-36.2	179.7	-58.9	0	0	0	0	112.1	F475 R501 C502 R509	F475-S505 VanDerWaalsContact CZ-CB 3.49Å; R501-S505 VanDerWaalsContact O-CB 3.25Å; R501-S505 WeakPolarHBondContact O-CB 3.3Å; R501-S505 PolarHBondContact O-N 3.32Å; R501-S505 PolarHBondContact O-OG 3.02Å; C502-S505 PolarHBondContact O-N 3.25Å; S505-R509 WeakPolarHBondContact O-CG 3.34Å; S505-R509 PolarHBondContact O-N 3.4Å
506	Q	78.3	Confident	80.5	Confident	59 Å²	59	82 Å²	82	28%	0.276	42%	0.424	S	S	.	.	H	α-helix	trans	-69.8	-39.4	176.2	-172.7	174.2	18.4	0	0	112	F475 M479 C502 M503 V504 R509 D567	F475-Q506 HydrophobicContact CB-CB 4.3Å; F475-Q506 HydrophobicContact CD2-CB 4.48Å; M479-Q506 PolarHBondContact SD-OE1 3.13Å; C502-Q506 VanDerWaalsContact O-CB 3.25Å; C502-Q506 WeakPolarHBondContact O-CB 3.47Å; C502-Q506 PolarHBondContact O-N 3.17Å; M503-Q506 PolarHBondContact O-N 3.43Å; V504-Q506 VanDerWaalsContact C-N 3.32Å; V504-Q506 PolarHBondContact O-N 2.83Å; Q506-R509 PolarHBondContact O-N 3.33Å; Q506-D567 PolarHBondContact NE2-O 3.27Å
507	T	73.9	Confident	79.6	Confident	106 Å²	106	84.9 Å²	84.9	65%	0.65	43%	0.431	S	S	*	.	H	α-helix	trans	-73.9	-29.5	177.6	47.8	0	0	0	0	113.3	M503 V504 R509	M503-T507 WeakPolarHBondContact O-CG2 3.5Å; M503-T507 PolarHBondContact O-N 3.04Å; M503-T507 PolarHBondContact O-OG1 3.21Å; V504-T507 WeakPolarHBondContact CA-OG1 3.47Å; V504-T507 PolarHBondContact O-N 3.26Å; V504-T507 PolarHBondContact O-OG1 2.94Å; T507-R509 VanDerWaalsContact C-N 3.33Å
508	M	72.9	Confident	78.8	Confident	153 Å²	153	88 Å²	88	75%	0.754	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-4.2	175.4	-68.4	-172.9	176.1	0	0	113.8	V504 N510	V504-M508 HydrophobicContact CG1-CE 3.71Å; V504-M508 HydrophobicContact CG1-CG 4.27Å; V504-M508 HydrophobicContact CG1-SD 3.8Å; V504-M508 WeakPolarHBondContact O-CB 3.46Å; V504-M508 VanDerWaalsContact O-CG 3.32Å; V504-M508 WeakPolarHBondContact O-CG 3.5Å; V504-M508 PolarHBondContact O-N 2.84Å; M508-N510 PolarHBondContact O-N 3.48Å
509	R	68.1	Low	77.9	Confident	70 Å²	70	91.7 Å²	91.7	26%	0.264	46%	0.456	S	S	.	.			trans	-69.4	116.4	175.2	-90.2	177.7	108.9	150.4	6.5	110.3	K473 F475 S505 Q506 T507 D511	K473-R509 PolarHBondContact O-NH1 3.48Å; F475-R509 HydrophobicContact CE2-CG 4.31Å; S505-R509 WeakPolarHBondContact O-CG 3.34Å; S505-R509 PolarHBondContact O-N 3.4Å; Q506-R509 PolarHBondContact O-N 3.33Å; T507-R509 VanDerWaalsContact C-N 3.33Å; R509-D511 VanDerWaalsContact C-N 3.3Å; R509-D511 VanDerWaalsContact CD-OD2 3.29Å; R509-D511 WeakPolarHBondContact CD-OD2 3.44Å; R509-D511 IonicContact CZ-OD1 2.84Å; R509-D511 IonicContact CZ-OD2 3.83Å; R509-D511 IonicContact NE-OD1 3.07Å; R509-D511 PolarHBondContact NE-OD1 2.97Å; R509-D511 IonicContact NE-OD2 2.68Å; R509-D511 PolarHBondContact NE-OD2 3.32Å; R509-D511 IonicContact NH2-OD1 2.86Å; R509-D511 PolarHBondContact O-N 3.47Å
510	N	64.8	Low	77	Confident	169 Å²	169	89.3 Å²	89.3	90%	0.904	45%	0.445	S	S	*	.			trans	-97	59.4	169.8	-154	24.6	0	0	0	109.4	M508	M508-N510 PolarHBondContact O-N 3.48Å
511	D	67	Low	76.4	Confident	46 Å²	46	86 Å²	86	25%	0.246	43%	0.431	C	S	.	.			trans	-74	140.4	-178.6	-59.9	-49.2	0	0	0	110.1	R509 E515 V516 R519	R509-D511 VanDerWaalsContact C-N 3.3Å; R509-D511 VanDerWaalsContact CD-OD2 3.29Å; R509-D511 WeakPolarHBondContact CD-OD2 3.44Å; R509-D511 IonicContact CZ-OD1 2.84Å; R509-D511 IonicContact CZ-OD2 3.83Å; R509-D511 IonicContact NE-OD1 3.07Å; R509-D511 PolarHBondContact NE-OD1 2.97Å; R509-D511 IonicContact NE-OD2 2.68Å; R509-D511 PolarHBondContact NE-OD2 3.32Å; R509-D511 IonicContact NH2-OD1 2.86Å; R509-D511 PolarHBondContact O-N 3.47Å; D511-E515 HydrophobicContact CB-CB 4.49Å; D511-V516 HydrophobicContact CB-CG2 3.62Å; D511-R519 IonicContact OD1-NH2 3.47Å; D511-R519 IonicContact OD2-CZ 3.75Å; D511-R519 VanDerWaalsContact OD2-CZ 3.26Å; D511-R519 IonicContact OD2-NH1 2.75Å; D511-R519 PolarHBondContact OD2-NH1 2.98Å; D511-R519 VanDerWaalsContact OD2-NH1 3.15Å; D511-R519 IonicContact OD2-NH2 3.01Å; D511-R519 PolarHBondContact OD2-NH2 3.23Å
512	S	72.1	Confident	75.6	Confident	46 Å²	46	84.6 Å²	84.6	32%	0.322	44%	0.441	S	S	.	.			trans	-67.1	153.3	171.8	65.4	0	0	0	0	111.1	E514 E515 V516	S512-E514 PolarHBondContact O-N 3.44Å; S512-E514 VanDerWaalsContact O-N 3.08Å; S512-E515 WeakPolarHBondContact CB-OE2 3.5Å; S512-E515 PolarHBondContact N-OE2 3.4Å; S512-E515 PolarHBondContact O-N 3.03Å; S512-E515 WeakPolarHBondContact OG-CG 3.41Å; S512-E515 PolarHBondContact OG-N 3.15Å; S512-E515 PolarHBondContact OG-OE2 3.15Å; S512-V516 WeakPolarHBondContact O-CG2 3.41Å; S512-V516 PolarHBondContact O-N 3.13Å
513	P	71.3	Confident	74.9	Confident	113 Å²	113	85.5 Å²	85.5	73%	0.734	45%	0.446	S	S	*	.	H	α-helix	trans	-54.4	-30.7	177.5	-27.7	35.1	0	0	0	114.1	K517	P513-K517 WeakPolarHBondContact O-CB 3.47Å; P513-K517 PolarHBondContact O-N 3.37Å; P513-K517 VanDerWaalsContact O-N 3.09Å
514	E	72.2	Confident	74.5	Confident	162 Å²	162	84.3 Å²	84.3	76%	0.757	45%	0.447	S	S	*	.	H	α-helix	trans	-72.6	-39.1	177.2	-65	-170.2	165.4	0	0	112.7	S512 K517 K518	S512-E514 PolarHBondContact O-N 3.44Å; S512-E514 VanDerWaalsContact O-N 3.08Å; E514-K517 PolarHBondContact O-N 3.35Å; E514-K518 WeakPolarHBondContact O-CB 3.45Å; E514-K518 PolarHBondContact O-N 3.4Å
515	E	72.4	Confident	74.3	Confident	105 Å²	105	86.1 Å²	86.1	49%	0.491	45%	0.451	S	S	.	.	H	α-helix	trans	-71.4	-35.1	177.8	-71.7	165.7	141.1	0	0	112.3	D511 S512 R519	D511-E515 HydrophobicContact CB-CB 4.49Å; S512-E515 WeakPolarHBondContact CB-OE2 3.5Å; S512-E515 PolarHBondContact N-OE2 3.4Å; S512-E515 PolarHBondContact O-N 3.03Å; S512-E515 WeakPolarHBondContact OG-CG 3.41Å; S512-E515 PolarHBondContact OG-N 3.15Å; S512-E515 PolarHBondContact OG-OE2 3.15Å; E515-R519 WeakPolarHBondContact O-CB 3.49Å; E515-R519 PolarHBondContact O-N 3.01Å; E515-R519 VanDerWaalsContact O-N 3.11Å
516	V	71.8	Confident	74.3	Confident	23 Å²	23	84.1 Å²	84.1	14%	0.139	44%	0.437	C	S	.	.	H	α-helix	trans	-61.9	-50.1	170.8	176.8	0	0	0	0	109.7	D511 S512 K518 R519 A520 V568 G569	D511-V516 HydrophobicContact CB-CG2 3.62Å; S512-V516 WeakPolarHBondContact O-CG2 3.41Å; S512-V516 PolarHBondContact O-N 3.13Å; V516-K518 PolarHBondContact O-N 3.47Å; V516-R519 PolarHBondContact O-N 3.27Å; V516-A520 VanDerWaalsContact O-CB 3.28Å; V516-A520 WeakPolarHBondContact O-CB 3.46Å; V516-A520 PolarHBondContact O-N 3.42Å; V516-V568 WeakPolarHBondContact CG1-O 3.3Å; V516-G569 VanDerWaalsContact CG1-C 3.48Å; V516-G569 VanDerWaalsContact CG1-O 3.29Å; V516-G569 WeakPolarHBondContact CG1-O 3.45Å
517	K	75.4	Confident	74.5	Confident	127 Å²	127	86.2 Å²	86.2	55%	0.552	45%	0.447	S	S	*	.	H	α-helix	trans	-61.2	-45.1	178.2	-172.9	178.3	-180	-179.4	0	112.4	P513 E514 R519 A520 M521 L570	P513-K517 WeakPolarHBondContact O-CB 3.47Å; P513-K517 PolarHBondContact O-N 3.37Å; P513-K517 VanDerWaalsContact O-N 3.09Å; E514-K517 PolarHBondContact O-N 3.35Å; K517-R519 PolarHBondContact O-N 3.15Å; K517-A520 PolarHBondContact O-N 3.48Å; K517-M521 HydrophobicContact CG-CG 4.35Å; K517-M521 VanDerWaalsContact O-CB 3.28Å; K517-M521 WeakPolarHBondContact O-CB 3.48Å; K517-M521 WeakPolarHBondContact O-CG 3.45Å; K517-M521 PolarHBondContact O-N 3.27Å; K517-L570 HydrophobicContact CB-CD2 4.35Å; K517-L570 HydrophobicContact CG-CD2 4.28Å
518	K	78.3	Confident	75.2	Confident	169 Å²	169	87.9 Å²	87.9	74%	0.735	45%	0.447	S	S	*	.	H	α-helix	trans	-61.9	-42.4	-179.8	-175.9	178.1	178.2	-179.4	0	112.3	E514 V516 A522	E514-K518 WeakPolarHBondContact O-CB 3.45Å; E514-K518 PolarHBondContact O-N 3.4Å; V516-K518 PolarHBondContact O-N 3.47Å; K518-A522 PolarHBondContact O-N 3.44Å
519	R	73.6	Confident	75.9	Confident	76 Å²	76	81.1 Å²	81.1	29%	0.287	41%	0.414	S	S	.	.	H	α-helix	trans	-70.1	-46.9	178.6	-175.7	-162.1	-32.6	147.6	20.5	112	D511 E515 V516 K517 M521 A522	D511-R519 IonicContact OD1-NH2 3.47Å; D511-R519 IonicContact OD2-CZ 3.75Å; D511-R519 VanDerWaalsContact OD2-CZ 3.26Å; D511-R519 IonicContact OD2-NH1 2.75Å; D511-R519 PolarHBondContact OD2-NH1 2.98Å; D511-R519 VanDerWaalsContact OD2-NH1 3.15Å; D511-R519 IonicContact OD2-NH2 3.01Å; D511-R519 PolarHBondContact OD2-NH2 3.23Å; E515-R519 WeakPolarHBondContact O-CB 3.49Å; E515-R519 PolarHBondContact O-N 3.01Å; E515-R519 VanDerWaalsContact O-N 3.11Å; V516-R519 PolarHBondContact O-N 3.27Å; K517-R519 PolarHBondContact O-N 3.15Å; R519-M521 VanDerWaalsContact C-N 3.26Å; R519-M521 PolarHBondContact O-N 2.95Å; R519-A522 WeakPolarHBondContact O-CA 3.37Å; R519-A522 VanDerWaalsContact O-CB 3.29Å; R519-A522 WeakPolarHBondContact O-CB 3.46Å; R519-A522 PolarHBondContact O-N 3.05Å
520	A	74	Confident	76.6	Confident	3 Å²	3	80.1 Å²	80.1	3%	0.025	41%	0.413	C	S	.	.	H	α-helix	trans	-61.6	-39.9	179.2	0	0	0	0	0	110.6	V516 K517 A522 D523 V526 V568 L570	V516-A520 VanDerWaalsContact O-CB 3.28Å; V516-A520 WeakPolarHBondContact O-CB 3.46Å; V516-A520 PolarHBondContact O-N 3.42Å; K517-A520 PolarHBondContact O-N 3.48Å; A520-A522 PolarHBondContact O-N 3.02Å; A520-D523 WeakPolarHBondContact O-CB 3.46Å; A520-D523 PolarHBondContact O-N 3.44Å; A520-D523 VanDerWaalsContact O-N 3.14Å; A520-V526 HydrophobicContact CB-CG1 4.19Å; A520-V526 WeakPolarHBondContact O-CB 3.3Å; A520-V526 VanDerWaalsContact O-CG1 3.26Å; A520-V526 WeakPolarHBondContact O-CG1 3.22Å; A520-V568 HydrophobicContact CB-CB 4.02Å; A520-V568 HydrophobicContact CB-CG2 3.76Å; A520-L570 HydrophobicContact CB-CD1 3.35Å; A520-L570 HydrophobicContact CB-CD2 4.16Å; A520-L570 HydrophobicContact CB-CG 3.47Å; A520-L570 VanDerWaalsContact CB-CG 3.47Å
521	M	78.9	Confident	77.6	Confident	57 Å²	57	75.1 Å²	75.1	28%	0.281	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-5.4	173.1	-66	-70.3	174.3	0	0	114.2	K517 R519 Q527 M530	K517-M521 HydrophobicContact CG-CG 4.35Å; K517-M521 VanDerWaalsContact O-CB 3.28Å; K517-M521 WeakPolarHBondContact O-CB 3.48Å; K517-M521 WeakPolarHBondContact O-CG 3.45Å; K517-M521 PolarHBondContact O-N 3.27Å; R519-M521 VanDerWaalsContact C-N 3.26Å; R519-M521 PolarHBondContact O-N 2.95Å; M521-Q527 WeakPolarHBondContact O-CG 3.34Å; M521-Q527 PolarHBondContact O-NE2 2.58Å; M521-M530 HydrophobicContact CE-CB 4.09Å; M521-M530 HydrophobicContact CE-CE 3.94Å; M521-M530 HydrophobicContact CE-CG 3.79Å; M521-M530 HydrophobicContact SD-CG 4.48Å
522	A	74.9	Confident	78.7	Confident	72 Å²	72	74.9 Å²	74.9	60%	0.595	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-11.7	170.3	0	0	0	0	0	112.4	K518 R519 A520 P524	K518-A522 PolarHBondContact O-N 3.44Å; R519-A522 WeakPolarHBondContact O-CA 3.37Å; R519-A522 VanDerWaalsContact O-CB 3.29Å; R519-A522 WeakPolarHBondContact O-CB 3.46Å; R519-A522 PolarHBondContact O-N 3.05Å; A520-A522 PolarHBondContact O-N 3.02Å; A522-P524 WeakPolarHBondContact O-CD 3.38Å
523	D	76.6	Confident	79.5	Confident	20 Å²	20	77.2 Å²	77.2	11%	0.107	40%	0.404	C	S	.	.	S	Bend	trans	-85.8	117.3	173.1	-170.9	-24.6	0	0	0	109.8	A520 E525 V526 Q527 K564	A520-D523 WeakPolarHBondContact O-CB 3.46Å; A520-D523 PolarHBondContact O-N 3.44Å; A520-D523 VanDerWaalsContact O-N 3.14Å; D523-E525 PolarHBondContact O-N 3.12Å; D523-E525 WeakPolarHBondContact OD1-CB 3.34Å; D523-E525 PolarHBondContact OD1-N 2.99Å; D523-V526 HydrophobicContact CB-CB 4.01Å; D523-V526 HydrophobicContact CB-CG2 3.79Å; D523-V526 PolarHBondContact O-N 3.34Å; D523-V526 VanDerWaalsContact O-N 3.15Å; D523-Q527 PolarHBondContact O-N 2.94Å; D523-K564 IonicContact OD2-NZ 3.74Å
524	P	77.9	Confident	80.2	Confident	91 Å²	91	74.4 Å²	74.4	59%	0.591	39%	0.39	S	S	*	.	H	α-helix	trans	-57.6	-32.6	178.5	-24.3	34.4	0	0	0	113.6	A522 Q527 Q528	A522-P524 WeakPolarHBondContact O-CD 3.38Å; P524-Q527 PolarHBondContact O-N 2.93Å; P524-Q528 WeakPolarHBondContact O-CB 3.28Å; P524-Q528 PolarHBondContact O-N 3.13Å
525	E	81.6	Confident	80.9	Confident	99 Å²	99	66.8 Å²	66.8	46%	0.463	35%	0.354	S	S	.	.	H	α-helix	trans	-66.3	-44.7	177.6	-172.7	178.7	-156.5	0	0	110.3	D523 Q528 I529 K564	D523-E525 PolarHBondContact O-N 3.12Å; D523-E525 WeakPolarHBondContact OD1-CB 3.34Å; D523-E525 PolarHBondContact OD1-N 2.99Å; E525-Q528 WeakPolarHBondContact O-CB 3.24Å; E525-Q528 PolarHBondContact O-N 3.26Å; E525-I529 HydrophobicContact CG-CD1 4.35Å; E525-I529 VanDerWaalsContact O-CG1 3.27Å; E525-I529 WeakPolarHBondContact O-CG1 3.39Å; E525-I529 PolarHBondContact O-N 3.09Å; E525-K564 WeakPolarHBondContact OE2-CE 3.48Å; E525-K564 IonicContact OE2-NZ 3.62Å; E525-K564 PolarHBondContact OE2-NZ 3.27Å
526	V	83.5	Confident	81.5	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-66.1	-40.2	176.3	174.6	0	0	0	0	111.4	A520 D523 Q528 I529 M530 K564 L565 V568 L570	A520-V526 HydrophobicContact CB-CG1 4.19Å; A520-V526 WeakPolarHBondContact O-CB 3.3Å; A520-V526 VanDerWaalsContact O-CG1 3.26Å; A520-V526 WeakPolarHBondContact O-CG1 3.22Å; D523-V526 HydrophobicContact CB-CB 4.01Å; D523-V526 HydrophobicContact CB-CG2 3.79Å; D523-V526 PolarHBondContact O-N 3.34Å; D523-V526 VanDerWaalsContact O-N 3.15Å; V526-Q528 VanDerWaalsContact C-N 3.28Å; V526-Q528 PolarHBondContact O-N 3.32Å; V526-I529 PolarHBondContact O-N 2.86Å; V526-M530 HydrophobicContact CG1-CG 4.24Å; V526-M530 WeakPolarHBondContact O-CB 3.37Å; V526-M530 VanDerWaalsContact O-CG 3.27Å; V526-M530 WeakPolarHBondContact O-CG 3.44Å; V526-M530 PolarHBondContact O-N 3.48Å; V526-K564 HydrophobicContact CG2-CG 4.48Å; V526-L565 HydrophobicContact CG1-CD2 3.93Å; V526-V568 HydrophobicContact CG2-CG1 4.13Å; V526-V568 HydrophobicContact CG2-CG2 4.28Å; V526-L570 HydrophobicContact CG1-CD1 3.53Å
527	Q	84.2	Confident	82.2	Confident	103 Å²	103	72.5 Å²	72.5	48%	0.481	38%	0.376	S	S	.	.	H	α-helix	trans	-58.5	-43.4	173.5	-71.8	-175.7	0.5	0	0	111.4	M521 D523 P524 M530 S531	M521-Q527 WeakPolarHBondContact O-CG 3.34Å; M521-Q527 PolarHBondContact O-NE2 2.58Å; D523-Q527 PolarHBondContact O-N 2.94Å; P524-Q527 PolarHBondContact O-N 2.93Å; Q527-M530 PolarHBondContact O-N 2.73Å; Q527-S531 VanDerWaalsContact O-CB 3.3Å; Q527-S531 WeakPolarHBondContact O-CB 3.49Å; Q527-S531 PolarHBondContact O-N 2.81Å; Q527-S531 PolarHBondContact O-OG 3.31Å
528	Q	87.8	Confident	82.7	Confident	142 Å²	142	67.1 Å²	67.1	66%	0.664	35%	0.353	S	S	*	.	H	α-helix	trans	-62.8	-46.7	178.5	-167.9	174.7	5.8	0	0	110.9	P524 E525 V526 M530 S531 D532	P524-Q528 WeakPolarHBondContact O-CB 3.28Å; P524-Q528 PolarHBondContact O-N 3.13Å; E525-Q528 WeakPolarHBondContact O-CB 3.24Å; E525-Q528 PolarHBondContact O-N 3.26Å; V526-Q528 VanDerWaalsContact C-N 3.28Å; V526-Q528 PolarHBondContact O-N 3.32Å; Q528-M530 VanDerWaalsContact C-N 3.34Å; Q528-M530 PolarHBondContact O-N 3.44Å; Q528-S531 WeakPolarHBondContact CA-OG 3.07Å; Q528-S531 PolarHBondContact O-N 3.24Å; Q528-S531 PolarHBondContact O-OG 3.29Å; Q528-D532 PolarHBondContact O-N 3.28Å; Q528-D532 VanDerWaalsContact O-N 3.17Å
529	I	87.1	Confident	82.9	Confident	11 Å²	11	60.1 Å²	60.1	6%	0.056	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-44.6	175.4	-65.3	168.2	0	0	0	111.1	E525 V526 S531 D532 M535 K561 K564 L565	E525-I529 HydrophobicContact CG-CD1 4.35Å; E525-I529 VanDerWaalsContact O-CG1 3.27Å; E525-I529 WeakPolarHBondContact O-CG1 3.39Å; E525-I529 PolarHBondContact O-N 3.09Å; V526-I529 PolarHBondContact O-N 2.86Å; I529-S531 VanDerWaalsContact C-N 3.3Å; I529-S531 PolarHBondContact O-N 3.45Å; I529-D532 WeakPolarHBondContact O-CB 3.04Å; I529-D532 PolarHBondContact O-N 2.87Å; I529-M535 HydrophobicContact CG2-CG 3.8Å; I529-M535 WeakPolarHBondContact O-CB 3.46Å; I529-K561 HydrophobicContact CD1-CB 4.27Å; I529-K561 HydrophobicContact CD1-CG 4.2Å; I529-K561 HydrophobicContact CG1-CB 4.4Å; I529-K561 HydrophobicContact CG1-CD 4.41Å; I529-K561 HydrophobicContact CG1-CG 4.06Å; I529-K561 HydrophobicContact CG2-CB 4.1Å; I529-K561 HydrophobicContact CG2-CG 4.46Å; I529-K564 HydrophobicContact CD1-CB 4.26Å; I529-K564 HydrophobicContact CD1-CG 4.12Å; I529-L565 HydrophobicContact CG2-CD1 3.79Å; I529-L565 HydrophobicContact CG2-CD2 4.16Å; I529-L565 HydrophobicContact CG2-CG 4.05Å
530	M	83	Confident	83.4	Confident	48 Å²	48	61 Å²	61	24%	0.236	33%	0.331	C	S	.	.	H	α-helix	trans	-75	-17	-179.5	-68.1	-63.2	-64.7	0	0	113.7	M521 V526 Q527 Q528 R536 L539 L565	M521-M530 HydrophobicContact CE-CB 4.09Å; M521-M530 HydrophobicContact CE-CE 3.94Å; M521-M530 HydrophobicContact CE-CG 3.79Å; M521-M530 HydrophobicContact SD-CG 4.48Å; V526-M530 HydrophobicContact CG1-CG 4.24Å; V526-M530 WeakPolarHBondContact O-CB 3.37Å; V526-M530 VanDerWaalsContact O-CG 3.27Å; V526-M530 WeakPolarHBondContact O-CG 3.44Å; V526-M530 PolarHBondContact O-N 3.48Å; Q527-M530 PolarHBondContact O-N 2.73Å; Q528-M530 VanDerWaalsContact C-N 3.34Å; Q528-M530 PolarHBondContact O-N 3.44Å; M530-R536 PolarHBondContact O-NE 3.25Å; M530-R536 PolarHBondContact O-NH2 2.99Å; M530-R536 VanDerWaalsContact O-NH2 3.15Å; M530-L539 HydrophobicContact CE-CD1 4.4Å; M530-L539 HydrophobicContact SD-CD1 3.88Å; M530-L565 HydrophobicContact CG-CD2 4.27Å; M530-L565 HydrophobicContact SD-CD1 4.25Å; M530-L565 HydrophobicContact SD-CD2 4.03Å
531	S	86.6	Confident	83.8	Confident	64 Å²	64	65 Å²	65	45%	0.448	35%	0.349	S	S	.	.	H	α-helix	trans	-87.1	-19.2	174.9	72.8	0	0	0	0	113.4	Q527 Q528 I529 P533	Q527-S531 VanDerWaalsContact O-CB 3.3Å; Q527-S531 WeakPolarHBondContact O-CB 3.49Å; Q527-S531 PolarHBondContact O-N 2.81Å; Q527-S531 PolarHBondContact O-OG 3.31Å; Q528-S531 WeakPolarHBondContact CA-OG 3.07Å; Q528-S531 PolarHBondContact O-N 3.24Å; Q528-S531 PolarHBondContact O-OG 3.29Å; I529-S531 VanDerWaalsContact C-N 3.3Å; I529-S531 PolarHBondContact O-N 3.45Å; S531-P533 VanDerWaalsContact O-CD 3.32Å; S531-P533 WeakPolarHBondContact O-CD 3.47Å
532	D	90.8	Very high	83.8	Confident	42 Å²	42	64 Å²	64	23%	0.225	34%	0.344	C	S	.	.			trans	-65.7	115.8	-179.9	-176.6	-15.4	0	0	0	110.7	Q528 I529 A534 M535 R536 K561	Q528-D532 PolarHBondContact O-N 3.28Å; Q528-D532 VanDerWaalsContact O-N 3.17Å; I529-D532 WeakPolarHBondContact O-CB 3.04Å; I529-D532 PolarHBondContact O-N 2.87Å; D532-A534 VanDerWaalsContact C-N 3.27Å; D532-A534 PolarHBondContact O-N 3.09Å; D532-A534 WeakPolarHBondContact OD1-CB 3.33Å; D532-A534 PolarHBondContact OD1-N 3.13Å; D532-M535 HydrophobicContact CB-CB 3.79Å; D532-M535 PolarHBondContact O-N 3.1Å; D532-M535 VanDerWaalsContact O-N 3.16Å; D532-R536 PolarHBondContact O-N 2.52Å; D532-K561 IonicContact OD2-NZ 3.67Å; D532-K561 PolarHBondContact OD2-NZ 3.1Å
533	P	87.4	Confident	84	Confident	94 Å²	94	68.5 Å²	68.5	61%	0.61	35%	0.353	S	S	*	.	H	α-helix	trans	-59.7	-35.3	-179.1	-24	34.3	0	0	0	113.4	S531 R536 L537	S531-P533 VanDerWaalsContact O-CD 3.32Å; S531-P533 WeakPolarHBondContact O-CD 3.47Å; P533-R536 PolarHBondContact O-N 3.39Å; P533-L537 WeakPolarHBondContact O-CG 3.35Å; P533-L537 PolarHBondContact O-N 3.35Å
534	A	86.1	Confident	84.2	Confident	54 Å²	54	75 Å²	75	45%	0.446	38%	0.38	S	S	.	.	H	α-helix	trans	-68.3	-42.1	177.8	0	0	0	0	0	110.5	D532 L537 I538	D532-A534 VanDerWaalsContact C-N 3.27Å; D532-A534 PolarHBondContact O-N 3.09Å; D532-A534 WeakPolarHBondContact OD1-CB 3.33Å; D532-A534 PolarHBondContact OD1-N 3.13Å; A534-L537 PolarHBondContact O-N 3.43Å; A534-I538 WeakPolarHBondContact O-CD1 3.44Å; A534-I538 VanDerWaalsContact O-CG1 3.28Å; A534-I538 WeakPolarHBondContact O-CG1 3.35Å; A534-I538 PolarHBondContact O-N 3.09Å; A534-I538 VanDerWaalsContact O-N 3.1Å
535	M	87.4	Confident	84.4	Confident	2 Å²	2	74.1 Å²	74.1	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-65.1	-39.9	176.8	-162.9	66.6	-131.9	0	0	111.8	I529 D532 L537 I538 L539 I558 K561 I562	I529-M535 HydrophobicContact CG2-CG 3.8Å; I529-M535 WeakPolarHBondContact O-CB 3.46Å; D532-M535 HydrophobicContact CB-CB 3.79Å; D532-M535 PolarHBondContact O-N 3.1Å; D532-M535 VanDerWaalsContact O-N 3.16Å; M535-L537 VanDerWaalsContact C-N 3.35Å; M535-L537 PolarHBondContact O-N 2.88Å; M535-I538 HydrophobicContact CE-CB 4.21Å; M535-I538 HydrophobicContact CE-CG2 3.94Å; M535-I538 PolarHBondContact O-N 2.56Å; M535-L539 HydrophobicContact CE-CD2 3.71Å; M535-L539 HydrophobicContact CE-CG 3.87Å; M535-L539 HydrophobicContact CG-CD1 4.46Å; M535-L539 VanDerWaalsContact O-CG 3.28Å; M535-L539 WeakPolarHBondContact O-CG 3.32Å; M535-L539 PolarHBondContact O-N 3.23Å; M535-I558 HydrophobicContact SD-CG2 4.45Å; M535-K561 HydrophobicContact SD-CB 4.11Å; M535-K561 HydrophobicContact SD-CD 4.2Å; M535-I562 HydrophobicContact CE-CD1 4.02Å; M535-I562 HydrophobicContact CE-CG1 3.44Å; M535-I562 VanDerWaalsContact CE-CG1 3.44Å
536	R	85.8	Confident	83.7	Confident	147 Å²	147	74.2 Å²	74.2	56%	0.555	38%	0.38	S	S	*	.	H	α-helix	trans	-59.1	-43.5	175.1	-74.4	-178.9	-178.5	174.1	2.6	112.8	M530 D532 P533 I538 L539 E540	M530-R536 PolarHBondContact O-NE 3.25Å; M530-R536 PolarHBondContact O-NH2 2.99Å; M530-R536 VanDerWaalsContact O-NH2 3.15Å; D532-R536 PolarHBondContact O-N 2.52Å; P533-R536 PolarHBondContact O-N 3.39Å; R536-I538 VanDerWaalsContact C-N 3.34Å; R536-L539 PolarHBondContact O-N 2.88Å; R536-E540 WeakPolarHBondContact O-CB 3.37Å; R536-E540 PolarHBondContact O-N 2.89Å
537	L	85.1	Confident	83.3	Confident	102 Å²	102	81.8 Å²	81.8	53%	0.534	42%	0.415	S	S	.	.	H	α-helix	trans	-62.9	-41.5	176.7	-72.2	167.6	0	0	0	111.5	P533 A534 M535 E540 Q541	P533-L537 WeakPolarHBondContact O-CG 3.35Å; P533-L537 PolarHBondContact O-N 3.35Å; A534-L537 PolarHBondContact O-N 3.43Å; M535-L537 VanDerWaalsContact C-N 3.35Å; M535-L537 PolarHBondContact O-N 2.88Å; L537-E540 PolarHBondContact O-N 2.79Å; L537-Q541 WeakPolarHBondContact O-CB 3.36Å; L537-Q541 VanDerWaalsContact O-CG 3.3Å; L537-Q541 WeakPolarHBondContact O-CG 3.1Å; L537-Q541 PolarHBondContact O-N 2.85Å
538	I	85.5	Confident	82.6	Confident	14 Å²	14	77.9 Å²	77.9	7%	0.072	40%	0.4	C	S	.	.	H	α-helix	trans	-63.5	-43.9	176.6	-66.6	161.8	0	0	0	110.8	A534 M535 R536 E540 Q541 M542 H552 I558 I562	A534-I538 WeakPolarHBondContact O-CD1 3.44Å; A534-I538 VanDerWaalsContact O-CG1 3.28Å; A534-I538 WeakPolarHBondContact O-CG1 3.35Å; A534-I538 PolarHBondContact O-N 3.09Å; A534-I538 VanDerWaalsContact O-N 3.1Å; M535-I538 HydrophobicContact CE-CB 4.21Å; M535-I538 HydrophobicContact CE-CG2 3.94Å; M535-I538 PolarHBondContact O-N 2.56Å; R536-I538 VanDerWaalsContact C-N 3.34Å; I538-E540 PolarHBondContact O-N 2.91Å; I538-Q541 PolarHBondContact O-N 3.47Å; I538-M542 WeakPolarHBondContact O-CB 3.17Å; I538-M542 PolarHBondContact O-N 3.29Å; I538-H552 HydrophobicContact CG2-CB 4.09Å; I538-I558 HydrophobicContact CD1-CD1 3.79Å; I538-I558 HydrophobicContact CD1-CG1 4.36Å; I538-I558 HydrophobicContact CD1-CG2 4.03Å; I538-I562 HydrophobicContact CG2-CD1 4.41Å
539	L	83.7	Confident	81.8	Confident	22 Å²	22	72 Å²	72	12%	0.115	37%	0.373	C	S	.	.	H	α-helix	trans	-65.9	-35.9	177.4	-66.2	-180	0	0	0	112.7	M530 M535 R536 M542 Q543 L565 I571	M530-L539 HydrophobicContact CE-CD1 4.4Å; M530-L539 HydrophobicContact SD-CD1 3.88Å; M535-L539 HydrophobicContact CE-CD2 3.71Å; M535-L539 HydrophobicContact CE-CG 3.87Å; M535-L539 HydrophobicContact CG-CD1 4.46Å; M535-L539 VanDerWaalsContact O-CG 3.28Å; M535-L539 WeakPolarHBondContact O-CG 3.32Å; M535-L539 PolarHBondContact O-N 3.23Å; R536-L539 PolarHBondContact O-N 2.88Å; L539-M542 HydrophobicContact CD2-CE 3.9Å; L539-Q543 PolarHBondContact O-N 3.38Å; L539-L565 HydrophobicContact CD1-CD1 4.06Å; L539-L565 HydrophobicContact CD2-CD1 4.29Å; L539-I571 HydrophobicContact CD1-CD1 4.33Å; L539-I571 HydrophobicContact CD2-CD1 3.24Å; L539-I571 HydrophobicContact CG-CD1 4.41Å
540	E	84.2	Confident	81.3	Confident	93 Å²	93	75.1 Å²	75.1	44%	0.435	40%	0.396	S	S	.	.	H	α-helix	trans	-69.8	-41.2	174.7	-170	-175.9	170.3	0	0	111.7	R536 L537 I538 M542 Q543 K544	R536-E540 WeakPolarHBondContact O-CB 3.37Å; R536-E540 PolarHBondContact O-N 2.89Å; L537-E540 PolarHBondContact O-N 2.79Å; I538-E540 PolarHBondContact O-N 2.91Å; E540-M542 VanDerWaalsContact C-N 3.33Å; E540-Q543 PolarHBondContact O-N 2.91Å; E540-K544 PolarHBondContact O-N 2.83Å; E540-K544 IonicContact OE1-NZ 2.73Å; E540-K544 PolarHBondContact OE1-NZ 3Å
541	Q	82.2	Confident	81.1	Confident	88 Å²	88	77.5 Å²	77.5	41%	0.411	41%	0.41	S	S	.	.	H	α-helix	trans	-61.7	-42.4	173.5	-76.7	176.7	-3.6	0	0	111.1	L537 I538 Q543 K544 D545 H552	L537-Q541 WeakPolarHBondContact O-CB 3.36Å; L537-Q541 VanDerWaalsContact O-CG 3.3Å; L537-Q541 WeakPolarHBondContact O-CG 3.1Å; L537-Q541 PolarHBondContact O-N 2.85Å; I538-Q541 PolarHBondContact O-N 3.47Å; Q541-Q543 PolarHBondContact O-N 3.43Å; Q541-K544 PolarHBondContact O-N 2.91Å; Q541-D545 PolarHBondContact O-N 3.09Å; Q541-H552 PolarHBondContact OE1-NE2 3.48Å
542	M	79.6	Confident	80.9	Confident	36 Å²	36	76.7 Å²	76.7	18%	0.177	40%	0.399	C	S	.	.	H	α-helix	trans	-59.6	-32.1	177.1	-176.3	-173.7	70.9	0	0	113	I538 L539 E540 L549 I571	I538-M542 WeakPolarHBondContact O-CB 3.17Å; I538-M542 PolarHBondContact O-N 3.29Å; L539-M542 HydrophobicContact CD2-CE 3.9Å; E540-M542 VanDerWaalsContact C-N 3.33Å; M542-L549 HydrophobicContact CG-CD1 4.01Å; M542-L549 HydrophobicContact CG-CD2 4.27Å; M542-L549 HydrophobicContact CG-CG 4.49Å; M542-L549 HydrophobicContact SD-CD1 3.82Å; M542-L549 HydrophobicContact SD-CD2 4.33Å; M542-I571 HydrophobicContact CE-CD1 4.18Å; M542-I571 HydrophobicContact CE-CG1 4.5Å; M542-I571 HydrophobicContact CE-CG2 3.61Å; M542-I571 HydrophobicContact SD-CG2 4.18Å
543	Q	77.8	Confident	80.3	Confident	167 Å²	167	77.8 Å²	77.8	78%	0.78	41%	0.405	S	S	*	.	H	α-helix	trans	-73.3	-26.9	174.7	-74.2	-175.8	-6.5	0	0	113.3	L539 E540 Q541	L539-Q543 PolarHBondContact O-N 3.38Å; E540-Q543 PolarHBondContact O-N 2.91Å; Q541-Q543 PolarHBondContact O-N 3.43Å
544	K	81.4	Confident	80.3	Confident	156 Å²	156	80.6 Å²	80.6	68%	0.678	41%	0.407	S	S	*	.	H	α-helix	trans	-97.2	-31.3	-175.5	-65.1	178.4	-171	170.5	0	112.8	E540 Q541	E540-K544 PolarHBondContact O-N 2.83Å; E540-K544 IonicContact OE1-NZ 2.73Å; E540-K544 PolarHBondContact OE1-NZ 3Å; Q541-K544 PolarHBondContact O-N 2.91Å
545	D	80.8	Confident	80.3	Confident	73 Å²	73	81.4 Å²	81.4	39%	0.39	40%	0.404	S	S	.	.			trans	-144.2	101.3	-176.8	-176.2	2.6	0	0	0	111.7	Q541 Q547 A548	Q541-D545 PolarHBondContact O-N 3.09Å; D545-Q547 PolarHBondContact O-N 3.12Å; D545-Q547 WeakPolarHBondContact OD1-CB 3.02Å; D545-Q547 PolarHBondContact OD1-N 2.74Å; D545-A548 HydrophobicContact CB-CB 4.18Å; D545-A548 PolarHBondContact O-N 3.02Å
546	P	68.3	Low	80.2	Confident	100 Å²	100	85.6 Å²	85.6	65%	0.649	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.1	176.9	-22.9	34	0	0	0	114.7	L549	P546-L549 WeakPolarHBondContact O-CB 3.49Å
547	Q	74.3	Confident	80.1	Confident	160 Å²	160	82.5 Å²	82.5	75%	0.748	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-33	179.4	-70.7	-174.3	-8	0	0	112.2	D545 L549 S550	D545-Q547 PolarHBondContact O-N 3.12Å; D545-Q547 WeakPolarHBondContact OD1-CB 3.02Å; D545-Q547 PolarHBondContact OD1-N 2.74Å; Q547-L549 PolarHBondContact O-N 3.2Å; Q547-L549 VanDerWaalsContact O-N 3.16Å; Q547-S550 WeakPolarHBondContact O-CB 3.24Å; Q547-S550 PolarHBondContact O-N 3.09Å; Q547-S550 VanDerWaalsContact O-N 3.15Å
548	A	70.9	Confident	80.1	Confident	20 Å²	20	79 Å²	79	17%	0.165	41%	0.41	C	S	.	.	H	α-helix	trans	-60.4	-23.4	175	0	0	0	0	0	113	D545 S550 D551 H552	D545-A548 HydrophobicContact CB-CB 4.18Å; D545-A548 PolarHBondContact O-N 3.02Å; A548-S550 VanDerWaalsContact C-N 3.32Å; A548-S550 PolarHBondContact O-N 3.01Å; A548-D551 PolarHBondContact O-N 3.32Å; A548-H552 PolarHBondContact O-CD2 3.41Å; A548-H552 PolarHBondContact O-N 3.2Å
549	L	70	Confident	80	Confident	18 Å²	18	79.7 Å²	79.7	9%	0.094	42%	0.418	C	S	.	.	H	α-helix	trans	-61.1	-39.2	175.8	-178.3	62	0	0	0	112.3	M542 P546 Q547 D551 H552 L553 I562 I573	M542-L549 HydrophobicContact CG-CD1 4.01Å; M542-L549 HydrophobicContact CG-CD2 4.27Å; M542-L549 HydrophobicContact CG-CG 4.49Å; M542-L549 HydrophobicContact SD-CD1 3.82Å; M542-L549 HydrophobicContact SD-CD2 4.33Å; P546-L549 WeakPolarHBondContact O-CB 3.49Å; Q547-L549 PolarHBondContact O-N 3.2Å; Q547-L549 VanDerWaalsContact O-N 3.16Å; L549-D551 VanDerWaalsContact C-N 3.27Å; L549-D551 PolarHBondContact O-N 3.47Å; L549-H552 PolarHBondContact O-N 2.86Å; L549-L553 HydrophobicContact CD1-CD1 4.25Å; L549-L553 HydrophobicContact CD1-CG 4.2Å; L549-L553 HydrophobicContact CD2-CD1 4.47Å; L549-L553 HydrophobicContact CG-CD1 3.89Å; L549-L553 HydrophobicContact CG-CG 4.29Å; L549-L553 WeakPolarHBondContact O-CB 3.41Å; L549-L553 VanDerWaalsContact O-CG 3.27Å; L549-L553 WeakPolarHBondContact O-CG 3.47Å; L549-L553 PolarHBondContact O-N 3Å; L549-I562 HydrophobicContact CD1-CD1 4.05Å; L549-I573 HydrophobicContact CD2-CD1 4.49Å; L549-I573 HydrophobicContact CD2-CG1 4.42Å; L549-I573 HydrophobicContact CD2-CG2 4.22Å
550	S	76.1	Confident	80	Confident	77 Å²	77	85.4 Å²	85.4	54%	0.538	44%	0.444	S	S	.	.	H	α-helix	trans	-63.6	-34.3	-178.8	-170.6	0	0	0	0	112.1	Q547 A548	Q547-S550 WeakPolarHBondContact O-CB 3.24Å; Q547-S550 PolarHBondContact O-N 3.09Å; Q547-S550 VanDerWaalsContact O-N 3.15Å; A548-S550 VanDerWaalsContact C-N 3.32Å; A548-S550 PolarHBondContact O-N 3.01Å
551	D	80.3	Confident	80.1	Confident	99 Å²	99	83.8 Å²	83.8	53%	0.529	44%	0.435	S	S	.	.	H	α-helix	trans	-75	-37.2	178.7	-74.3	-31.3	0	0	0	112.6	A548 L549 K554	A548-D551 PolarHBondContact O-N 3.32Å; L549-D551 VanDerWaalsContact C-N 3.27Å; L549-D551 PolarHBondContact O-N 3.47Å; D551-K554 WeakPolarHBondContact O-CB 3.42Å; D551-K554 PolarHBondContact O-N 3.47Å; D551-K554 IonicContact OD1-NZ 2.72Å; D551-K554 PolarHBondContact OD1-NZ 2.99Å
552	H	80.6	Confident	80.3	Confident	47 Å²	47	79.7 Å²	79.7	22%	0.218	42%	0.416	C	S	.	.	H	α-helix	trans	-71.6	-32.3	175.8	-70.6	-58.5	0	0	0	112.9	I538 Q541 A548 L549 K554 N555 I558	I538-H552 HydrophobicContact CG2-CB 4.09Å; Q541-H552 PolarHBondContact OE1-NE2 3.48Å; A548-H552 PolarHBondContact O-CD2 3.41Å; A548-H552 PolarHBondContact O-N 3.2Å; L549-H552 PolarHBondContact O-N 2.86Å; H552-K554 PolarHBondContact O-N 3.24Å; H552-N555 PolarHBondContact O-N 3.16Å; H552-I558 HydrophobicContact CB-CG2 4.32Å
553	L	80	Confident	80.3	Confident	65 Å²	65	82.7 Å²	82.7	34%	0.34	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-14.5	176	-73.1	173.8	0	0	0	113.8	L549 N555 A559 I562	L549-L553 HydrophobicContact CD1-CD1 4.25Å; L549-L553 HydrophobicContact CD1-CG 4.2Å; L549-L553 HydrophobicContact CD2-CD1 4.47Å; L549-L553 HydrophobicContact CG-CD1 3.89Å; L549-L553 HydrophobicContact CG-CG 4.29Å; L549-L553 WeakPolarHBondContact O-CB 3.41Å; L549-L553 VanDerWaalsContact O-CG 3.27Å; L549-L553 WeakPolarHBondContact O-CG 3.47Å; L549-L553 PolarHBondContact O-N 3Å; L553-N555 PolarHBondContact O-N 3.28Å; L553-A559 HydrophobicContact CD2-CB 4.08Å; L553-I562 HydrophobicContact CD2-CB 4.41Å; L553-I562 HydrophobicContact CD2-CD1 3.93Å; L553-I562 HydrophobicContact CD2-CG2 4.33Å
554	K	85.5	Confident	80.5	Confident	153 Å²	153	76.2 Å²	76.2	67%	0.665	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-21.8	171.4	-68.2	169.9	-176.7	162.9	0	112.4	D551 H552 P556	D551-K554 WeakPolarHBondContact O-CB 3.42Å; D551-K554 PolarHBondContact O-N 3.47Å; D551-K554 IonicContact OD1-NZ 2.72Å; D551-K554 PolarHBondContact OD1-NZ 2.99Å; H552-K554 PolarHBondContact O-N 3.24Å; K554-P556 WeakPolarHBondContact O-CD 3.32Å
555	N	87.3	Confident	80.6	Confident	70 Å²	70	68.8 Å²	68.8	37%	0.374	37%	0.367	S	S	.	.	S	Bend	trans	-85.8	115.7	173.6	-175.6	-34.1	0	0	0	109.8	H552 L553 V557 I558 A559	H552-N555 PolarHBondContact O-N 3.16Å; L553-N555 PolarHBondContact O-N 3.28Å; N555-V557 VanDerWaalsContact C-N 3.25Å; N555-V557 PolarHBondContact O-N 2.82Å; N555-V557 WeakPolarHBondContact OD1-CB 3.45Å; N555-V557 PolarHBondContact OD1-N 2.85Å; N555-I558 HydrophobicContact CB-CB 4.1Å; N555-I558 HydrophobicContact CB-CD1 3.85Å; N555-I558 HydrophobicContact CB-CG1 4.04Å; N555-I558 PolarHBondContact O-N 3.07Å; N555-I558 VanDerWaalsContact O-N 3.14Å; N555-A559 WeakPolarHBondContact O-CB 3.38Å; N555-A559 PolarHBondContact O-N 2.9Å
556	P	84.4	Confident	80.6	Confident	91 Å²	91	67.5 Å²	67.5	59%	0.591	36%	0.36	S	S	*	.	H	α-helix	trans	-62.6	-30.1	-174.6	23.4	-32.9	0	0	0	113.4	K554 Q560	K554-P556 WeakPolarHBondContact O-CD 3.32Å; P556-Q560 WeakPolarHBondContact O-CG 3.35Å; P556-Q560 PolarHBondContact O-N 3.41Å
557	V	84.5	Confident	80.8	Confident	82 Å²	82	66.1 Å²	66.1	50%	0.497	35%	0.346	S	S	.	.	H	α-helix	trans	-71.7	-41	178.2	-178.5	0	0	0	0	110.7	N555 K561	N555-V557 VanDerWaalsContact C-N 3.25Å; N555-V557 PolarHBondContact O-N 2.82Å; N555-V557 WeakPolarHBondContact OD1-CB 3.45Å; N555-V557 PolarHBondContact OD1-N 2.85Å; V557-K561 WeakPolarHBondContact O-CG 3.32Å; V557-K561 PolarHBondContact O-N 3.21Å
558	I	85.4	Confident	80.8	Confident	29 Å²	29	59.4 Å²	59.4	15%	0.149	32%	0.317	C	S	.	.	H	α-helix	trans	-70.3	-40.7	177.4	-62.4	174.2	0	0	0	109.8	M535 I538 H552 N555 Q560 K561 I562	M535-I558 HydrophobicContact SD-CG2 4.45Å; I538-I558 HydrophobicContact CD1-CD1 3.79Å; I538-I558 HydrophobicContact CD1-CG1 4.36Å; I538-I558 HydrophobicContact CD1-CG2 4.03Å; H552-I558 HydrophobicContact CB-CG2 4.32Å; N555-I558 HydrophobicContact CB-CB 4.1Å; N555-I558 HydrophobicContact CB-CD1 3.85Å; N555-I558 HydrophobicContact CB-CG1 4.04Å; N555-I558 PolarHBondContact O-N 3.07Å; N555-I558 VanDerWaalsContact O-N 3.14Å; I558-Q560 PolarHBondContact O-N 2.69Å; I558-K561 PolarHBondContact O-N 2.88Å; I558-I562 HydrophobicContact CG2-CD1 3.78Å; I558-I562 HydrophobicContact CG2-CG1 4.32Å; I558-I562 WeakPolarHBondContact O-CG1 3.43Å; I558-I562 PolarHBondContact O-N 3.42Å
559	A	83.6	Confident	80.8	Confident	27 Å²	27	60.6 Å²	60.6	22%	0.223	33%	0.33	C	S	.	.	H	α-helix	trans	-59.1	-44.2	175.6	0	0	0	0	0	112.3	L553 N555 I562 Q563	L553-A559 HydrophobicContact CD2-CB 4.08Å; N555-A559 WeakPolarHBondContact O-CB 3.38Å; N555-A559 PolarHBondContact O-N 2.9Å; A559-I562 PolarHBondContact O-N 3.25Å; A559-Q563 WeakPolarHBondContact O-CB 3.37Å; A559-Q563 PolarHBondContact O-N 3.13Å
560	Q	83.8	Confident	81.2	Confident	143 Å²	143	62 Å²	62	67%	0.668	34%	0.338	S	S	*	.	H	α-helix	trans	-62	-43.4	174.8	-78.3	178.7	-9.4	0	0	112.5	P556 I558 Q563 K564	P556-Q560 WeakPolarHBondContact O-CG 3.35Å; P556-Q560 PolarHBondContact O-N 3.41Å; I558-Q560 PolarHBondContact O-N 2.69Å; Q560-Q563 PolarHBondContact O-N 3.25Å; Q560-K564 WeakPolarHBondContact O-CB 3.47Å; Q560-K564 PolarHBondContact O-N 3.07Å
561	K	86	Confident	81.2	Confident	58 Å²	58	59.4 Å²	59.4	25%	0.252	32%	0.318	S	S	.	.	H	α-helix	trans	-62	-43.2	176.3	-71.6	179.4	176.4	-179.5	0	111.7	I529 D532 M535 V557 I558 K564 L565	I529-K561 HydrophobicContact CD1-CB 4.27Å; I529-K561 HydrophobicContact CD1-CG 4.2Å; I529-K561 HydrophobicContact CG1-CB 4.4Å; I529-K561 HydrophobicContact CG1-CD 4.41Å; I529-K561 HydrophobicContact CG1-CG 4.06Å; I529-K561 HydrophobicContact CG2-CB 4.1Å; I529-K561 HydrophobicContact CG2-CG 4.46Å; D532-K561 IonicContact OD2-NZ 3.67Å; D532-K561 PolarHBondContact OD2-NZ 3.1Å; M535-K561 HydrophobicContact SD-CB 4.11Å; M535-K561 HydrophobicContact SD-CD 4.2Å; V557-K561 WeakPolarHBondContact O-CG 3.32Å; V557-K561 PolarHBondContact O-N 3.21Å; I558-K561 PolarHBondContact O-N 2.88Å; K561-K564 PolarHBondContact O-N 2.74Å; K561-L565 WeakPolarHBondContact O-CG 3.4Å; K561-L565 PolarHBondContact O-N 2.98Å
562	I	85.1	Confident	80.6	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-65.5	-44.4	176.9	-68.9	172.5	0	0	0	110.5	M535 I538 L549 L553 I558 A559 K564 L565 I566	M535-I562 HydrophobicContact CE-CD1 4.02Å; M535-I562 HydrophobicContact CE-CG1 3.44Å; M535-I562 VanDerWaalsContact CE-CG1 3.44Å; I538-I562 HydrophobicContact CG2-CD1 4.41Å; L549-I562 HydrophobicContact CD1-CD1 4.05Å; L553-I562 HydrophobicContact CD2-CB 4.41Å; L553-I562 HydrophobicContact CD2-CD1 3.93Å; L553-I562 HydrophobicContact CD2-CG2 4.33Å; I558-I562 HydrophobicContact CG2-CD1 3.78Å; I558-I562 HydrophobicContact CG2-CG1 4.32Å; I558-I562 WeakPolarHBondContact O-CG1 3.43Å; I558-I562 PolarHBondContact O-N 3.42Å; A559-I562 PolarHBondContact O-N 3.25Å; I562-K564 VanDerWaalsContact C-N 3.33Å; I562-K564 PolarHBondContact O-N 3.49Å; I562-L565 PolarHBondContact O-N 3.02Å; I562-L565 VanDerWaalsContact O-N 3.11Å; I562-I566 HydrophobicContact CG2-CD1 3.84Å; I562-I566 HydrophobicContact CG2-CG1 4.49Å; I562-I566 WeakPolarHBondContact O-CG1 2.75Å; I562-I566 PolarHBondContact O-N 3.12Å
563	Q	81	Confident	79.9	Confident	99 Å²	99	60.9 Å²	60.9	46%	0.463	34%	0.337	S	S	.	.	H	α-helix	trans	-58.5	-45.4	176.9	-172.1	60.7	47	0	0	111.3	A559 Q560 L565 I566 D567	A559-Q563 WeakPolarHBondContact O-CB 3.37Å; A559-Q563 PolarHBondContact O-N 3.13Å; Q560-Q563 PolarHBondContact O-N 3.25Å; Q563-L565 VanDerWaalsContact C-N 3.29Å; Q563-L565 PolarHBondContact O-N 3.03Å; Q563-I566 WeakPolarHBondContact O-CA 3.16Å; Q563-I566 WeakPolarHBondContact O-CB 3.27Å; Q563-I566 PolarHBondContact O-N 3.19Å; Q563-D567 PolarHBondContact NE2-OD1 2.9Å; Q563-D567 PolarHBondContact O-N 3.5Å
564	K	81.9	Confident	78.7	Confident	32 Å²	32	72.2 Å²	72.2	14%	0.139	38%	0.375	C	S	.	.	H	α-helix	trans	-57.7	-40.5	175.5	-175	70.1	-179.4	-153.1	0	112.3	D523 E525 V526 I529 Q560 K561 I562 I566 D567 V568	D523-K564 IonicContact OD2-NZ 3.74Å; E525-K564 WeakPolarHBondContact OE2-CE 3.48Å; E525-K564 IonicContact OE2-NZ 3.62Å; E525-K564 PolarHBondContact OE2-NZ 3.27Å; V526-K564 HydrophobicContact CG2-CG 4.48Å; I529-K564 HydrophobicContact CD1-CB 4.26Å; I529-K564 HydrophobicContact CD1-CG 4.12Å; Q560-K564 WeakPolarHBondContact O-CB 3.47Å; Q560-K564 PolarHBondContact O-N 3.07Å; K561-K564 PolarHBondContact O-N 2.74Å; I562-K564 VanDerWaalsContact C-N 3.33Å; I562-K564 PolarHBondContact O-N 3.49Å; K564-I566 VanDerWaalsContact C-N 3.33Å; K564-D567 PolarHBondContact O-N 3.17Å; K564-V568 WeakPolarHBondContact O-CG2 3.46Å; K564-V568 PolarHBondContact O-N 2.88Å
565	L	83	Confident	78.3	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-69	-29.6	177	-66.9	175.9	0	0	0	112.9	V526 I529 M530 L539 K561 I562 Q563 V568 G569 L570 I571	V526-L565 HydrophobicContact CG1-CD2 3.93Å; I529-L565 HydrophobicContact CG2-CD1 3.79Å; I529-L565 HydrophobicContact CG2-CD2 4.16Å; I529-L565 HydrophobicContact CG2-CG 4.05Å; M530-L565 HydrophobicContact CG-CD2 4.27Å; M530-L565 HydrophobicContact SD-CD1 4.25Å; M530-L565 HydrophobicContact SD-CD2 4.03Å; L539-L565 HydrophobicContact CD1-CD1 4.06Å; L539-L565 HydrophobicContact CD2-CD1 4.29Å; K561-L565 WeakPolarHBondContact O-CG 3.4Å; K561-L565 PolarHBondContact O-N 2.98Å; I562-L565 PolarHBondContact O-N 3.02Å; I562-L565 VanDerWaalsContact O-N 3.11Å; Q563-L565 VanDerWaalsContact C-N 3.29Å; Q563-L565 PolarHBondContact O-N 3.03Å; L565-V568 WeakPolarHBondContact O-CG2 3.49Å; L565-G569 PolarHBondContact O-N 3.14Å; L565-L570 HydrophobicContact CD2-CD1 3.76Å; L565-L570 PolarHBondContact O-N 3.48Å; L565-I571 HydrophobicContact CB-CD1 3.62Å; L565-I571 HydrophobicContact CB-CG1 4.1Å; L565-I571 HydrophobicContact CD1-CD1 3.5Å; L565-I571 HydrophobicContact CG-CD1 4.19Å; L565-I571 PolarHBondContact O-N 3.06Å
566	I	80.9	Confident	77.8	Confident	46 Å²	46	68.1 Å²	68.1	24%	0.236	36%	0.36	C	S	.	.	H	α-helix	trans	-72.9	-44.4	173	-66.1	163.7	0	0	0	110.4	I562 Q563 K564 V568 G569 I571 I573	I562-I566 HydrophobicContact CG2-CD1 3.84Å; I562-I566 HydrophobicContact CG2-CG1 4.49Å; I562-I566 WeakPolarHBondContact O-CG1 2.75Å; I562-I566 PolarHBondContact O-N 3.12Å; Q563-I566 WeakPolarHBondContact O-CA 3.16Å; Q563-I566 WeakPolarHBondContact O-CB 3.27Å; Q563-I566 PolarHBondContact O-N 3.19Å; K564-I566 VanDerWaalsContact C-N 3.33Å; I566-V568 VanDerWaalsContact C-N 3.26Å; I566-V568 PolarHBondContact O-N 2.83Å; I566-G569 WeakPolarHBondContact O-CA 3.38Å; I566-G569 PolarHBondContact O-N 3Å; I566-I571 HydrophobicContact CG1-CB 4.33Å; I566-I571 HydrophobicContact CG1-CG2 4.46Å; I566-I573 HydrophobicContact CD1-CD1 3.47Å; I566-I573 VanDerWaalsContact CD1-CD1 3.47Å; I566-I573 HydrophobicContact CD1-CG1 3.71Å
567	D	72.6	Confident	77.5	Confident	70 Å²	70	66.8 Å²	66.8	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-34.6	-178.9	-62.7	-20.3	0	0	0	112	Q506 Q563 K564 G569	Q506-D567 PolarHBondContact NE2-O 3.27Å; Q563-D567 PolarHBondContact NE2-OD1 2.9Å; Q563-D567 PolarHBondContact O-N 3.5Å; K564-D567 PolarHBondContact O-N 3.17Å; D567-G569 VanDerWaalsContact C-N 3.31Å
568	V	74.1	Confident	77.1	Confident	20 Å²	20	65.9 Å²	65.9	12%	0.121	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-1.8	173.8	-56.3	0	0	0	0	113.7	V516 A520 V526 K564 L565 I566 L570	V516-V568 WeakPolarHBondContact CG1-O 3.3Å; A520-V568 HydrophobicContact CB-CB 4.02Å; A520-V568 HydrophobicContact CB-CG2 3.76Å; V526-V568 HydrophobicContact CG2-CG1 4.13Å; V526-V568 HydrophobicContact CG2-CG2 4.28Å; K564-V568 WeakPolarHBondContact O-CG2 3.46Å; K564-V568 PolarHBondContact O-N 2.88Å; L565-V568 WeakPolarHBondContact O-CG2 3.49Å; I566-V568 VanDerWaalsContact C-N 3.26Å; I566-V568 PolarHBondContact O-N 2.83Å; V568-L570 HydrophobicContact CG2-CB 4.17Å; V568-L570 HydrophobicContact CG2-CD1 3.96Å; V568-L570 HydrophobicContact CG2-CG 4.1Å; V568-L570 PolarHBondContact O-N 3.48Å
569	G	71.3	Confident	76.6	Confident	44 Å²	44	68.2 Å²	68.2	45%	0.454	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	9.9	175.6	0	0	0	0	0	115.7	V516 L565 I566 D567 I571	V516-G569 VanDerWaalsContact CG1-C 3.48Å; V516-G569 VanDerWaalsContact CG1-O 3.29Å; V516-G569 WeakPolarHBondContact CG1-O 3.45Å; L565-G569 PolarHBondContact O-N 3.14Å; I566-G569 WeakPolarHBondContact O-CA 3.38Å; I566-G569 PolarHBondContact O-N 3Å; D567-G569 VanDerWaalsContact C-N 3.31Å; G569-I571 VanDerWaalsContact C-N 3.29Å; G569-I571 PolarHBondContact O-N 2.66Å
570	L	78	Confident	76.1	Confident	47 Å²	47	70.9 Å²	70.9	25%	0.246	36%	0.359	C	S	.	.	S	Bend	trans	-70.2	-28	178.8	-90.1	169.9	0	0	0	112.6	K517 A520 V526 L565 V568	K517-L570 HydrophobicContact CB-CD2 4.35Å; K517-L570 HydrophobicContact CG-CD2 4.28Å; A520-L570 HydrophobicContact CB-CD1 3.35Å; A520-L570 HydrophobicContact CB-CD2 4.16Å; A520-L570 HydrophobicContact CB-CG 3.47Å; A520-L570 VanDerWaalsContact CB-CG 3.47Å; V526-L570 HydrophobicContact CG1-CD1 3.53Å; L565-L570 HydrophobicContact CD2-CD1 3.76Å; L565-L570 PolarHBondContact O-N 3.48Å; V568-L570 HydrophobicContact CG2-CB 4.17Å; V568-L570 HydrophobicContact CG2-CD1 3.96Å; V568-L570 HydrophobicContact CG2-CG 4.1Å; V568-L570 PolarHBondContact O-N 3.48Å
571	I	76.8	Confident	75.5	Confident	24 Å²	24	65.8 Å²	65.8	12%	0.123	34%	0.337	C	S	.	.			trans	-131.3	140	-177.4	-59.1	173.7	0	0	0	108.6	L539 M542 L565 I566 G569	L539-I571 HydrophobicContact CD1-CD1 4.33Å; L539-I571 HydrophobicContact CD2-CD1 3.24Å; L539-I571 HydrophobicContact CG-CD1 4.41Å; M542-I571 HydrophobicContact CE-CD1 4.18Å; M542-I571 HydrophobicContact CE-CG1 4.5Å; M542-I571 HydrophobicContact CE-CG2 3.61Å; M542-I571 HydrophobicContact SD-CG2 4.18Å; L565-I571 HydrophobicContact CB-CD1 3.62Å; L565-I571 HydrophobicContact CB-CG1 4.1Å; L565-I571 HydrophobicContact CD1-CD1 3.5Å; L565-I571 HydrophobicContact CG-CD1 4.19Å; L565-I571 PolarHBondContact O-N 3.06Å; I566-I571 HydrophobicContact CG1-CB 4.33Å; I566-I571 HydrophobicContact CG1-CG2 4.46Å; G569-I571 VanDerWaalsContact C-N 3.29Å; G569-I571 PolarHBondContact O-N 2.66Å
572	A	67.8	Low	74.7	Confident	79 Å²	79	66.4 Å²	66.4	65%	0.653	34%	0.343	S	S	*	.			trans	-118.3	128.9	165.8	0	0	0	0	0	108.4
573	I	65.1	Low	73.9	Confident	97 Å²	97	71.8 Å²	71.8	50%	0.497	37%	0.371	S	S	.	.			trans	-79.5	117.9	166.9	-56.4	176.7	0	0	0	105.9	L549 I566	L549-I573 HydrophobicContact CD2-CD1 4.49Å; L549-I573 HydrophobicContact CD2-CG1 4.42Å; L549-I573 HydrophobicContact CD2-CG2 4.22Å; I566-I573 HydrophobicContact CD1-CD1 3.47Å; I566-I573 VanDerWaalsContact CD1-CD1 3.47Å; I566-I573 HydrophobicContact CD1-CG1 3.71Å
574	R	54	Low	73.2	Confident	303 Å²	303	69.3 Å²	69.3	100%	1.143	36%	0.362	S	S	*	.			trans	-106.4	0	173.9	-81.7	-170	-179	-178.2	1.4	110.8

Retrieved 574 of 574 residues in 216.2 ms (Link to these results)

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