A0A060WTK7_ONCMY Loading...

DnaJ homolog subfamily C member 3

AlphaFold DB , UniProt , Accession A0A060WTK7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 500 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	42.7	Very low	57.2	Low	250 Å²	250	126 Å²	126	100%	1.232	69%	0.693	S	S	*	*				0	102.4	0	-78.5	173.4	168.8	0	0	107.9
2	V	47.1	Very low	57.6	Low	139 Å²	139	124.8 Å²	124.8	84%	0.842	68%	0.684	S	S	*	*			trans	-97.6	111	172.2	179.4	0	0	0	0	106.4	I4	V2-I4 PolarHBondContact O-N 3.03Å
3	A	53.6	Low	58.4	Low	99 Å²	99	119.8 Å²	119.8	82%	0.818	66%	0.664	S	S	*	*			trans	-70.6	111.2	179.1	0	0	0	0	0	109.2	N5	A3-N5 PolarHBondContact O-N 3.14Å
4	I	55.7	Low	59.1	Low	134 Å²	134	122.4 Å²	122.4	69%	0.687	66%	0.66	S	S	*	*			trans	-74	124.1	173.8	-61.3	170.6	0	0	0	107.7	V2 V8	V2-I4 PolarHBondContact O-N 3.03Å; I4-V8 HydrophobicContact CG2-CB 4.3Å; I4-V8 HydrophobicContact CG2-CG1 4.41Å
5	N	61	Low	60	Low	108 Å²	108	118.9 Å²	118.9	58%	0.578	64%	0.644	S	S	*	*			trans	-59.3	128.5	-173.6	-150.5	-15.5	0	0	0	110.7	A3 V7 V8	A3-N5 PolarHBondContact O-N 3.14Å; N5-V7 PolarHBondContact O-N 3.05Å; N5-V8 HydrophobicContact CB-CG2 4.35Å; N5-V8 WeakPolarHBondContact O-CB 3.27Å; N5-V8 PolarHBondContact O-N 2.95Å
6	P	58.5	Low	60.5	Low	100 Å²	100	115.9 Å²	115.9	65%	0.649	63%	0.633	S	S	*	*	H	α-helix	trans	-59.8	-16.5	-171.4	19.2	-33	0	0	0	115.2	K10	P6-K10 PolarHBondContact O-N 3.2Å
7	V	61.6	Low	61	Low	93 Å²	93	117.8 Å²	117.8	56%	0.564	63%	0.634	S	S	*	*	H	α-helix	trans	-70.5	-37.1	174.2	-177.3	0	0	0	0	111.7	N5 H9 K10 I11	N5-V7 PolarHBondContact O-N 3.05Å; V7-H9 VanDerWaalsContact C-N 3.33Å; V7-H9 PolarHBondContact O-N 3.2Å; V7-K10 PolarHBondContact O-N 3.28Å; V7-I11 HydrophobicContact CG1-CD1 4.22Å; V7-I11 WeakPolarHBondContact O-CG1 3.47Å; V7-I11 PolarHBondContact O-N 2.98Å
8	V	60.8	Low	61.2	Low	67 Å²	67	117.2 Å²	117.2	41%	0.406	63%	0.63	S	S	.	*	H	α-helix	trans	-68.8	-35.4	-179.3	-179.9	0	0	0	0	110.7	I4 N5 K10 I11 L12	I4-V8 HydrophobicContact CG2-CB 4.3Å; I4-V8 HydrophobicContact CG2-CG1 4.41Å; N5-V8 HydrophobicContact CB-CG2 4.35Å; N5-V8 WeakPolarHBondContact O-CB 3.27Å; N5-V8 PolarHBondContact O-N 2.95Å; V8-K10 PolarHBondContact O-N 2.88Å; V8-I11 PolarHBondContact O-N 2.91Å; V8-L12 HydrophobicContact CG1-CD1 3.67Å; V8-L12 WeakPolarHBondContact O-CD1 3.39Å; V8-L12 PolarHBondContact O-N 3.31Å
9	H	61.6	Low	61.4	Low	144 Å²	144	116.3 Å²	116.3	67%	0.667	62%	0.624	S	S	*	*	H	α-helix	trans	-69	-32.6	177.8	-153.4	-50.4	0	0	0	112.9	V7 S13	V7-H9 VanDerWaalsContact C-N 3.33Å; V7-H9 PolarHBondContact O-N 3.2Å; H9-S13 PolarHBondContact O-N 3.29Å
10	K	62.2	Low	61.6	Low	144 Å²	144	114.4 Å²	114.4	63%	0.626	62%	0.616	S	S	*	*	H	α-helix	trans	-68.9	-44.8	173	-81.4	-173.6	176.2	-177.6	0	111.2	P6 V7 V8 L12 S13 Y14	P6-K10 PolarHBondContact O-N 3.2Å; V7-K10 PolarHBondContact O-N 3.28Å; V8-K10 PolarHBondContact O-N 2.88Å; K10-L12 PolarHBondContact O-N 3.49Å; K10-S13 PolarHBondContact O-N 3.43Å; K10-S13 VanDerWaalsContact O-N 3.17Å; K10-S13 PolarHBondContact O-OG 3.08Å; K10-Y14 WeakPolarHBondContact O-CD2 3.47Å; K10-Y14 WeakPolarHBondContact O-CE2 3.31Å
11	I	64	Low	61.5	Low	108 Å²	108	113.7 Å²	113.7	55%	0.554	61%	0.612	S	S	*	*	H	α-helix	trans	-62.5	-44.4	179.2	-63.9	169.4	0	0	0	111	V7 V8 S13 Y14 V15	V7-I11 HydrophobicContact CG1-CD1 4.22Å; V7-I11 WeakPolarHBondContact O-CG1 3.47Å; V7-I11 PolarHBondContact O-N 2.98Å; V8-I11 PolarHBondContact O-N 2.91Å; I11-S13 VanDerWaalsContact C-N 3.25Å; I11-S13 PolarHBondContact O-N 3.26Å; I11-Y14 PolarHBondContact O-N 3.11Å; I11-Y14 VanDerWaalsContact O-N 3.17Å; I11-V15 PolarHBondContact O-N 3.18Å
12	L	61.8	Low	62.4	Low	112 Å²	112	105.8 Å²	105.8	59%	0.586	57%	0.574	S	S	*	*	H	α-helix	trans	-63.1	-27.8	176.4	-96.4	107.5	0	0	0	113.7	V8 K10 Y14 V15 P16	V8-L12 HydrophobicContact CG1-CD1 3.67Å; V8-L12 WeakPolarHBondContact O-CD1 3.39Å; V8-L12 PolarHBondContact O-N 3.31Å; K10-L12 PolarHBondContact O-N 3.49Å; L12-Y14 VanDerWaalsContact C-N 3.28Å; L12-Y14 PolarHBondContact O-N 2.87Å; L12-V15 PolarHBondContact O-N 3.4Å; L12-P16 VanDerWaalsContact O-CD 3.29Å; L12-P16 WeakPolarHBondContact O-CD 3.42Å
13	S	68.4	Low	62.8	Low	60 Å²	60	104.3 Å²	104.3	42%	0.42	56%	0.561	S	S	.	*	H	α-helix	trans	-70.8	-22.1	177.4	77.9	0	0	0	0	113.8	H9 K10 I11 P16	H9-S13 PolarHBondContact O-N 3.29Å; K10-S13 PolarHBondContact O-N 3.43Å; K10-S13 VanDerWaalsContact O-N 3.17Å; K10-S13 PolarHBondContact O-OG 3.08Å; I11-S13 VanDerWaalsContact C-N 3.25Å; I11-S13 PolarHBondContact O-N 3.26Å; S13-P16 WeakPolarHBondContact O-CD 3.42Å; S13-P16 WeakPolarHBondContact O-CG 3.35Å
14	Y	68.5	Low	62.6	Low	155 Å²	155	104.3 Å²	104.3	61%	0.608	55%	0.547	S	S	*	.	H	α-helix	trans	-92.5	-15.5	177.8	-63.5	-69.5	0	0	0	113.3	K10 I11 L12 F17 L18	K10-Y14 WeakPolarHBondContact O-CD2 3.47Å; K10-Y14 WeakPolarHBondContact O-CE2 3.31Å; I11-Y14 PolarHBondContact O-N 3.11Å; I11-Y14 VanDerWaalsContact O-N 3.17Å; L12-Y14 VanDerWaalsContact C-N 3.28Å; L12-Y14 PolarHBondContact O-N 2.87Å; Y14-F17 PolarHBondContact O-N 3.1Å; Y14-F17 VanDerWaalsContact O-N 3.15Å; Y14-L18 PolarHBondContact O-N 2.94Å
15	V	72.1	Confident	62.3	Low	71 Å²	71	108 Å²	108	43%	0.43	55%	0.553	S	S	.	*	H	α-helix	trans	-55.5	-45.4	175.1	177	0	0	0	0	113	I11 L12 F17 L18 L19	I11-V15 PolarHBondContact O-N 3.18Å; L12-V15 PolarHBondContact O-N 3.4Å; V15-F17 VanDerWaalsContact C-N 3.32Å; V15-F17 PolarHBondContact O-N 3.45Å; V15-L18 PolarHBondContact O-N 3.05Å; V15-L19 HydrophobicContact CG1-CD1 4.05Å; V15-L19 HydrophobicContact CG1-CG 4.46Å; V15-L19 WeakPolarHBondContact O-CG 3.39Å; V15-L19 PolarHBondContact O-N 2.8Å
16	P	68.3	Low	61.8	Low	71 Å²	71	112.3 Å²	112.3	46%	0.461	56%	0.562	S	S	.	*	H	α-helix	trans	-65.7	-33.5	176.2	22.4	-31.6	0	0	0	112.8	L12 S13 L19 V20	L12-P16 VanDerWaalsContact O-CD 3.29Å; L12-P16 WeakPolarHBondContact O-CD 3.42Å; S13-P16 WeakPolarHBondContact O-CD 3.42Å; S13-P16 WeakPolarHBondContact O-CG 3.35Å; P16-L19 PolarHBondContact O-N 3.13Å; P16-V20 VanDerWaalsContact O-CG2 3.27Å; P16-V20 WeakPolarHBondContact O-CG2 3.31Å; P16-V20 PolarHBondContact O-N 3.03Å
17	F	69.2	Low	61.1	Low	147 Å²	147	115.2 Å²	115.2	65%	0.645	57%	0.567	S	S	*	*	H	α-helix	trans	-69.1	-36	173	-93	-87.4	0	0	0	112.4	Y14 V15 V20 L21	Y14-F17 PolarHBondContact O-N 3.1Å; Y14-F17 VanDerWaalsContact O-N 3.15Å; V15-F17 VanDerWaalsContact C-N 3.32Å; V15-F17 PolarHBondContact O-N 3.45Å; F17-V20 PolarHBondContact O-N 3.16Å; F17-L21 WeakPolarHBondContact O-CB 3.43Å; F17-L21 VanDerWaalsContact O-CG 3.25Å; F17-L21 WeakPolarHBondContact O-CG 3.11Å; F17-L21 PolarHBondContact O-N 2.85Å
18	L	64.9	Low	60.2	Low	108 Å²	108	113.7 Å²	113.7	57%	0.565	57%	0.57	S	S	*	*	H	α-helix	trans	-66.9	-38.7	174.7	-151	100.9	0	0	0	111.2	Y14 V15 L21 I22	Y14-L18 PolarHBondContact O-N 2.94Å; V15-L18 PolarHBondContact O-N 3.05Å; L18-L21 PolarHBondContact O-N 2.88Å; L18-I22 HydrophobicContact CD2-CD1 4.15Å; L18-I22 WeakPolarHBondContact O-CB 3.44Å; L18-I22 WeakPolarHBondContact O-CD1 3.37Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 3.42Å
19	L	64.5	Low	59.2	Low	99 Å²	99	116.5 Å²	116.5	52%	0.518	59%	0.587	S	S	.	*	H	α-helix	trans	-66.8	-41.4	174.6	-71.5	168.7	0	0	0	111.8	V15 P16 L21 I22 D23	V15-L19 HydrophobicContact CG1-CD1 4.05Å; V15-L19 HydrophobicContact CG1-CG 4.46Å; V15-L19 WeakPolarHBondContact O-CG 3.39Å; V15-L19 PolarHBondContact O-N 2.8Å; P16-L19 PolarHBondContact O-N 3.13Å; L19-L21 VanDerWaalsContact C-N 3.32Å; L19-L21 PolarHBondContact O-N 3.2Å; L19-I22 PolarHBondContact O-N 2.85Å; L19-I22 VanDerWaalsContact O-N 3.16Å; L19-D23 PolarHBondContact O-N 2.76Å
20	V	65.9	Low	58.3	Low	78 Å²	78	115.1 Å²	115.1	47%	0.473	59%	0.592	S	S	.	*	H	α-helix	trans	-64.5	-35.7	173.3	170.4	0	0	0	0	111.9	P16 F17 I22 D23 L24	P16-V20 VanDerWaalsContact O-CG2 3.27Å; P16-V20 WeakPolarHBondContact O-CG2 3.31Å; P16-V20 PolarHBondContact O-N 3.03Å; F17-V20 PolarHBondContact O-N 3.16Å; V20-I22 VanDerWaalsContact C-N 3.35Å; V20-D23 PolarHBondContact O-N 2.74Å; V20-L24 HydrophobicContact CG1-CD1 3.96Å; V20-L24 WeakPolarHBondContact O-CB 3.43Å; V20-L24 WeakPolarHBondContact O-CG 3.46Å; V20-L24 PolarHBondContact O-N 2.66Å
21	L	60	Low	57.4	Low	100 Å²	100	110.4 Å²	110.4	52%	0.524	58%	0.584	S	S	.	*	H	α-helix	trans	-73	-26.6	174.2	-73	169.7	0	0	0	113	F17 L18 L19 R25	F17-L21 WeakPolarHBondContact O-CB 3.43Å; F17-L21 VanDerWaalsContact O-CG 3.25Å; F17-L21 WeakPolarHBondContact O-CG 3.11Å; F17-L21 PolarHBondContact O-N 2.85Å; L18-L21 PolarHBondContact O-N 2.88Å; L19-L21 VanDerWaalsContact C-N 3.32Å; L19-L21 PolarHBondContact O-N 3.2Å; L21-R25 WeakPolarHBondContact O-CB 3.17Å; L21-R25 WeakPolarHBondContact O-CG 3.36Å; L21-R25 PolarHBondContact O-N 3.49Å; L21-R25 VanDerWaalsContact O-N 3.16Å
22	I	60.5	Low	56.8	Low	84 Å²	84	113.7 Å²	113.7	43%	0.431	60%	0.595	S	S	.	*	H	α-helix	trans	-74.6	-40.8	171.4	-70.6	162.6	0	0	0	110.2	L18 L19 V20 R25 Y26	L18-I22 HydrophobicContact CD2-CD1 4.15Å; L18-I22 WeakPolarHBondContact O-CB 3.44Å; L18-I22 WeakPolarHBondContact O-CD1 3.37Å; L18-I22 WeakPolarHBondContact O-CG1 3.47Å; L18-I22 PolarHBondContact O-N 3.42Å; L19-I22 PolarHBondContact O-N 2.85Å; L19-I22 VanDerWaalsContact O-N 3.16Å; V20-I22 VanDerWaalsContact C-N 3.35Å; I22-R25 PolarHBondContact O-N 3.25Å; I22-Y26 PolarHBondContact O-N 3.19Å
23	D	54.9	Low	56.3	Low	108 Å²	108	114.8 Å²	114.8	58%	0.578	60%	0.601	S	S	*	*	H	α-helix	trans	-63.8	-43.8	173	-87	-21.7	0	0	0	111.8	L19 V20 R25 Y26 E27	L19-D23 PolarHBondContact O-N 2.76Å; V20-D23 PolarHBondContact O-N 2.74Å; D23-R25 VanDerWaalsContact C-N 3.26Å; D23-R25 PolarHBondContact O-N 2.85Å; D23-Y26 PolarHBondContact O-N 3.02Å; D23-E27 PolarHBondContact O-N 3.48Å
24	L	50.9	Low	55.7	Low	100 Å²	100	114.4 Å²	114.4	52%	0.524	61%	0.607	S	S	.	*	H	α-helix	trans	-65.5	-26.5	174.7	-83.2	160.8	0	0	0	113.2	V20	V20-L24 HydrophobicContact CG1-CD1 3.96Å; V20-L24 WeakPolarHBondContact O-CB 3.43Å; V20-L24 WeakPolarHBondContact O-CG 3.46Å; V20-L24 PolarHBondContact O-N 2.66Å
25	R	48.7	Very low	55.9	Low	212 Å²	212	110.2 Å²	110.2	80%	0.8	60%	0.6	S	S	*	*	H	α-helix	trans	-80.8	-23.5	172.5	-79.2	-171.8	179.7	-155.8	1.7	112.8	L21 I22 D23	L21-R25 WeakPolarHBondContact O-CB 3.17Å; L21-R25 WeakPolarHBondContact O-CG 3.36Å; L21-R25 PolarHBondContact O-N 3.49Å; L21-R25 VanDerWaalsContact O-N 3.16Å; I22-R25 PolarHBondContact O-N 3.25Å; D23-R25 VanDerWaalsContact C-N 3.26Å; D23-R25 PolarHBondContact O-N 2.85Å
26	Y	51	Low	56	Low	198 Å²	198	107.9 Å²	107.9	78%	0.776	59%	0.585	S	S	*	*	H	α-helix	trans	-81.9	-27.7	172.8	-112.4	-91.6	0	0	0	112.9	I22 D23 G28	I22-Y26 PolarHBondContact O-N 3.19Å; D23-Y26 PolarHBondContact O-N 3.02Å; Y26-G28 PolarHBondContact O-N 2.89Å
27	E	43.3	Very low	56.6	Low	160 Å²	160	109.2 Å²	109.2	75%	0.748	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-9.4	169.7	-75.3	-172.3	149.9	0	0	113.7	D23	D23-E27 PolarHBondContact O-N 3.48Å
28	G	42	Very low	57.5	Low	61 Å²	61	107.1 Å²	107.1	63%	0.629	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-8.8	-176.8	0	0	0	0	0	116.5	Y26 C30	Y26-G28 PolarHBondContact O-N 2.89Å; G28-C30 PolarHBondContact O-N 3.1Å
29	V	40.8	Very low	58.7	Low	126 Å²	126	104.4 Å²	104.4	76%	0.764	57%	0.565	S	S	*	*			trans	-95.8	85.8	173.5	-175.2	0	0	0	0	108.7	G31	V29-G31 VanDerWaalsContact C-N 3.33Å; V29-G31 PolarHBondContact O-N 3.09Å
30	C	43.2	Very low	59.9	Low	116 Å²	116	100 Å²	100	78%	0.784	54%	0.542	S	S	*	.			trans	-54.3	94.1	166.1	-166.4	0	0	0	0	110.2	G28	G28-C30 PolarHBondContact O-N 3.1Å
31	G	43	Very low	61.1	Low	44 Å²	44	99.9 Å²	99.9	45%	0.454	54%	0.536	S	S	.	.			trans	-120	37.7	165.2	0	0	0	0	0	110.8	V29 D33 G34	V29-G31 VanDerWaalsContact C-N 3.33Å; V29-G31 PolarHBondContact O-N 3.09Å; G31-D33 PolarHBondContact O-N 3.17Å; G31-G34 PolarHBondContact O-N 3.49Å
32	K	51.8	Low	62.6	Low	177 Å²	177	98.8 Å²	98.8	77%	0.77	53%	0.529	S	S	*	.	H	α-helix	trans	-61.8	-31.1	-178.9	-81.5	-178	174.5	174.8	0	112.6
33	D	50.3	Low	64.1	Low	135 Å²	135	94.8 Å²	94.8	72%	0.722	51%	0.509	S	S	*	.	H	α-helix	trans	-84.1	-31.3	-179.9	-61.9	-26.2	0	0	0	112.9	G31 E37	G31-D33 PolarHBondContact O-N 3.17Å; D33-E37 WeakPolarHBondContact O-CB 3.17Å; D33-E37 PolarHBondContact O-N 3.05Å
34	G	56.8	Low	65.9	Low	52 Å²	52	92.8 Å²	92.8	54%	0.536	50%	0.495	S	S	.	.	H	α-helix	trans	-72.1	-35.1	-175.9	0	0	0	0	0	114.2	G31 N38	G31-G34 PolarHBondContact O-N 3.49Å; G34-N38 WeakPolarHBondContact O-CB 3.34Å; G34-N38 PolarHBondContact O-N 3.44Å
35	S	71.1	Confident	68	Low	67 Å²	67	94.7 Å²	94.7	47%	0.469	50%	0.499	S	S	.	.	H	α-helix	trans	-74.6	-37.3	178.9	-164.6	0	0	0	0	112.2	H39	S35-H39 PolarHBondContact O-CD2 3.26Å; S35-H39 PolarHBondContact O-N 3.24Å; S35-H39 VanDerWaalsContact O-N 3.08Å
36	L	75.3	Confident	70.1	Confident	22 Å²	22	85.3 Å²	85.3	12%	0.115	46%	0.464	C	S	.	.	H	α-helix	trans	-68.3	-51.7	179	173.4	63.6	0	0	0	111.7	N38 H39 L40 A62 D66	L36-N38 PolarHBondContact O-N 3.07Å; L36-H39 PolarHBondContact O-N 3.1Å; L36-H39 VanDerWaalsContact O-N 3.08Å; L36-L40 PolarHBondContact O-N 2.66Å; L36-A62 VanDerWaalsContact CD1-CA 3.49Å; L36-A62 HydrophobicContact CD1-CB 3.79Å; L36-A62 WeakPolarHBondContact CD1-O 3.47Å; L36-D66 HydrophobicContact CD1-CB 4.36Å; L36-D66 HydrophobicContact CD2-CB 3.47Å; L36-D66 VanDerWaalsContact CD2-CB 3.47Å
37	E	80.9	Confident	72.1	Confident	100 Å²	100	77.8 Å²	77.8	47%	0.467	44%	0.438	S	S	.	.	H	α-helix	trans	-63	-35.4	179.8	-162	64.4	-156.7	0	0	110.5	D33 L40 E41	D33-E37 WeakPolarHBondContact O-CB 3.17Å; D33-E37 PolarHBondContact O-N 3.05Å; E37-L40 PolarHBondContact O-N 3.02Å; E37-E41 WeakPolarHBondContact O-CB 3.24Å; E37-E41 WeakPolarHBondContact O-CG 3.22Å; E37-E41 PolarHBondContact O-N 2.82Å
38	N	87.2	Confident	74.4	Confident	102 Å²	102	74.6 Å²	74.6	55%	0.545	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-41	173.1	-171.6	26.4	0	0	0	112.4	G34 L36 E41 M42	G34-N38 WeakPolarHBondContact O-CB 3.34Å; G34-N38 PolarHBondContact O-N 3.44Å; L36-N38 PolarHBondContact O-N 3.07Å; N38-E41 PolarHBondContact O-N 3.02Å; N38-M42 WeakPolarHBondContact O-CB 3.22Å; N38-M42 PolarHBondContact O-N 3.42Å
39	H	89.8	Confident	76.8	Confident	52 Å²	52	75 Å²	75	24%	0.241	44%	0.436	C	S	.	.	H	α-helix	trans	-65.3	-39.4	173.9	-73.9	-42.8	0	0	0	112.7	S35 L36 G43 H58 A62	S35-H39 PolarHBondContact O-CD2 3.26Å; S35-H39 PolarHBondContact O-N 3.24Å; S35-H39 VanDerWaalsContact O-N 3.08Å; L36-H39 PolarHBondContact O-N 3.1Å; L36-H39 VanDerWaalsContact O-N 3.08Å; H39-G43 PolarHBondContact O-N 3.45Å; H39-H58 AromaticContact CE1-ND1 4Å; H39-H58 AromaticContact ND1-CE1 3.96Å; H39-H58 AromaticContact ND1-ND1 3.22Å; H39-H58 PolarHBondContact ND1-ND1 3.22Å; H39-A62 HydrophobicContact CB-CB 4.22Å
40	L	89.9	Confident	79.2	Confident	7 Å²	7	71.4 Å²	71.4	4%	0.037	42%	0.424	C	S	.	.	H	α-helix	trans	-65.2	-45.3	175.2	-72.5	174.7	0	0	0	112.2	L36 E37 G43 K44 F59 A62 N69 A72	L36-L40 PolarHBondContact O-N 2.66Å; E37-L40 PolarHBondContact O-N 3.02Å; L40-G43 PolarHBondContact O-N 3.29Å; L40-K44 VanDerWaalsContact O-CG 3.23Å; L40-K44 WeakPolarHBondContact O-CG 3.26Å; L40-K44 PolarHBondContact O-N 2.97Å; L40-F59 HydrophobicContact CD2-CD1 4Å; L40-F59 HydrophobicContact CD2-CE1 4.14Å; L40-A62 HydrophobicContact CD2-CB 3.74Å; L40-A62 HydrophobicContact CG-CB 4Å; L40-N69 WeakPolarHBondContact CD1-ND2 3.18Å; L40-A72 HydrophobicContact CD2-CB 3.88Å
41	E	91.8	Very high	81.7	Confident	75 Å²	75	70.4 Å²	70.4	35%	0.35	41%	0.408	S	S	.	.	H	α-helix	trans	-66.2	-43.5	178	-77.3	-58.2	125.3	0	0	112.2	E37 N38 K44 K45	E37-E41 WeakPolarHBondContact O-CB 3.24Å; E37-E41 WeakPolarHBondContact O-CG 3.22Å; E37-E41 PolarHBondContact O-N 2.82Å; N38-E41 PolarHBondContact O-N 3.02Å; E41-K44 PolarHBondContact O-N 2.82Å; E41-K44 IonicContact OE1-NZ 2.72Å; E41-K44 PolarHBondContact OE1-NZ 3.38Å; E41-K45 WeakPolarHBondContact O-CG 3.32Å; E41-K45 PolarHBondContact O-N 3.19Å
42	M	91.7	Very high	84.1	Confident	77 Å²	77	70.4 Å²	70.4	38%	0.379	40%	0.398	S	S	.	.	H	α-helix	trans	-64.1	-44.5	175.9	-168.7	61.8	-177.4	0	0	111.2	N38 K44 K45 L46	N38-M42 WeakPolarHBondContact O-CB 3.22Å; N38-M42 PolarHBondContact O-N 3.42Å; M42-K44 VanDerWaalsContact C-N 3.31Å; M42-K44 PolarHBondContact O-N 3.39Å; M42-K45 PolarHBondContact O-N 3.44Å; M42-L46 HydrophobicContact CE-CD1 4.12Å; M42-L46 HydrophobicContact CE-CD2 4.14Å; M42-L46 HydrophobicContact CE-CG 4.12Å; M42-L46 HydrophobicContact CG-CD1 3.94Å; M42-L46 HydrophobicContact CG-CG 4.45Å; M42-L46 WeakPolarHBondContact O-CB 3.46Å; M42-L46 VanDerWaalsContact O-CG 3.3Å; M42-L46 WeakPolarHBondContact O-CG 3.44Å; M42-L46 PolarHBondContact O-N 3.12Å
43	G	92.4	Very high	86.1	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-58.5	-40.8	174.6	0	0	0	0	0	112.7	H39 L40 L47	H39-G43 PolarHBondContact O-N 3.45Å; L40-G43 PolarHBondContact O-N 3.29Å; G43-L47 VanDerWaalsContact O-CB 3.28Å; G43-L47 WeakPolarHBondContact O-CB 3.47Å; G43-L47 PolarHBondContact O-N 3.07Å
44	K	92.5	Very high	88.1	Confident	66 Å²	66	62 Å²	62	29%	0.287	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-45	174.7	-73.8	169.4	-164	168.2	0	111.9	L40 E41 M42 L47 A48	L40-K44 VanDerWaalsContact O-CG 3.23Å; L40-K44 WeakPolarHBondContact O-CG 3.26Å; L40-K44 PolarHBondContact O-N 2.97Å; E41-K44 PolarHBondContact O-N 2.82Å; E41-K44 IonicContact OE1-NZ 2.72Å; E41-K44 PolarHBondContact OE1-NZ 3.38Å; M42-K44 VanDerWaalsContact C-N 3.31Å; M42-K44 PolarHBondContact O-N 3.39Å; K44-L47 PolarHBondContact O-N 3.12Å; K44-A48 WeakPolarHBondContact O-CB 3.45Å; K44-A48 PolarHBondContact O-N 3.09Å
45	K	94.1	Very high	89.8	Confident	140 Å²	140	59.6 Å²	59.6	61%	0.609	34%	0.344	S	S	*	.	H	α-helix	trans	-62.4	-45.8	178.1	-73.3	177.2	-176.5	175.5	0	111.6	E41 M42 A48 A49	E41-K45 WeakPolarHBondContact O-CG 3.32Å; E41-K45 PolarHBondContact O-N 3.19Å; M42-K45 PolarHBondContact O-N 3.44Å; K45-A48 PolarHBondContact O-N 2.79Å; K45-A49 WeakPolarHBondContact O-CB 3.45Å; K45-A49 PolarHBondContact O-N 3.27Å
46	L	93.8	Very high	91	Very high	14 Å²	14	57.5 Å²	57.5	7%	0.073	33%	0.328	C	S	.	.	H	α-helix	trans	-64.5	-39.6	177.9	-69.6	166.8	0	0	0	111.9	M42 A49 G50 Q51 D54 A55 H58	M42-L46 HydrophobicContact CE-CD1 4.12Å; M42-L46 HydrophobicContact CE-CD2 4.14Å; M42-L46 HydrophobicContact CE-CG 4.12Å; M42-L46 HydrophobicContact CG-CD1 3.94Å; M42-L46 HydrophobicContact CG-CG 4.45Å; M42-L46 WeakPolarHBondContact O-CB 3.46Å; M42-L46 VanDerWaalsContact O-CG 3.3Å; M42-L46 WeakPolarHBondContact O-CG 3.44Å; M42-L46 PolarHBondContact O-N 3.12Å; L46-A49 CarbonylContact O-C 3.17Å; L46-A49 PolarHBondContact O-N 2.84Å; L46-G50 PolarHBondContact O-N 3.3Å; L46-G50 VanDerWaalsContact O-N 3.1Å; L46-Q51 HydrophobicContact CB-CB 4.29Å; L46-Q51 HydrophobicContact CD2-CB 4.07Å; L46-Q51 PolarHBondContact O-N 3.27Å; L46-D54 HydrophobicContact CD1-CB 3.88Å; L46-D54 HydrophobicContact CD2-CB 4.31Å; L46-A55 HydrophobicContact CB-CB 3.85Å; L46-H58 WeakPolarHBondContact CD1-CD2 3.33Å
47	L	91.9	Very high	91.8	Very high	41 Å²	41	60 Å²	60	22%	0.215	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-44.6	173.9	-179.7	60.5	0	0	0	111.5	G43 K44 A49 G50 L52 A55 V79	G43-L47 VanDerWaalsContact O-CB 3.28Å; G43-L47 WeakPolarHBondContact O-CB 3.47Å; G43-L47 PolarHBondContact O-N 3.07Å; K44-L47 PolarHBondContact O-N 3.12Å; L47-A49 VanDerWaalsContact C-N 3.26Å; L47-A49 PolarHBondContact O-N 3.39Å; L47-G50 PolarHBondContact O-N 3.35Å; L47-G50 VanDerWaalsContact O-N 3.07Å; L47-L52 HydrophobicContact CD1-CD2 3.58Å; L47-A55 HydrophobicContact CB-CB 4.2Å; L47-V79 HydrophobicContact CD1-CG2 3.78Å; L47-V79 HydrophobicContact CD2-CG2 4.12Å; L47-V79 HydrophobicContact CG-CG2 4.42Å
48	A	92.3	Very high	92.5	Very high	93 Å²	93	57.6 Å²	57.6	77%	0.769	34%	0.336	S	S	*	.	H	α-helix	trans	-64.7	-31.2	175.7	0	0	0	0	0	112.6	K44 K45 G50	K44-A48 WeakPolarHBondContact O-CB 3.45Å; K44-A48 PolarHBondContact O-N 3.09Å; K45-A48 PolarHBondContact O-N 2.79Å; A48-G50 VanDerWaalsContact C-N 3.25Å; A48-G50 PolarHBondContact O-N 3.41Å
49	A	93	Very high	92.8	Very high	68 Å²	68	52.8 Å²	52.8	56%	0.562	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-2.4	173.7	0	0	0	0	0	113.8	K45 L46 L47 Q51	K45-A49 WeakPolarHBondContact O-CB 3.45Å; K45-A49 PolarHBondContact O-N 3.27Å; L46-A49 CarbonylContact O-C 3.17Å; L46-A49 PolarHBondContact O-N 2.84Å; L47-A49 VanDerWaalsContact C-N 3.26Å; L47-A49 PolarHBondContact O-N 3.39Å; A49-Q51 HydrophobicContact CB-CG 4.49Å; A49-Q51 PolarHBondContact O-N 3.47Å
50	G	91.1	Very high	93	Very high	51 Å²	51	53.1 Å²	53.1	53%	0.526	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	5.9	-177.6	0	0	0	0	0	114.7	L46 L47 A48 L52	L46-G50 PolarHBondContact O-N 3.3Å; L46-G50 VanDerWaalsContact O-N 3.1Å; L47-G50 PolarHBondContact O-N 3.35Å; L47-G50 VanDerWaalsContact O-N 3.07Å; A48-G50 VanDerWaalsContact C-N 3.25Å; A48-G50 PolarHBondContact O-N 3.41Å; G50-L52 PolarHBondContact O-N 3.14Å
51	Q	94.6	Very high	93.1	Very high	95 Å²	95	54.4 Å²	54.4	44%	0.444	32%	0.323	S	S	.	.			trans	-80.1	71	176.5	-65.6	-176.8	-76.6	0	0	110.3	L46 A49 A53 D54 A55	L46-Q51 HydrophobicContact CB-CB 4.29Å; L46-Q51 HydrophobicContact CD2-CB 4.07Å; L46-Q51 PolarHBondContact O-N 3.27Å; A49-Q51 HydrophobicContact CB-CG 4.49Å; A49-Q51 PolarHBondContact O-N 3.47Å; Q51-A53 PolarHBondContact O-N 3.47Å; Q51-D54 HydrophobicContact CB-CB 4.48Å; Q51-D54 PolarHBondContact O-N 2.91Å; Q51-A55 WeakPolarHBondContact O-CB 3.41Å; Q51-A55 PolarHBondContact O-N 3.23Å
52	L	93.5	Very high	93.2	Very high	45 Å²	45	50.9 Å²	50.9	24%	0.236	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-39.5	-170.3	-58	-178.4	0	0	0	112.9	L47 G50 L56 V79 A82 M83	L47-L52 HydrophobicContact CD1-CD2 3.58Å; G50-L52 PolarHBondContact O-N 3.14Å; L52-L56 WeakPolarHBondContact O-CB 3.41Å; L52-L56 PolarHBondContact O-N 3.17Å; L52-V79 HydrophobicContact CB-CG1 4.16Å; L52-V79 HydrophobicContact CD2-CG1 4.46Å; L52-V79 VanDerWaalsContact O-CG1 3.28Å; L52-V79 WeakPolarHBondContact O-CG1 3.14Å; L52-A82 HydrophobicContact CD1-CB 4.06Å; L52-A82 HydrophobicContact CD2-CB 4.01Å; L52-M83 HydrophobicContact CB-CE 3.49Å; L52-M83 VanDerWaalsContact CB-CE 3.49Å; L52-M83 HydrophobicContact CB-CG 3.93Å; L52-M83 HydrophobicContact CD1-CG 3.8Å; L52-M83 HydrophobicContact CG-CG 4.49Å; L52-M83 WeakPolarHBondContact O-CE 3.28Å
53	A	93.5	Very high	93.3	Very high	59 Å²	59	47.7 Å²	47.7	49%	0.488	29%	0.291	S	S	.	.	H	α-helix	trans	-68.5	-42.2	-176.9	0	0	0	0	0	112.5	Q51 L56 S57 M83	Q51-A53 PolarHBondContact O-N 3.47Å; A53-L56 WeakPolarHBondContact O-CB 3.2Å; A53-L56 PolarHBondContact O-N 3.3Å; A53-S57 PolarHBondContact O-N 2.97Å; A53-S57 PolarHBondContact O-OG 3.38Å; A53-S57 VanDerWaalsContact O-OG 3.13Å; A53-M83 HydrophobicContact CB-CE 4.09Å
54	D	92.4	Very high	93.2	Very high	77 Å²	77	53.7 Å²	53.7	41%	0.412	32%	0.323	S	S	.	.	H	α-helix	trans	-69.5	-42.2	177.4	-57	-36.7	0	0	0	110.4	L46 Q51 L56 S57 H58	L46-D54 HydrophobicContact CD1-CB 3.88Å; L46-D54 HydrophobicContact CD2-CB 4.31Å; Q51-D54 HydrophobicContact CB-CB 4.48Å; Q51-D54 PolarHBondContact O-N 2.91Å; D54-L56 VanDerWaalsContact C-N 3.28Å; D54-L56 PolarHBondContact O-N 3.16Å; D54-S57 WeakPolarHBondContact O-CB 3.18Å; D54-S57 PolarHBondContact O-N 3.27Å; D54-S57 VanDerWaalsContact O-N 3.13Å; D54-H58 PolarHBondContact O-CD2 3Å; D54-H58 VanDerWaalsContact O-CD2 3.28Å; D54-H58 PolarHBondContact O-N 3.3Å; D54-H58 VanDerWaalsContact O-N 3.11Å
55	A	94.3	Very high	93.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-57.1	-42.4	173.2	0	0	0	0	0	111.8	L46 L47 Q51 S57 H58 F59 V79	L46-A55 HydrophobicContact CB-CB 3.85Å; L47-A55 HydrophobicContact CB-CB 4.2Å; Q51-A55 WeakPolarHBondContact O-CB 3.41Å; Q51-A55 PolarHBondContact O-N 3.23Å; A55-S57 VanDerWaalsContact C-N 3.31Å; A55-S57 PolarHBondContact O-N 3.49Å; A55-H58 PolarHBondContact O-N 3.3Å; A55-F59 HydrophobicContact CB-CE2 4.21Å; A55-F59 WeakPolarHBondContact O-CD2 3.44Å; A55-F59 WeakPolarHBondContact O-CG 3.32Å; A55-F59 PolarHBondContact O-N 3.15Å; A55-V79 HydrophobicContact CB-CG2 4.38Å
56	L	94.7	Very high	92.9	Very high	24 Å²	24	49.2 Å²	49.2	13%	0.126	32%	0.323	C	S	.	.	H	α-helix	trans	-59.3	-42.8	176.8	-163.5	98.6	0	0	0	111.8	L52 A53 D54 F59 H60 R76 V79 Y80 M83	L52-L56 WeakPolarHBondContact O-CB 3.41Å; L52-L56 PolarHBondContact O-N 3.17Å; A53-L56 WeakPolarHBondContact O-CB 3.2Å; A53-L56 PolarHBondContact O-N 3.3Å; D54-L56 VanDerWaalsContact C-N 3.28Å; D54-L56 PolarHBondContact O-N 3.16Å; L56-F59 PolarHBondContact O-N 3.29Å; L56-H60 PolarHBondContact O-N 3.49Å; L56-H60 PolarHBondContact O-ND1 3.17Å; L56-R76 HydrophobicContact CD1-CG 4.33Å; L56-V79 HydrophobicContact CB-CG1 4.16Å; L56-V79 HydrophobicContact CD1-CB 4.21Å; L56-V79 HydrophobicContact CD1-CG1 3.83Å; L56-Y80 HydrophobicContact CD1-CD1 3.65Å; L56-Y80 HydrophobicContact CD1-CE1 3.46Å; L56-Y80 VanDerWaalsContact CD1-CE1 3.46Å; L56-Y80 HydrophobicContact CD1-CE2 4.36Å; L56-Y80 HydrophobicContact CD1-CG 4.18Å; L56-Y80 HydrophobicContact CD2-CE1 4.14Å; L56-Y80 HydrophobicContact CG-CE1 4.35Å; L56-M83 HydrophobicContact CD1-SD 4.42Å
57	S	93.6	Very high	92.8	Very high	74 Å²	74	52.2 Å²	52.2	52%	0.517	34%	0.343	S	S	.	.	H	α-helix	trans	-64.6	-42.7	-179.4	-57.8	0	0	0	0	111.4	A53 D54 A55 H60 A61	A53-S57 PolarHBondContact O-N 2.97Å; A53-S57 PolarHBondContact O-OG 3.38Å; A53-S57 VanDerWaalsContact O-OG 3.13Å; D54-S57 WeakPolarHBondContact O-CB 3.18Å; D54-S57 PolarHBondContact O-N 3.27Å; D54-S57 VanDerWaalsContact O-N 3.13Å; A55-S57 VanDerWaalsContact C-N 3.31Å; A55-S57 PolarHBondContact O-N 3.49Å; S57-H60 WeakPolarHBondContact O-CB 3.32Å; S57-H60 PolarHBondContact O-N 2.93Å; S57-A61 PolarHBondContact O-N 3.1Å
58	H	94	Very high	92.9	Very high	50 Å²	50	58.2 Å²	58.2	23%	0.231	37%	0.367	C	S	.	.	H	α-helix	trans	-65.9	-37.8	174.7	-76.7	-65.5	0	0	0	113.2	H39 L46 D54 A55 H60 A61 A62	H39-H58 AromaticContact CE1-ND1 4Å; H39-H58 AromaticContact ND1-CE1 3.96Å; H39-H58 AromaticContact ND1-ND1 3.22Å; H39-H58 PolarHBondContact ND1-ND1 3.22Å; L46-H58 WeakPolarHBondContact CD1-CD2 3.33Å; D54-H58 PolarHBondContact O-CD2 3Å; D54-H58 VanDerWaalsContact O-CD2 3.28Å; D54-H58 PolarHBondContact O-N 3.3Å; D54-H58 VanDerWaalsContact O-N 3.11Å; A55-H58 PolarHBondContact O-N 3.3Å; H58-H60 VanDerWaalsContact C-N 3.34Å; H58-A61 PolarHBondContact O-N 3.47Å; H58-A62 WeakPolarHBondContact O-CB 3.27Å; H58-A62 PolarHBondContact O-N 2.98Å
59	F	94.3	Very high	92.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-71.5	-26.8	175	-65.2	-48.3	0	0	0	113.3	L40 A55 L56 I63 R75 R76 V79	L40-F59 HydrophobicContact CD2-CD1 4Å; L40-F59 HydrophobicContact CD2-CE1 4.14Å; A55-F59 HydrophobicContact CB-CE2 4.21Å; A55-F59 WeakPolarHBondContact O-CD2 3.44Å; A55-F59 WeakPolarHBondContact O-CG 3.32Å; A55-F59 PolarHBondContact O-N 3.15Å; L56-F59 PolarHBondContact O-N 3.29Å; F59-I63 WeakPolarHBondContact O-CD1 3.39Å; F59-I63 WeakPolarHBondContact O-CG1 3.43Å; F59-I63 PolarHBondContact O-N 3.41Å; F59-I63 VanDerWaalsContact O-N 3.14Å; F59-R75 HydrophobicContact CD1-CB 3.79Å; F59-R75 HydrophobicContact CD2-CB 4.17Å; F59-R75 HydrophobicContact CE1-CB 3.5Å; F59-R75 VanDerWaalsContact CE1-CB 3.5Å; F59-R75 HydrophobicContact CE1-CG 4.02Å; F59-R75 HydrophobicContact CE2-CB 3.89Å; F59-R75 HydrophobicContact CG-CB 4.14Å; F59-R75 HydrophobicContact CZ-CB 3.55Å; F59-R75 HydrophobicContact CZ-CG 4.14Å; F59-R76 HydrophobicContact CB-CB 3.9Å; F59-R76 HydrophobicContact CB-CG 4.22Å; F59-V79 HydrophobicContact CD2-CG2 3.59Å; F59-V79 HydrophobicContact CE2-CG2 3.49Å; F59-V79 VanDerWaalsContact CE2-CG2 3.49Å
60	H	94.6	Very high	93	Very high	59 Å²	59	54.4 Å²	54.4	27%	0.273	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-52.5	167.4	-81.5	75.6	0	0	0	111	L56 S57 H58 A62 I63 D64 R76 Y80	L56-H60 PolarHBondContact O-N 3.49Å; L56-H60 PolarHBondContact O-ND1 3.17Å; S57-H60 WeakPolarHBondContact O-CB 3.32Å; S57-H60 PolarHBondContact O-N 2.93Å; H58-H60 VanDerWaalsContact C-N 3.34Å; H60-A62 PolarHBondContact O-N 2.95Å; H60-I63 PolarHBondContact O-N 3.26Å; H60-D64 PolarHBondContact O-N 3.05Å; H60-R76 PolarHBondContact CD2-NH1 2.88Å; H60-R76 PolarHBondContact NE2-NH1 3.36Å; H60-Y80 PolarHBondContact CE1-OH 3Å; H60-Y80 PolarHBondContact NE2-OH 3.17Å
61	A	92.2	Very high	93.1	Very high	35 Å²	35	55.1 Å²	55.1	29%	0.289	31%	0.311	S	S	.	.	H	α-helix	trans	-57.4	-35.4	177.5	0	0	0	0	0	112.3	S57 H58 D64 G65	S57-A61 PolarHBondContact O-N 3.1Å; H58-A61 PolarHBondContact O-N 3.47Å; A61-D64 PolarHBondContact O-N 3.31Å; A61-G65 PolarHBondContact O-N 2.63Å
62	A	92.3	Very high	93.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-66.4	-38.7	174.7	0	0	0	0	0	113	L36 H39 L40 H58 H60 G65 D66 A72	L36-A62 VanDerWaalsContact CD1-CA 3.49Å; L36-A62 HydrophobicContact CD1-CB 3.79Å; L36-A62 WeakPolarHBondContact CD1-O 3.47Å; H39-A62 HydrophobicContact CB-CB 4.22Å; L40-A62 HydrophobicContact CD2-CB 3.74Å; L40-A62 HydrophobicContact CG-CB 4Å; H58-A62 WeakPolarHBondContact O-CB 3.27Å; H58-A62 PolarHBondContact O-N 2.98Å; H60-A62 PolarHBondContact O-N 2.95Å; A62-G65 PolarHBondContact O-N 3.18Å; A62-D66 PolarHBondContact O-N 3.43Å; A62-A72 HydrophobicContact CB-CB 4.18Å
63	I	93.6	Very high	93.2	Very high	10 Å²	10	49.7 Å²	49.7	5%	0.051	28%	0.284	C	S	.	.	H	α-helix	trans	-71.2	-38.7	176.2	-71.1	164.4	0	0	0	111.2	F59 H60 G65 D66 P67 A72 Y73 R76	F59-I63 WeakPolarHBondContact O-CD1 3.39Å; F59-I63 WeakPolarHBondContact O-CG1 3.43Å; F59-I63 PolarHBondContact O-N 3.41Å; F59-I63 VanDerWaalsContact O-N 3.14Å; H60-I63 PolarHBondContact O-N 3.26Å; I63-G65 VanDerWaalsContact C-N 3.27Å; I63-G65 PolarHBondContact O-N 3.03Å; I63-D66 CarbonylContact O-C 3.49Å; I63-D66 PolarHBondContact O-N 2.83Å; I63-P67 WeakPolarHBondContact O-CA 3.43Å; I63-P67 WeakPolarHBondContact O-CD 3.17Å; I63-P67 WeakPolarHBondContact O-CG 3.35Å; I63-P67 VanDerWaalsContact O-N 3.1Å; I63-A72 HydrophobicContact CD1-CB 4.49Å; I63-A72 HydrophobicContact CG1-CB 3.61Å; I63-Y73 HydrophobicContact CD1-CD1 3.78Å; I63-Y73 HydrophobicContact CD1-CE1 4.03Å; I63-Y73 HydrophobicContact CD1-CG 4.12Å; I63-Y73 HydrophobicContact CG1-CD1 4.32Å; I63-Y73 HydrophobicContact CG1-CD2 4.42Å; I63-Y73 HydrophobicContact CG1-CE1 4.31Å; I63-Y73 HydrophobicContact CG1-CE2 4.39Å; I63-Y73 HydrophobicContact CG1-CG 4.38Å; I63-Y73 HydrophobicContact CG2-CE1 3.78Å; I63-Y73 HydrophobicContact CG2-CE2 4.25Å; I63-R76 HydrophobicContact CD1-CB 4.14Å; I63-R76 VanDerWaalsContact CD1-NE 3.32Å
64	D	92.2	Very high	93.3	Very high	126 Å²	126	48.5 Å²	48.5	67%	0.674	27%	0.267	S	S	*	.	H	α-helix	trans	-65.5	-34.3	176.5	-64.7	-22.3	0	0	0	111.3	H60 A61	H60-D64 PolarHBondContact O-N 3.05Å; A61-D64 PolarHBondContact O-N 3.31Å
65	G	89.9	Confident	93.4	Very high	58 Å²	58	48.9 Å²	48.9	60%	0.598	26%	0.263	S	S	*	.	H	α-helix	trans	-72.4	-41.3	175.3	0	0	0	0	0	114.2	A61 A62 I63	A61-G65 PolarHBondContact O-N 2.63Å; A62-G65 PolarHBondContact O-N 3.18Å; I63-G65 VanDerWaalsContact C-N 3.27Å; I63-G65 PolarHBondContact O-N 3.03Å
66	D	89.4	Confident	93.5	Very high	55 Å²	55	50.3 Å²	50.3	29%	0.294	27%	0.268	S	S	.	.			trans	-139.5	96.3	172.2	-179.3	8.7	0	0	0	112.2	L36 A62 I63 K68 N69	L36-D66 HydrophobicContact CD1-CB 4.36Å; L36-D66 HydrophobicContact CD2-CB 3.47Å; L36-D66 VanDerWaalsContact CD2-CB 3.47Å; A62-D66 PolarHBondContact O-N 3.43Å; I63-D66 CarbonylContact O-C 3.49Å; I63-D66 PolarHBondContact O-N 2.83Å; D66-K68 PolarHBondContact O-N 3.35Å; D66-K68 VanDerWaalsContact O-N 3.08Å; D66-K68 WeakPolarHBondContact OD1-CB 3.47Å; D66-K68 PolarHBondContact OD1-N 3.34Å; D66-N69 HydrophobicContact CB-CB 4.11Å; D66-N69 PolarHBondContact O-N 3.19Å; D66-N69 VanDerWaalsContact O-N 3.15Å; D66-N69 WeakPolarHBondContact OD2-CB 3.3Å
67	P	92.8	Very high	93.5	Very high	76 Å²	76	49.2 Å²	49.2	49%	0.494	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-9.1	178.9	-24.4	34.7	0	0	0	115.2	I63 Y73	I63-P67 WeakPolarHBondContact O-CA 3.43Å; I63-P67 WeakPolarHBondContact O-CD 3.17Å; I63-P67 WeakPolarHBondContact O-CG 3.35Å; I63-P67 VanDerWaalsContact O-N 3.1Å; P67-Y73 VanDerWaalsContact O-CE2 3.24Å; P67-Y73 WeakPolarHBondContact O-CE2 3.14Å; P67-Y73 PolarHBondContact O-OH 3.45Å; P67-Y73 VanDerWaalsContact O-OH 3.07Å
68	K	93.1	Very high	93.5	Very high	168 Å²	168	47.2 Å²	47.2	73%	0.73	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-6	177.9	-65.4	-177.8	179.5	178.7	0	112.9	D66 Y70	D66-K68 PolarHBondContact O-N 3.35Å; D66-K68 VanDerWaalsContact O-N 3.08Å; D66-K68 WeakPolarHBondContact OD1-CB 3.47Å; D66-K68 PolarHBondContact OD1-N 3.34Å; K68-Y70 PolarHBondContact O-N 3.5Å
69	N	92.8	Very high	93.5	Very high	29 Å²	29	44.9 Å²	44.9	16%	0.155	24%	0.236	C	C	.	.			trans	-75	98.2	179.8	-169.7	-24.9	0	0	0	111.9	L40 D66 M71 A72 Y73	L40-N69 WeakPolarHBondContact CD1-ND2 3.18Å; D66-N69 HydrophobicContact CB-CB 4.11Å; D66-N69 PolarHBondContact O-N 3.19Å; D66-N69 VanDerWaalsContact O-N 3.15Å; D66-N69 WeakPolarHBondContact OD2-CB 3.3Å; N69-M71 PolarHBondContact O-N 2.96Å; N69-M71 WeakPolarHBondContact OD1-CB 3.49Å; N69-M71 PolarHBondContact OD1-N 2.95Å; N69-A72 HydrophobicContact CB-CB 4.18Å; N69-A72 WeakPolarHBondContact O-CB 3.3Å; N69-A72 PolarHBondContact O-N 2.86Å; N69-A72 VanDerWaalsContact O-N 3.13Å; N69-A72 PolarHBondContact OD1-N 3.11Å; N69-Y73 VanDerWaalsContact O-CD2 3.31Å; N69-Y73 WeakPolarHBondContact O-CD2 3.39Å
70	Y	94.4	Very high	93.6	Very high	52 Å²	52	46.1 Å²	46.1	20%	0.204	24%	0.241	C	C	.	.	H	α-helix	trans	-59.3	-29.5	179	80.9	-87.4	0	0	0	113.4	K68 A72 Y73 Y74 V96 K100 F103	K68-Y70 PolarHBondContact O-N 3.5Å; Y70-A72 VanDerWaalsContact C-N 3.34Å; Y70-Y73 PolarHBondContact O-N 3.49Å; Y70-Y74 PolarHBondContact O-N 3.39Å; Y70-V96 HydrophobicContact CD2-CG1 4.12Å; Y70-V96 WeakPolarHBondContact O-CG2 3.5Å; Y70-K100 HydrophobicContact CD1-CB 4.26Å; Y70-K100 HydrophobicContact CD1-CD 3.89Å; Y70-K100 HydrophobicContact CD2-CB 4.1Å; Y70-K100 HydrophobicContact CD2-CD 3.93Å; Y70-K100 HydrophobicContact CE1-CD 3.47Å; Y70-K100 VanDerWaalsContact CE1-CD 3.47Å; Y70-K100 HydrophobicContact CE2-CD 3.51Å; Y70-K100 HydrophobicContact CG-CB 3.93Å; Y70-K100 HydrophobicContact CG-CD 4.09Å; Y70-K100 PolarHBondContact OH-NZ 3.37Å; Y70-K100 VanDerWaalsContact OH-NZ 3.11Å; Y70-F103 HydrophobicContact CE2-CD1 4.4Å; Y70-F103 HydrophobicContact CE2-CD2 4.38Å; Y70-F103 HydrophobicContact CE2-CG 4.26Å
71	M	93.4	Very high	93.4	Very high	65 Å²	65	45.6 Å²	45.6	32%	0.32	24%	0.24	S	C	.	.	H	α-helix	trans	-69	-34.3	179.1	-76.9	-62.5	-161.8	0	0	111.8	N69 Y74 R75	N69-M71 PolarHBondContact O-N 2.96Å; N69-M71 WeakPolarHBondContact OD1-CB 3.49Å; N69-M71 PolarHBondContact OD1-N 2.95Å; M71-Y74 PolarHBondContact O-N 3.01Å; M71-R75 WeakPolarHBondContact O-CB 3.48Å; M71-R75 WeakPolarHBondContact O-CG 3.35Å; M71-R75 PolarHBondContact O-N 3.41Å
72	A	93.9	Very high	93.3	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-47	177	0	0	0	0	0	110.8	L40 A62 I63 N69 Y70 R75 R76	L40-A72 HydrophobicContact CD2-CB 3.88Å; A62-A72 HydrophobicContact CB-CB 4.18Å; I63-A72 HydrophobicContact CD1-CB 4.49Å; I63-A72 HydrophobicContact CG1-CB 3.61Å; N69-A72 HydrophobicContact CB-CB 4.18Å; N69-A72 WeakPolarHBondContact O-CB 3.3Å; N69-A72 PolarHBondContact O-N 2.86Å; N69-A72 VanDerWaalsContact O-N 3.13Å; N69-A72 PolarHBondContact OD1-N 3.11Å; Y70-A72 VanDerWaalsContact C-N 3.34Å; A72-R75 PolarHBondContact O-N 3.22Å; A72-R76 WeakPolarHBondContact O-CB 3.47Å; A72-R76 PolarHBondContact O-N 3.3Å
73	Y	96.4	Very high	93.1	Very high	26 Å²	26	49.6 Å²	49.6	10%	0.102	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-44.8	173.3	-68.2	-83.1	0	0	0	112.4	I63 P67 N69 Y70 R75 R76 A77 K95 L99	I63-Y73 HydrophobicContact CD1-CD1 3.78Å; I63-Y73 HydrophobicContact CD1-CE1 4.03Å; I63-Y73 HydrophobicContact CD1-CG 4.12Å; I63-Y73 HydrophobicContact CG1-CD1 4.32Å; I63-Y73 HydrophobicContact CG1-CD2 4.42Å; I63-Y73 HydrophobicContact CG1-CE1 4.31Å; I63-Y73 HydrophobicContact CG1-CE2 4.39Å; I63-Y73 HydrophobicContact CG1-CG 4.38Å; I63-Y73 HydrophobicContact CG2-CE1 3.78Å; I63-Y73 HydrophobicContact CG2-CE2 4.25Å; P67-Y73 VanDerWaalsContact O-CE2 3.24Å; P67-Y73 WeakPolarHBondContact O-CE2 3.14Å; P67-Y73 PolarHBondContact O-OH 3.45Å; P67-Y73 VanDerWaalsContact O-OH 3.07Å; N69-Y73 VanDerWaalsContact O-CD2 3.31Å; N69-Y73 WeakPolarHBondContact O-CD2 3.39Å; Y70-Y73 PolarHBondContact O-N 3.49Å; Y73-R75 PolarHBondContact O-N 3.18Å; Y73-R76 PolarHBondContact O-N 3.28Å; Y73-A77 WeakPolarHBondContact O-CB 3.29Å; Y73-A77 PolarHBondContact O-N 3.06Å; Y73-K95 HydrophobicContact CD1-CB 4.21Å; Y73-K95 HydrophobicContact CD1-CG 4.09Å; Y73-K95 HydrophobicContact CD2-CG 4.28Å; Y73-K95 HydrophobicContact CE1-CB 4.46Å; Y73-K95 HydrophobicContact CE1-CG 3.95Å; Y73-K95 HydrophobicContact CE2-CG 4.16Å; Y73-K95 HydrophobicContact CG-CB 4.44Å; Y73-K95 HydrophobicContact CG-CG 4.25Å; Y73-L99 HydrophobicContact CD2-CD1 3.96Å; Y73-L99 HydrophobicContact CE2-CD1 3.96Å
74	Y	95.9	Very high	92.7	Very high	34 Å²	34	51.3 Å²	51.3	13%	0.133	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-44.3	179.7	-178.6	-114.4	0	0	0	111.6	Y70 M71 A77 T78 L93 F103 A106	Y70-Y74 PolarHBondContact O-N 3.39Å; M71-Y74 PolarHBondContact O-N 3.01Å; Y74-A77 WeakPolarHBondContact O-CB 3.23Å; Y74-A77 PolarHBondContact O-N 3.45Å; Y74-T78 HydrophobicContact CE1-CG2 4.21Å; Y74-T78 HydrophobicContact CE2-CG2 4.28Å; Y74-T78 WeakPolarHBondContact O-CG2 3.23Å; Y74-T78 PolarHBondContact O-N 3.42Å; Y74-L93 HydrophobicContact CD2-CD2 4.15Å; Y74-L93 HydrophobicContact CE2-CD2 4.36Å; Y74-F103 AromaticContact CD1-CE1 3.88Å; Y74-F103 HydrophobicContact CD1-CE1 3.88Å; Y74-F103 HydrophobicContact CD1-CZ 4.05Å; Y74-F103 AromaticContact CD2-CE1 3.69Å; Y74-F103 HydrophobicContact CD2-CE1 3.69Å; Y74-F103 AromaticContact CE1-CE1 3.98Å; Y74-F103 HydrophobicContact CE1-CE1 3.98Å; Y74-F103 AromaticContact CE1-CZ 3.91Å; Y74-F103 HydrophobicContact CE1-CZ 3.91Å; Y74-F103 AromaticContact CE2-CE1 3.79Å; Y74-F103 HydrophobicContact CE2-CE1 3.79Å; Y74-F103 HydrophobicContact CE2-CZ 4.43Å; Y74-F103 AromaticContact CG-CE1 3.73Å; Y74-F103 HydrophobicContact CG-CE1 3.73Å; Y74-F103 HydrophobicContact CG-CZ 4.36Å; Y74-F103 AromaticContact CZ-CE1 3.93Å; Y74-A106 HydrophobicContact CD2-CB 3.92Å; Y74-A106 HydrophobicContact CE2-CB 4.08Å
75	R	94.7	Very high	92.4	Very high	85 Å²	85	50.1 Å²	50.1	32%	0.321	27%	0.273	S	S	.	.	H	α-helix	trans	-64.7	-44.9	177.6	-67.3	-65.7	178.1	-178.2	1	111.2	F59 M71 A72 Y73 A77 T78 V79	F59-R75 HydrophobicContact CD1-CB 3.79Å; F59-R75 HydrophobicContact CD2-CB 4.17Å; F59-R75 HydrophobicContact CE1-CB 3.5Å; F59-R75 VanDerWaalsContact CE1-CB 3.5Å; F59-R75 HydrophobicContact CE1-CG 4.02Å; F59-R75 HydrophobicContact CE2-CB 3.89Å; F59-R75 HydrophobicContact CG-CB 4.14Å; F59-R75 HydrophobicContact CZ-CB 3.55Å; F59-R75 HydrophobicContact CZ-CG 4.14Å; M71-R75 WeakPolarHBondContact O-CB 3.48Å; M71-R75 WeakPolarHBondContact O-CG 3.35Å; M71-R75 PolarHBondContact O-N 3.41Å; A72-R75 PolarHBondContact O-N 3.22Å; Y73-R75 PolarHBondContact O-N 3.18Å; R75-A77 VanDerWaalsContact C-N 3.33Å; R75-A77 PolarHBondContact O-N 2.96Å; R75-T78 WeakPolarHBondContact CA-OG1 3.23Å; R75-T78 PolarHBondContact O-N 2.92Å; R75-T78 VanDerWaalsContact O-N 3.13Å; R75-T78 PolarHBondContact O-OG1 3.05Å; R75-V79 VanDerWaalsContact O-CG2 3.3Å; R75-V79 WeakPolarHBondContact O-CG2 3.43Å; R75-V79 PolarHBondContact O-N 2.97Å
76	R	95.7	Very high	92.2	Very high	31 Å²	31	48 Å²	48	12%	0.117	25%	0.249	C	C	.	.	H	α-helix	trans	-58.7	-44	174.8	-165.2	172.8	67.5	-177.2	-2.5	112	L56 F59 H60 I63 A72 Y73 T78 V79 Y80 D92	L56-R76 HydrophobicContact CD1-CG 4.33Å; F59-R76 HydrophobicContact CB-CB 3.9Å; F59-R76 HydrophobicContact CB-CG 4.22Å; H60-R76 PolarHBondContact CD2-NH1 2.88Å; H60-R76 PolarHBondContact NE2-NH1 3.36Å; I63-R76 HydrophobicContact CD1-CB 4.14Å; I63-R76 VanDerWaalsContact CD1-NE 3.32Å; A72-R76 WeakPolarHBondContact O-CB 3.47Å; A72-R76 PolarHBondContact O-N 3.3Å; Y73-R76 PolarHBondContact O-N 3.28Å; R76-T78 VanDerWaalsContact C-N 3.34Å; R76-T78 PolarHBondContact O-N 3.23Å; R76-V79 PolarHBondContact O-N 2.83Å; R76-V79 VanDerWaalsContact O-N 3.16Å; R76-Y80 HydrophobicContact CG-CD2 4.01Å; R76-Y80 HydrophobicContact CG-CE2 3.62Å; R76-Y80 WeakPolarHBondContact O-CD2 3.46Å; R76-Y80 PolarHBondContact O-N 3.06Å; R76-D92 IonicContact CZ-OD1 2.97Å; R76-D92 IonicContact CZ-OD2 3.07Å; R76-D92 IonicContact NE-OD1 3.71Å; R76-D92 IonicContact NE-OD2 2.77Å; R76-D92 PolarHBondContact NE-OD2 3.04Å; R76-D92 IonicContact NH2-OD1 3.53Å; R76-D92 PolarHBondContact NH2-OD1 3.22Å; R76-D92 IonicContact NH2-OD2 2.75Å; R76-D92 PolarHBondContact NH2-OD2 3.43Å
77	A	95.6	Very high	92	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.1	-44.2	174.2	0	0	0	0	0	112.3	Y73 Y74 R75 V79 Y80 L81 D92 L93	Y73-A77 WeakPolarHBondContact O-CB 3.29Å; Y73-A77 PolarHBondContact O-N 3.06Å; Y74-A77 WeakPolarHBondContact O-CB 3.23Å; Y74-A77 PolarHBondContact O-N 3.45Å; R75-A77 VanDerWaalsContact C-N 3.33Å; R75-A77 PolarHBondContact O-N 2.96Å; A77-V79 VanDerWaalsContact C-N 3.31Å; A77-V79 PolarHBondContact O-N 3.18Å; A77-Y80 PolarHBondContact O-N 3.08Å; A77-L81 WeakPolarHBondContact O-CG 3.44Å; A77-L81 PolarHBondContact O-N 3.28Å; A77-D92 HydrophobicContact CB-CB 3.78Å; A77-L93 HydrophobicContact CB-CD2 3.78Å; A77-L93 HydrophobicContact CB-CG 3.82Å
78	T	92.9	Very high	91.9	Very high	33 Å²	33	49 Å²	49	20%	0.202	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-36.4	177	58.1	0	0	0	0	112.7	Y74 R75 R76 L81 A82	Y74-T78 HydrophobicContact CE1-CG2 4.21Å; Y74-T78 HydrophobicContact CE2-CG2 4.28Å; Y74-T78 WeakPolarHBondContact O-CG2 3.23Å; Y74-T78 PolarHBondContact O-N 3.42Å; R75-T78 WeakPolarHBondContact CA-OG1 3.23Å; R75-T78 PolarHBondContact O-N 2.92Å; R75-T78 VanDerWaalsContact O-N 3.13Å; R75-T78 PolarHBondContact O-OG1 3.05Å; R76-T78 VanDerWaalsContact C-N 3.34Å; R76-T78 PolarHBondContact O-N 3.23Å; T78-L81 PolarHBondContact O-N 3.48Å; T78-A82 WeakPolarHBondContact O-CB 3.24Å; T78-A82 PolarHBondContact O-N 3.2Å
79	V	94.6	Very high	91.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-44.1	173.5	-176.5	0	0	0	0	110.7	L47 L52 A55 L56 F59 R75 R76 A77 L81 A82 M83	L47-V79 HydrophobicContact CD1-CG2 3.78Å; L47-V79 HydrophobicContact CD2-CG2 4.12Å; L47-V79 HydrophobicContact CG-CG2 4.42Å; L52-V79 HydrophobicContact CB-CG1 4.16Å; L52-V79 HydrophobicContact CD2-CG1 4.46Å; L52-V79 VanDerWaalsContact O-CG1 3.28Å; L52-V79 WeakPolarHBondContact O-CG1 3.14Å; A55-V79 HydrophobicContact CB-CG2 4.38Å; L56-V79 HydrophobicContact CB-CG1 4.16Å; L56-V79 HydrophobicContact CD1-CB 4.21Å; L56-V79 HydrophobicContact CD1-CG1 3.83Å; F59-V79 HydrophobicContact CD2-CG2 3.59Å; F59-V79 HydrophobicContact CE2-CG2 3.49Å; F59-V79 VanDerWaalsContact CE2-CG2 3.49Å; R75-V79 VanDerWaalsContact O-CG2 3.3Å; R75-V79 WeakPolarHBondContact O-CG2 3.43Å; R75-V79 PolarHBondContact O-N 2.97Å; R76-V79 PolarHBondContact O-N 2.83Å; R76-V79 VanDerWaalsContact O-N 3.16Å; A77-V79 VanDerWaalsContact C-N 3.31Å; A77-V79 PolarHBondContact O-N 3.18Å; V79-L81 VanDerWaalsContact C-N 3.31Å; V79-L81 PolarHBondContact O-N 2.92Å; V79-A82 PolarHBondContact O-N 3.27Å; V79-M83 WeakPolarHBondContact O-CG 3.32Å; V79-M83 PolarHBondContact O-N 3.38Å
80	Y	94.3	Very high	91.9	Very high	27 Å²	27	41 Å²	41	11%	0.106	21%	0.214	C	C	.	.	H	α-helix	trans	-58.9	-42.4	174.4	-77.7	-50.3	0	0	0	112.3	L56 H60 R76 A77 M83 G84 K85 D92	L56-Y80 HydrophobicContact CD1-CD1 3.65Å; L56-Y80 HydrophobicContact CD1-CE1 3.46Å; L56-Y80 VanDerWaalsContact CD1-CE1 3.46Å; L56-Y80 HydrophobicContact CD1-CE2 4.36Å; L56-Y80 HydrophobicContact CD1-CG 4.18Å; L56-Y80 HydrophobicContact CD2-CE1 4.14Å; L56-Y80 HydrophobicContact CG-CE1 4.35Å; H60-Y80 PolarHBondContact CE1-OH 3Å; H60-Y80 PolarHBondContact NE2-OH 3.17Å; R76-Y80 HydrophobicContact CG-CD2 4.01Å; R76-Y80 HydrophobicContact CG-CE2 3.62Å; R76-Y80 WeakPolarHBondContact O-CD2 3.46Å; R76-Y80 PolarHBondContact O-N 3.06Å; A77-Y80 PolarHBondContact O-N 3.08Å; Y80-M83 CarbonylContact O-C 3.39Å; Y80-M83 PolarHBondContact O-N 3.34Å; Y80-G84 PolarHBondContact O-N 3.24Å; Y80-K85 HydrophobicContact CD1-CB 3.96Å; Y80-K85 HydrophobicContact CD1-CD 4.04Å; Y80-K85 HydrophobicContact CE1-CD 4.39Å; Y80-K85 WeakPolarHBondContact O-CA 3.31Å; Y80-K85 PolarHBondContact O-N 2.66Å; Y80-D92 WeakPolarHBondContact CE2-OD2 3.38Å
81	L	90.8	Very high	92	Very high	48 Å²	48	42 Å²	42	25%	0.251	23%	0.227	S	C	.	.	H	α-helix	trans	-64.4	-41.7	175.8	-69.7	174.6	0	0	0	112	A77 T78 V79 M83 G84 A89 L93 L113	A77-L81 WeakPolarHBondContact O-CG 3.44Å; A77-L81 PolarHBondContact O-N 3.28Å; T78-L81 PolarHBondContact O-N 3.48Å; V79-L81 VanDerWaalsContact C-N 3.31Å; V79-L81 PolarHBondContact O-N 2.92Å; L81-M83 VanDerWaalsContact C-N 3.25Å; L81-M83 PolarHBondContact O-N 3.19Å; L81-G84 PolarHBondContact O-N 2.91Å; L81-A89 HydrophobicContact CD2-CB 3.75Å; L81-A89 HydrophobicContact CG-CB 3.81Å; L81-L93 HydrophobicContact CD1-CD1 4.5Å; L81-L113 HydrophobicContact CD2-CD1 4.07Å; L81-L113 HydrophobicContact CD2-CD2 4.42Å
82	A	89.9	Confident	92.1	Very high	64 Å²	64	39.4 Å²	39.4	53%	0.529	21%	0.214	S	C	.	.	H	α-helix	trans	-63.5	-31.7	174.9	0	0	0	0	0	112.4	L52 T78 V79 G84	L52-A82 HydrophobicContact CD1-CB 4.06Å; L52-A82 HydrophobicContact CD2-CB 4.01Å; T78-A82 WeakPolarHBondContact O-CB 3.24Å; T78-A82 PolarHBondContact O-N 3.2Å; V79-A82 PolarHBondContact O-N 3.27Å; A82-G84 VanDerWaalsContact C-N 3.28Å; A82-G84 PolarHBondContact O-N 3.18Å
83	M	89.6	Confident	92.3	Very high	54 Å²	54	39.4 Å²	39.4	27%	0.266	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-3.1	172.2	-70.5	-172.3	160.6	0	0	114.2	L52 A53 L56 V79 Y80 L81 K85	L52-M83 HydrophobicContact CB-CE 3.49Å; L52-M83 VanDerWaalsContact CB-CE 3.49Å; L52-M83 HydrophobicContact CB-CG 3.93Å; L52-M83 HydrophobicContact CD1-CG 3.8Å; L52-M83 HydrophobicContact CG-CG 4.49Å; L52-M83 WeakPolarHBondContact O-CE 3.28Å; A53-M83 HydrophobicContact CB-CE 4.09Å; L56-M83 HydrophobicContact CD1-SD 4.42Å; V79-M83 WeakPolarHBondContact O-CG 3.32Å; V79-M83 PolarHBondContact O-N 3.38Å; Y80-M83 CarbonylContact O-C 3.39Å; Y80-M83 PolarHBondContact O-N 3.34Å; L81-M83 VanDerWaalsContact C-N 3.25Å; L81-M83 PolarHBondContact O-N 3.19Å; M83-K85 HydrophobicContact CB-CD 4.21Å; M83-K85 HydrophobicContact CB-CG 4.04Å; M83-K85 PolarHBondContact O-N 3.28Å; M83-K85 HydrophobicContact SD-CD 4.07Å
84	G	84.5	Confident	92.3	Very high	46 Å²	46	39.9 Å²	39.9	47%	0.474	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	11	-172.9	0	0	0	0	0	114.8	Y80 L81 A82 S86	Y80-G84 PolarHBondContact O-N 3.24Å; L81-G84 PolarHBondContact O-N 2.91Å; A82-G84 VanDerWaalsContact C-N 3.28Å; A82-G84 PolarHBondContact O-N 3.18Å; G84-S86 VanDerWaalsContact C-N 3.32Å; G84-S86 PolarHBondContact O-N 3.45Å; G84-S86 VanDerWaalsContact O-N 3.09Å
85	K	86.8	Confident	92.3	Very high	102 Å²	102	41.1 Å²	41.1	44%	0.443	23%	0.228	S	C	.	.			trans	-86.2	65.7	-179.3	-66.2	-178.3	178.9	177.1	0	111.6	Y80 M83 K87 S88 A89	Y80-K85 HydrophobicContact CD1-CB 3.96Å; Y80-K85 HydrophobicContact CD1-CD 4.04Å; Y80-K85 HydrophobicContact CE1-CD 4.39Å; Y80-K85 WeakPolarHBondContact O-CA 3.31Å; Y80-K85 PolarHBondContact O-N 2.66Å; M83-K85 HydrophobicContact CB-CD 4.21Å; M83-K85 HydrophobicContact CB-CG 4.04Å; M83-K85 PolarHBondContact O-N 3.28Å; M83-K85 HydrophobicContact SD-CD 4.07Å; K85-K87 VanDerWaalsContact C-N 3.35Å; K85-K87 PolarHBondContact O-N 3.33Å; K85-S88 PolarHBondContact O-N 3.4Å; K85-A89 PolarHBondContact O-N 3.29Å
86	S	84.3	Confident	92.4	Very high	13 Å²	13	37.1 Å²	37.1	9%	0.091	21%	0.212	C	C	.	.	H	α-helix	trans	-56.3	-40.8	-177.9	52.9	0	0	0	0	114.7	G84 S88 A89 L90 L113 W185	G84-S86 VanDerWaalsContact C-N 3.32Å; G84-S86 PolarHBondContact O-N 3.45Å; G84-S86 VanDerWaalsContact O-N 3.09Å; S86-S88 VanDerWaalsContact C-N 3.29Å; S86-S88 PolarHBondContact O-N 2.84Å; S86-A89 PolarHBondContact O-N 2.9Å; S86-L90 PolarHBondContact O-N 2.95Å; S86-L113 VanDerWaalsContact CB-CD1 3.49Å; S86-W185 VanDerWaalsContact CB-CH2 3.49Å
87	K	85.1	Confident	92.4	Very high	105 Å²	105	36.5 Å²	36.5	46%	0.457	21%	0.211	S	C	.	.	H	α-helix	trans	-58.1	-39.5	177.9	-70.3	-176	177	179.1	0	112.9	K85 P91 L216	K85-K87 VanDerWaalsContact C-N 3.35Å; K85-K87 PolarHBondContact O-N 3.33Å; K87-P91 VanDerWaalsContact O-CD 3.23Å; K87-P91 WeakPolarHBondContact O-CD 3.41Å; K87-L216 WeakPolarHBondContact CE-O 3.35Å; K87-L216 PolarHBondContact NZ-O 3.17Å
88	S	90.4	Very high	92.4	Very high	47 Å²	47	42.6 Å²	42.6	33%	0.329	24%	0.24	S	C	.	.	H	α-helix	trans	-80.2	-28	-179.6	-54.7	0	0	0	0	112.5	K85 S86 P91	K85-S88 PolarHBondContact O-N 3.4Å; S86-S88 VanDerWaalsContact C-N 3.29Å; S86-S88 PolarHBondContact O-N 2.84Å; S88-P91 WeakPolarHBondContact O-CD 3.42Å; S88-P91 WeakPolarHBondContact O-CG 3.32Å
89	A	93.4	Very high	92.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-73	-35.9	179.6	0	0	0	0	0	113.7	L81 K85 S86 D92 L93 L113	L81-A89 HydrophobicContact CD2-CB 3.75Å; L81-A89 HydrophobicContact CG-CB 3.81Å; K85-A89 PolarHBondContact O-N 3.29Å; S86-A89 PolarHBondContact O-N 2.9Å; A89-D92 PolarHBondContact O-N 3.1Å; A89-L93 WeakPolarHBondContact O-CG 3.08Å; A89-L93 PolarHBondContact O-N 2.99Å; A89-L113 HydrophobicContact CB-CD2 4.25Å
90	L	93.9	Very high	92.6	Very high	30 Å²	30	46.6 Å²	46.6	16%	0.157	26%	0.257	C	S	.	.	H	α-helix	trans	-57.7	-47.1	-176.1	-162.1	148	0	0	0	114.8	S86 L93 S94 L113 L114 Q117	S86-L90 PolarHBondContact O-N 2.95Å; L90-L93 PolarHBondContact O-N 3.07Å; L90-S94 WeakPolarHBondContact O-CB 3.39Å; L90-S94 PolarHBondContact O-N 2.76Å; L90-S94 PolarHBondContact O-OG 3.4Å; L90-L113 HydrophobicContact CB-CD2 3.68Å; L90-L113 HydrophobicContact CD1-CD2 4.14Å; L90-L113 HydrophobicContact CD1-CG 4.36Å; L90-L113 HydrophobicContact CG-CD2 4.11Å; L90-L114 HydrophobicContact CD1-CD2 3.95Å; L90-Q117 VanDerWaalsContact CD1-OE1 3.28Å
91	P	95.3	Very high	92.4	Very high	73 Å²	73	48.9 Å²	48.9	47%	0.474	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-39.8	177.1	24.2	-34.2	0	0	0	112	K87 S88 S94 K95	K87-P91 VanDerWaalsContact O-CD 3.23Å; K87-P91 WeakPolarHBondContact O-CD 3.41Å; S88-P91 WeakPolarHBondContact O-CD 3.42Å; S88-P91 WeakPolarHBondContact O-CG 3.32Å; P91-S94 PolarHBondContact O-N 3.48Å; P91-K95 PolarHBondContact O-N 3.46Å
92	D	96.3	Very high	92.4	Very high	9 Å²	9	51.6 Å²	51.6	5%	0.048	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-46.9	177.2	-76.8	-5.4	0	0	0	111.4	R76 A77 Y80 A89 S94 K95 V96	R76-D92 IonicContact CZ-OD1 2.97Å; R76-D92 IonicContact CZ-OD2 3.07Å; R76-D92 IonicContact NE-OD1 3.71Å; R76-D92 IonicContact NE-OD2 2.77Å; R76-D92 PolarHBondContact NE-OD2 3.04Å; R76-D92 IonicContact NH2-OD1 3.53Å; R76-D92 PolarHBondContact NH2-OD1 3.22Å; R76-D92 IonicContact NH2-OD2 2.75Å; R76-D92 PolarHBondContact NH2-OD2 3.43Å; A77-D92 HydrophobicContact CB-CB 3.78Å; Y80-D92 WeakPolarHBondContact CE2-OD2 3.38Å; A89-D92 PolarHBondContact O-N 3.1Å; D92-S94 VanDerWaalsContact C-N 3.28Å; D92-S94 PolarHBondContact O-N 3.02Å; D92-K95 PolarHBondContact O-N 3Å; D92-K95 VanDerWaalsContact O-N 3.15Å; D92-V96 VanDerWaalsContact O-CG2 3.29Å; D92-V96 WeakPolarHBondContact O-CG2 3.34Å; D92-V96 PolarHBondContact O-N 3.29Å
93	L	96.9	Very high	92.4	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-38.4	175.8	-69.8	172.1	0	0	0	112.1	Y74 A77 L81 A89 L90 K95 V96 I97 A106 Q109 R110 L113	Y74-L93 HydrophobicContact CD2-CD2 4.15Å; Y74-L93 HydrophobicContact CE2-CD2 4.36Å; A77-L93 HydrophobicContact CB-CD2 3.78Å; A77-L93 HydrophobicContact CB-CG 3.82Å; L81-L93 HydrophobicContact CD1-CD1 4.5Å; A89-L93 WeakPolarHBondContact O-CG 3.08Å; A89-L93 PolarHBondContact O-N 2.99Å; L90-L93 PolarHBondContact O-N 3.07Å; L93-K95 VanDerWaalsContact C-N 3.35Å; L93-V96 PolarHBondContact O-N 3.42Å; L93-I97 WeakPolarHBondContact O-CD1 3.48Å; L93-I97 VanDerWaalsContact O-CG1 3.31Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 3.32Å; L93-I97 VanDerWaalsContact O-N 3.12Å; L93-A106 HydrophobicContact CD2-CB 4.29Å; L93-Q109 HydrophobicContact CD1-CB 4.15Å; L93-Q109 HydrophobicContact CD2-CB 4.08Å; L93-R110 HydrophobicContact CB-CB 4.14Å; L93-R110 HydrophobicContact CB-CG 4.36Å; L93-R110 HydrophobicContact CD1-CB 4.24Å; L93-L113 HydrophobicContact CD1-CD2 4.05Å
94	S	96.8	Very high	92.5	Very high	35 Å²	35	48.6 Å²	48.6	25%	0.245	27%	0.265	C	S	.	.	H	α-helix	trans	-66.1	-39.2	176.2	-60.3	0	0	0	0	111.5	L90 P91 D92 I97 E98 R110	L90-S94 WeakPolarHBondContact O-CB 3.39Å; L90-S94 PolarHBondContact O-N 2.76Å; L90-S94 PolarHBondContact O-OG 3.4Å; P91-S94 PolarHBondContact O-N 3.48Å; D92-S94 VanDerWaalsContact C-N 3.28Å; D92-S94 PolarHBondContact O-N 3.02Å; S94-I97 PolarHBondContact O-N 3.13Å; S94-E98 PolarHBondContact O-N 3.22Å; S94-R110 WeakPolarHBondContact OG-CD 3.3Å; S94-R110 PolarHBondContact OG-NH1 3.37Å
95	K	96.8	Very high	92.9	Very high	61 Å²	61	48 Å²	48	27%	0.265	25%	0.254	S	S	.	.	H	α-helix	trans	-65.8	-37.5	175.2	-168.2	55.7	171	-177.5	0	112.3	Y73 P91 D92 L93 I97 E98 L99	Y73-K95 HydrophobicContact CD1-CB 4.21Å; Y73-K95 HydrophobicContact CD1-CG 4.09Å; Y73-K95 HydrophobicContact CD2-CG 4.28Å; Y73-K95 HydrophobicContact CE1-CB 4.46Å; Y73-K95 HydrophobicContact CE1-CG 3.95Å; Y73-K95 HydrophobicContact CE2-CG 4.16Å; Y73-K95 HydrophobicContact CG-CB 4.44Å; Y73-K95 HydrophobicContact CG-CG 4.25Å; P91-K95 PolarHBondContact O-N 3.46Å; D92-K95 PolarHBondContact O-N 3Å; D92-K95 VanDerWaalsContact O-N 3.15Å; L93-K95 VanDerWaalsContact C-N 3.35Å; K95-I97 VanDerWaalsContact C-N 3.32Å; K95-I97 PolarHBondContact O-N 2.99Å; K95-E98 WeakPolarHBondContact CD-OE2 3.5Å; K95-E98 IonicContact NZ-OE1 2.72Å; K95-E98 PolarHBondContact NZ-OE1 2.98Å; K95-E98 IonicContact NZ-OE2 3.84Å; K95-E98 PolarHBondContact NZ-OE2 3.33Å; K95-E98 WeakPolarHBondContact O-CB 3.47Å; K95-E98 PolarHBondContact O-N 3.01Å; K95-L99 HydrophobicContact CD-CD1 4.48Å; K95-L99 HydrophobicContact CD-CG 4.38Å; K95-L99 HydrophobicContact CG-CD1 4.05Å; K95-L99 HydrophobicContact CG-CG 4.41Å; K95-L99 WeakPolarHBondContact O-CB 3.35Å; K95-L99 VanDerWaalsContact O-CG 3.31Å; K95-L99 WeakPolarHBondContact O-CG 3.42Å; K95-L99 PolarHBondContact O-N 3.36Å
96	V	97.1	Very high	93.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.3	-45.4	172.9	176.6	0	0	0	0	110.9	Y70 D92 L93 E98 L99 K100 F103 A106	Y70-V96 HydrophobicContact CD2-CG1 4.12Å; Y70-V96 WeakPolarHBondContact O-CG2 3.5Å; D92-V96 VanDerWaalsContact O-CG2 3.29Å; D92-V96 WeakPolarHBondContact O-CG2 3.34Å; D92-V96 PolarHBondContact O-N 3.29Å; L93-V96 PolarHBondContact O-N 3.42Å; V96-E98 VanDerWaalsContact C-N 3.32Å; V96-E98 PolarHBondContact O-N 3.13Å; V96-L99 PolarHBondContact O-N 3.42Å; V96-K100 WeakPolarHBondContact O-CA 3.34Å; V96-K100 PolarHBondContact O-N 3.1Å; V96-F103 HydrophobicContact CG1-CD1 3.66Å; V96-F103 HydrophobicContact CG1-CE1 4.31Å; V96-A106 HydrophobicContact CB-CB 4.01Å; V96-A106 HydrophobicContact CG1-CB 3.46Å; V96-A106 VanDerWaalsContact CG1-CB 3.46Å
97	I	95.9	Very high	93.7	Very high	18 Å²	18	43.5 Å²	43.5	9%	0.092	23%	0.232	C	C	.	.	H	α-helix	trans	-68.4	-32.8	-179.4	-66.4	161.7	0	0	0	111.6	L93 S94 K95 K100 P101 A106 R107 R110	L93-I97 WeakPolarHBondContact O-CD1 3.48Å; L93-I97 VanDerWaalsContact O-CG1 3.31Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 3.32Å; L93-I97 VanDerWaalsContact O-N 3.12Å; S94-I97 PolarHBondContact O-N 3.13Å; K95-I97 VanDerWaalsContact C-N 3.32Å; K95-I97 PolarHBondContact O-N 2.99Å; I97-K100 CarbonylContact O-C 3.55Å; I97-P101 WeakPolarHBondContact O-CA 3.45Å; I97-A106 HydrophobicContact CG1-CB 4.31Å; I97-R107 HydrophobicContact CD1-CB 4.06Å; I97-R107 HydrophobicContact CD1-CG 4.3Å; I97-R107 HydrophobicContact CG1-CB 4.3Å; I97-R110 HydrophobicContact CD1-CB 4.08Å; I97-R110 VanDerWaalsContact CD1-NE 3.33Å
98	E	95.9	Very high	94.2	Very high	129 Å²	129	38.6 Å²	38.6	60%	0.603	21%	0.211	S	C	*	.	H	α-helix	trans	-67.1	-47.8	173.5	-172	-161.8	141.5	0	0	111.6	S94 K95 V96	S94-E98 PolarHBondContact O-N 3.22Å; K95-E98 WeakPolarHBondContact CD-OE2 3.5Å; K95-E98 IonicContact NZ-OE1 2.72Å; K95-E98 PolarHBondContact NZ-OE1 2.98Å; K95-E98 IonicContact NZ-OE2 3.84Å; K95-E98 PolarHBondContact NZ-OE2 3.33Å; K95-E98 WeakPolarHBondContact O-CB 3.47Å; K95-E98 PolarHBondContact O-N 3.01Å; V96-E98 VanDerWaalsContact C-N 3.32Å; V96-E98 PolarHBondContact O-N 3.13Å
99	L	95.7	Very high	94.5	Very high	60 Å²	60	39.2 Å²	39.2	31%	0.314	21%	0.209	S	C	.	.	H	α-helix	trans	-72.2	-35.4	-179.4	-68.7	172.2	0	0	0	112.6	Y73 K95 V96	Y73-L99 HydrophobicContact CD2-CD1 3.96Å; Y73-L99 HydrophobicContact CE2-CD1 3.96Å; K95-L99 HydrophobicContact CD-CD1 4.48Å; K95-L99 HydrophobicContact CD-CG 4.38Å; K95-L99 HydrophobicContact CG-CD1 4.05Å; K95-L99 HydrophobicContact CG-CG 4.41Å; K95-L99 WeakPolarHBondContact O-CB 3.35Å; K95-L99 VanDerWaalsContact O-CG 3.31Å; K95-L99 WeakPolarHBondContact O-CG 3.42Å; K95-L99 PolarHBondContact O-N 3.36Å; V96-L99 PolarHBondContact O-N 3.42Å
100	K	94.4	Very high	94.6	Very high	56 Å²	56	41.4 Å²	41.4	24%	0.243	22%	0.217	C	C	.	.			trans	-140.1	84.3	-176.1	-166.3	168.6	-178.8	153.3	0	112	Y70 V96 I97 D102 F103	Y70-K100 HydrophobicContact CD1-CB 4.26Å; Y70-K100 HydrophobicContact CD1-CD 3.89Å; Y70-K100 HydrophobicContact CD2-CB 4.1Å; Y70-K100 HydrophobicContact CD2-CD 3.93Å; Y70-K100 HydrophobicContact CE1-CD 3.47Å; Y70-K100 VanDerWaalsContact CE1-CD 3.47Å; Y70-K100 HydrophobicContact CE2-CD 3.51Å; Y70-K100 HydrophobicContact CG-CB 3.93Å; Y70-K100 HydrophobicContact CG-CD 4.09Å; Y70-K100 PolarHBondContact OH-NZ 3.37Å; Y70-K100 VanDerWaalsContact OH-NZ 3.11Å; V96-K100 WeakPolarHBondContact O-CA 3.34Å; V96-K100 PolarHBondContact O-N 3.1Å; I97-K100 CarbonylContact O-C 3.55Å; K100-D102 VanDerWaalsContact C-N 3.28Å; K100-D102 WeakPolarHBondContact CE-OD1 3.49Å; K100-D102 WeakPolarHBondContact CE-OD2 3.4Å; K100-D102 WeakPolarHBondContact CG-OD1 3.39Å; K100-D102 IonicContact NZ-OD2 3.74Å; K100-D102 PolarHBondContact O-N 3.02Å; K100-F103 HydrophobicContact CB-CB 4.23Å; K100-F103 HydrophobicContact CD-CB 4.05Å; K100-F103 HydrophobicContact CG-CB 3.9Å; K100-F103 WeakPolarHBondContact O-CB 3.49Å; K100-F103 PolarHBondContact O-N 3Å; K100-F103 VanDerWaalsContact O-N 3.16Å
101	P	91.8	Very high	94.7	Very high	75 Å²	75	40 Å²	40	49%	0.487	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-25.5	-176.2	-24.3	34.9	0	0	0	115.2	I97 F103 R107	I97-P101 WeakPolarHBondContact O-CA 3.45Å; P101-F103 VanDerWaalsContact C-N 3.28Å; P101-R107 VanDerWaalsContact O-CZ 3.28Å; P101-R107 PolarHBondContact O-NH1 3.22Å; P101-R107 PolarHBondContact O-NH2 3.18Å
102	D	89.1	Confident	94.7	Very high	105 Å²	105	37.4 Å²	37.4	56%	0.561	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-11.4	177.8	58.5	-48	0	0	0	113.1	K100 T104	K100-D102 VanDerWaalsContact C-N 3.28Å; K100-D102 WeakPolarHBondContact CE-OD1 3.49Å; K100-D102 WeakPolarHBondContact CE-OD2 3.4Å; K100-D102 WeakPolarHBondContact CG-OD1 3.39Å; K100-D102 IonicContact NZ-OD2 3.74Å; K100-D102 PolarHBondContact O-N 3.02Å; D102-T104 PolarHBondContact O-N 3.4Å
103	F	91.5	Very high	94.6	Very high	36 Å²	36	37.1 Å²	37.1	16%	0.158	19%	0.19	C	C	.	.			trans	-79.4	82.6	-179.7	-166.5	-119.4	0	0	0	112.1	Y70 Y74 V96 K100 P101 S105 A106	Y70-F103 HydrophobicContact CE2-CD1 4.4Å; Y70-F103 HydrophobicContact CE2-CD2 4.38Å; Y70-F103 HydrophobicContact CE2-CG 4.26Å; Y74-F103 AromaticContact CD1-CE1 3.88Å; Y74-F103 HydrophobicContact CD1-CE1 3.88Å; Y74-F103 HydrophobicContact CD1-CZ 4.05Å; Y74-F103 AromaticContact CD2-CE1 3.69Å; Y74-F103 HydrophobicContact CD2-CE1 3.69Å; Y74-F103 AromaticContact CE1-CE1 3.98Å; Y74-F103 HydrophobicContact CE1-CE1 3.98Å; Y74-F103 AromaticContact CE1-CZ 3.91Å; Y74-F103 HydrophobicContact CE1-CZ 3.91Å; Y74-F103 AromaticContact CE2-CE1 3.79Å; Y74-F103 HydrophobicContact CE2-CE1 3.79Å; Y74-F103 HydrophobicContact CE2-CZ 4.43Å; Y74-F103 AromaticContact CG-CE1 3.73Å; Y74-F103 HydrophobicContact CG-CE1 3.73Å; Y74-F103 HydrophobicContact CG-CZ 4.36Å; Y74-F103 AromaticContact CZ-CE1 3.93Å; V96-F103 HydrophobicContact CG1-CD1 3.66Å; V96-F103 HydrophobicContact CG1-CE1 4.31Å; K100-F103 HydrophobicContact CB-CB 4.23Å; K100-F103 HydrophobicContact CD-CB 4.05Å; K100-F103 HydrophobicContact CG-CB 3.9Å; K100-F103 WeakPolarHBondContact O-CB 3.49Å; K100-F103 PolarHBondContact O-N 3Å; K100-F103 VanDerWaalsContact O-N 3.16Å; P101-F103 VanDerWaalsContact C-N 3.28Å; F103-S105 VanDerWaalsContact C-N 3.3Å; F103-S105 PolarHBondContact O-N 3.1Å; F103-A106 HydrophobicContact CD1-CB 3.49Å; F103-A106 VanDerWaalsContact CD1-CB 3.49Å; F103-A106 HydrophobicContact CE1-CB 3.86Å; F103-A106 PolarHBondContact O-N 3.23Å
104	T	91	Very high	94.6	Very high	20 Å²	20	37.2 Å²	37.2	12%	0.123	19%	0.191	C	C	.	.	H	α-helix	trans	-59.1	-34.2	-175.6	52.9	0	0	0	0	113.8	D102 A106 R107 L108 S133	D102-T104 PolarHBondContact O-N 3.4Å; T104-A106 PolarHBondContact O-N 2.9Å; T104-R107 PolarHBondContact O-N 3.39Å; T104-R107 VanDerWaalsContact O-N 3.11Å; T104-L108 PolarHBondContact O-N 3.16Å; T104-S133 VanDerWaalsContact CG2-CB 3.47Å
105	S	91.7	Very high	94.5	Very high	34 Å²	34	35.7 Å²	35.7	24%	0.238	18%	0.18	C	C	.	.	H	α-helix	trans	-61.2	-40.4	-179.9	-50.7	0	0	0	0	112.6	F103 R107 L108 Q109	F103-S105 VanDerWaalsContact C-N 3.3Å; F103-S105 PolarHBondContact O-N 3.1Å; S105-R107 VanDerWaalsContact C-N 3.34Å; S105-L108 PolarHBondContact O-N 3.49Å; S105-Q109 VanDerWaalsContact O-CG 3.31Å; S105-Q109 WeakPolarHBondContact O-CG 3.45Å; S105-Q109 PolarHBondContact O-N 3.28Å
106	A	94.1	Very high	94.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67	-37.2	175.4	0	0	0	0	0	112.1	Y74 L93 V96 I97 F103 T104 Q109 R110	Y74-A106 HydrophobicContact CD2-CB 3.92Å; Y74-A106 HydrophobicContact CE2-CB 4.08Å; L93-A106 HydrophobicContact CD2-CB 4.29Å; V96-A106 HydrophobicContact CB-CB 4.01Å; V96-A106 HydrophobicContact CG1-CB 3.46Å; V96-A106 VanDerWaalsContact CG1-CB 3.46Å; I97-A106 HydrophobicContact CG1-CB 4.31Å; F103-A106 HydrophobicContact CD1-CB 3.49Å; F103-A106 VanDerWaalsContact CD1-CB 3.49Å; F103-A106 HydrophobicContact CE1-CB 3.86Å; F103-A106 PolarHBondContact O-N 3.23Å; T104-A106 PolarHBondContact O-N 2.9Å; A106-Q109 PolarHBondContact O-N 3.1Å; A106-R110 WeakPolarHBondContact O-CB 3.32Å; A106-R110 PolarHBondContact O-N 2.98Å
107	R	95.8	Very high	94.2	Very high	19 Å²	19	39.2 Å²	39.2	7%	0.072	20%	0.196	C	C	.	.	H	α-helix	trans	-66.2	-40.6	175.6	-168.3	176.4	-71.5	109.2	-1.4	112	I97 P101 T104 S105 R110 G111 D126 V130	I97-R107 HydrophobicContact CD1-CB 4.06Å; I97-R107 HydrophobicContact CD1-CG 4.3Å; I97-R107 HydrophobicContact CG1-CB 4.3Å; P101-R107 VanDerWaalsContact O-CZ 3.28Å; P101-R107 PolarHBondContact O-NH1 3.22Å; P101-R107 PolarHBondContact O-NH2 3.18Å; T104-R107 PolarHBondContact O-N 3.39Å; T104-R107 VanDerWaalsContact O-N 3.11Å; S105-R107 VanDerWaalsContact C-N 3.34Å; R107-R110 PolarHBondContact O-N 3.42Å; R107-G111 PolarHBondContact O-N 3.09Å; R107-D126 WeakPolarHBondContact CD-O 3.38Å; R107-D126 HydrophobicContact CG-CB 3.86Å; R107-V130 HydrophobicContact CB-CG2 3.86Å; R107-V130 HydrophobicContact CG-CG2 3.9Å
108	L	95.4	Very high	94.1	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-61.5	-45.7	173.7	-176.7	66.7	0	0	0	111.4	T104 S105 R110 G111 N112 F127 V130 D139 E142 A143	T104-L108 PolarHBondContact O-N 3.16Å; S105-L108 PolarHBondContact O-N 3.49Å; L108-R110 VanDerWaalsContact C-N 3.34Å; L108-R110 PolarHBondContact O-N 3.05Å; L108-G111 PolarHBondContact O-N 2.83Å; L108-N112 PolarHBondContact O-N 3.44Å; L108-N112 PolarHBondContact O-ND2 3.12Å; L108-F127 HydrophobicContact CD1-CD1 3.87Å; L108-F127 HydrophobicContact CD1-CE1 3.87Å; L108-V130 HydrophobicContact CB-CG2 4.24Å; L108-D139 HydrophobicContact CD2-CB 3.98Å; L108-D139 WeakPolarHBondContact CD2-OD1 3.4Å; L108-E142 HydrophobicContact CD1-CG 4.28Å; L108-E142 HydrophobicContact CD2-CB 4.33Å; L108-E142 HydrophobicContact CD2-CG 4.33Å; L108-A143 HydrophobicContact CD1-CB 4.02Å
109	Q	95.2	Very high	94	Very high	61 Å²	61	37.8 Å²	37.8	29%	0.285	19%	0.19	S	C	.	.	H	α-helix	trans	-62.8	-39.4	175.9	-68.9	-58.4	-41	0	0	112.2	L93 S105 A106 N112 L113	L93-Q109 HydrophobicContact CD1-CB 4.15Å; L93-Q109 HydrophobicContact CD2-CB 4.08Å; S105-Q109 VanDerWaalsContact O-CG 3.31Å; S105-Q109 WeakPolarHBondContact O-CG 3.45Å; S105-Q109 PolarHBondContact O-N 3.28Å; A106-Q109 PolarHBondContact O-N 3.1Å; Q109-N112 PolarHBondContact O-N 2.95Å; Q109-L113 WeakPolarHBondContact O-CB 3.47Å; Q109-L113 PolarHBondContact O-N 3.23Å
110	R	96.4	Very high	94.1	Very high	45 Å²	45	35.3 Å²	35.3	17%	0.17	18%	0.177	C	C	.	.	H	α-helix	trans	-66.2	-44.5	175.6	-165.6	176.9	68.9	174.5	1	111.5	L93 S94 I97 A106 R107 L108 N112 L113 L114 D126	L93-R110 HydrophobicContact CB-CB 4.14Å; L93-R110 HydrophobicContact CB-CG 4.36Å; L93-R110 HydrophobicContact CD1-CB 4.24Å; S94-R110 WeakPolarHBondContact OG-CD 3.3Å; S94-R110 PolarHBondContact OG-NH1 3.37Å; I97-R110 HydrophobicContact CD1-CB 4.08Å; I97-R110 VanDerWaalsContact CD1-NE 3.33Å; A106-R110 WeakPolarHBondContact O-CB 3.32Å; A106-R110 PolarHBondContact O-N 2.98Å; R107-R110 PolarHBondContact O-N 3.42Å; L108-R110 VanDerWaalsContact C-N 3.34Å; L108-R110 PolarHBondContact O-N 3.05Å; R110-N112 VanDerWaalsContact C-N 3.33Å; R110-N112 PolarHBondContact O-N 3.29Å; R110-L113 WeakPolarHBondContact O-CB 3.28Å; R110-L113 PolarHBondContact O-N 2.92Å; R110-L113 VanDerWaalsContact O-N 3.12Å; R110-L114 HydrophobicContact CG-CD1 3.97Å; R110-L114 HydrophobicContact CG-CG 4.31Å; R110-L114 WeakPolarHBondContact O-CB 3.22Å; R110-L114 VanDerWaalsContact O-CG 3.26Å; R110-L114 WeakPolarHBondContact O-CG 3.5Å; R110-L114 PolarHBondContact O-N 3.02Å; R110-D126 IonicContact CZ-OD1 3.39Å; R110-D126 IonicContact CZ-OD2 2.68Å; R110-D126 VanDerWaalsContact CZ-OD2 3.32Å; R110-D126 IonicContact NE-OD1 3.53Å; R110-D126 IonicContact NE-OD2 2.91Å; R110-D126 PolarHBondContact NE-OD2 2.87Å; R110-D126 VanDerWaalsContact NH2-CG 3.32Å; R110-D126 IonicContact NH2-OD1 3.62Å; R110-D126 PolarHBondContact NH2-OD1 2.69Å; R110-D126 IonicContact NH2-OD2 3.86Å; R110-D126 PolarHBondContact NH2-OD2 3.07Å; R110-D126 VanDerWaalsContact NH2-OD2 3.11Å
111	G	96.3	Very high	94.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-57.2	-44.9	174.3	0	0	0	0	0	112.4	R107 L108 L113 L114 L115 A123 F127	R107-G111 PolarHBondContact O-N 3.09Å; L108-G111 PolarHBondContact O-N 2.83Å; G111-L113 VanDerWaalsContact C-N 3.32Å; G111-L113 PolarHBondContact O-N 3.43Å; G111-L114 PolarHBondContact O-N 3.18Å; G111-L115 WeakPolarHBondContact O-CB 3.36Å; G111-L115 PolarHBondContact O-N 3.14Å; G111-A123 WeakPolarHBondContact O-CB 3.38Å; G111-F127 WeakPolarHBondContact O-CZ 3.4Å
112	N	95.1	Very high	94.3	Very high	19 Å²	19	39 Å²	39	10%	0.102	19%	0.193	C	C	.	.	H	α-helix	trans	-60.7	-40.3	174.9	-79.7	-30.5	0	0	0	112.7	L108 Q109 R110 K116 E142 R146	L108-N112 PolarHBondContact O-N 3.44Å; L108-N112 PolarHBondContact O-ND2 3.12Å; Q109-N112 PolarHBondContact O-N 2.95Å; R110-N112 VanDerWaalsContact C-N 3.33Å; R110-N112 PolarHBondContact O-N 3.29Å; N112-K116 WeakPolarHBondContact O-CG 3.29Å; N112-K116 PolarHBondContact O-N 2.65Å; N112-K116 VanDerWaalsContact O-N 3.12Å; N112-E142 PolarHBondContact ND2-OE1 2.86Å; N112-R146 WeakPolarHBondContact OD1-CD 3.41Å; N112-R146 WeakPolarHBondContact OD1-CG 3.44Å; N112-R146 PolarHBondContact OD1-NE 2.98Å; N112-R146 VanDerWaalsContact OD1-NE 3.13Å
113	L	94.9	Very high	94.7	Very high	4 Å²	4	34 Å²	34	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-44.6	177.8	-175.6	58.7	0	0	0	111.8	L81 S86 A89 L90 L93 Q109 R110 G111 K116 Q117 W185	L81-L113 HydrophobicContact CD2-CD1 4.07Å; L81-L113 HydrophobicContact CD2-CD2 4.42Å; S86-L113 VanDerWaalsContact CB-CD1 3.49Å; A89-L113 HydrophobicContact CB-CD2 4.25Å; L90-L113 HydrophobicContact CB-CD2 3.68Å; L90-L113 HydrophobicContact CD1-CD2 4.14Å; L90-L113 HydrophobicContact CD1-CG 4.36Å; L90-L113 HydrophobicContact CG-CD2 4.11Å; L93-L113 HydrophobicContact CD1-CD2 4.05Å; Q109-L113 WeakPolarHBondContact O-CB 3.47Å; Q109-L113 PolarHBondContact O-N 3.23Å; R110-L113 WeakPolarHBondContact O-CB 3.28Å; R110-L113 PolarHBondContact O-N 2.92Å; R110-L113 VanDerWaalsContact O-N 3.12Å; G111-L113 VanDerWaalsContact C-N 3.32Å; G111-L113 PolarHBondContact O-N 3.43Å; L113-K116 PolarHBondContact O-N 3.45Å; L113-Q117 WeakPolarHBondContact O-CG 3.39Å; L113-Q117 PolarHBondContact O-N 3.47Å; L113-Q117 VanDerWaalsContact O-N 3.13Å; L113-W185 HydrophobicContact CD1-CE3 4.11Å; L113-W185 HydrophobicContact CD1-CH2 4.39Å; L113-W185 HydrophobicContact CD1-CZ3 3.45Å; L113-W185 VanDerWaalsContact CD1-CZ3 3.45Å
114	L	95.9	Very high	95	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-41.5	176.4	-70.4	166.8	0	0	0	111.3	L90 R110 G111 K116 Q117 G118 R119 E122 A123	L90-L114 HydrophobicContact CD1-CD2 3.95Å; R110-L114 HydrophobicContact CG-CD1 3.97Å; R110-L114 HydrophobicContact CG-CG 4.31Å; R110-L114 WeakPolarHBondContact O-CB 3.22Å; R110-L114 VanDerWaalsContact O-CG 3.26Å; R110-L114 WeakPolarHBondContact O-CG 3.5Å; R110-L114 PolarHBondContact O-N 3.02Å; G111-L114 PolarHBondContact O-N 3.18Å; L114-K116 PolarHBondContact O-N 3.05Å; L114-Q117 CarbonylContact O-C 3.56Å; L114-Q117 WeakPolarHBondContact O-CA 3.28Å; L114-Q117 WeakPolarHBondContact O-CB 3.46Å; L114-Q117 PolarHBondContact O-N 3.14Å; L114-Q117 VanDerWaalsContact O-N 3.1Å; L114-G118 PolarHBondContact O-N 3.02Å; L114-G118 VanDerWaalsContact O-N 3.16Å; L114-R119 HydrophobicContact CB-CB 4.26Å; L114-R119 HydrophobicContact CD2-CB 4.03Å; L114-R119 PolarHBondContact O-N 3.3Å; L114-E122 HydrophobicContact CD1-CB 3.93Å; L114-E122 HydrophobicContact CD2-CB 4.42Å; L114-A123 HydrophobicContact CB-CB 3.8Å
115	L	95.7	Very high	95.2	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-46	174.7	-177.6	64.3	0	0	0	111.2	G111 Q117 G118 L120 A123 F127 R146 I153 C183	G111-L115 WeakPolarHBondContact O-CB 3.36Å; G111-L115 PolarHBondContact O-N 3.14Å; L115-Q117 PolarHBondContact O-N 2.94Å; L115-G118 PolarHBondContact O-N 2.96Å; L115-L120 HydrophobicContact CD1-CD2 3.62Å; L115-A123 HydrophobicContact CB-CB 4.11Å; L115-F127 HydrophobicContact CD2-CE2 4.45Å; L115-R146 HydrophobicContact CD2-CB 4.44Å; L115-I153 HydrophobicContact CD1-CD1 4.29Å; L115-C183 PolarHBondContact O-SG 2.96Å
116	K	93.4	Very high	95.5	Very high	96 Å²	96	33 Å²	33	42%	0.417	16%	0.161	S	C	.	.	H	α-helix	trans	-62	-28.3	175.8	-74.3	-178.6	177.5	-174.5	0	113.3	N112 L113 L114 G118 C183 V184 W185 D186	N112-K116 WeakPolarHBondContact O-CG 3.29Å; N112-K116 PolarHBondContact O-N 2.65Å; N112-K116 VanDerWaalsContact O-N 3.12Å; L113-K116 PolarHBondContact O-N 3.45Å; L114-K116 PolarHBondContact O-N 3.05Å; K116-G118 VanDerWaalsContact C-N 3.31Å; K116-C183 CarbonylContact O-C 3.57Å; K116-C183 WeakPolarHBondContact O-CA 3.5Å; K116-V184 HydrophobicContact CB-CG2 4.41Å; K116-V184 HydrophobicContact CD-CG2 4.5Å; K116-V184 HydrophobicContact CG-CG2 4.47Å; K116-V184 PolarHBondContact O-N 3.42Å; K116-W185 HydrophobicContact CB-CD2 4.38Å; K116-W185 HydrophobicContact CB-CE3 3.62Å; K116-W185 HydrophobicContact CB-CZ3 3.93Å; K116-W185 HydrophobicContact CD-CE3 4.18Å; K116-W185 HydrophobicContact CD-CH2 4.1Å; K116-W185 HydrophobicContact CD-CZ3 3.7Å; K116-W185 HydrophobicContact CG-CZ3 4.49Å; K116-W185 CarbonylContact O-C 3.31Å; K116-W185 WeakPolarHBondContact O-CA 3.21Å; K116-W185 WeakPolarHBondContact O-CB 3.06Å; K116-W185 PolarHBondContact O-N 2.95Å; K116-D186 PolarHBondContact O-N 3.13Å
117	Q	92.8	Very high	95.6	Very high	39 Å²	39	33 Å²	33	18%	0.182	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-4.5	175.1	-70.5	178.5	-13.5	0	0	113.5	L90 L113 L114 L115 R119 W185	L90-Q117 VanDerWaalsContact CD1-OE1 3.28Å; L113-Q117 WeakPolarHBondContact O-CG 3.39Å; L113-Q117 PolarHBondContact O-N 3.47Å; L113-Q117 VanDerWaalsContact O-N 3.13Å; L114-Q117 CarbonylContact O-C 3.56Å; L114-Q117 WeakPolarHBondContact O-CA 3.28Å; L114-Q117 WeakPolarHBondContact O-CB 3.46Å; L114-Q117 PolarHBondContact O-N 3.14Å; L114-Q117 VanDerWaalsContact O-N 3.1Å; L115-Q117 PolarHBondContact O-N 2.94Å; Q117-R119 VanDerWaalsContact C-N 3.27Å; Q117-R119 HydrophobicContact CB-CG 4.34Å; Q117-R119 PolarHBondContact O-N 2.74Å; Q117-W185 HydrophobicContact CG-CB 4.4Å; Q117-W185 HydrophobicContact CG-CE3 4.47Å
118	G	93.8	Very high	95.6	Very high	20 Å²	20	36.8 Å²	36.8	21%	0.206	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	12.7	-174.6	0	0	0	0	0	114.2	L114 L115 K116 L120	L114-G118 PolarHBondContact O-N 3.02Å; L114-G118 VanDerWaalsContact O-N 3.16Å; L115-G118 PolarHBondContact O-N 2.96Å; K116-G118 VanDerWaalsContact C-N 3.31Å; G118-L120 PolarHBondContact O-N 3.04Å
119	R	95	Very high	95.6	Very high	96 Å²	96	41.5 Å²	41.5	36%	0.362	20%	0.199	S	C	.	.			trans	-84.2	67.5	175.3	-66.4	173.9	69.3	-176	7.8	109.8	L114 Q117 E122 A123	L114-R119 HydrophobicContact CB-CB 4.26Å; L114-R119 HydrophobicContact CD2-CB 4.03Å; L114-R119 PolarHBondContact O-N 3.3Å; Q117-R119 VanDerWaalsContact C-N 3.27Å; Q117-R119 HydrophobicContact CB-CG 4.34Å; Q117-R119 PolarHBondContact O-N 2.74Å; R119-E122 IonicContact CZ-OE1 2.7Å; R119-E122 IonicContact CZ-OE2 3.23Å; R119-E122 IonicContact NE-OE1 3.69Å; R119-E122 PolarHBondContact NE-OE1 3.1Å; R119-E122 IonicContact NE-OE2 2.58Å; R119-E122 IonicContact NH2-OE1 3.11Å; R119-E122 PolarHBondContact NH2-OE1 3.11Å; R119-E122 IonicContact NH2-OE2 3.32Å; R119-E122 PolarHBondContact NH2-OE2 3.11Å; R119-E122 PolarHBondContact O-N 3.41Å; R119-A123 WeakPolarHBondContact O-CB 3.48Å; R119-A123 PolarHBondContact O-N 3.34Å
120	L	95.9	Very high	95.6	Very high	9 Å²	9	38.6 Å²	38.6	5%	0.047	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-50.6	-167	-56.5	178.1	0	0	0	112.5	L115 G118 E122 A123 E124 I153 Q154 V157	L115-L120 HydrophobicContact CD1-CD2 3.62Å; G118-L120 PolarHBondContact O-N 3.04Å; L120-E122 VanDerWaalsContact C-N 3.32Å; L120-E122 PolarHBondContact O-N 3.2Å; L120-A123 WeakPolarHBondContact O-CB 3.27Å; L120-A123 PolarHBondContact O-N 3.46Å; L120-A123 VanDerWaalsContact O-N 3.15Å; L120-E124 WeakPolarHBondContact O-CG 3.48Å; L120-E124 PolarHBondContact O-N 2.95Å; L120-I153 HydrophobicContact CD1-CB 4.31Å; L120-I153 HydrophobicContact CD1-CG2 3.74Å; L120-I153 HydrophobicContact CD2-CB 4.45Å; L120-I153 HydrophobicContact CD2-CG2 4.04Å; L120-Q154 HydrophobicContact CD1-CB 4.15Å; L120-V157 HydrophobicContact CD1-CG2 4.25Å
121	D	96.1	Very high	95.5	Very high	119 Å²	119	38.7 Å²	38.7	64%	0.636	19%	0.189	S	C	*	.	H	α-helix	trans	-57.7	-43	-178.9	-63.7	-39.1	0	0	0	112.9	S125	D121-S125 WeakPolarHBondContact O-CB 3.4Å; D121-S125 PolarHBondContact O-N 3.06Å
122	E	96	Very high	95.3	Very high	90 Å²	90	45.1 Å²	45.1	42%	0.421	22%	0.223	S	C	.	.	H	α-helix	trans	-70.7	-39.8	179	-65.8	-179.7	-109.2	0	0	111.8	L114 R119 L120 S125 D126	L114-E122 HydrophobicContact CD1-CB 3.93Å; L114-E122 HydrophobicContact CD2-CB 4.42Å; R119-E122 IonicContact CZ-OE1 2.7Å; R119-E122 IonicContact CZ-OE2 3.23Å; R119-E122 IonicContact NE-OE1 3.69Å; R119-E122 PolarHBondContact NE-OE1 3.1Å; R119-E122 IonicContact NE-OE2 2.58Å; R119-E122 IonicContact NH2-OE1 3.11Å; R119-E122 PolarHBondContact NH2-OE1 3.11Å; R119-E122 IonicContact NH2-OE2 3.32Å; R119-E122 PolarHBondContact NH2-OE2 3.11Å; R119-E122 PolarHBondContact O-N 3.41Å; L120-E122 VanDerWaalsContact C-N 3.32Å; L120-E122 PolarHBondContact O-N 3.2Å; E122-S125 PolarHBondContact O-N 3.01Å; E122-D126 PolarHBondContact O-N 3.47Å
123	A	96.9	Very high	95	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-45.9	174.5	0	0	0	0	0	111	G111 L114 L115 R119 L120 D126 F127	G111-A123 WeakPolarHBondContact O-CB 3.38Å; L114-A123 HydrophobicContact CB-CB 3.8Å; L115-A123 HydrophobicContact CB-CB 4.11Å; R119-A123 WeakPolarHBondContact O-CB 3.48Å; R119-A123 PolarHBondContact O-N 3.34Å; L120-A123 WeakPolarHBondContact O-CB 3.27Å; L120-A123 PolarHBondContact O-N 3.46Å; L120-A123 VanDerWaalsContact O-N 3.15Å; A123-D126 PolarHBondContact O-N 3.05Å; A123-F127 HydrophobicContact CB-CD2 4.48Å; A123-F127 HydrophobicContact CB-CE2 4.01Å; A123-F127 WeakPolarHBondContact O-CD2 3.17Å; A123-F127 WeakPolarHBondContact O-CG 3.48Å; A123-F127 PolarHBondContact O-N 3.48Å
124	E	96.9	Very high	94.6	Very high	20 Å²	20	54 Å²	54	9%	0.093	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-43.4	177.1	-72.2	-175.1	-160.1	0	0	112.8	L120 D126 F127 K128 L147 S150	L120-E124 WeakPolarHBondContact O-CG 3.48Å; L120-E124 PolarHBondContact O-N 2.95Å; E124-D126 PolarHBondContact O-N 2.96Å; E124-F127 PolarHBondContact O-N 3.02Å; E124-K128 VanDerWaalsContact O-CB 3.31Å; E124-K128 WeakPolarHBondContact O-CB 3.44Å; E124-K128 VanDerWaalsContact O-CG 3.24Å; E124-K128 WeakPolarHBondContact O-CG 3.08Å; E124-K128 PolarHBondContact O-N 3.39Å; E124-K128 IonicContact OE2-NZ 3.24Å; E124-K128 PolarHBondContact OE2-NZ 3.03Å; E124-L147 HydrophobicContact CB-CD2 3.89Å; E124-L147 HydrophobicContact CG-CD2 3.85Å; E124-S150 WeakPolarHBondContact CG-OG 3.44Å; E124-S150 PolarHBondContact OE1-OG 3Å
125	S	96.8	Very high	94.2	Very high	46 Å²	46	54.8 Å²	54.8	32%	0.322	28%	0.28	S	S	.	.	H	α-helix	trans	-55.9	-43.7	174	153.1	0	0	0	0	110.9	D121 E122 K129	D121-S125 WeakPolarHBondContact O-CB 3.4Å; D121-S125 PolarHBondContact O-N 3.06Å; E122-S125 PolarHBondContact O-N 3.01Å; S125-K129 WeakPolarHBondContact O-CB 3.48Å; S125-K129 VanDerWaalsContact O-CG 3.28Å; S125-K129 WeakPolarHBondContact O-CG 3.33Å; S125-K129 PolarHBondContact O-N 3.34Å
126	D	96.6	Very high	94	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.011	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-46.1	178.2	-86.6	-6.3	0	0	0	112.7	R107 R110 E122 A123 E124 K129 V130	R107-D126 WeakPolarHBondContact CD-O 3.38Å; R107-D126 HydrophobicContact CG-CB 3.86Å; R110-D126 IonicContact CZ-OD1 3.39Å; R110-D126 IonicContact CZ-OD2 2.68Å; R110-D126 VanDerWaalsContact CZ-OD2 3.32Å; R110-D126 IonicContact NE-OD1 3.53Å; R110-D126 IonicContact NE-OD2 2.91Å; R110-D126 PolarHBondContact NE-OD2 2.87Å; R110-D126 VanDerWaalsContact NH2-CG 3.32Å; R110-D126 IonicContact NH2-OD1 3.62Å; R110-D126 PolarHBondContact NH2-OD1 2.69Å; R110-D126 IonicContact NH2-OD2 3.86Å; R110-D126 PolarHBondContact NH2-OD2 3.07Å; R110-D126 VanDerWaalsContact NH2-OD2 3.11Å; E122-D126 PolarHBondContact O-N 3.47Å; A123-D126 PolarHBondContact O-N 3.05Å; E124-D126 PolarHBondContact O-N 2.96Å; D126-K129 PolarHBondContact O-N 3.29Å; D126-V130 WeakPolarHBondContact O-CG2 3.39Å; D126-V130 PolarHBondContact O-N 3.29Å
127	F	97.1	Very high	93.8	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64.4	-41.7	177.5	-62.4	-49.2	0	0	0	112.2	L108 G111 L115 A123 E124 K129 V130 L131 A143 R146 L147	L108-F127 HydrophobicContact CD1-CD1 3.87Å; L108-F127 HydrophobicContact CD1-CE1 3.87Å; G111-F127 WeakPolarHBondContact O-CZ 3.4Å; L115-F127 HydrophobicContact CD2-CE2 4.45Å; A123-F127 HydrophobicContact CB-CD2 4.48Å; A123-F127 HydrophobicContact CB-CE2 4.01Å; A123-F127 WeakPolarHBondContact O-CD2 3.17Å; A123-F127 WeakPolarHBondContact O-CG 3.48Å; A123-F127 PolarHBondContact O-N 3.48Å; E124-F127 PolarHBondContact O-N 3.02Å; F127-K129 VanDerWaalsContact C-N 3.32Å; F127-K129 PolarHBondContact O-N 3.06Å; F127-V130 WeakPolarHBondContact O-CB 3.4Å; F127-V130 PolarHBondContact O-N 3.4Å; F127-V130 VanDerWaalsContact O-N 3.14Å; F127-L131 WeakPolarHBondContact O-CG 3.42Å; F127-L131 PolarHBondContact O-N 3.04Å; F127-A143 HydrophobicContact CB-CB 4.32Å; F127-A143 HydrophobicContact CD1-CB 4.32Å; F127-R146 HydrophobicContact CD1-CB 4.25Å; F127-R146 HydrophobicContact CD2-CB 3.99Å; F127-R146 HydrophobicContact CE1-CB 3.81Å; F127-R146 HydrophobicContact CE1-CG 4.1Å; F127-R146 HydrophobicContact CE2-CB 3.52Å; F127-R146 HydrophobicContact CE2-CG 4.46Å; F127-R146 HydrophobicContact CG-CB 4.34Å; F127-R146 HydrophobicContact CZ-CB 3.41Å; F127-R146 VanDerWaalsContact CZ-CB 3.41Å; F127-R146 HydrophobicContact CZ-CG 3.89Å; F127-L147 HydrophobicContact CB-CD1 3.94Å; F127-L147 HydrophobicContact CB-CD2 3.71Å; F127-L147 HydrophobicContact CB-CG 3.53Å; F127-L147 HydrophobicContact CD2-CD2 4.16Å; F127-L147 HydrophobicContact CD2-CG 4.24Å; F127-L147 HydrophobicContact CG-CD2 4.43Å; F127-L147 HydrophobicContact CG-CG 4.26Å
128	K	96.1	Very high	93.8	Very high	98 Å²	98	64.2 Å²	64.2	43%	0.426	33%	0.334	S	S	.	.	H	α-helix	trans	-59.9	-42.2	174.8	-73.7	164.9	-174	158.5	0	111.1	E124 V130 L131 N132 L147	E124-K128 VanDerWaalsContact O-CB 3.31Å; E124-K128 WeakPolarHBondContact O-CB 3.44Å; E124-K128 VanDerWaalsContact O-CG 3.24Å; E124-K128 WeakPolarHBondContact O-CG 3.08Å; E124-K128 PolarHBondContact O-N 3.39Å; E124-K128 IonicContact OE2-NZ 3.24Å; E124-K128 PolarHBondContact OE2-NZ 3.03Å; K128-V130 PolarHBondContact O-N 2.89Å; K128-L131 PolarHBondContact O-N 3.04Å; K128-N132 VanDerWaalsContact O-CG 3.25Å; K128-N132 PolarHBondContact O-N 3.49Å; K128-N132 VanDerWaalsContact O-N 3.08Å; K128-N132 PolarHBondContact O-ND2 3.21Å; K128-L147 HydrophobicContact CG-CD1 4.13Å; K128-L147 HydrophobicContact CG-CD2 4.12Å
129	K	94.9	Very high	93.7	Very high	101 Å²	101	64.4 Å²	64.4	44%	0.439	33%	0.33	S	S	.	.	H	α-helix	trans	-65.2	-35.7	174.8	-76.6	172.1	-174.2	171	0	112.8	S125 D126 F127 N132 S133	S125-K129 WeakPolarHBondContact O-CB 3.48Å; S125-K129 VanDerWaalsContact O-CG 3.28Å; S125-K129 WeakPolarHBondContact O-CG 3.33Å; S125-K129 PolarHBondContact O-N 3.34Å; D126-K129 PolarHBondContact O-N 3.29Å; F127-K129 VanDerWaalsContact C-N 3.32Å; F127-K129 PolarHBondContact O-N 3.06Å; K129-N132 PolarHBondContact O-N 3.29Å; K129-S133 WeakPolarHBondContact O-CB 3.4Å; K129-S133 PolarHBondContact O-N 2.9Å; K129-S133 PolarHBondContact O-OG 3Å
130	V	95.2	Very high	93.6	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61	-47.7	173	170	0	0	0	0	110.4	R107 L108 D126 F127 K128 N132 S133 P135 A143	R107-V130 HydrophobicContact CB-CG2 3.86Å; R107-V130 HydrophobicContact CG-CG2 3.9Å; L108-V130 HydrophobicContact CB-CG2 4.24Å; D126-V130 WeakPolarHBondContact O-CG2 3.39Å; D126-V130 PolarHBondContact O-N 3.29Å; F127-V130 WeakPolarHBondContact O-CB 3.4Å; F127-V130 PolarHBondContact O-N 3.4Å; F127-V130 VanDerWaalsContact O-N 3.14Å; K128-V130 PolarHBondContact O-N 2.89Å; V130-N132 PolarHBondContact O-N 3.34Å; V130-S133 PolarHBondContact O-N 2.86Å; V130-S133 VanDerWaalsContact O-N 3.1Å; V130-P135 HydrophobicContact CG1-CB 3.99Å; V130-P135 WeakPolarHBondContact O-CD 3.42Å; V130-A143 HydrophobicContact CB-CB 4.44Å; V130-A143 HydrophobicContact CG1-CB 4.12Å
131	L	94.3	Very high	93.5	Very high	47 Å²	47	70 Å²	70	25%	0.246	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-32.1	178.5	-64.5	178.9	0	0	0	113.1	F127 K128 S133 E140 A143 Q144 L147	F127-L131 WeakPolarHBondContact O-CG 3.42Å; F127-L131 PolarHBondContact O-N 3.04Å; K128-L131 PolarHBondContact O-N 3.04Å; L131-S133 VanDerWaalsContact C-N 3.31Å; L131-S133 PolarHBondContact O-N 3.42Å; L131-E140 HydrophobicContact CD2-CB 4.37Å; L131-E140 HydrophobicContact CD2-CG 3.56Å; L131-A143 HydrophobicContact CD2-CB 3.82Å; L131-A143 HydrophobicContact CG-CB 4.07Å; L131-Q144 HydrophobicContact CD1-CG 4Å; L131-Q144 HydrophobicContact CD2-CG 3.89Å; L131-L147 HydrophobicContact CD1-CD1 3.53Å
132	N	92.9	Very high	93.5	Very high	136 Å²	136	66.7 Å²	66.7	73%	0.727	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-2.3	178.2	-65	-17	0	0	0	114.3	K128 K129 V130	K128-N132 VanDerWaalsContact O-CG 3.25Å; K128-N132 PolarHBondContact O-N 3.49Å; K128-N132 VanDerWaalsContact O-N 3.08Å; K128-N132 PolarHBondContact O-ND2 3.21Å; K129-N132 PolarHBondContact O-N 3.29Å; V130-N132 PolarHBondContact O-N 3.34Å
133	S	88.9	Confident	93.5	Very high	51 Å²	51	62.4 Å²	62.4	36%	0.357	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	26.7	-171.3	-58.9	0	0	0	0	113.9	T104 K129 V130 L131	T104-S133 VanDerWaalsContact CG2-CB 3.47Å; K129-S133 WeakPolarHBondContact O-CB 3.4Å; K129-S133 PolarHBondContact O-N 2.9Å; K129-S133 PolarHBondContact O-OG 3Å; V130-S133 PolarHBondContact O-N 2.86Å; V130-S133 VanDerWaalsContact O-N 3.1Å; L131-S133 VanDerWaalsContact C-N 3.31Å; L131-S133 PolarHBondContact O-N 3.42Å
134	N	85.7	Confident	93.4	Very high	158 Å²	158	66.2 Å²	66.2	85%	0.845	34%	0.336	S	S	*	.			trans	49.6	63	-174	-63.8	-22.1	0	0	0	112.8
135	P	87.5	Confident	93.4	Very high	20 Å²	20	68.8 Å²	68.8	13%	0.13	36%	0.357	C	S	.	.			trans	-67.3	164.5	-178.9	31.6	-36.1	0	0	0	112	V130 D139 E140	V130-P135 HydrophobicContact CG1-CB 3.99Å; V130-P135 WeakPolarHBondContact O-CD 3.42Å; P135-D139 HydrophobicContact CB-CB 4.02Å; P135-E140 HydrophobicContact CB-CB 4.39Å; P135-E140 HydrophobicContact CG-CB 3.77Å; P135-E140 HydrophobicContact CG-CG 3.95Å
136	S	90.3	Very high	93.4	Very high	59 Å²	59	71.1 Å²	71.1	41%	0.413	36%	0.358	S	S	.	.			trans	-65.8	153	165.6	71.4	0	0	0	0	110.4	K138 D139 E140	S136-K138 PolarHBondContact O-N 2.93Å; S136-D139 PolarHBondContact O-N 3.32Å; S136-D139 WeakPolarHBondContact OG-CB 3.36Å; S136-D139 PolarHBondContact OG-N 3.49Å; S136-D139 PolarHBondContact OG-OD2 2.02Å; S136-E140 PolarHBondContact O-N 3.03Å
137	D	91.3	Very high	93.4	Very high	122 Å²	122	71.9 Å²	71.9	65%	0.652	36%	0.362	S	S	*	.	H	α-helix	trans	-50.4	-33.4	176.9	-68.1	3.7	0	0	0	113.2	K141	D137-K141 VanDerWaalsContact O-CG 3.26Å; D137-K141 WeakPolarHBondContact O-CG 3.36Å; D137-K141 PolarHBondContact O-N 3.43Å
138	K	92.1	Very high	93.3	Very high	155 Å²	155	79.3 Å²	79.3	67%	0.674	40%	0.395	S	S	*	.	H	α-helix	trans	-69.9	-51.2	176.7	-178.8	-175.2	172.6	-173.8	0	111.2	S136 E140 K141 E142	S136-K138 PolarHBondContact O-N 2.93Å; K138-E140 VanDerWaalsContact C-N 3.28Å; K138-E140 PolarHBondContact O-N 3.28Å; K138-K141 PolarHBondContact O-N 3.35Å; K138-E142 WeakPolarHBondContact O-CB 3.35Å; K138-E142 PolarHBondContact O-N 3.39Å
139	D	90.8	Very high	93.3	Very high	24 Å²	24	77.3 Å²	77.3	13%	0.128	39%	0.386	C	S	.	.	H	α-helix	trans	-65.9	-34	-178.8	-63.7	-31.4	0	0	0	111.1	L108 P135 S136 A143	L108-D139 HydrophobicContact CD2-CB 3.98Å; L108-D139 WeakPolarHBondContact CD2-OD1 3.4Å; P135-D139 HydrophobicContact CB-CB 4.02Å; S136-D139 PolarHBondContact O-N 3.32Å; S136-D139 WeakPolarHBondContact OG-CB 3.36Å; S136-D139 PolarHBondContact OG-N 3.49Å; S136-D139 PolarHBondContact OG-OD2 2.02Å; D139-A143 VanDerWaalsContact O-CB 3.24Å; D139-A143 WeakPolarHBondContact O-CB 3.29Å; D139-A143 PolarHBondContact O-N 2.62Å
140	E	92.9	Very high	93.4	Very high	76 Å²	76	72.5 Å²	72.5	36%	0.355	37%	0.365	S	S	.	.	H	α-helix	trans	-62.5	-52.7	174.7	-161.5	-169.8	147.5	0	0	111.4	L131 P135 S136 K138 E142 A143 Q144	L131-E140 HydrophobicContact CD2-CB 4.37Å; L131-E140 HydrophobicContact CD2-CG 3.56Å; P135-E140 HydrophobicContact CB-CB 4.39Å; P135-E140 HydrophobicContact CG-CB 3.77Å; P135-E140 HydrophobicContact CG-CG 3.95Å; S136-E140 PolarHBondContact O-N 3.03Å; K138-E140 VanDerWaalsContact C-N 3.28Å; K138-E140 PolarHBondContact O-N 3.28Å; E140-E142 VanDerWaalsContact C-N 3.3Å; E140-E142 PolarHBondContact O-N 2.91Å; E140-A143 PolarHBondContact O-N 2.99Å; E140-Q144 WeakPolarHBondContact O-CB 3.26Å; E140-Q144 WeakPolarHBondContact O-CG 3.46Å; E140-Q144 PolarHBondContact O-N 3.46Å; E140-Q144 PolarHBondContact OE1-NE2 2.96Å
141	K	95.1	Very high	93.3	Very high	147 Å²	147	75.8 Å²	75.8	64%	0.639	38%	0.383	S	S	*	.	H	α-helix	trans	-61.1	-40.5	178.2	-73.2	173.8	-173.6	175.5	0	111.7	D137 K138 S145	D137-K141 VanDerWaalsContact O-CG 3.26Å; D137-K141 WeakPolarHBondContact O-CG 3.36Å; D137-K141 PolarHBondContact O-N 3.43Å; K138-K141 PolarHBondContact O-N 3.35Å; K141-S145 VanDerWaalsContact O-CB 3.31Å; K141-S145 WeakPolarHBondContact O-CB 3.45Å; K141-S145 PolarHBondContact O-N 3.09Å
142	E	95.4	Very high	93.4	Very high	49 Å²	49	77.2 Å²	77.2	23%	0.229	39%	0.388	C	S	.	.	H	α-helix	trans	-64	-51.2	176.4	-172.3	172.5	165.9	0	0	110.9	L108 N112 K138 E140 Q144 S145 R146	L108-E142 HydrophobicContact CD1-CG 4.28Å; L108-E142 HydrophobicContact CD2-CB 4.33Å; L108-E142 HydrophobicContact CD2-CG 4.33Å; N112-E142 PolarHBondContact ND2-OE1 2.86Å; K138-E142 WeakPolarHBondContact O-CB 3.35Å; K138-E142 PolarHBondContact O-N 3.39Å; E140-E142 VanDerWaalsContact C-N 3.3Å; E140-E142 PolarHBondContact O-N 2.91Å; E142-Q144 PolarHBondContact O-N 2.82Å; E142-S145 PolarHBondContact O-N 3Å; E142-R146 HydrophobicContact CG-CG 4.29Å; E142-R146 VanDerWaalsContact O-CG 3.23Å; E142-R146 WeakPolarHBondContact O-CG 3.38Å; E142-R146 PolarHBondContact O-N 3.13Å
143	A	95.5	Very high	93.5	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-59.4	-43	179.2	0	0	0	0	0	112.4	L108 F127 V130 L131 D139 E140 R146 L147	L108-A143 HydrophobicContact CD1-CB 4.02Å; F127-A143 HydrophobicContact CB-CB 4.32Å; F127-A143 HydrophobicContact CD1-CB 4.32Å; V130-A143 HydrophobicContact CB-CB 4.44Å; V130-A143 HydrophobicContact CG1-CB 4.12Å; L131-A143 HydrophobicContact CD2-CB 3.82Å; L131-A143 HydrophobicContact CG-CB 4.07Å; D139-A143 VanDerWaalsContact O-CB 3.24Å; D139-A143 WeakPolarHBondContact O-CB 3.29Å; D139-A143 PolarHBondContact O-N 2.62Å; E140-A143 PolarHBondContact O-N 2.99Å; A143-R146 PolarHBondContact O-N 3.44Å; A143-L147 WeakPolarHBondContact O-CB 3.45Å; A143-L147 WeakPolarHBondContact O-CG 3.35Å; A143-L147 PolarHBondContact O-N 3.1Å
144	Q	95.9	Very high	93.8	Very high	79 Å²	79	71.5 Å²	71.5	37%	0.369	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-43	175.9	-73.2	176.4	6.9	0	0	112.4	L131 E140 E142 L147 K148	L131-Q144 HydrophobicContact CD1-CG 4Å; L131-Q144 HydrophobicContact CD2-CG 3.89Å; E140-Q144 WeakPolarHBondContact O-CB 3.26Å; E140-Q144 WeakPolarHBondContact O-CG 3.46Å; E140-Q144 PolarHBondContact O-N 3.46Å; E140-Q144 PolarHBondContact OE1-NE2 2.96Å; E142-Q144 PolarHBondContact O-N 2.82Å; Q144-L147 PolarHBondContact O-N 3.47Å; Q144-K148 WeakPolarHBondContact O-CG 3.44Å; Q144-K148 PolarHBondContact O-N 3.47Å; Q144-K148 VanDerWaalsContact O-N 3.14Å
145	S	96.7	Very high	94.3	Very high	75 Å²	75	72.3 Å²	72.3	52%	0.524	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-44.8	177.3	-178.1	0	0	0	0	111.4	K141 E142 K148 K149	K141-S145 VanDerWaalsContact O-CB 3.31Å; K141-S145 WeakPolarHBondContact O-CB 3.45Å; K141-S145 PolarHBondContact O-N 3.09Å; E142-S145 PolarHBondContact O-N 3Å; S145-K148 PolarHBondContact O-N 2.88Å; S145-K149 PolarHBondContact O-N 3.43Å; S145-K149 VanDerWaalsContact O-N 3.12Å
146	R	96.4	Very high	94.7	Very high	94 Å²	94	73.5 Å²	73.5	36%	0.355	34%	0.344	S	S	.	.	H	α-helix	trans	-66.6	-37	178.3	-63.9	-67	-179.1	-160.7	-3.5	112.9	N112 L115 F127 E142 A143 K149 S150	N112-R146 WeakPolarHBondContact OD1-CD 3.41Å; N112-R146 WeakPolarHBondContact OD1-CG 3.44Å; N112-R146 PolarHBondContact OD1-NE 2.98Å; N112-R146 VanDerWaalsContact OD1-NE 3.13Å; L115-R146 HydrophobicContact CD2-CB 4.44Å; F127-R146 HydrophobicContact CD1-CB 4.25Å; F127-R146 HydrophobicContact CD2-CB 3.99Å; F127-R146 HydrophobicContact CE1-CB 3.81Å; F127-R146 HydrophobicContact CE1-CG 4.1Å; F127-R146 HydrophobicContact CE2-CB 3.52Å; F127-R146 HydrophobicContact CE2-CG 4.46Å; F127-R146 HydrophobicContact CG-CB 4.34Å; F127-R146 HydrophobicContact CZ-CB 3.41Å; F127-R146 VanDerWaalsContact CZ-CB 3.41Å; F127-R146 HydrophobicContact CZ-CG 3.89Å; E142-R146 HydrophobicContact CG-CG 4.29Å; E142-R146 VanDerWaalsContact O-CG 3.23Å; E142-R146 WeakPolarHBondContact O-CG 3.38Å; E142-R146 PolarHBondContact O-N 3.13Å; A143-R146 PolarHBondContact O-N 3.44Å; R146-K149 PolarHBondContact O-N 3.17Å; R146-S150 PolarHBondContact O-N 3.47Å
147	L	96	Very high	95	Very high	19 Å²	19	71.7 Å²	71.7	10%	0.099	33%	0.331	C	S	.	.	H	α-helix	trans	-61.2	-50.4	173.6	-81.7	171.4	0	0	0	112.2	E124 F127 K128 L131 A143 Q144 K149 S150 D151	E124-L147 HydrophobicContact CB-CD2 3.89Å; E124-L147 HydrophobicContact CG-CD2 3.85Å; F127-L147 HydrophobicContact CB-CD1 3.94Å; F127-L147 HydrophobicContact CB-CD2 3.71Å; F127-L147 HydrophobicContact CB-CG 3.53Å; F127-L147 HydrophobicContact CD2-CD2 4.16Å; F127-L147 HydrophobicContact CD2-CG 4.24Å; F127-L147 HydrophobicContact CG-CD2 4.43Å; F127-L147 HydrophobicContact CG-CG 4.26Å; K128-L147 HydrophobicContact CG-CD1 4.13Å; K128-L147 HydrophobicContact CG-CD2 4.12Å; L131-L147 HydrophobicContact CD1-CD1 3.53Å; A143-L147 WeakPolarHBondContact O-CB 3.45Å; A143-L147 WeakPolarHBondContact O-CG 3.35Å; A143-L147 PolarHBondContact O-N 3.1Å; Q144-L147 PolarHBondContact O-N 3.47Å; L147-K149 PolarHBondContact O-N 2.91Å; L147-S150 WeakPolarHBondContact O-CB 3.24Å; L147-S150 PolarHBondContact O-N 2.94Å; L147-D151 PolarHBondContact O-N 3.27Å
148	K	96.1	Very high	95.2	Very high	156 Å²	156	70 Å²	70	68%	0.678	33%	0.325	S	S	*	.	H	α-helix	trans	-56.9	-39.1	177	-70.3	176.4	-177.6	178.6	0	111.8	Q144 S145 E152	Q144-K148 WeakPolarHBondContact O-CG 3.44Å; Q144-K148 PolarHBondContact O-N 3.47Å; Q144-K148 VanDerWaalsContact O-N 3.14Å; S145-K148 PolarHBondContact O-N 2.88Å; K148-E152 PolarHBondContact O-N 3.27Å; K148-E152 VanDerWaalsContact O-N 3.14Å
149	K	95.6	Very high	95.5	Very high	55 Å²	55	67 Å²	67	24%	0.239	31%	0.313	C	S	.	.	H	α-helix	trans	-69.1	-39.6	177	-169.5	51.6	166	172.1	0	112.2	S145 R146 L147 E152 I153 T182	S145-K149 PolarHBondContact O-N 3.43Å; S145-K149 VanDerWaalsContact O-N 3.12Å; R146-K149 PolarHBondContact O-N 3.17Å; L147-K149 PolarHBondContact O-N 2.91Å; K149-E152 VanDerWaalsContact CD-OE2 3.22Å; K149-E152 WeakPolarHBondContact CD-OE2 3.46Å; K149-E152 IonicContact NZ-OE2 2.74Å; K149-E152 PolarHBondContact NZ-OE2 3.43Å; K149-E152 PolarHBondContact O-N 2.87Å; K149-I153 HydrophobicContact CD-CD1 4.25Å; K149-I153 HydrophobicContact CD-CG1 4.44Å; K149-I153 HydrophobicContact CG-CD1 3.96Å; K149-I153 WeakPolarHBondContact O-CD1 3.3Å; K149-I153 VanDerWaalsContact O-CG1 3.22Å; K149-I153 WeakPolarHBondContact O-CG1 3.47Å; K149-I153 PolarHBondContact O-N 3.47Å; K149-T182 VanDerWaalsContact CE-OG1 3.29Å; K149-T182 WeakPolarHBondContact CE-OG1 3.44Å; K149-T182 HydrophobicContact CG-CG2 4.1Å
150	S	96.3	Very high	95.8	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-47.6	173.4	-170.8	0	0	0	0	111.5	E124 R146 L147 E152 I153 Q154	E124-S150 WeakPolarHBondContact CG-OG 3.44Å; E124-S150 PolarHBondContact OE1-OG 3Å; R146-S150 PolarHBondContact O-N 3.47Å; L147-S150 WeakPolarHBondContact O-CB 3.24Å; L147-S150 PolarHBondContact O-N 2.94Å; S150-E152 VanDerWaalsContact C-N 3.3Å; S150-E152 PolarHBondContact O-N 3.33Å; S150-I153 PolarHBondContact O-N 3.08Å; S150-I153 VanDerWaalsContact O-N 3.15Å; S150-Q154 WeakPolarHBondContact O-CB 3.38Å; S150-Q154 PolarHBondContact O-N 2.96Å
151	D	94.6	Very high	96	Very high	70 Å²	70	68.3 Å²	68.3	37%	0.374	31%	0.313	S	S	.	.	H	α-helix	trans	-58.9	-41.4	178	-68.9	-33	0	0	0	112	L147 R155	L147-D151 PolarHBondContact O-N 3.27Å; D151-R155 WeakPolarHBondContact O-CG 3.34Å; D151-R155 PolarHBondContact O-N 3.33Å
152	E	95.2	Very high	96.1	Very high	77 Å²	77	63 Å²	63	36%	0.36	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-47.3	175.9	-175.6	-177.5	-149	0	0	111.3	K148 K149 S150 Q154 R155 W156	K148-E152 PolarHBondContact O-N 3.27Å; K148-E152 VanDerWaalsContact O-N 3.14Å; K149-E152 VanDerWaalsContact CD-OE2 3.22Å; K149-E152 WeakPolarHBondContact CD-OE2 3.46Å; K149-E152 IonicContact NZ-OE2 2.74Å; K149-E152 PolarHBondContact NZ-OE2 3.43Å; K149-E152 PolarHBondContact O-N 2.87Å; S150-E152 VanDerWaalsContact C-N 3.3Å; S150-E152 PolarHBondContact O-N 3.33Å; E152-Q154 PolarHBondContact O-N 3.03Å; E152-R155 WeakPolarHBondContact O-CB 3.36Å; E152-R155 PolarHBondContact O-N 3.3Å; E152-W156 HydrophobicContact CG-CD2 4.17Å; E152-W156 HydrophobicContact CG-CE3 4.23Å; E152-W156 HydrophobicContact CG-CH2 3.6Å; E152-W156 HydrophobicContact CG-CZ2 3.51Å; E152-W156 HydrophobicContact CG-CZ3 3.97Å; E152-W156 PolarHBondContact O-N 3.47Å; E152-W156 VanDerWaalsContact O-N 3.1Å; E152-W156 VanDerWaalsContact OE1-CH2 3.22Å; E152-W156 WeakPolarHBondContact OE1-CH2 3.43Å; E152-W156 WeakPolarHBondContact OE1-CZ2 3.35Å
153	I	96	Very high	96.2	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-65.7	-40.4	179.8	-66	165.6	0	0	0	110.8	L115 L120 K149 S150 R155 W156 V157 I179 T182	L115-I153 HydrophobicContact CD1-CD1 4.29Å; L120-I153 HydrophobicContact CD1-CB 4.31Å; L120-I153 HydrophobicContact CD1-CG2 3.74Å; L120-I153 HydrophobicContact CD2-CB 4.45Å; L120-I153 HydrophobicContact CD2-CG2 4.04Å; K149-I153 HydrophobicContact CD-CD1 4.25Å; K149-I153 HydrophobicContact CD-CG1 4.44Å; K149-I153 HydrophobicContact CG-CD1 3.96Å; K149-I153 WeakPolarHBondContact O-CD1 3.3Å; K149-I153 VanDerWaalsContact O-CG1 3.22Å; K149-I153 WeakPolarHBondContact O-CG1 3.47Å; K149-I153 PolarHBondContact O-N 3.47Å; S150-I153 PolarHBondContact O-N 3.08Å; S150-I153 VanDerWaalsContact O-N 3.15Å; I153-R155 PolarHBondContact O-N 2.86Å; I153-W156 HydrophobicContact CG1-CE3 4.08Å; I153-W156 HydrophobicContact CG1-CZ3 4.18Å; I153-W156 CarbonylContact O-C 3.49Å; I153-W156 PolarHBondContact O-N 3.09Å; I153-W156 VanDerWaalsContact O-N 3.08Å; I153-V157 HydrophobicContact CG2-CG2 4.22Å; I153-V157 WeakPolarHBondContact O-CG2 3.37Å; I153-V157 PolarHBondContact O-N 2.87Å; I153-I179 HydrophobicContact CG2-CG1 4.22Å; I153-I179 HydrophobicContact CG2-CG2 3.97Å; I153-T182 HydrophobicContact CD1-CG2 3.61Å
154	Q	95.6	Very high	96.3	Very high	67 Å²	67	63.8 Å²	63.8	31%	0.313	30%	0.301	S	S	.	.	H	α-helix	trans	-58.2	-39.4	177	-173	66.1	33.7	0	0	111.6	L120 S150 E152 T158	L120-Q154 HydrophobicContact CD1-CB 4.15Å; S150-Q154 WeakPolarHBondContact O-CB 3.38Å; S150-Q154 PolarHBondContact O-N 2.96Å; E152-Q154 PolarHBondContact O-N 3.03Å; Q154-T158 PolarHBondContact O-N 3.32Å; Q154-T158 VanDerWaalsContact O-N 3.14Å; Q154-T158 PolarHBondContact O-OG1 3.27Å
155	R	95.4	Very high	96.4	Very high	174 Å²	174	66 Å²	66	66%	0.657	32%	0.315	S	S	*	.	H	α-helix	trans	-64.8	-46.3	174	-67.8	169.8	-173.3	178.8	3.1	111.3	D151 E152 I153 V157 T158 Q159	D151-R155 WeakPolarHBondContact O-CG 3.34Å; D151-R155 PolarHBondContact O-N 3.33Å; E152-R155 WeakPolarHBondContact O-CB 3.36Å; E152-R155 PolarHBondContact O-N 3.3Å; I153-R155 PolarHBondContact O-N 2.86Å; R155-V157 PolarHBondContact O-N 3.43Å; R155-T158 PolarHBondContact O-N 2.99Å; R155-Q159 WeakPolarHBondContact O-CG 3.46Å; R155-Q159 PolarHBondContact O-N 2.97Å
156	W	96.4	Very high	96.4	Very high	46 Å²	46	71.5 Å²	71.5	17%	0.174	32%	0.324	C	S	.	.	H	α-helix	trans	-62.8	-39.5	177	-66.8	-31.7	0	0	0	112.8	E152 I153 T158 Q159 S160 L178 I179	E152-W156 HydrophobicContact CG-CD2 4.17Å; E152-W156 HydrophobicContact CG-CE3 4.23Å; E152-W156 HydrophobicContact CG-CH2 3.6Å; E152-W156 HydrophobicContact CG-CZ2 3.51Å; E152-W156 HydrophobicContact CG-CZ3 3.97Å; E152-W156 PolarHBondContact O-N 3.47Å; E152-W156 VanDerWaalsContact O-N 3.1Å; E152-W156 VanDerWaalsContact OE1-CH2 3.22Å; E152-W156 WeakPolarHBondContact OE1-CH2 3.43Å; E152-W156 WeakPolarHBondContact OE1-CZ2 3.35Å; I153-W156 HydrophobicContact CG1-CE3 4.08Å; I153-W156 HydrophobicContact CG1-CZ3 4.18Å; I153-W156 CarbonylContact O-C 3.49Å; I153-W156 PolarHBondContact O-N 3.09Å; I153-W156 VanDerWaalsContact O-N 3.08Å; W156-T158 VanDerWaalsContact C-N 3.28Å; W156-T158 PolarHBondContact O-N 2.91Å; W156-Q159 PolarHBondContact O-N 3.47Å; W156-S160 VanDerWaalsContact O-CB 3.32Å; W156-S160 WeakPolarHBondContact O-CB 3.5Å; W156-S160 PolarHBondContact O-N 3.1Å; W156-S160 PolarHBondContact O-OG 2.7Å; W156-S160 VanDerWaalsContact O-OG 3.12Å; W156-L178 HydrophobicContact CE3-CB 4.26Å; W156-L178 HydrophobicContact CH2-CB 4.39Å; W156-L178 HydrophobicContact CZ2-CD1 4.38Å; W156-L178 HydrophobicContact CZ3-CB 4.09Å; W156-I179 HydrophobicContact CB-CD1 3.82Å; W156-I179 HydrophobicContact CB-CG1 3.82Å; W156-I179 HydrophobicContact CE3-CG1 4.28Å
157	V	96	Very high	96.4	Very high	21 Å²	21	74.3 Å²	74.3	13%	0.127	34%	0.339	C	S	.	.	H	α-helix	trans	-60.6	-41	175.8	169.6	0	0	0	0	110.8	L120 I153 R155 S160 R161 I179	L120-V157 HydrophobicContact CD1-CG2 4.25Å; I153-V157 HydrophobicContact CG2-CG2 4.22Å; I153-V157 WeakPolarHBondContact O-CG2 3.37Å; I153-V157 PolarHBondContact O-N 2.87Å; R155-V157 PolarHBondContact O-N 3.43Å; V157-S160 PolarHBondContact O-OG 3.44Å; V157-R161 VanDerWaalsContact O-CG 3.27Å; V157-R161 WeakPolarHBondContact O-CG 3.28Å; V157-R161 PolarHBondContact O-N 3.22Å; V157-I179 HydrophobicContact CB-CD1 4.48Å; V157-I179 HydrophobicContact CG2-CD1 3.75Å; V157-I179 HydrophobicContact CG2-CG1 4.4Å; V157-I179 HydrophobicContact CG2-CG2 4.46Å
158	T	96.1	Very high	96.5	Very high	85 Å²	85	76.3 Å²	76.3	52%	0.521	35%	0.35	S	S	.	.	H	α-helix	trans	-68	-43.4	177.5	-52.8	0	0	0	0	111.2	Q154 R155 W156 A162	Q154-T158 PolarHBondContact O-N 3.32Å; Q154-T158 VanDerWaalsContact O-N 3.14Å; Q154-T158 PolarHBondContact O-OG1 3.27Å; R155-T158 PolarHBondContact O-N 2.99Å; W156-T158 VanDerWaalsContact C-N 3.28Å; W156-T158 PolarHBondContact O-N 2.91Å; T158-A162 WeakPolarHBondContact O-CB 3.21Å; T158-A162 PolarHBondContact O-N 2.86Å; T158-A162 VanDerWaalsContact O-N 3.08Å
159	Q	96.8	Very high	96.6	Very high	92 Å²	92	70.9 Å²	70.9	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-67.6	-42.8	179.2	-72	175.5	-5.1	0	0	112.6	R155 W156 R161 A162 N163	R155-Q159 WeakPolarHBondContact O-CG 3.46Å; R155-Q159 PolarHBondContact O-N 2.97Å; W156-Q159 PolarHBondContact O-N 3.47Å; Q159-R161 VanDerWaalsContact C-N 3.34Å; Q159-R161 PolarHBondContact O-N 3.16Å; Q159-A162 PolarHBondContact O-N 2.97Å; Q159-N163 WeakPolarHBondContact O-CB 3.29Å; Q159-N163 VanDerWaalsContact O-CG 3.31Å; Q159-N163 PolarHBondContact O-N 2.98Å; Q159-N163 PolarHBondContact O-ND2 3.17Å
160	S	97.3	Very high	96.7	Very high	1 Å²	1	74 Å²	74	1%	0.007	34%	0.343	C	S	.	.	H	α-helix	trans	-65.2	-39.8	-179	65.6	0	0	0	0	111.2	W156 V157 N163 F164 A172 Q175	W156-S160 VanDerWaalsContact O-CB 3.32Å; W156-S160 WeakPolarHBondContact O-CB 3.5Å; W156-S160 PolarHBondContact O-N 3.1Å; W156-S160 PolarHBondContact O-OG 2.7Å; W156-S160 VanDerWaalsContact O-OG 3.12Å; V157-S160 PolarHBondContact O-OG 3.44Å; S160-N163 PolarHBondContact O-N 2.71Å; S160-F164 VanDerWaalsContact O-CB 3.31Å; S160-F164 WeakPolarHBondContact O-CB 3.47Å; S160-F164 PolarHBondContact O-N 3.49Å; S160-A172 WeakPolarHBondContact O-CB 3.48Å; S160-Q175 VanDerWaalsContact CA-OE1 3.29Å
161	R	96.8	Very high	96.8	Very high	127 Å²	127	76.6 Å²	76.6	48%	0.479	36%	0.36	S	S	.	.	H	α-helix	trans	-61.7	-47.4	170.9	-71.4	174.9	-174.8	-87.4	0.4	112	V157 Q159 N163 F164 D165 L192	V157-R161 VanDerWaalsContact O-CG 3.27Å; V157-R161 WeakPolarHBondContact O-CG 3.28Å; V157-R161 PolarHBondContact O-N 3.22Å; Q159-R161 VanDerWaalsContact C-N 3.34Å; Q159-R161 PolarHBondContact O-N 3.16Å; R161-N163 VanDerWaalsContact C-N 3.31Å; R161-N163 PolarHBondContact O-N 3.13Å; R161-F164 WeakPolarHBondContact O-CB 3.35Å; R161-F164 PolarHBondContact O-N 3.33Å; R161-D165 VanDerWaalsContact O-CG 3.26Å; R161-D165 PolarHBondContact O-N 3.29Å; R161-L192 HydrophobicContact CG-CD2 3.95Å
162	A	97.6	Very high	97	Very high	36 Å²	36	73.3 Å²	73.3	30%	0.298	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-37	177.9	0	0	0	0	0	112.8	T158 Q159 R166	T158-A162 WeakPolarHBondContact O-CB 3.21Å; T158-A162 PolarHBondContact O-N 2.86Å; T158-A162 VanDerWaalsContact O-N 3.08Å; Q159-A162 PolarHBondContact O-N 2.97Å; A162-R166 WeakPolarHBondContact O-CD 3.4Å; A162-R166 WeakPolarHBondContact O-CG 2.98Å; A162-R166 PolarHBondContact O-N 3.42Å; A162-R166 VanDerWaalsContact O-N 3.14Å
163	N	97.9	Very high	97.1	Very high	23 Å²	23	69.9 Å²	69.9	12%	0.123	33%	0.327	C	S	.	.	H	α-helix	trans	-69.5	-41	175.1	-73.9	-28.6	0	0	0	111.4	Q159 S160 R161 D165 R166 K167 D168 A172 Q175	Q159-N163 WeakPolarHBondContact O-CB 3.29Å; Q159-N163 VanDerWaalsContact O-CG 3.31Å; Q159-N163 PolarHBondContact O-N 2.98Å; Q159-N163 PolarHBondContact O-ND2 3.17Å; S160-N163 PolarHBondContact O-N 2.71Å; R161-N163 VanDerWaalsContact C-N 3.31Å; R161-N163 PolarHBondContact O-N 3.13Å; N163-D165 PolarHBondContact O-N 3.45Å; N163-R166 CarbonylContact O-C 3.49Å; N163-R166 PolarHBondContact O-N 3.02Å; N163-K167 PolarHBondContact O-N 3.21Å; N163-K167 VanDerWaalsContact O-N 3.16Å; N163-D168 HydrophobicContact CB-CB 4.39Å; N163-D168 PolarHBondContact O-N 3.31Å; N163-A172 HydrophobicContact CB-CB 3.98Å; N163-Q175 PolarHBondContact ND2-OE1 3.48Å
164	F	97.8	Very high	97.1	Very high	42 Å²	42	72.4 Å²	72.4	18%	0.184	35%	0.347	C	S	.	.	H	α-helix	trans	-58.1	-47	173	-176.9	-88.7	0	0	0	111.6	S160 R161 R166 K167 Y169 A172 L192 E195	S160-F164 VanDerWaalsContact O-CB 3.31Å; S160-F164 WeakPolarHBondContact O-CB 3.47Å; S160-F164 PolarHBondContact O-N 3.49Å; R161-F164 WeakPolarHBondContact O-CB 3.35Å; R161-F164 PolarHBondContact O-N 3.33Å; F164-R166 PolarHBondContact O-N 3.48Å; F164-K167 WeakPolarHBondContact O-CA 3.49Å; F164-K167 PolarHBondContact O-N 3.27Å; F164-Y169 AromaticContact CD2-CD1 3.91Å; F164-Y169 HydrophobicContact CD2-CD1 3.91Å; F164-Y169 HydrophobicContact CD2-CE1 4.05Å; F164-Y169 HydrophobicContact CE2-CD1 4.04Å; F164-Y169 AromaticContact CE2-CE1 3.93Å; F164-Y169 HydrophobicContact CE2-CE1 3.93Å; F164-Y169 HydrophobicContact CZ-CE1 4.37Å; F164-A172 HydrophobicContact CB-CB 4.3Å; F164-L192 HydrophobicContact CB-CD1 4.37Å; F164-L192 HydrophobicContact CD1-CD1 4.01Å; F164-L192 HydrophobicContact CD2-CD1 3.64Å; F164-L192 HydrophobicContact CD2-CG 4.38Å; F164-L192 HydrophobicContact CE1-CD1 4.22Å; F164-L192 HydrophobicContact CE2-CD1 3.86Å; F164-L192 HydrophobicContact CG-CD1 3.72Å; F164-L192 HydrophobicContact CZ-CD1 4.15Å; F164-E195 HydrophobicContact CE2-CB 3.96Å; F164-E195 HydrophobicContact CE2-CG 3.67Å; F164-E195 HydrophobicContact CZ-CB 4.21Å; F164-E195 HydrophobicContact CZ-CG 3.49Å; F164-E195 VanDerWaalsContact CZ-CG 3.49Å
165	D	97.3	Very high	97.2	Very high	126 Å²	126	70.5 Å²	70.5	67%	0.674	34%	0.339	S	S	*	.	H	α-helix	trans	-63.2	-31.4	178	-66	-24.6	0	0	0	112.3	R161 N163 K167	R161-D165 VanDerWaalsContact O-CG 3.26Å; R161-D165 PolarHBondContact O-N 3.29Å; N163-D165 PolarHBondContact O-N 3.45Å; D165-K167 PolarHBondContact O-N 3.15Å
166	R	97.6	Very high	97.3	Very high	191 Å²	191	62.3 Å²	62.3	72%	0.721	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-0.5	173	-69.7	169.9	-175.5	179.7	1.1	113.5	A162 N163 F164 D168	A162-R166 WeakPolarHBondContact O-CD 3.4Å; A162-R166 WeakPolarHBondContact O-CG 2.98Å; A162-R166 PolarHBondContact O-N 3.42Å; A162-R166 VanDerWaalsContact O-N 3.14Å; N163-R166 CarbonylContact O-C 3.49Å; N163-R166 PolarHBondContact O-N 3.02Å; F164-R166 PolarHBondContact O-N 3.48Å; R166-D168 PolarHBondContact O-N 3.36Å
167	K	97.3	Very high	97.3	Very high	152 Å²	152	63 Å²	63	66%	0.661	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	18.9	-174.3	-50.6	-177.7	178.2	-178.5	0	114.5	N163 F164 D165 Y169	N163-K167 PolarHBondContact O-N 3.21Å; N163-K167 VanDerWaalsContact O-N 3.16Å; F164-K167 WeakPolarHBondContact O-CA 3.49Å; F164-K167 PolarHBondContact O-N 3.27Å; D165-K167 PolarHBondContact O-N 3.15Å; K167-Y169 HydrophobicContact CB-CE1 4.34Å; K167-Y169 HydrophobicContact CB-CE2 3.94Å; K167-Y169 WeakPolarHBondContact O-CD2 3.14Å; K167-Y169 PolarHBondContact O-N 3.29Å; K167-Y169 VanDerWaalsContact O-N 3.09Å
168	D	97.8	Very high	97.3	Very high	61 Å²	61	65.4 Å²	65.4	33%	0.326	33%	0.327	S	S	.	.			trans	-84.8	73.9	169.9	-174.7	0	0	0	0	109.2	N163 R166 I170 T171 A172	N163-D168 HydrophobicContact CB-CB 4.39Å; N163-D168 PolarHBondContact O-N 3.31Å; R166-D168 PolarHBondContact O-N 3.36Å; D168-I170 VanDerWaalsContact C-N 3.29Å; D168-I170 PolarHBondContact O-N 3.08Å; D168-T171 VanDerWaalsContact CG-OG1 3.22Å; D168-T171 PolarHBondContact OD1-N 3.47Å; D168-T171 PolarHBondContact OD1-OG1 3.25Å; D168-T171 VanDerWaalsContact OD1-OG1 3.08Å; D168-T171 VanDerWaalsContact OD2-CB 3.23Å; D168-T171 WeakPolarHBondContact OD2-CB 3.36Å; D168-T171 PolarHBondContact OD2-OG1 2.91Å; D168-A172 VanDerWaalsContact O-CB 3.32Å; D168-A172 WeakPolarHBondContact O-CB 3.46Å; D168-A172 PolarHBondContact O-N 3.48Å; D168-A172 VanDerWaalsContact O-N 3.08Å
169	Y	98.1	Very high	97.3	Very high	43 Å²	43	61.4 Å²	61.4	17%	0.169	30%	0.302	C	S	.	.	H	α-helix	trans	-68.5	-29.8	-174.6	-54	-57.3	0	0	0	112.5	F164 K167 A173 Q199	F164-Y169 AromaticContact CD2-CD1 3.91Å; F164-Y169 HydrophobicContact CD2-CD1 3.91Å; F164-Y169 HydrophobicContact CD2-CE1 4.05Å; F164-Y169 HydrophobicContact CE2-CD1 4.04Å; F164-Y169 AromaticContact CE2-CE1 3.93Å; F164-Y169 HydrophobicContact CE2-CE1 3.93Å; F164-Y169 HydrophobicContact CZ-CE1 4.37Å; K167-Y169 HydrophobicContact CB-CE1 4.34Å; K167-Y169 HydrophobicContact CB-CE2 3.94Å; K167-Y169 WeakPolarHBondContact O-CD2 3.14Å; K167-Y169 PolarHBondContact O-N 3.29Å; K167-Y169 VanDerWaalsContact O-N 3.09Å; Y169-A173 WeakPolarHBondContact O-CB 3.03Å; Y169-A173 PolarHBondContact O-N 3.32Å; Y169-Q199 HydrophobicContact CD1-CB 4.11Å; Y169-Q199 HydrophobicContact CD1-CG 4.28Å; Y169-Q199 HydrophobicContact CD2-CB 3.57Å; Y169-Q199 HydrophobicContact CD2-CG 4.45Å; Y169-Q199 HydrophobicContact CE1-CB 4Å; Y169-Q199 HydrophobicContact CE1-CG 3.83Å; Y169-Q199 HydrophobicContact CE2-CB 3.42Å; Y169-Q199 VanDerWaalsContact CE2-CB 3.42Å; Y169-Q199 HydrophobicContact CE2-CG 3.99Å; Y169-Q199 HydrophobicContact CG-CB 3.9Å
170	I	97.6	Very high	97.2	Very high	119 Å²	119	57.6 Å²	57.6	61%	0.61	29%	0.285	S	S	*	.	H	α-helix	trans	-66.7	-52.7	-180	-58.7	173.1	0	0	0	109.6	D168 A172 A173 A174 M200	D168-I170 VanDerWaalsContact C-N 3.29Å; D168-I170 PolarHBondContact O-N 3.08Å; I170-A172 VanDerWaalsContact C-N 3.34Å; I170-A172 PolarHBondContact O-N 2.85Å; I170-A173 PolarHBondContact O-N 2.9Å; I170-A174 PolarHBondContact O-N 3.21Å; I170-M200 HydrophobicContact CG1-CE 4Å; I170-M200 HydrophobicContact CG1-SD 4.14Å
171	T	97.4	Very high	97.1	Very high	56 Å²	56	64.3 Å²	64.3	34%	0.344	32%	0.316	S	S	.	.	H	α-helix	trans	-65.4	-39.9	178.2	-52.6	0	0	0	0	111.3	D168 A174 Q175	D168-T171 VanDerWaalsContact CG-OG1 3.22Å; D168-T171 PolarHBondContact OD1-N 3.47Å; D168-T171 PolarHBondContact OD1-OG1 3.25Å; D168-T171 VanDerWaalsContact OD1-OG1 3.08Å; D168-T171 VanDerWaalsContact OD2-CB 3.23Å; D168-T171 WeakPolarHBondContact OD2-CB 3.36Å; D168-T171 PolarHBondContact OD2-OG1 2.91Å; T171-A174 PolarHBondContact O-N 2.93Å; T171-Q175 WeakPolarHBondContact O-CG 3.16Å; T171-Q175 PolarHBondContact O-N 3.26Å
172	A	98.1	Very high	96.9	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.8	-46.4	176.5	0	0	0	0	0	111.9	S160 N163 F164 D168 I170 Q175 L176	S160-A172 WeakPolarHBondContact O-CB 3.48Å; N163-A172 HydrophobicContact CB-CB 3.98Å; F164-A172 HydrophobicContact CB-CB 4.3Å; D168-A172 VanDerWaalsContact O-CB 3.32Å; D168-A172 WeakPolarHBondContact O-CB 3.46Å; D168-A172 PolarHBondContact O-N 3.48Å; D168-A172 VanDerWaalsContact O-N 3.08Å; I170-A172 VanDerWaalsContact C-N 3.34Å; I170-A172 PolarHBondContact O-N 2.85Å; A172-Q175 PolarHBondContact O-N 3.38Å; A172-L176 WeakPolarHBondContact O-CB 3.49Å; A172-L176 WeakPolarHBondContact O-CD1 3.46Å; A172-L176 WeakPolarHBondContact O-CG 3.11Å; A172-L176 PolarHBondContact O-N 2.8Å
173	A	97.7	Very high	96.8	Very high	5 Å²	5	58.2 Å²	58.2	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-44.8	178.1	0	0	0	0	0	112.1	Y169 I170 Q175 L176 D177 R193 C196 F197	Y169-A173 WeakPolarHBondContact O-CB 3.03Å; Y169-A173 PolarHBondContact O-N 3.32Å; I170-A173 PolarHBondContact O-N 2.9Å; A173-Q175 VanDerWaalsContact C-N 3.32Å; A173-Q175 PolarHBondContact O-N 2.98Å; A173-L176 CarbonylContact O-C 3.35Å; A173-L176 PolarHBondContact O-N 3.03Å; A173-L176 VanDerWaalsContact O-N 3.13Å; A173-D177 PolarHBondContact O-N 2.9Å; A173-R193 HydrophobicContact CB-CG 4.28Å; A173-C196 HydrophobicContact CB-CB 3.99Å; A173-F197 HydrophobicContact CB-CE1 4.2Å; A173-F197 HydrophobicContact CB-CZ 4.49Å
174	A	96.7	Very high	96.5	Very high	53 Å²	53	59.4 Å²	59.4	44%	0.438	30%	0.297	S	S	.	.	H	α-helix	trans	-62.4	-37.5	177.9	0	0	0	0	0	112.7	I170 T171 D177 L178	I170-A174 PolarHBondContact O-N 3.21Å; T171-A174 PolarHBondContact O-N 2.93Å; A174-D177 WeakPolarHBondContact O-CB 3.48Å; A174-D177 PolarHBondContact O-N 2.7Å; A174-L178 PolarHBondContact O-N 3.18Å
175	Q	96.6	Very high	96.2	Very high	28 Å²	28	60.4 Å²	60.4	13%	0.131	30%	0.3	C	S	.	.	H	α-helix	trans	-69.1	-38.6	173.9	-71.5	176.5	-33.9	0	0	112	S160 N163 T171 A172 A173 D177 L178 I179	S160-Q175 VanDerWaalsContact CA-OE1 3.29Å; N163-Q175 PolarHBondContact ND2-OE1 3.48Å; T171-Q175 WeakPolarHBondContact O-CG 3.16Å; T171-Q175 PolarHBondContact O-N 3.26Å; A172-Q175 PolarHBondContact O-N 3.38Å; A173-Q175 VanDerWaalsContact C-N 3.32Å; A173-Q175 PolarHBondContact O-N 2.98Å; Q175-D177 VanDerWaalsContact C-N 3.3Å; Q175-D177 PolarHBondContact O-N 3.01Å; Q175-L178 PolarHBondContact O-N 3.23Å; Q175-I179 WeakPolarHBondContact O-CG1 3.39Å; Q175-I179 PolarHBondContact O-N 3.36Å; Q175-I179 VanDerWaalsContact O-N 3.1Å
176	L	97.8	Very high	96.1	Very high	1 Å²	1	55 Å²	55	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-31	175.7	-69.5	160.9	0	0	0	112.3	A172 A173 I179 I180 L192 R193	A172-L176 WeakPolarHBondContact O-CB 3.49Å; A172-L176 WeakPolarHBondContact O-CD1 3.46Å; A172-L176 WeakPolarHBondContact O-CG 3.11Å; A172-L176 PolarHBondContact O-N 2.8Å; A173-L176 CarbonylContact O-C 3.35Å; A173-L176 PolarHBondContact O-N 3.03Å; A173-L176 VanDerWaalsContact O-N 3.13Å; L176-I179 HydrophobicContact CD2-CD1 3.99Å; L176-I179 PolarHBondContact O-N 2.95Å; L176-I180 WeakPolarHBondContact O-CB 3.29Å; L176-I180 WeakPolarHBondContact O-CD1 3.45Å; L176-I180 VanDerWaalsContact O-CG1 3.26Å; L176-I180 WeakPolarHBondContact O-CG1 3.33Å; L176-I180 PolarHBondContact O-N 3.11Å; L176-L192 HydrophobicContact CD1-CB 4.09Å; L176-L192 HydrophobicContact CD1-CD2 4.04Å; L176-L192 HydrophobicContact CD1-CG 3.83Å; L176-L192 HydrophobicContact CD2-CD2 4.21Å; L176-R193 HydrophobicContact CB-CB 3.91Å; L176-R193 HydrophobicContact CB-CG 4.02Å; L176-R193 HydrophobicContact CD1-CB 3.9Å; L176-R193 HydrophobicContact CD1-CG 4.43Å; L176-R193 HydrophobicContact CG-CB 4.48Å
177	D	96.6	Very high	95.8	Very high	62 Å²	62	47 Å²	47	33%	0.332	24%	0.244	S	C	.	.	H	α-helix	trans	-56.6	-52.1	169.1	-70.7	-34.7	0	0	0	111.2	A173 A174 Q175 I179 I180 E181 R193	A173-D177 PolarHBondContact O-N 2.9Å; A174-D177 WeakPolarHBondContact O-CB 3.48Å; A174-D177 PolarHBondContact O-N 2.7Å; Q175-D177 VanDerWaalsContact C-N 3.3Å; Q175-D177 PolarHBondContact O-N 3.01Å; D177-I179 VanDerWaalsContact C-N 3.27Å; D177-I179 PolarHBondContact O-N 3.13Å; D177-I180 PolarHBondContact O-N 2.77Å; D177-I180 VanDerWaalsContact O-N 3.14Å; D177-E181 WeakPolarHBondContact O-CG 3.36Å; D177-E181 PolarHBondContact O-N 3.42Å; D177-R193 WeakPolarHBondContact OD1-CD 3.2Å; D177-R193 IonicContact OD1-CZ 2.98Å; D177-R193 VanDerWaalsContact OD1-CZ 3.23Å; D177-R193 IonicContact OD1-NE 3.09Å; D177-R193 IonicContact OD1-NH1 2.7Å; D177-R193 PolarHBondContact OD1-NH1 3.2Å
178	L	95.5	Very high	95.6	Very high	71 Å²	71	42.9 Å²	42.9	37%	0.372	23%	0.234	S	C	.	.	H	α-helix	trans	-60.9	-35.6	178.1	-61.4	175.1	0	0	0	112.9	W156 A174 Q175	W156-L178 HydrophobicContact CE3-CB 4.26Å; W156-L178 HydrophobicContact CH2-CB 4.39Å; W156-L178 HydrophobicContact CZ2-CD1 4.38Å; W156-L178 HydrophobicContact CZ3-CB 4.09Å; A174-L178 PolarHBondContact O-N 3.18Å; Q175-L178 PolarHBondContact O-N 3.23Å
179	I	96.6	Very high	95.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-50.6	174.8	-66.7	161.9	0	0	0	109.7	I153 W156 V157 Q175 L176 D177 E181 T182 C183	I153-I179 HydrophobicContact CG2-CG1 4.22Å; I153-I179 HydrophobicContact CG2-CG2 3.97Å; W156-I179 HydrophobicContact CB-CD1 3.82Å; W156-I179 HydrophobicContact CB-CG1 3.82Å; W156-I179 HydrophobicContact CE3-CG1 4.28Å; V157-I179 HydrophobicContact CB-CD1 4.48Å; V157-I179 HydrophobicContact CG2-CD1 3.75Å; V157-I179 HydrophobicContact CG2-CG1 4.4Å; V157-I179 HydrophobicContact CG2-CG2 4.46Å; Q175-I179 WeakPolarHBondContact O-CG1 3.39Å; Q175-I179 PolarHBondContact O-N 3.36Å; Q175-I179 VanDerWaalsContact O-N 3.1Å; L176-I179 HydrophobicContact CD2-CD1 3.99Å; L176-I179 PolarHBondContact O-N 2.95Å; D177-I179 VanDerWaalsContact C-N 3.27Å; D177-I179 PolarHBondContact O-N 3.13Å; I179-E181 VanDerWaalsContact C-N 3.29Å; I179-E181 PolarHBondContact O-N 3.01Å; I179-T182 PolarHBondContact O-N 3.26Å; I179-T182 VanDerWaalsContact O-N 3.08Å; I179-C183 HydrophobicContact CG2-CB 4.14Å; I179-C183 WeakPolarHBondContact O-CB 3.47Å; I179-C183 PolarHBondContact O-N 3.38Å
180	I	95.9	Very high	95.4	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.062	22%	0.22	C	C	.	.	H	α-helix	trans	-68.7	-25.9	-174.4	-69.6	162.5	0	0	0	112.3	L176 D177 T182 C183 V184 R190 R193	L176-I180 WeakPolarHBondContact O-CB 3.29Å; L176-I180 WeakPolarHBondContact O-CD1 3.45Å; L176-I180 VanDerWaalsContact O-CG1 3.26Å; L176-I180 WeakPolarHBondContact O-CG1 3.33Å; L176-I180 PolarHBondContact O-N 3.11Å; D177-I180 PolarHBondContact O-N 2.77Å; D177-I180 VanDerWaalsContact O-N 3.14Å; I180-T182 PolarHBondContact O-N 3.37Å; I180-C183 CarbonylContact O-C 3.59Å; I180-V184 VanDerWaalsContact O-CA 3.29Å; I180-V184 WeakPolarHBondContact O-CA 3.36Å; I180-V184 WeakPolarHBondContact O-CG1 3.21Å; I180-V184 PolarHBondContact O-N 3.19Å; I180-R190 HydrophobicContact CD1-CB 4.4Å; I180-R190 HydrophobicContact CD1-CG 3.71Å; I180-R190 HydrophobicContact CG1-CG 4.15Å; I180-R193 HydrophobicContact CD1-CB 4.42Å; I180-R193 VanDerWaalsContact CD1-NH1 3.33Å
181	E	94.1	Very high	95.3	Very high	142 Å²	142	36.9 Å²	36.9	66%	0.664	20%	0.201	S	C	*	.	H	α-helix	trans	-57.4	-37	170.2	-76.4	-179.5	179.5	0	0	112.5	D177 I179	D177-E181 WeakPolarHBondContact O-CG 3.36Å; D177-E181 PolarHBondContact O-N 3.42Å; I179-E181 VanDerWaalsContact C-N 3.29Å; I179-E181 PolarHBondContact O-N 3.01Å
182	T	93.1	Very high	95.2	Very high	34 Å²	34	35.6 Å²	35.6	21%	0.209	19%	0.192	C	C	.	.	H	α-helix	trans	-93.8	-48.2	177.6	-51.9	0	0	0	0	111.6	K149 I153 I179 I180 V184	K149-T182 VanDerWaalsContact CE-OG1 3.29Å; K149-T182 WeakPolarHBondContact CE-OG1 3.44Å; K149-T182 HydrophobicContact CG-CG2 4.1Å; I153-T182 HydrophobicContact CD1-CG2 3.61Å; I179-T182 PolarHBondContact O-N 3.26Å; I179-T182 VanDerWaalsContact O-N 3.08Å; I180-T182 PolarHBondContact O-N 3.37Å; T182-V184 VanDerWaalsContact C-N 3.32Å; T182-V184 PolarHBondContact O-N 2.99Å
183	C	95.1	Very high	95.2	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.007	20%	0.197	C	C	.	.			trans	-91.8	61	-179.1	-59.9	0	0	0	0	110.6	L115 K116 I179 I180 W185 D186	L115-C183 PolarHBondContact O-SG 2.96Å; K116-C183 CarbonylContact O-C 3.57Å; K116-C183 WeakPolarHBondContact O-CA 3.5Å; I179-C183 HydrophobicContact CG2-CB 4.14Å; I179-C183 WeakPolarHBondContact O-CB 3.47Å; I179-C183 PolarHBondContact O-N 3.38Å; I180-C183 CarbonylContact O-C 3.59Å; C183-W185 PolarHBondContact O-N 3.25Å; C183-D186 HydrophobicContact CB-CB 3.81Å; C183-D186 WeakPolarHBondContact O-CB 3.36Å; C183-D186 PolarHBondContact O-N 3.34Å
184	V	92.6	Very high	95.2	Very high	49 Å²	49	36.7 Å²	36.7	30%	0.297	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.8	-172.9	-65.1	0	0	0	0	114.7	K116 I180 T182 R190	K116-V184 HydrophobicContact CB-CG2 4.41Å; K116-V184 HydrophobicContact CD-CG2 4.5Å; K116-V184 HydrophobicContact CG-CG2 4.47Å; K116-V184 PolarHBondContact O-N 3.42Å; I180-V184 VanDerWaalsContact O-CA 3.29Å; I180-V184 WeakPolarHBondContact O-CA 3.36Å; I180-V184 WeakPolarHBondContact O-CG1 3.21Å; I180-V184 PolarHBondContact O-N 3.19Å; T182-V184 VanDerWaalsContact C-N 3.32Å; T182-V184 PolarHBondContact O-N 2.99Å; V184-R190 PolarHBondContact O-NE 3.3Å; V184-R190 PolarHBondContact O-NH2 2.72Å
185	W	91.4	Very high	95.2	Very high	62 Å²	62	36 Å²	36	24%	0.235	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	12.8	-178.3	-57.1	-33.6	0	0	0	113.3	S86 L113 K116 Q117 C183 V187 L216	S86-W185 VanDerWaalsContact CB-CH2 3.49Å; L113-W185 HydrophobicContact CD1-CE3 4.11Å; L113-W185 HydrophobicContact CD1-CH2 4.39Å; L113-W185 HydrophobicContact CD1-CZ3 3.45Å; L113-W185 VanDerWaalsContact CD1-CZ3 3.45Å; K116-W185 HydrophobicContact CB-CD2 4.38Å; K116-W185 HydrophobicContact CB-CE3 3.62Å; K116-W185 HydrophobicContact CB-CZ3 3.93Å; K116-W185 HydrophobicContact CD-CE3 4.18Å; K116-W185 HydrophobicContact CD-CH2 4.1Å; K116-W185 HydrophobicContact CD-CZ3 3.7Å; K116-W185 HydrophobicContact CG-CZ3 4.49Å; K116-W185 CarbonylContact O-C 3.31Å; K116-W185 WeakPolarHBondContact O-CA 3.21Å; K116-W185 WeakPolarHBondContact O-CB 3.06Å; K116-W185 PolarHBondContact O-N 2.95Å; Q117-W185 HydrophobicContact CG-CB 4.4Å; Q117-W185 HydrophobicContact CG-CE3 4.47Å; C183-W185 PolarHBondContact O-N 3.25Å; W185-V187 PolarHBondContact O-N 2.99Å; W185-L216 HydrophobicContact CB-CD2 4.13Å; W185-L216 HydrophobicContact CG-CD2 4.09Å
186	D	93.6	Very high	95.2	Very high	13 Å²	13	34.7 Å²	34.7	7%	0.07	18%	0.177	C	C	.	.			trans	-75.4	106.3	173.3	-178.8	5.1	0	0	0	110.7	K116 C183 S188 S189 R190	K116-D186 PolarHBondContact O-N 3.13Å; C183-D186 HydrophobicContact CB-CB 3.81Å; C183-D186 WeakPolarHBondContact O-CB 3.36Å; C183-D186 PolarHBondContact O-N 3.34Å; D186-S188 WeakPolarHBondContact OD1-CB 3.32Å; D186-S188 PolarHBondContact OD1-N 3.16Å; D186-S189 PolarHBondContact OD1-N 3Å; D186-S189 WeakPolarHBondContact OD2-CB 3.2Å; D186-S189 PolarHBondContact OD2-OG 3.43Å; D186-R190 WeakPolarHBondContact O-CG 3.47Å; D186-R190 PolarHBondContact O-N 3.47Å
187	V	92.8	Very high	95.3	Very high	24 Å²	24	35.3 Å²	35.3	15%	0.145	18%	0.179	C	C	.	.	H	α-helix	trans	-67.9	-38.8	178.4	-178.3	0	0	0	0	110.9	W185 R190 E191 A213 L216 K217	W185-V187 PolarHBondContact O-N 2.99Å; V187-R190 PolarHBondContact O-N 2.69Å; V187-E191 HydrophobicContact CG1-CG 4.32Å; V187-E191 WeakPolarHBondContact O-CG 3.36Å; V187-E191 PolarHBondContact O-N 2.95Å; V187-A213 HydrophobicContact CG1-CB 4.01Å; V187-L216 HydrophobicContact CG2-CB 3.6Å; V187-L216 HydrophobicContact CG2-CD1 4.27Å; V187-K217 HydrophobicContact CG1-CB 4.28Å; V187-K217 HydrophobicContact CG2-CB 4.26Å
188	S	93.5	Very high	95.2	Very high	65 Å²	65	34.1 Å²	34.1	46%	0.455	17%	0.173	S	C	.	.	H	α-helix	trans	-68.2	-43.1	-174	-52.4	0	0	0	0	111.3	D186 E191 L192	D186-S188 WeakPolarHBondContact OD1-CB 3.32Å; D186-S188 PolarHBondContact OD1-N 3.16Å; S188-E191 PolarHBondContact O-N 3.13Å; S188-L192 WeakPolarHBondContact O-CB 3.38Å; S188-L192 PolarHBondContact O-N 3.05Å
189	S	95.4	Very high	95.3	Very high	5 Å²	5	35.3 Å²	35.3	4%	0.035	18%	0.176	C	C	.	.	H	α-helix	trans	-67.3	-37.7	176.5	-67.5	0	0	0	0	112.1	D186 L192 R193	D186-S189 PolarHBondContact OD1-N 3Å; D186-S189 WeakPolarHBondContact OD2-CB 3.2Å; D186-S189 PolarHBondContact OD2-OG 3.43Å; S189-L192 PolarHBondContact O-N 3.3Å; S189-R193 WeakPolarHBondContact O-CB 3.5Å; S189-R193 PolarHBondContact O-N 3.01Å
190	R	95.7	Very high	95.3	Very high	43 Å²	43	38.3 Å²	38.3	16%	0.162	19%	0.191	C	C	.	.	H	α-helix	trans	-63.6	-44	174.4	-75.1	175.4	177.7	-84.3	1.5	111.9	I180 V184 D186 V187 R193 A194 D209	I180-R190 HydrophobicContact CD1-CB 4.4Å; I180-R190 HydrophobicContact CD1-CG 3.71Å; I180-R190 HydrophobicContact CG1-CG 4.15Å; V184-R190 PolarHBondContact O-NE 3.3Å; V184-R190 PolarHBondContact O-NH2 2.72Å; D186-R190 WeakPolarHBondContact O-CG 3.47Å; D186-R190 PolarHBondContact O-N 3.47Å; V187-R190 PolarHBondContact O-N 2.69Å; R190-R193 PolarHBondContact O-N 3.08Å; R190-A194 WeakPolarHBondContact O-CB 3.35Å; R190-A194 PolarHBondContact O-N 3.15Å; R190-D209 IonicContact NH1-OD1 3.92Å
191	E	95.3	Very high	95.2	Very high	48 Å²	48	40.1 Å²	40.1	22%	0.224	21%	0.213	C	C	.	.	H	α-helix	trans	-65.1	-41.1	177.4	-74.9	179.2	170.2	0	0	112.5	V187 S188 R193 A194 E195 L210 A213 N220	V187-E191 HydrophobicContact CG1-CG 4.32Å; V187-E191 WeakPolarHBondContact O-CG 3.36Å; V187-E191 PolarHBondContact O-N 2.95Å; S188-E191 PolarHBondContact O-N 3.13Å; E191-R193 VanDerWaalsContact C-N 3.33Å; E191-A194 PolarHBondContact O-N 3.24Å; E191-E195 PolarHBondContact O-N 2.71Å; E191-L210 HydrophobicContact CG-CD2 4.47Å; E191-A213 HydrophobicContact CG-CB 4.1Å; E191-N220 PolarHBondContact OE1-ND2 3.48Å; E191-N220 PolarHBondContact OE1-OD1 3.3Å
192	L	96.4	Very high	95.3	Very high	29 Å²	29	36.5 Å²	36.5	15%	0.152	20%	0.196	C	C	.	.	H	α-helix	trans	-65.5	-39.1	176	-173.4	60.6	0	0	0	111.3	R161 F164 L176 S188 S189 E195 C196	R161-L192 HydrophobicContact CG-CD2 3.95Å; F164-L192 HydrophobicContact CB-CD1 4.37Å; F164-L192 HydrophobicContact CD1-CD1 4.01Å; F164-L192 HydrophobicContact CD2-CD1 3.64Å; F164-L192 HydrophobicContact CD2-CG 4.38Å; F164-L192 HydrophobicContact CE1-CD1 4.22Å; F164-L192 HydrophobicContact CE2-CD1 3.86Å; F164-L192 HydrophobicContact CG-CD1 3.72Å; F164-L192 HydrophobicContact CZ-CD1 4.15Å; L176-L192 HydrophobicContact CD1-CB 4.09Å; L176-L192 HydrophobicContact CD1-CD2 4.04Å; L176-L192 HydrophobicContact CD1-CG 3.83Å; L176-L192 HydrophobicContact CD2-CD2 4.21Å; S188-L192 WeakPolarHBondContact O-CB 3.38Å; S188-L192 PolarHBondContact O-N 3.05Å; S189-L192 PolarHBondContact O-N 3.3Å; L192-E195 WeakPolarHBondContact O-CB 3.37Å; L192-E195 PolarHBondContact O-N 3.23Å; L192-C196 PolarHBondContact O-N 3.44Å; L192-C196 PolarHBondContact O-SG 3.49Å; L192-C196 VanDerWaalsContact O-SG 3.36Å
193	R	97.8	Very high	95.4	Very high	28 Å²	28	37.2 Å²	37.2	11%	0.106	20%	0.197	C	C	.	.	H	α-helix	trans	-68.7	-39.5	177	-165.9	176	65.5	179.6	12.9	111.8	A173 L176 D177 I180 S189 R190 E191 E195 C196 F197 D209	A173-R193 HydrophobicContact CB-CG 4.28Å; L176-R193 HydrophobicContact CB-CB 3.91Å; L176-R193 HydrophobicContact CB-CG 4.02Å; L176-R193 HydrophobicContact CD1-CB 3.9Å; L176-R193 HydrophobicContact CD1-CG 4.43Å; L176-R193 HydrophobicContact CG-CB 4.48Å; D177-R193 WeakPolarHBondContact OD1-CD 3.2Å; D177-R193 IonicContact OD1-CZ 2.98Å; D177-R193 VanDerWaalsContact OD1-CZ 3.23Å; D177-R193 IonicContact OD1-NE 3.09Å; D177-R193 IonicContact OD1-NH1 2.7Å; D177-R193 PolarHBondContact OD1-NH1 3.2Å; I180-R193 HydrophobicContact CD1-CB 4.42Å; I180-R193 VanDerWaalsContact CD1-NH1 3.33Å; S189-R193 WeakPolarHBondContact O-CB 3.5Å; S189-R193 PolarHBondContact O-N 3.01Å; R190-R193 PolarHBondContact O-N 3.08Å; E191-R193 VanDerWaalsContact C-N 3.33Å; R193-E195 VanDerWaalsContact C-N 3.27Å; R193-E195 PolarHBondContact O-N 3.09Å; R193-C196 WeakPolarHBondContact O-CB 3.25Å; R193-C196 PolarHBondContact O-N 2.87Å; R193-F197 HydrophobicContact CG-CD2 4.22Å; R193-F197 HydrophobicContact CG-CE2 3.62Å; R193-F197 HydrophobicContact CG-CZ 3.96Å; R193-F197 VanDerWaalsContact O-CD2 3.27Å; R193-F197 WeakPolarHBondContact O-CD2 3.26Å; R193-F197 PolarHBondContact O-N 2.96Å; R193-D209 IonicContact CZ-OD1 2.65Å; R193-D209 IonicContact CZ-OD2 2.71Å; R193-D209 IonicContact NE-OD1 3.85Å; R193-D209 IonicContact NE-OD2 3.55Å; R193-D209 PolarHBondContact NE-OD2 3.39Å; R193-D209 IonicContact NH2-OD1 2.67Å; R193-D209 PolarHBondContact NH2-OD1 2.93Å; R193-D209 IonicContact NH2-OD2 3.58Å; R193-D209 PolarHBondContact NH2-OD2 2.94Å
194	A	97.3	Very high	95.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-42	171	0	0	0	0	0	111.3	R190 E191 F197 I198 A206 D209 L210	R190-A194 WeakPolarHBondContact O-CB 3.35Å; R190-A194 PolarHBondContact O-N 3.15Å; E191-A194 PolarHBondContact O-N 3.24Å; A194-F197 PolarHBondContact O-N 3.11Å; A194-I198 VanDerWaalsContact O-CG1 3.31Å; A194-I198 WeakPolarHBondContact O-CG1 3.31Å; A194-I198 PolarHBondContact O-N 3.45Å; A194-A206 HydrophobicContact CB-CB 4.37Å; A194-D209 HydrophobicContact CB-CB 3.83Å; A194-L210 HydrophobicContact CB-CD1 4.38Å; A194-L210 HydrophobicContact CB-CD2 3.99Å; A194-L210 HydrophobicContact CB-CG 3.73Å
195	E	96.3	Very high	95.6	Very high	40 Å²	40	42.7 Å²	42.7	19%	0.187	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-43.5	175.2	-166.4	63.7	-136.3	0	0	111.7	F164 E191 L192 R193 F197 I198 Q199 K226	F164-E195 HydrophobicContact CE2-CB 3.96Å; F164-E195 HydrophobicContact CE2-CG 3.67Å; F164-E195 HydrophobicContact CZ-CB 4.21Å; F164-E195 HydrophobicContact CZ-CG 3.49Å; F164-E195 VanDerWaalsContact CZ-CG 3.49Å; E191-E195 PolarHBondContact O-N 2.71Å; L192-E195 WeakPolarHBondContact O-CB 3.37Å; L192-E195 PolarHBondContact O-N 3.23Å; R193-E195 VanDerWaalsContact C-N 3.27Å; R193-E195 PolarHBondContact O-N 3.09Å; E195-F197 VanDerWaalsContact C-N 3.29Å; E195-F197 PolarHBondContact O-N 3.39Å; E195-I198 PolarHBondContact O-N 3.42Å; E195-Q199 WeakPolarHBondContact O-CG 3.4Å; E195-Q199 PolarHBondContact O-N 3.29Å; E195-Q199 PolarHBondContact OE1-NE2 3.41Å; E195-Q199 VanDerWaalsContact OE1-NE2 3.09Å; E195-K226 IonicContact OE2-NZ 3.13Å; E195-K226 PolarHBondContact OE2-NZ 2.83Å
196	C	97.8	Very high	95.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-53.7	-47.2	171.6	-63.4	0	0	0	0	111.6	A173 L192 R193 I198 Q199 M200	A173-C196 HydrophobicContact CB-CB 3.99Å; L192-C196 PolarHBondContact O-N 3.44Å; L192-C196 PolarHBondContact O-SG 3.49Å; L192-C196 VanDerWaalsContact O-SG 3.36Å; R193-C196 WeakPolarHBondContact O-CB 3.25Å; R193-C196 PolarHBondContact O-N 2.87Å; C196-I198 PolarHBondContact O-N 2.87Å; C196-Q199 PolarHBondContact O-N 2.83Å; C196-M200 VanDerWaalsContact O-CG 3.25Å; C196-M200 WeakPolarHBondContact O-CG 3.26Å; C196-M200 PolarHBondContact O-N 3.05Å
197	F	98.1	Very high	96.1	Very high	13 Å²	13	40.2 Å²	40.2	6%	0.057	22%	0.224	C	C	.	.	H	α-helix	trans	-65.2	-37.2	-180	-68.2	-43.5	0	0	0	112.9	A173 R193 A194 E195 M200 G201 E202 K205 A206 D209	A173-F197 HydrophobicContact CB-CE1 4.2Å; A173-F197 HydrophobicContact CB-CZ 4.49Å; R193-F197 HydrophobicContact CG-CD2 4.22Å; R193-F197 HydrophobicContact CG-CE2 3.62Å; R193-F197 HydrophobicContact CG-CZ 3.96Å; R193-F197 VanDerWaalsContact O-CD2 3.27Å; R193-F197 WeakPolarHBondContact O-CD2 3.26Å; R193-F197 PolarHBondContact O-N 2.96Å; A194-F197 PolarHBondContact O-N 3.11Å; E195-F197 VanDerWaalsContact C-N 3.29Å; E195-F197 PolarHBondContact O-N 3.39Å; F197-M200 HydrophobicContact CD1-SD 4.43Å; F197-M200 CarbonylContact O-C 3.56Å; F197-M200 PolarHBondContact O-N 3.3Å; F197-G201 PolarHBondContact O-N 2.94Å; F197-E202 HydrophobicContact CB-CB 4.23Å; F197-E202 HydrophobicContact CD1-CB 4.26Å; F197-E202 PolarHBondContact O-N 2.83Å; F197-K205 HydrophobicContact CB-CB 4.29Å; F197-K205 HydrophobicContact CD1-CB 4.06Å; F197-K205 HydrophobicContact CD1-CD 4.06Å; F197-K205 HydrophobicContact CD2-CB 3.5Å; F197-K205 VanDerWaalsContact CD2-CB 3.5Å; F197-K205 HydrophobicContact CE1-CB 4.26Å; F197-K205 HydrophobicContact CE1-CD 3.68Å; F197-K205 HydrophobicContact CE2-CB 3.7Å; F197-K205 HydrophobicContact CE2-CD 4.25Å; F197-K205 HydrophobicContact CG-CB 3.7Å; F197-K205 HydrophobicContact CZ-CB 4.1Å; F197-K205 HydrophobicContact CZ-CD 3.79Å; F197-A206 HydrophobicContact CB-CB 3.94Å; F197-D209 WeakPolarHBondContact CE2-OD2 3.31Å
198	I	96.3	Very high	96.3	Very high	38 Å²	38	42.9 Å²	42.9	20%	0.195	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-47.5	173.2	-66.8	165.6	0	0	0	110	A194 E195 C196 M200 G201 A206 I230	A194-I198 VanDerWaalsContact O-CG1 3.31Å; A194-I198 WeakPolarHBondContact O-CG1 3.31Å; A194-I198 PolarHBondContact O-N 3.45Å; E195-I198 PolarHBondContact O-N 3.42Å; C196-I198 PolarHBondContact O-N 2.87Å; I198-M200 PolarHBondContact O-N 3.39Å; I198-G201 PolarHBondContact O-N 3.44Å; I198-A206 HydrophobicContact CD1-CB 4.47Å; I198-A206 HydrophobicContact CG1-CB 3.73Å; I198-I230 HydrophobicContact CD1-CD1 3.91Å; I198-I230 HydrophobicContact CD1-CG1 4.4Å; I198-I230 HydrophobicContact CG1-CD1 4Å; I198-I230 HydrophobicContact CG1-CG1 4.42Å
199	Q	96.1	Very high	96.4	Very high	95 Å²	95	40 Å²	40	44%	0.444	22%	0.223	S	C	.	.	H	α-helix	trans	-66	-27.5	179.2	-60.1	-60.4	-39.7	0	0	112.8	Y169 E195 C196 G201	Y169-Q199 HydrophobicContact CD1-CB 4.11Å; Y169-Q199 HydrophobicContact CD1-CG 4.28Å; Y169-Q199 HydrophobicContact CD2-CB 3.57Å; Y169-Q199 HydrophobicContact CD2-CG 4.45Å; Y169-Q199 HydrophobicContact CE1-CB 4Å; Y169-Q199 HydrophobicContact CE1-CG 3.83Å; Y169-Q199 HydrophobicContact CE2-CB 3.42Å; Y169-Q199 VanDerWaalsContact CE2-CB 3.42Å; Y169-Q199 HydrophobicContact CE2-CG 3.99Å; Y169-Q199 HydrophobicContact CG-CB 3.9Å; E195-Q199 WeakPolarHBondContact O-CG 3.4Å; E195-Q199 PolarHBondContact O-N 3.29Å; E195-Q199 PolarHBondContact OE1-NE2 3.41Å; E195-Q199 VanDerWaalsContact OE1-NE2 3.09Å; C196-Q199 PolarHBondContact O-N 2.83Å; Q199-G201 VanDerWaalsContact C-N 3.34Å
200	M	96.2	Very high	96.4	Very high	64 Å²	64	39.8 Å²	39.8	32%	0.315	22%	0.222	S	C	.	.	H	α-helix	trans	-82.3	-8.9	173.8	-68.1	171.5	57.1	0	0	113.7	I170 C196 F197 I198 E202	I170-M200 HydrophobicContact CG1-CE 4Å; I170-M200 HydrophobicContact CG1-SD 4.14Å; C196-M200 VanDerWaalsContact O-CG 3.25Å; C196-M200 WeakPolarHBondContact O-CG 3.26Å; C196-M200 PolarHBondContact O-N 3.05Å; F197-M200 HydrophobicContact CD1-SD 4.43Å; F197-M200 CarbonylContact O-C 3.56Å; F197-M200 PolarHBondContact O-N 3.3Å; I198-M200 PolarHBondContact O-N 3.39Å; M200-E202 VanDerWaalsContact C-N 3.3Å; M200-E202 HydrophobicContact CB-CG 4.27Å
201	G	94.8	Very high	96.4	Very high	50 Å²	50	39.7 Å²	39.7	52%	0.515	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	8.1	-173.9	0	0	0	0	0	114.7	F197 I198 Q199 M203	F197-G201 PolarHBondContact O-N 2.94Å; I198-G201 PolarHBondContact O-N 3.44Å; Q199-G201 VanDerWaalsContact C-N 3.34Å; G201-M203 VanDerWaalsContact C-N 3.29Å; G201-M203 PolarHBondContact O-N 3.45Å
202	E	96.2	Very high	96.3	Very high	66 Å²	66	38.6 Å²	38.6	31%	0.308	23%	0.225	S	C	.	.			trans	-86.7	62.2	-179.9	-63.2	-168.2	-179.9	0	0	111.9	F197 M200 G204 K205 A206	F197-E202 HydrophobicContact CB-CB 4.23Å; F197-E202 HydrophobicContact CD1-CB 4.26Å; F197-E202 PolarHBondContact O-N 2.83Å; M200-E202 VanDerWaalsContact C-N 3.3Å; M200-E202 HydrophobicContact CB-CG 4.27Å; E202-G204 VanDerWaalsContact C-N 3.27Å; E202-G204 PolarHBondContact O-N 3.2Å; E202-G204 VanDerWaalsContact O-N 3.15Å; E202-K205 PolarHBondContact O-N 3.29Å; E202-K205 VanDerWaalsContact O-N 3.09Å; E202-K205 IonicContact OE1-NZ 3.73Å; E202-K205 WeakPolarHBondContact OE2-CD 3.48Å; E202-K205 WeakPolarHBondContact OE2-CE 3.48Å; E202-K205 IonicContact OE2-NZ 3.35Å; E202-K205 PolarHBondContact OE2-NZ 3.33Å; E202-A206 PolarHBondContact O-N 3.27Å
203	M	95.4	Very high	96.1	Very high	48 Å²	48	37.2 Å²	37.2	24%	0.236	22%	0.218	C	C	.	.	H	α-helix	trans	-55.4	-36.9	-172.5	-61.1	-56.5	-179.4	0	0	113.9	G201 K205 A206 I207 I230 L234	G201-M203 VanDerWaalsContact C-N 3.29Å; G201-M203 PolarHBondContact O-N 3.45Å; M203-K205 PolarHBondContact O-N 3Å; M203-A206 WeakPolarHBondContact O-CB 3.43Å; M203-A206 PolarHBondContact O-N 3.06Å; M203-I207 VanDerWaalsContact O-CG1 3.32Å; M203-I207 WeakPolarHBondContact O-CG1 3.45Å; M203-I207 PolarHBondContact O-N 2.86Å; M203-I230 HydrophobicContact CB-CG2 3.82Å; M203-I230 HydrophobicContact CG-CG2 4.18Å; M203-I230 HydrophobicContact SD-CG1 4.37Å; M203-I230 HydrophobicContact SD-CG2 3.96Å; M203-L234 HydrophobicContact CB-CD1 4.11Å; M203-L234 HydrophobicContact CB-CD2 4.08Å; M203-L234 HydrophobicContact CB-CG 4.41Å; M203-L234 HydrophobicContact CG-CD2 4.11Å
204	G	95.8	Very high	95.8	Very high	56 Å²	56	36.6 Å²	36.6	58%	0.577	22%	0.218	S	C	*	.	H	α-helix	trans	-62	-39	179	0	0	0	0	0	113.5	E202 S208	E202-G204 VanDerWaalsContact C-N 3.27Å; E202-G204 PolarHBondContact O-N 3.2Å; E202-G204 VanDerWaalsContact O-N 3.15Å; G204-S208 PolarHBondContact O-N 3.34Å
205	K	96.6	Very high	95.4	Very high	109 Å²	109	44.3 Å²	44.3	47%	0.474	25%	0.252	S	S	.	.	H	α-helix	trans	-71.8	-38.7	176.4	-63.1	-168.3	-165.5	157.6	0	111.2	F197 E202 M203 I207 S208 D209	F197-K205 HydrophobicContact CB-CB 4.29Å; F197-K205 HydrophobicContact CD1-CB 4.06Å; F197-K205 HydrophobicContact CD1-CD 4.06Å; F197-K205 HydrophobicContact CD2-CB 3.5Å; F197-K205 VanDerWaalsContact CD2-CB 3.5Å; F197-K205 HydrophobicContact CE1-CB 4.26Å; F197-K205 HydrophobicContact CE1-CD 3.68Å; F197-K205 HydrophobicContact CE2-CB 3.7Å; F197-K205 HydrophobicContact CE2-CD 4.25Å; F197-K205 HydrophobicContact CG-CB 3.7Å; F197-K205 HydrophobicContact CZ-CB 4.1Å; F197-K205 HydrophobicContact CZ-CD 3.79Å; E202-K205 PolarHBondContact O-N 3.29Å; E202-K205 VanDerWaalsContact O-N 3.09Å; E202-K205 IonicContact OE1-NZ 3.73Å; E202-K205 WeakPolarHBondContact OE2-CD 3.48Å; E202-K205 WeakPolarHBondContact OE2-CE 3.48Å; E202-K205 IonicContact OE2-NZ 3.35Å; E202-K205 PolarHBondContact OE2-NZ 3.33Å; M203-K205 PolarHBondContact O-N 3Å; K205-I207 PolarHBondContact O-N 3.39Å; K205-S208 WeakPolarHBondContact O-CB 3.34Å; K205-S208 PolarHBondContact O-N 3.02Å; K205-D209 PolarHBondContact O-N 3.09Å
206	A	97.6	Very high	95	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-43.9	174.8	0	0	0	0	0	112.6	A194 F197 I198 E202 M203 S208 D209 L210 I230	A194-A206 HydrophobicContact CB-CB 4.37Å; F197-A206 HydrophobicContact CB-CB 3.94Å; I198-A206 HydrophobicContact CD1-CB 4.47Å; I198-A206 HydrophobicContact CG1-CB 3.73Å; E202-A206 PolarHBondContact O-N 3.27Å; M203-A206 WeakPolarHBondContact O-CB 3.43Å; M203-A206 PolarHBondContact O-N 3.06Å; A206-S208 VanDerWaalsContact C-N 3.32Å; A206-S208 PolarHBondContact O-N 3.17Å; A206-D209 PolarHBondContact O-N 3.46Å; A206-L210 WeakPolarHBondContact O-CG 3.44Å; A206-L210 PolarHBondContact O-N 3.42Å; A206-I230 HydrophobicContact CB-CD1 4Å
207	I	97.3	Very high	94.4	Very high	24 Å²	24	48.2 Å²	48.2	12%	0.123	27%	0.27	C	S	.	.	H	α-helix	trans	-58.5	-44.8	176.3	-70.5	163.9	0	0	0	110.8	M203 K205 D209 L210 T211 L227 I230 Y231 L234	M203-I207 VanDerWaalsContact O-CG1 3.32Å; M203-I207 WeakPolarHBondContact O-CG1 3.45Å; M203-I207 PolarHBondContact O-N 2.86Å; K205-I207 PolarHBondContact O-N 3.39Å; I207-D209 VanDerWaalsContact C-N 3.35Å; I207-D209 PolarHBondContact O-N 3.27Å; I207-L210 PolarHBondContact O-N 3.3Å; I207-T211 VanDerWaalsContact O-CB 3.24Å; I207-T211 WeakPolarHBondContact O-CB 3.31Å; I207-T211 PolarHBondContact O-N 3.32Å; I207-T211 PolarHBondContact O-OG1 2.88Å; I207-L227 HydrophobicContact CB-CD2 4.31Å; I207-L227 HydrophobicContact CG1-CD2 4.36Å; I207-L227 HydrophobicContact CG2-CD2 4.07Å; I207-I230 HydrophobicContact CD1-CG2 3.82Å; I207-I230 HydrophobicContact CG1-CB 4.45Å; I207-I230 HydrophobicContact CG1-CD1 4.49Å; I207-I230 HydrophobicContact CG1-CG2 3.78Å; I207-Y231 HydrophobicContact CD1-CD1 4.32Å; I207-Y231 HydrophobicContact CD1-CE1 3.86Å; I207-Y231 WeakPolarHBondContact CG2-OH 3.3Å; I207-L234 HydrophobicContact CD1-CD1 3.87Å
208	S	96.4	Very high	93.6	Very high	80 Å²	80	51.8 Å²	51.8	56%	0.559	30%	0.296	S	S	*	.	H	α-helix	trans	-57.6	-47.2	178.6	-174.2	0	0	0	0	111.8	G204 K205 A206 A212	G204-S208 PolarHBondContact O-N 3.34Å; K205-S208 WeakPolarHBondContact O-CB 3.34Å; K205-S208 PolarHBondContact O-N 3.02Å; A206-S208 VanDerWaalsContact C-N 3.32Å; A206-S208 PolarHBondContact O-N 3.17Å; S208-A212 PolarHBondContact O-N 3.03Å
209	D	95.9	Very high	93.2	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-68.7	-44.3	-179.5	-83.7	-20.8	0	0	0	113.3	R190 R193 A194 F197 K205 A206 I207 T211 A212 A213	R190-D209 IonicContact NH1-OD1 3.92Å; R193-D209 IonicContact CZ-OD1 2.65Å; R193-D209 IonicContact CZ-OD2 2.71Å; R193-D209 IonicContact NE-OD1 3.85Å; R193-D209 IonicContact NE-OD2 3.55Å; R193-D209 PolarHBondContact NE-OD2 3.39Å; R193-D209 IonicContact NH2-OD1 2.67Å; R193-D209 PolarHBondContact NH2-OD1 2.93Å; R193-D209 IonicContact NH2-OD2 3.58Å; R193-D209 PolarHBondContact NH2-OD2 2.94Å; A194-D209 HydrophobicContact CB-CB 3.83Å; F197-D209 WeakPolarHBondContact CE2-OD2 3.31Å; K205-D209 PolarHBondContact O-N 3.09Å; A206-D209 PolarHBondContact O-N 3.46Å; I207-D209 VanDerWaalsContact C-N 3.35Å; I207-D209 PolarHBondContact O-N 3.27Å; D209-T211 VanDerWaalsContact C-N 3.34Å; D209-T211 PolarHBondContact O-N 3.36Å; D209-A212 PolarHBondContact O-N 2.94Å; D209-A213 WeakPolarHBondContact O-CB 3.04Å; D209-A213 PolarHBondContact O-N 3.35Å
210	L	96.1	Very high	92.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.8	-36.1	178.1	-69.4	169.4	0	0	0	112.1	E191 A194 A206 I207 A212 A213 S214 A223 K226 L227 I230	E191-L210 HydrophobicContact CG-CD2 4.47Å; A194-L210 HydrophobicContact CB-CD1 4.38Å; A194-L210 HydrophobicContact CB-CD2 3.99Å; A194-L210 HydrophobicContact CB-CG 3.73Å; A206-L210 WeakPolarHBondContact O-CG 3.44Å; A206-L210 PolarHBondContact O-N 3.42Å; I207-L210 PolarHBondContact O-N 3.3Å; L210-A212 VanDerWaalsContact C-N 3.33Å; L210-A213 PolarHBondContact O-N 3.34Å; L210-S214 WeakPolarHBondContact O-CB 3.49Å; L210-S214 PolarHBondContact O-N 2.8Å; L210-S214 PolarHBondContact O-OG 2.48Å; L210-A223 HydrophobicContact CD2-CB 4.37Å; L210-K226 HydrophobicContact CD1-CB 3.76Å; L210-K226 HydrophobicContact CD2-CB 4.35Å; L210-K226 HydrophobicContact CD2-CD 4.22Å; L210-L227 HydrophobicContact CB-CD1 4.1Å; L210-L227 HydrophobicContact CB-CD2 3.65Å; L210-L227 HydrophobicContact CB-CG 3.63Å; L210-L227 HydrophobicContact CD1-CD2 4.27Å; L210-L227 HydrophobicContact CD1-CG 4.22Å; L210-I230 HydrophobicContact CD1-CD1 3.59Å
211	T	95	Very high	92.6	Very high	42 Å²	42	48.7 Å²	48.7	26%	0.258	29%	0.285	S	S	.	.	H	α-helix	trans	-65.5	-38.4	174.4	-59	0	0	0	0	111.3	I207 D209 S214 K215	I207-T211 VanDerWaalsContact O-CB 3.24Å; I207-T211 WeakPolarHBondContact O-CB 3.31Å; I207-T211 PolarHBondContact O-N 3.32Å; I207-T211 PolarHBondContact O-OG1 2.88Å; D209-T211 VanDerWaalsContact C-N 3.34Å; D209-T211 PolarHBondContact O-N 3.36Å; T211-S214 PolarHBondContact O-OG 3.02Å; T211-S214 VanDerWaalsContact O-OG 3.07Å; T211-K215 WeakPolarHBondContact O-CG 3.27Å; T211-K215 PolarHBondContact O-N 3.44Å
212	A	93	Very high	92.4	Very high	25 Å²	25	50 Å²	50	21%	0.207	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-43.5	173	0	0	0	0	0	111.1	S208 D209 L210 K215 L216	S208-A212 PolarHBondContact O-N 3.03Å; D209-A212 PolarHBondContact O-N 2.94Å; L210-A212 VanDerWaalsContact C-N 3.33Å; A212-K215 PolarHBondContact O-N 3.15Å; A212-L216 VanDerWaalsContact O-CG 3.27Å; A212-L216 WeakPolarHBondContact O-CG 3.46Å; A212-L216 PolarHBondContact O-N 2.82Å
213	A	92.8	Very high	92.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-43.2	178.3	0	0	0	0	0	112.6	V187 E191 D209 L210 K215 L216 K217	V187-A213 HydrophobicContact CG1-CB 4.01Å; E191-A213 HydrophobicContact CG-CB 4.1Å; D209-A213 WeakPolarHBondContact O-CB 3.04Å; D209-A213 PolarHBondContact O-N 3.35Å; L210-A213 PolarHBondContact O-N 3.34Å; A213-K215 VanDerWaalsContact C-N 3.33Å; A213-K215 PolarHBondContact O-N 3.31Å; A213-L216 PolarHBondContact O-N 3.41Å; A213-K217 PolarHBondContact O-N 3.36Å
214	S	91.9	Very high	92.3	Very high	15 Å²	15	46 Å²	46	11%	0.105	26%	0.258	C	S	.	.	H	α-helix	trans	-66.8	-31.6	178.3	67.9	0	0	0	0	113	L210 T211	L210-S214 WeakPolarHBondContact O-CB 3.49Å; L210-S214 PolarHBondContact O-N 2.8Å; L210-S214 PolarHBondContact O-OG 2.48Å; T211-S214 PolarHBondContact O-OG 3.02Å; T211-S214 VanDerWaalsContact O-OG 3.07Å
215	K	88.8	Confident	92.3	Very high	161 Å²	161	45.7 Å²	45.7	70%	0.7	24%	0.24	S	C	*	.	H	α-helix	trans	-71.6	-35.2	171.8	-69.6	172.6	-175.9	176	0	112.2	T211 A212 A213	T211-K215 WeakPolarHBondContact O-CG 3.27Å; T211-K215 PolarHBondContact O-N 3.44Å; A212-K215 PolarHBondContact O-N 3.15Å; A213-K215 VanDerWaalsContact C-N 3.33Å; A213-K215 PolarHBondContact O-N 3.31Å
216	L	86.9	Confident	92.2	Very high	41 Å²	41	42.9 Å²	42.9	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-76.6	-29	-179.4	-71.6	171.8	0	0	0	112.9	K87 W185 V187 A212 A213	K87-L216 WeakPolarHBondContact CE-O 3.35Å; K87-L216 PolarHBondContact NZ-O 3.17Å; W185-L216 HydrophobicContact CB-CD2 4.13Å; W185-L216 HydrophobicContact CG-CD2 4.09Å; V187-L216 HydrophobicContact CG2-CB 3.6Å; V187-L216 HydrophobicContact CG2-CD1 4.27Å; A212-L216 VanDerWaalsContact O-CG 3.27Å; A212-L216 WeakPolarHBondContact O-CG 3.46Å; A212-L216 PolarHBondContact O-N 2.82Å; A213-L216 PolarHBondContact O-N 3.41Å
217	K	85	Confident	92.2	Very high	81 Å²	81	42.9 Å²	42.9	35%	0.352	23%	0.228	S	C	.	.			trans	-124.1	116	177.8	-179	-179.5	177	-171.3	0	110.4	V187 A213 D219 N220	V187-K217 HydrophobicContact CG1-CB 4.28Å; V187-K217 HydrophobicContact CG2-CB 4.26Å; A213-K217 PolarHBondContact O-N 3.36Å; K217-D219 VanDerWaalsContact C-N 3.32Å; K217-D219 WeakPolarHBondContact CE-O 3.38Å; K217-D219 WeakPolarHBondContact CE-OD1 3.17Å; K217-D219 VanDerWaalsContact CE-OD2 3.27Å; K217-D219 WeakPolarHBondContact CE-OD2 3.45Å; K217-D219 WeakPolarHBondContact CG-OD1 3.43Å; K217-D219 IonicContact NZ-OD2 2.76Å; K217-D219 PolarHBondContact O-N 3.25Å; K217-N220 HydrophobicContact CB-CB 3.93Å; K217-N220 HydrophobicContact CD-CB 4Å; K217-N220 HydrophobicContact CG-CB 3.92Å; K217-N220 WeakPolarHBondContact O-CB 3.43Å
218	S	82.2	Confident	92.2	Very high	88 Å²	88	41.8 Å²	41.8	62%	0.615	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-25	-174.1	42.9	0	0	0	0	113.8	L250	S218-L250 WeakPolarHBondContact O-CD2 3.38Å
219	D	86.7	Confident	92.2	Very high	103 Å²	103	39.5 Å²	39.5	55%	0.551	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.7	41.8	178.8	62.6	-41.6	0	0	0	110.6	K217 T221	K217-D219 VanDerWaalsContact C-N 3.32Å; K217-D219 WeakPolarHBondContact CE-O 3.38Å; K217-D219 WeakPolarHBondContact CE-OD1 3.17Å; K217-D219 VanDerWaalsContact CE-OD2 3.27Å; K217-D219 WeakPolarHBondContact CE-OD2 3.45Å; K217-D219 WeakPolarHBondContact CG-OD1 3.43Å; K217-D219 IonicContact NZ-OD2 2.76Å; K217-D219 PolarHBondContact O-N 3.25Å; D219-T221 PolarHBondContact O-N 3.15Å
220	N	88.1	Confident	92.3	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.027	21%	0.206	C	C	.	.			trans	-101.9	66.2	-177.3	-159.4	-12.7	0	0	0	113.1	E191 K217 Q222 A223 F224	E191-N220 PolarHBondContact OE1-ND2 3.48Å; E191-N220 PolarHBondContact OE1-OD1 3.3Å; K217-N220 HydrophobicContact CB-CB 3.93Å; K217-N220 HydrophobicContact CD-CB 4Å; K217-N220 HydrophobicContact CG-CB 3.92Å; K217-N220 WeakPolarHBondContact O-CB 3.43Å; N220-Q222 VanDerWaalsContact C-N 3.25Å; N220-Q222 PolarHBondContact O-N 3.22Å; N220-A223 HydrophobicContact CB-CB 4.17Å; N220-A223 WeakPolarHBondContact ND2-CB 3.35Å; N220-A223 PolarHBondContact O-N 3.13Å; N220-A223 WeakPolarHBondContact OD1-CB 3.37Å; N220-A223 PolarHBondContact OD1-N 3.18Å; N220-F224 VanDerWaalsContact O-CD2 3.23Å; N220-F224 WeakPolarHBondContact O-CD2 3.37Å; N220-F224 PolarHBondContact O-N 3.41Å
221	T	91.9	Very high	92.4	Very high	24 Å²	24	41.1 Å²	41.1	15%	0.147	21%	0.212	C	C	.	.	H	α-helix	trans	-57.9	-38.7	178.8	-47.3	0	0	0	0	112.2	D219 A223 F224 Y225 C247 D251 H254	D219-T221 PolarHBondContact O-N 3.15Å; T221-A223 PolarHBondContact O-N 3.23Å; T221-F224 PolarHBondContact O-N 2.93Å; T221-Y225 PolarHBondContact O-N 2.95Å; T221-C247 HydrophobicContact CG2-CB 4.46Å; T221-C247 WeakPolarHBondContact CG2-SG 3.25Å; T221-D251 HydrophobicContact CG2-CB 3.96Å; T221-H254 HydrophobicContact CG2-CB 4.41Å; T221-H254 WeakPolarHBondContact CG2-CD2 3.46Å
222	Q	90.8	Very high	92.5	Very high	78 Å²	78	39.6 Å²	39.6	36%	0.364	20%	0.201	S	C	.	.	H	α-helix	trans	-65.3	-38.9	-179.9	-171.3	63.7	35	0	0	112.9	N220 Y225 K226	N220-Q222 VanDerWaalsContact C-N 3.25Å; N220-Q222 PolarHBondContact O-N 3.22Å; Q222-Y225 PolarHBondContact O-N 3.03Å; Q222-K226 WeakPolarHBondContact O-CG 3.49Å; Q222-K226 PolarHBondContact O-N 2.98Å
223	A	93.3	Very high	92.6	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-42.3	177.8	0	0	0	0	0	111.8	L210 N220 T221 K226 L227	L210-A223 HydrophobicContact CD2-CB 4.37Å; N220-A223 HydrophobicContact CB-CB 4.17Å; N220-A223 WeakPolarHBondContact ND2-CB 3.35Å; N220-A223 PolarHBondContact O-N 3.13Å; N220-A223 WeakPolarHBondContact OD1-CB 3.37Å; N220-A223 PolarHBondContact OD1-N 3.18Å; T221-A223 PolarHBondContact O-N 3.23Å; A223-K226 PolarHBondContact O-N 3.26Å; A223-L227 WeakPolarHBondContact O-CB 3.33Å; A223-L227 WeakPolarHBondContact O-CG 3.4Å; A223-L227 PolarHBondContact O-N 3.4Å
224	F	95.9	Very high	92.7	Very high	28 Å²	28	45.9 Å²	45.9	12%	0.123	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-41.3	175.1	-74.1	-69.1	0	0	0	112.2	N220 T221 L227 S228 E243 E246 C247 L250	N220-F224 VanDerWaalsContact O-CD2 3.23Å; N220-F224 WeakPolarHBondContact O-CD2 3.37Å; N220-F224 PolarHBondContact O-N 3.41Å; T221-F224 PolarHBondContact O-N 2.93Å; F224-L227 PolarHBondContact O-N 3.46Å; F224-S228 WeakPolarHBondContact O-CB 3.42Å; F224-S228 PolarHBondContact O-N 3.12Å; F224-E243 VanDerWaalsContact CD1-OE2 3.27Å; F224-E243 WeakPolarHBondContact CD1-OE2 3.3Å; F224-E246 HydrophobicContact CD1-CB 3.81Å; F224-E246 HydrophobicContact CE1-CB 3.82Å; F224-E246 HydrophobicContact CE1-CG 4.47Å; F224-E246 HydrophobicContact CG-CB 4.28Å; F224-E246 HydrophobicContact CZ-CB 4.32Å; F224-C247 HydrophobicContact CB-CB 3.82Å; F224-L250 HydrophobicContact CD2-CD1 3.65Å; F224-L250 HydrophobicContact CE2-CD1 3.63Å
225	Y	95.9	Very high	92.9	Very high	50 Å²	50	46 Å²	46	20%	0.196	23%	0.231	C	C	.	.	H	α-helix	trans	-59.8	-48.2	173.8	-179.3	-112.1	0	0	0	112.2	T221 Q222 S228 T229 Q256 C257 H260	T221-Y225 PolarHBondContact O-N 2.95Å; Q222-Y225 PolarHBondContact O-N 3.03Å; Y225-S228 PolarHBondContact O-N 3.48Å; Y225-T229 WeakPolarHBondContact O-CB 3.36Å; Y225-T229 PolarHBondContact O-N 3.11Å; Y225-T229 PolarHBondContact O-OG1 3.3Å; Y225-Q256 HydrophobicContact CD2-CB 4.35Å; Y225-Q256 HydrophobicContact CE1-CB 4.31Å; Y225-Q256 HydrophobicContact CE2-CB 3.77Å; Y225-C257 VanDerWaalsContact CB-SG 3.58Å; Y225-C257 HydrophobicContact CD2-CB 4.46Å; Y225-C257 VanDerWaalsContact CD2-SG 3.51Å; Y225-H260 HydrophobicContact CE2-CB 3.98Å
226	K	95.6	Very high	93.2	Very high	50 Å²	50	42 Å²	42	22%	0.217	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-45.3	177.9	-72.3	-172.1	179.8	-163	0	111.8	E195 L210 Q222 A223 S228 T229 I230	E195-K226 IonicContact OE2-NZ 3.13Å; E195-K226 PolarHBondContact OE2-NZ 2.83Å; L210-K226 HydrophobicContact CD1-CB 3.76Å; L210-K226 HydrophobicContact CD2-CB 4.35Å; L210-K226 HydrophobicContact CD2-CD 4.22Å; Q222-K226 WeakPolarHBondContact O-CG 3.49Å; Q222-K226 PolarHBondContact O-N 2.98Å; A223-K226 PolarHBondContact O-N 3.26Å; K226-S228 PolarHBondContact O-N 2.93Å; K226-T229 PolarHBondContact O-N 3.01Å; K226-I230 WeakPolarHBondContact O-CG1 3.4Å; K226-I230 PolarHBondContact O-N 2.88Å
227	L	96.9	Very high	93.7	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-56.9	-49.9	175.2	-80.7	167.7	0	0	0	111.5	I207 L210 A223 F224 T229 I230 Y231 E243	I207-L227 HydrophobicContact CB-CD2 4.31Å; I207-L227 HydrophobicContact CG1-CD2 4.36Å; I207-L227 HydrophobicContact CG2-CD2 4.07Å; L210-L227 HydrophobicContact CB-CD1 4.1Å; L210-L227 HydrophobicContact CB-CD2 3.65Å; L210-L227 HydrophobicContact CB-CG 3.63Å; L210-L227 HydrophobicContact CD1-CD2 4.27Å; L210-L227 HydrophobicContact CD1-CG 4.22Å; A223-L227 WeakPolarHBondContact O-CB 3.33Å; A223-L227 WeakPolarHBondContact O-CG 3.4Å; A223-L227 PolarHBondContact O-N 3.4Å; F224-L227 PolarHBondContact O-N 3.46Å; L227-T229 VanDerWaalsContact C-N 3.26Å; L227-T229 PolarHBondContact O-N 2.74Å; L227-I230 PolarHBondContact O-N 2.97Å; L227-Y231 HydrophobicContact CD2-CE2 4.48Å; L227-Y231 WeakPolarHBondContact O-CD2 3.31Å; L227-Y231 PolarHBondContact O-N 3.25Å; L227-E243 HydrophobicContact CB-CB 4.38Å; L227-E243 HydrophobicContact CB-CG 4.19Å
228	S	97.7	Very high	94.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.7	-40	177.9	179.3	0	0	0	0	112.3	F224 Y225 K226 Y232 S240 V244 H260	F224-S228 WeakPolarHBondContact O-CB 3.42Å; F224-S228 PolarHBondContact O-N 3.12Å; Y225-S228 PolarHBondContact O-N 3.48Å; K226-S228 PolarHBondContact O-N 2.93Å; S228-Y232 WeakPolarHBondContact O-CB 3.44Å; S228-Y232 PolarHBondContact O-N 3.37Å; S228-S240 WeakPolarHBondContact CB-O 3.44Å; S228-S240 WeakPolarHBondContact O-CB 3.45Å; S228-S240 PolarHBondContact O-OG 2.9Å; S228-S240 PolarHBondContact OG-O 2.98Å; S228-S240 PolarHBondContact OG-OG 3.13Å; S228-S240 VanDerWaalsContact OG-OG 3.05Å; S228-V244 WeakPolarHBondContact OG-CB 3.3Å; S228-H260 PolarHBondContact OG-CD2 3.36Å; S228-H260 PolarHBondContact OG-NE2 3.2Å
229	T	96.6	Very high	95	Very high	33 Å²	33	41.7 Å²	41.7	20%	0.202	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-41.5	178.4	-55.3	0	0	0	0	111.4	Y225 K226 L227 Y232 H233	Y225-T229 WeakPolarHBondContact O-CB 3.36Å; Y225-T229 PolarHBondContact O-N 3.11Å; Y225-T229 PolarHBondContact O-OG1 3.3Å; K226-T229 PolarHBondContact O-N 3.01Å; L227-T229 VanDerWaalsContact C-N 3.26Å; L227-T229 PolarHBondContact O-N 2.74Å; T229-Y232 WeakPolarHBondContact O-CB 3.39Å; T229-Y232 PolarHBondContact O-N 3.39Å; T229-H233 PolarHBondContact O-CD2 3.49Å; T229-H233 PolarHBondContact O-N 3.08Å
230	I	96.7	Very high	95.6	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.036	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-49.6	176.2	-65.2	164.6	0	0	0	110.4	I198 M203 A206 I207 L210 K226 L227 Y232 H233 L234	I198-I230 HydrophobicContact CD1-CD1 3.91Å; I198-I230 HydrophobicContact CD1-CG1 4.4Å; I198-I230 HydrophobicContact CG1-CD1 4Å; I198-I230 HydrophobicContact CG1-CG1 4.42Å; M203-I230 HydrophobicContact CB-CG2 3.82Å; M203-I230 HydrophobicContact CG-CG2 4.18Å; M203-I230 HydrophobicContact SD-CG1 4.37Å; M203-I230 HydrophobicContact SD-CG2 3.96Å; A206-I230 HydrophobicContact CB-CD1 4Å; I207-I230 HydrophobicContact CD1-CG2 3.82Å; I207-I230 HydrophobicContact CG1-CB 4.45Å; I207-I230 HydrophobicContact CG1-CD1 4.49Å; I207-I230 HydrophobicContact CG1-CG2 3.78Å; L210-I230 HydrophobicContact CD1-CD1 3.59Å; K226-I230 WeakPolarHBondContact O-CG1 3.4Å; K226-I230 PolarHBondContact O-N 2.88Å; L227-I230 PolarHBondContact O-N 2.97Å; I230-Y232 PolarHBondContact O-N 2.84Å; I230-H233 PolarHBondContact O-N 3.32Å; I230-H233 VanDerWaalsContact O-N 3.13Å; I230-L234 HydrophobicContact CG2-CD1 4Å; I230-L234 HydrophobicContact CG2-CG 4.39Å; I230-L234 WeakPolarHBondContact O-CG 3.32Å; I230-L234 PolarHBondContact O-N 3.27Å
231	Y	97.9	Very high	96.1	Very high	30 Å²	30	36.8 Å²	36.8	12%	0.118	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-38	177	-76.1	-56.6	0	0	0	112.1	I207 L227 L234 G235 D236 M239 E243	I207-Y231 HydrophobicContact CD1-CD1 4.32Å; I207-Y231 HydrophobicContact CD1-CE1 3.86Å; I207-Y231 WeakPolarHBondContact CG2-OH 3.3Å; L227-Y231 HydrophobicContact CD2-CE2 4.48Å; L227-Y231 WeakPolarHBondContact O-CD2 3.31Å; L227-Y231 PolarHBondContact O-N 3.25Å; Y231-L234 PolarHBondContact O-N 3.5Å; Y231-G235 PolarHBondContact O-N 3.02Å; Y231-D236 HydrophobicContact CD1-CB 3.92Å; Y231-D236 HydrophobicContact CG-CB 4.44Å; Y231-D236 PolarHBondContact O-N 3.11Å; Y231-M239 HydrophobicContact CD1-CB 3.79Å; Y231-M239 HydrophobicContact CD1-CG 4.47Å; Y231-M239 HydrophobicContact CD2-CB 3.86Å; Y231-M239 HydrophobicContact CE1-CB 4.09Å; Y231-M239 HydrophobicContact CE1-CG 4.41Å; Y231-M239 HydrophobicContact CE2-CB 4.15Å; Y231-M239 HydrophobicContact CE2-CE 4.31Å; Y231-M239 HydrophobicContact CG-CB 3.68Å; Y231-E243 HydrophobicContact CD2-CG 3.9Å; Y231-E243 HydrophobicContact CE2-CG 3.9Å
232	Y	97.3	Very high	96.3	Very high	10 Å²	10	39.1 Å²	39.1	4%	0.039	19%	0.193	C	C	.	.	H	α-helix	trans	-59.2	-48.1	174.9	-171.2	-104.3	0	0	0	112.4	S228 T229 I230 L234 G235 H260 Q263 V264 L267 E297 V300 Y303	S228-Y232 WeakPolarHBondContact O-CB 3.44Å; S228-Y232 PolarHBondContact O-N 3.37Å; T229-Y232 WeakPolarHBondContact O-CB 3.39Å; T229-Y232 PolarHBondContact O-N 3.39Å; I230-Y232 PolarHBondContact O-N 2.84Å; Y232-L234 VanDerWaalsContact C-N 3.27Å; Y232-L234 PolarHBondContact O-N 3.19Å; Y232-G235 PolarHBondContact O-N 3.38Å; Y232-G235 VanDerWaalsContact O-N 3.09Å; Y232-H260 AromaticContact CD2-CE1 3.93Å; Y232-H260 AromaticContact CG-CE1 3.73Å; Y232-Q263 HydrophobicContact CE2-CG 4.5Å; Y232-Q263 WeakPolarHBondContact OH-CG 3.45Å; Y232-Q263 PolarHBondContact OH-NE2 3.39Å; Y232-V264 HydrophobicContact CD2-CG2 3.6Å; Y232-V264 HydrophobicContact CE2-CG2 3.8Å; Y232-L267 HydrophobicContact CE2-CD2 3.66Å; Y232-E297 HydrophobicContact CE1-CG 4.24Å; Y232-E297 VanDerWaalsContact OH-CD 3.25Å; Y232-E297 VanDerWaalsContact OH-CG 3.31Å; Y232-E297 WeakPolarHBondContact OH-CG 3.48Å; Y232-E297 PolarHBondContact OH-OE2 3.44Å; Y232-V300 HydrophobicContact CD1-CG2 4.16Å; Y232-V300 HydrophobicContact CE1-CG2 3.85Å; Y232-Y303 HydrophobicContact CD1-CE2 4.44Å; Y232-Y303 HydrophobicContact CD2-CE2 4.06Å; Y232-Y303 WeakPolarHBondContact CD2-OH 3.26Å; Y232-Y303 HydrophobicContact CE1-CE2 4.24Å; Y232-Y303 AromaticContact CE2-CE2 3.88Å; Y232-Y303 HydrophobicContact CE2-CE2 3.88Å; Y232-Y303 HydrophobicContact CG-CE2 4.37Å; Y232-Y303 AromaticContact CZ-CE2 3.98Å; Y232-Y303 VanDerWaalsContact O-CE2 3.3Å; Y232-Y303 WeakPolarHBondContact O-CE2 3.5Å; Y232-Y303 PolarHBondContact O-OH 3.02Å; Y232-Y303 VanDerWaalsContact O-OH 3.14Å
233	H	95.3	Very high	96.7	Very high	88 Å²	88	37 Å²	37	41%	0.407	18%	0.183	S	C	.	.	H	α-helix	trans	-69.7	-23.7	179.1	-71.4	-59	0	0	0	113.6	T229 I230 G235 Q302	T229-H233 PolarHBondContact O-CD2 3.49Å; T229-H233 PolarHBondContact O-N 3.08Å; I230-H233 PolarHBondContact O-N 3.32Å; I230-H233 VanDerWaalsContact O-N 3.13Å; H233-G235 VanDerWaalsContact C-N 3.27Å; H233-Q302 PolarHBondContact O-NE2 3.34Å; H233-Q302 PolarHBondContact O-OE1 3.39Å
234	L	95.1	Very high	96.9	Very high	70 Å²	70	37 Å²	37	37%	0.366	18%	0.183	S	C	.	.	H	α-helix	trans	-78.7	-10.7	172.3	-67.4	176.7	0	0	0	113.1	M203 I207 I230 Y231 Y232	M203-L234 HydrophobicContact CB-CD1 4.11Å; M203-L234 HydrophobicContact CB-CD2 4.08Å; M203-L234 HydrophobicContact CB-CG 4.41Å; M203-L234 HydrophobicContact CG-CD2 4.11Å; I207-L234 HydrophobicContact CD1-CD1 3.87Å; I230-L234 HydrophobicContact CG2-CD1 4Å; I230-L234 HydrophobicContact CG2-CG 4.39Å; I230-L234 WeakPolarHBondContact O-CG 3.32Å; I230-L234 PolarHBondContact O-N 3.27Å; Y231-L234 PolarHBondContact O-N 3.5Å; Y232-L234 VanDerWaalsContact C-N 3.27Å; Y232-L234 PolarHBondContact O-N 3.19Å
235	G	95.6	Very high	96.9	Very high	16 Å²	16	41 Å²	41	17%	0.165	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	91	-4.6	-175.1	0	0	0	0	0	114	Y231 Y232 H233 H237 Y303	Y231-G235 PolarHBondContact O-N 3.02Å; Y232-G235 PolarHBondContact O-N 3.38Å; Y232-G235 VanDerWaalsContact O-N 3.09Å; H233-G235 VanDerWaalsContact C-N 3.27Å; G235-H237 PolarHBondContact O-CD2 2.88Å; G235-H237 PolarHBondContact O-N 3.45Å; G235-Y303 VanDerWaalsContact O-CE1 3.31Å; G235-Y303 WeakPolarHBondContact O-CE1 3.44Å
236	D	96.6	Very high	96.9	Very high	78 Å²	78	42.2 Å²	42.2	42%	0.417	20%	0.204	S	C	.	.			trans	-76.7	68.4	179.6	-67.3	-31.2	0	0	0	111.4	Y231 E238 M239 S240	Y231-D236 HydrophobicContact CD1-CB 3.92Å; Y231-D236 HydrophobicContact CG-CB 4.44Å; Y231-D236 PolarHBondContact O-N 3.11Å; D236-E238 VanDerWaalsContact C-N 3.26Å; D236-E238 PolarHBondContact O-N 2.92Å; D236-M239 HydrophobicContact CB-CB 4.26Å; D236-M239 PolarHBondContact O-N 3.44Å; D236-S240 WeakPolarHBondContact O-CB 3.38Å; D236-S240 PolarHBondContact O-N 3.11Å
237	H	96.9	Very high	97	Very high	26 Å²	26	39.8 Å²	39.8	12%	0.12	19%	0.194	C	C	.	.	H	α-helix	trans	-59.5	-32.3	-176.4	54.7	82.4	0	0	0	113.5	G235 L241 V264 N268 I271 Y303	G235-H237 PolarHBondContact O-CD2 2.88Å; G235-H237 PolarHBondContact O-N 3.45Å; H237-L241 WeakPolarHBondContact O-CB 3.36Å; H237-L241 PolarHBondContact O-N 3.45Å; H237-V264 WeakPolarHBondContact O-CG1 3.41Å; H237-N268 PolarHBondContact ND1-OD1 3.05Å; H237-I271 VanDerWaalsContact CD2-CD1 3.45Å; H237-I271 WeakPolarHBondContact CD2-CD1 3.45Å; H237-Y303 HydrophobicContact CB-CE1 3.97Å
238	E	97.6	Very high	97	Very high	102 Å²	102	41 Å²	41	48%	0.477	20%	0.2	S	C	.	.	H	α-helix	trans	-70.5	-48.5	179.8	-57.4	-157.2	143.1	0	0	112	D236 S240 L241 N242 Q272	D236-E238 VanDerWaalsContact C-N 3.26Å; D236-E238 PolarHBondContact O-N 2.92Å; E238-S240 VanDerWaalsContact C-N 3.34Å; E238-L241 PolarHBondContact O-N 2.96Å; E238-N242 PolarHBondContact O-N 3.27Å; E238-N242 PolarHBondContact O-ND2 3.13Å; E238-Q272 PolarHBondContact OE1-NE2 3.46Å; E238-Q272 VanDerWaalsContact OE1-NE2 3.13Å
239	M	97.5	Very high	96.9	Very high	76 Å²	76	47.8 Å²	47.8	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-63.2	-44.1	175.5	-68.8	-58.2	-65.9	0	0	110.3	Y231 D236 L241 N242 E243	Y231-M239 HydrophobicContact CD1-CB 3.79Å; Y231-M239 HydrophobicContact CD1-CG 4.47Å; Y231-M239 HydrophobicContact CD2-CB 3.86Å; Y231-M239 HydrophobicContact CE1-CB 4.09Å; Y231-M239 HydrophobicContact CE1-CG 4.41Å; Y231-M239 HydrophobicContact CE2-CB 4.15Å; Y231-M239 HydrophobicContact CE2-CE 4.31Å; Y231-M239 HydrophobicContact CG-CB 3.68Å; D236-M239 HydrophobicContact CB-CB 4.26Å; D236-M239 PolarHBondContact O-N 3.44Å; M239-L241 VanDerWaalsContact C-N 3.29Å; M239-L241 PolarHBondContact O-N 3.49Å; M239-N242 PolarHBondContact O-N 3.15Å; M239-N242 VanDerWaalsContact O-N 3.11Å; M239-E243 WeakPolarHBondContact O-CG 3.48Å; M239-E243 PolarHBondContact O-N 3.32Å
240	S	98.2	Very high	96.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-53.4	-46.2	174.1	-174.3	0	0	0	0	112.2	S228 D236 E238 N242 V244 H260	S228-S240 WeakPolarHBondContact CB-O 3.44Å; S228-S240 WeakPolarHBondContact O-CB 3.45Å; S228-S240 PolarHBondContact O-OG 2.9Å; S228-S240 PolarHBondContact OG-O 2.98Å; S228-S240 PolarHBondContact OG-OG 3.13Å; S228-S240 VanDerWaalsContact OG-OG 3.05Å; D236-S240 WeakPolarHBondContact O-CB 3.38Å; D236-S240 PolarHBondContact O-N 3.11Å; E238-S240 VanDerWaalsContact C-N 3.34Å; S240-N242 PolarHBondContact O-N 2.91Å; S240-V244 WeakPolarHBondContact O-CG1 3.29Å; S240-V244 PolarHBondContact O-N 3.14Å; S240-V244 VanDerWaalsContact O-N 3.12Å; S240-H260 PolarHBondContact OG-NE2 2.96Å
241	L	98.3	Very high	96.6	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-66.5	-36.1	179.4	-174.7	57.5	0	0	0	112.7	H237 E238 M239 V244 R245 Y261 V264 K265 N268	H237-L241 WeakPolarHBondContact O-CB 3.36Å; H237-L241 PolarHBondContact O-N 3.45Å; E238-L241 PolarHBondContact O-N 2.96Å; M239-L241 VanDerWaalsContact C-N 3.29Å; M239-L241 PolarHBondContact O-N 3.49Å; L241-V244 HydrophobicContact CD1-CG1 4.33Å; L241-V244 WeakPolarHBondContact O-CG1 3.41Å; L241-R245 WeakPolarHBondContact O-CD 3.42Å; L241-R245 WeakPolarHBondContact O-CG 3.27Å; L241-R245 PolarHBondContact O-N 3.46Å; L241-Y261 HydrophobicContact CD1-CD2 3.83Å; L241-Y261 HydrophobicContact CD1-CE2 3.91Å; L241-V264 HydrophobicContact CB-CG1 3.8Å; L241-V264 HydrophobicContact CD1-CG1 4.33Å; L241-K265 HydrophobicContact CD1-CB 4.08Å; L241-N268 HydrophobicContact CD2-CB 4.07Å
242	N	97.6	Very high	96.5	Very high	74 Å²	74	55 Å²	55	40%	0.396	27%	0.274	S	S	.	.	H	α-helix	trans	-69.6	-46	177.9	-69.9	-22.7	0	0	0	111.4	E238 M239 S240 V244 R245 E246	E238-N242 PolarHBondContact O-N 3.27Å; E238-N242 PolarHBondContact O-ND2 3.13Å; M239-N242 PolarHBondContact O-N 3.15Å; M239-N242 VanDerWaalsContact O-N 3.11Å; S240-N242 PolarHBondContact O-N 2.91Å; N242-V244 PolarHBondContact O-N 3.04Å; N242-R245 WeakPolarHBondContact O-CB 3.33Å; N242-R245 PolarHBondContact O-N 2.96Å; N242-R245 PolarHBondContact OD1-NH1 3.42Å; N242-R245 VanDerWaalsContact OD1-NH1 3.16Å; N242-E246 PolarHBondContact O-N 3.15Å; N242-E246 VanDerWaalsContact O-N 3.13Å
243	E	97.4	Very high	96.3	Very high	34 Å²	34	61.6 Å²	61.6	16%	0.159	31%	0.31	C	S	.	.	H	α-helix	trans	-65.1	-39.9	180	-63.1	-54.1	151.1	0	0	112.3	F224 L227 Y231 M239 R245 E246 C247	F224-E243 VanDerWaalsContact CD1-OE2 3.27Å; F224-E243 WeakPolarHBondContact CD1-OE2 3.3Å; L227-E243 HydrophobicContact CB-CB 4.38Å; L227-E243 HydrophobicContact CB-CG 4.19Å; Y231-E243 HydrophobicContact CD2-CG 3.9Å; Y231-E243 HydrophobicContact CE2-CG 3.9Å; M239-E243 WeakPolarHBondContact O-CG 3.48Å; M239-E243 PolarHBondContact O-N 3.32Å; E243-R245 VanDerWaalsContact C-N 3.29Å; E243-R245 PolarHBondContact O-N 2.94Å; E243-E246 PolarHBondContact O-N 3.42Å; E243-C247 PolarHBondContact O-N 3.49Å
244	V	97.8	Very high	96.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-70.5	-25.3	176.6	72.3	0	0	0	0	112.7	S228 S240 L241 N242 C247 L248 C257 H260 Y261	S228-V244 WeakPolarHBondContact OG-CB 3.3Å; S240-V244 WeakPolarHBondContact O-CG1 3.29Å; S240-V244 PolarHBondContact O-N 3.14Å; S240-V244 VanDerWaalsContact O-N 3.12Å; L241-V244 HydrophobicContact CD1-CG1 4.33Å; L241-V244 WeakPolarHBondContact O-CG1 3.41Å; N242-V244 PolarHBondContact O-N 3.04Å; V244-C247 WeakPolarHBondContact O-CB 3.48Å; V244-C247 PolarHBondContact O-N 3.36Å; V244-L248 WeakPolarHBondContact O-CG 3.41Å; V244-L248 PolarHBondContact O-N 2.91Å; V244-C257 HydrophobicContact CG2-CB 3.95Å; V244-C257 WeakPolarHBondContact CG2-O 3.34Å; V244-H260 HydrophobicContact CG2-CB 4.44Å; V244-Y261 HydrophobicContact CG1-CD2 4.06Å
245	R	97.6	Very high	96.4	Very high	113 Å²	113	63.3 Å²	63.3	43%	0.426	32%	0.316	S	S	.	.	H	α-helix	trans	-67.9	-41.6	170.4	-77.1	166.2	175.1	156.5	-2.8	111.2	L241 N242 E243 C247 L248 K249 Y261	L241-R245 WeakPolarHBondContact O-CD 3.42Å; L241-R245 WeakPolarHBondContact O-CG 3.27Å; L241-R245 PolarHBondContact O-N 3.46Å; N242-R245 WeakPolarHBondContact O-CB 3.33Å; N242-R245 PolarHBondContact O-N 2.96Å; N242-R245 PolarHBondContact OD1-NH1 3.42Å; N242-R245 VanDerWaalsContact OD1-NH1 3.16Å; E243-R245 VanDerWaalsContact C-N 3.29Å; E243-R245 PolarHBondContact O-N 2.94Å; R245-C247 VanDerWaalsContact C-N 3.29Å; R245-L248 PolarHBondContact O-N 2.93Å; R245-K249 WeakPolarHBondContact O-CB 3.19Å; R245-K249 PolarHBondContact O-N 3.21Å; R245-Y261 HydrophobicContact CG-CD2 4.38Å; R245-Y261 HydrophobicContact CG-CE2 4.1Å
246	E	95.9	Very high	96.4	Very high	74 Å²	74	67.1 Å²	67.1	35%	0.346	33%	0.329	S	S	.	.	H	α-helix	trans	-64.7	-36.6	173.6	-68.3	-59.5	127.5	0	0	111.1	F224 N242 E243 K249 L250	F224-E246 HydrophobicContact CD1-CB 3.81Å; F224-E246 HydrophobicContact CE1-CB 3.82Å; F224-E246 HydrophobicContact CE1-CG 4.47Å; F224-E246 HydrophobicContact CG-CB 4.28Å; F224-E246 HydrophobicContact CZ-CB 4.32Å; N242-E246 PolarHBondContact O-N 3.15Å; N242-E246 VanDerWaalsContact O-N 3.13Å; E243-E246 PolarHBondContact O-N 3.42Å; E246-K249 WeakPolarHBondContact O-CB 3.5Å; E246-K249 PolarHBondContact O-N 3.23Å; E246-K249 IonicContact OE1-NZ 3.59Å; E246-K249 PolarHBondContact OE1-NZ 3.03Å; E246-K249 WeakPolarHBondContact OE2-CD 3.36Å; E246-K249 IonicContact OE2-NZ 3.52Å; E246-K249 PolarHBondContact OE2-NZ 2.02Å; E246-L250 WeakPolarHBondContact O-CG 3.32Å; E246-L250 PolarHBondContact O-N 3.14Å
247	C	96.1	Very high	96.4	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-54.4	-54.8	169.6	179.5	0	0	0	0	112.1	T221 F224 E243 V244 R245 K249 L250 D251 C257	T221-C247 HydrophobicContact CG2-CB 4.46Å; T221-C247 WeakPolarHBondContact CG2-SG 3.25Å; F224-C247 HydrophobicContact CB-CB 3.82Å; E243-C247 PolarHBondContact O-N 3.49Å; V244-C247 WeakPolarHBondContact O-CB 3.48Å; V244-C247 PolarHBondContact O-N 3.36Å; R245-C247 VanDerWaalsContact C-N 3.29Å; C247-K249 PolarHBondContact O-N 2.96Å; C247-L250 PolarHBondContact O-N 2.98Å; C247-L250 VanDerWaalsContact O-N 3.14Å; C247-D251 PolarHBondContact O-N 3.3Å; C247-C257 HydrophobicContact CB-CB 3.94Å; C247-C257 WeakPolarHBondContact CB-SG 3.38Å; C247-C257 WeakPolarHBondContact SG-CB 3.38Å; C247-C257 CovalentContact SG-SG 2.02Å; C247-C257 PolarHBondContact SG-SG 2.96Å
248	L	96.4	Very high	96.5	Very high	26 Å²	26	67.7 Å²	67.7	14%	0.136	33%	0.326	C	S	.	.	H	α-helix	trans	-69.7	-19.3	-177.9	-70.2	174.6	0	0	0	114.1	V244 R245 D251 P252 C257 Y258 Y261	V244-L248 WeakPolarHBondContact O-CG 3.41Å; V244-L248 PolarHBondContact O-N 2.91Å; R245-L248 PolarHBondContact O-N 2.93Å; L248-D251 WeakPolarHBondContact CA-O 3.12Å; L248-D251 CarbonylContact O-C 3.21Å; L248-P252 VanDerWaalsContact O-CA 3.27Å; L248-P252 WeakPolarHBondContact O-CA 3.18Å; L248-P252 VanDerWaalsContact O-N 3.16Å; L248-C257 HydrophobicContact CD2-CB 3.79Å; L248-C257 HydrophobicContact CG-CB 4.06Å; L248-Y258 HydrophobicContact CD1-CD2 4.36Å; L248-Y261 HydrophobicContact CD1-CD1 4.14Å; L248-Y261 HydrophobicContact CD1-CD2 4.17Å; L248-Y261 HydrophobicContact CD1-CG 3.74Å
249	K	95.9	Very high	96.5	Very high	143 Å²	143	66.7 Å²	66.7	62%	0.622	33%	0.33	S	S	*	.	H	α-helix	trans	-74.6	-32.5	173.2	179.7	-176.8	169.7	-166.3	0	111.7	R245 E246 C247	R245-K249 WeakPolarHBondContact O-CB 3.19Å; R245-K249 PolarHBondContact O-N 3.21Å; E246-K249 WeakPolarHBondContact O-CB 3.5Å; E246-K249 PolarHBondContact O-N 3.23Å; E246-K249 IonicContact OE1-NZ 3.59Å; E246-K249 PolarHBondContact OE1-NZ 3.03Å; E246-K249 WeakPolarHBondContact OE2-CD 3.36Å; E246-K249 IonicContact OE2-NZ 3.52Å; E246-K249 PolarHBondContact OE2-NZ 2.02Å; C247-K249 PolarHBondContact O-N 2.96Å
250	L	93.7	Very high	96.5	Very high	71 Å²	71	64.1 Å²	64.1	37%	0.372	32%	0.317	S	S	.	.	H	α-helix	trans	-76.5	-42.3	172.8	-63.7	-179.1	0	0	0	111.4	S218 F224 E246 C247	S218-L250 WeakPolarHBondContact O-CD2 3.38Å; F224-L250 HydrophobicContact CD2-CD1 3.65Å; F224-L250 HydrophobicContact CE2-CD1 3.63Å; E246-L250 WeakPolarHBondContact O-CG 3.32Å; E246-L250 PolarHBondContact O-N 3.14Å; C247-L250 PolarHBondContact O-N 2.98Å; C247-L250 VanDerWaalsContact O-N 3.14Å
251	D	94.1	Very high	96.5	Very high	59 Å²	59	66.2 Å²	66.2	32%	0.316	33%	0.325	S	S	.	.			trans	-139.7	97	180	-176.8	1.9	0	0	0	110.9	T221 C247 L248 D253 H254	T221-D251 HydrophobicContact CG2-CB 3.96Å; C247-D251 PolarHBondContact O-N 3.3Å; L248-D251 WeakPolarHBondContact CA-O 3.12Å; L248-D251 CarbonylContact O-C 3.21Å; D251-D253 PolarHBondContact O-N 3.38Å; D251-D253 PolarHBondContact OD1-N 2.79Å; D251-D253 VanDerWaalsContact OD1-N 3.09Å; D251-H254 HydrophobicContact CB-CB 4.09Å; D251-H254 PolarHBondContact O-N 3.35Å; D251-H254 PolarHBondContact OD1-N 3.06Å
252	P	95.1	Very high	96.4	Very high	91 Å²	91	71.4 Å²	71.4	59%	0.591	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.6	179.5	-24.6	35.2	0	0	0	114.5	L248	L248-P252 VanDerWaalsContact O-CA 3.27Å; L248-P252 WeakPolarHBondContact O-CA 3.18Å; L248-P252 VanDerWaalsContact O-N 3.16Å
253	D	94.4	Very high	96.4	Very high	149 Å²	149	70.7 Å²	70.7	80%	0.797	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	4.2	-175.1	-65.7	-34.6	0	0	0	112.3	D251 E255	D251-D253 PolarHBondContact O-N 3.38Å; D251-D253 PolarHBondContact OD1-N 2.79Å; D251-D253 VanDerWaalsContact OD1-N 3.09Å; D253-E255 PolarHBondContact O-N 2.96Å
254	H	95.9	Very high	96.4	Very high	31 Å²	31	69 Å²	69	14%	0.144	33%	0.334	C	S	.	.			trans	-66.1	107	179.2	-168.5	-42.8	0	0	0	111.8	T221 D251 Q256 C257 Y258	T221-H254 HydrophobicContact CG2-CB 4.41Å; T221-H254 WeakPolarHBondContact CG2-CD2 3.46Å; D251-H254 HydrophobicContact CB-CB 4.09Å; D251-H254 PolarHBondContact O-N 3.35Å; D251-H254 PolarHBondContact OD1-N 3.06Å; H254-Q256 PolarHBondContact ND1-N 2.67Å; H254-Q256 PolarHBondContact O-N 3.21Å; H254-C257 HydrophobicContact CB-CB 4.17Å; H254-C257 PolarHBondContact ND1-N 2.7Å; H254-C257 PolarHBondContact O-N 3.33Å; H254-Y258 WeakPolarHBondContact O-CB 3.48Å; H254-Y258 PolarHBondContact O-N 3.05Å
255	E	95.5	Very high	96.4	Very high	163 Å²	163	73.8 Å²	73.8	76%	0.762	36%	0.355	S	S	*	.	H	α-helix	trans	-56.9	-49.6	-174.2	-172	178.5	-177.8	0	0	113.3	D253 Y258 S259	D253-E255 PolarHBondContact O-N 2.96Å; E255-Y258 PolarHBondContact O-N 3.08Å; E255-S259 WeakPolarHBondContact O-CB 3.35Å; E255-S259 PolarHBondContact O-N 3.14Å
256	Q	96.4	Very high	96.4	Very high	95 Å²	95	73.7 Å²	73.7	44%	0.444	36%	0.357	S	S	.	.	H	α-helix	trans	-64.1	-46.4	-178.7	-52.6	179.5	-51.4	0	0	112.4	Y225 H254 Y258 S259 H260	Y225-Q256 HydrophobicContact CD2-CB 4.35Å; Y225-Q256 HydrophobicContact CE1-CB 4.31Å; Y225-Q256 HydrophobicContact CE2-CB 3.77Å; H254-Q256 PolarHBondContact ND1-N 2.67Å; H254-Q256 PolarHBondContact O-N 3.21Å; Q256-Y258 VanDerWaalsContact C-N 3.31Å; Q256-Y258 PolarHBondContact O-N 3.07Å; Q256-S259 PolarHBondContact O-N 3.09Å; Q256-H260 WeakPolarHBondContact O-CB 3.39Å; Q256-H260 PolarHBondContact O-N 3.2Å
257	C	97	Very high	96.5	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-62.4	-38.1	175.7	-76.4	0	0	0	0	112.4	Y225 V244 C247 L248 H254 Y261	Y225-C257 VanDerWaalsContact CB-SG 3.58Å; Y225-C257 HydrophobicContact CD2-CB 4.46Å; Y225-C257 VanDerWaalsContact CD2-SG 3.51Å; V244-C257 HydrophobicContact CG2-CB 3.95Å; V244-C257 WeakPolarHBondContact CG2-O 3.34Å; C247-C257 HydrophobicContact CB-CB 3.94Å; C247-C257 WeakPolarHBondContact CB-SG 3.38Å; C247-C257 WeakPolarHBondContact SG-CB 3.38Å; C247-C257 CovalentContact SG-SG 2.02Å; C247-C257 PolarHBondContact SG-SG 2.96Å; L248-C257 HydrophobicContact CD2-CB 3.79Å; L248-C257 HydrophobicContact CG-CB 4.06Å; H254-C257 HydrophobicContact CB-CB 4.17Å; H254-C257 PolarHBondContact ND1-N 2.7Å; H254-C257 PolarHBondContact O-N 3.33Å; C257-Y261 WeakPolarHBondContact O-CB 3.2Å; C257-Y261 PolarHBondContact O-N 3.46Å
258	Y	97.6	Very high	96.6	Very high	116 Å²	116	70.6 Å²	70.6	46%	0.455	34%	0.343	S	S	.	.	H	α-helix	trans	-69.2	-41.3	179.3	-175	-114.5	0	0	0	112.3	L248 H254 E255 Q256 K262	L248-Y258 HydrophobicContact CD1-CD2 4.36Å; H254-Y258 WeakPolarHBondContact O-CB 3.48Å; H254-Y258 PolarHBondContact O-N 3.05Å; E255-Y258 PolarHBondContact O-N 3.08Å; Q256-Y258 VanDerWaalsContact C-N 3.31Å; Q256-Y258 PolarHBondContact O-N 3.07Å; Y258-K262 HydrophobicContact CE1-CD 4.26Å; Y258-K262 WeakPolarHBondContact O-CG 3.47Å; Y258-K262 PolarHBondContact O-N 3.13Å; Y258-K262 VanDerWaalsContact O-N 3.15Å; Y258-K262 WeakPolarHBondContact OH-CE 3.27Å
259	S	97.3	Very high	96.7	Very high	81 Å²	81	76.8 Å²	76.8	57%	0.566	37%	0.369	S	S	*	.	H	α-helix	trans	-60.5	-50.4	173.5	-172.3	0	0	0	0	111.2	E255 Q256 Y261 K262 Q263	E255-S259 WeakPolarHBondContact O-CB 3.35Å; E255-S259 PolarHBondContact O-N 3.14Å; Q256-S259 PolarHBondContact O-N 3.09Å; S259-Y261 PolarHBondContact O-N 3.39Å; S259-K262 PolarHBondContact O-N 3.3Å; S259-Q263 PolarHBondContact O-N 3.29Å
260	H	97.7	Very high	96.8	Very high	22 Å²	22	71.8 Å²	71.8	10%	0.102	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-45.2	178	-171.7	53.9	0	0	0	111.9	Y225 S228 Y232 S240 V244 Q256 K262 Q263 V264	Y225-H260 HydrophobicContact CE2-CB 3.98Å; S228-H260 PolarHBondContact OG-CD2 3.36Å; S228-H260 PolarHBondContact OG-NE2 3.2Å; Y232-H260 AromaticContact CD2-CE1 3.93Å; Y232-H260 AromaticContact CG-CE1 3.73Å; S240-H260 PolarHBondContact OG-NE2 2.96Å; V244-H260 HydrophobicContact CG2-CB 4.44Å; Q256-H260 WeakPolarHBondContact O-CB 3.39Å; Q256-H260 PolarHBondContact O-N 3.2Å; H260-K262 VanDerWaalsContact C-N 3.3Å; H260-K262 PolarHBondContact O-N 2.98Å; H260-Q263 WeakPolarHBondContact O-CB 3.44Å; H260-Q263 PolarHBondContact O-N 3.21Å; H260-Q263 VanDerWaalsContact O-N 3.08Å; H260-V264 WeakPolarHBondContact CE1-CG2 3.33Å; H260-V264 WeakPolarHBondContact NE2-CG2 3.23Å; H260-V264 WeakPolarHBondContact O-CG2 3.42Å; H260-V264 PolarHBondContact O-N 3.28Å
261	Y	98.4	Very high	97	Very high	45 Å²	45	68.6 Å²	68.6	18%	0.176	33%	0.331	C	S	.	.	H	α-helix	trans	-54.1	-43.4	175.8	167.1	-99.8	0	0	0	112.7	L241 V244 R245 L248 C257 S259 Q263 K265	L241-Y261 HydrophobicContact CD1-CD2 3.83Å; L241-Y261 HydrophobicContact CD1-CE2 3.91Å; V244-Y261 HydrophobicContact CG1-CD2 4.06Å; R245-Y261 HydrophobicContact CG-CD2 4.38Å; R245-Y261 HydrophobicContact CG-CE2 4.1Å; L248-Y261 HydrophobicContact CD1-CD1 4.14Å; L248-Y261 HydrophobicContact CD1-CD2 4.17Å; L248-Y261 HydrophobicContact CD1-CG 3.74Å; C257-Y261 WeakPolarHBondContact O-CB 3.2Å; C257-Y261 PolarHBondContact O-N 3.46Å; S259-Y261 PolarHBondContact O-N 3.39Å; Y261-Q263 VanDerWaalsContact C-N 3.34Å; Y261-Q263 PolarHBondContact O-N 3.26Å; Y261-K265 HydrophobicContact CE1-CD 3.85Å; Y261-K265 HydrophobicContact CE2-CD 4.3Å; Y261-K265 WeakPolarHBondContact O-CB 3.41Å; Y261-K265 PolarHBondContact O-N 2.92Å; Y261-K265 WeakPolarHBondContact OH-CD 3.34Å; Y261-K265 WeakPolarHBondContact OH-CE 3.49Å; Y261-K265 PolarHBondContact OH-NZ 3.16Å
262	K	97.7	Very high	97.2	Very high	113 Å²	113	69.6 Å²	69.6	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-44.9	177.8	-75.4	178.7	178.2	173	0	111.6	Y258 S259 H260 K266	Y258-K262 HydrophobicContact CE1-CD 4.26Å; Y258-K262 WeakPolarHBondContact O-CG 3.47Å; Y258-K262 PolarHBondContact O-N 3.13Å; Y258-K262 VanDerWaalsContact O-N 3.15Å; Y258-K262 WeakPolarHBondContact OH-CE 3.27Å; S259-K262 PolarHBondContact O-N 3.3Å; H260-K262 VanDerWaalsContact C-N 3.3Å; H260-K262 PolarHBondContact O-N 2.98Å; K262-K266 WeakPolarHBondContact O-CB 3.39Å; K262-K266 PolarHBondContact O-N 3.36Å; K262-K266 VanDerWaalsContact O-N 3.1Å
263	Q	96.6	Very high	97.3	Very high	58 Å²	58	66.7 Å²	66.7	27%	0.271	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-56.4	179	179.1	63.6	8.9	0	0	110.7	Y232 S259 H260 Y261 K265 K266 L267 T296 E297	Y232-Q263 HydrophobicContact CE2-CG 4.5Å; Y232-Q263 WeakPolarHBondContact OH-CG 3.45Å; Y232-Q263 PolarHBondContact OH-NE2 3.39Å; S259-Q263 PolarHBondContact O-N 3.29Å; H260-Q263 WeakPolarHBondContact O-CB 3.44Å; H260-Q263 PolarHBondContact O-N 3.21Å; H260-Q263 VanDerWaalsContact O-N 3.08Å; Y261-Q263 VanDerWaalsContact C-N 3.34Å; Y261-Q263 PolarHBondContact O-N 3.26Å; Q263-K265 VanDerWaalsContact C-N 3.35Å; Q263-K265 PolarHBondContact O-N 3.25Å; Q263-K266 PolarHBondContact O-N 3.45Å; Q263-L267 WeakPolarHBondContact O-CB 3.33Å; Q263-L267 PolarHBondContact O-N 3Å; Q263-T296 PolarHBondContact NE2-O 2.97Å; Q263-E297 PolarHBondContact NE2-OE2 3.46Å
264	V	97.8	Very high	97.5	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.9	-41.9	-178.2	-174	0	0	0	0	111.4	Y232 H237 L241 H260 K266 L267 N268	Y232-V264 HydrophobicContact CD2-CG2 3.6Å; Y232-V264 HydrophobicContact CE2-CG2 3.8Å; H237-V264 WeakPolarHBondContact O-CG1 3.41Å; L241-V264 HydrophobicContact CB-CG1 3.8Å; L241-V264 HydrophobicContact CD1-CG1 4.33Å; H260-V264 WeakPolarHBondContact CE1-CG2 3.33Å; H260-V264 WeakPolarHBondContact NE2-CG2 3.23Å; H260-V264 WeakPolarHBondContact O-CG2 3.42Å; H260-V264 PolarHBondContact O-N 3.28Å; V264-K266 VanDerWaalsContact C-N 3.34Å; V264-K266 PolarHBondContact O-N 2.88Å; V264-L267 PolarHBondContact O-N 3.29Å; V264-N268 WeakPolarHBondContact O-CB 3.35Å; V264-N268 PolarHBondContact O-N 3.36Å
265	K	98.3	Very high	97.5	Very high	100 Å²	100	60.6 Å²	60.6	44%	0.435	28%	0.283	S	S	.	.	H	α-helix	trans	-60.8	-43.2	178	-177.6	-174.3	-170.1	169.4	0	111.8	L241 Y261 Q263 K269	L241-K265 HydrophobicContact CD1-CB 4.08Å; Y261-K265 HydrophobicContact CE1-CD 3.85Å; Y261-K265 HydrophobicContact CE2-CD 4.3Å; Y261-K265 WeakPolarHBondContact O-CB 3.41Å; Y261-K265 PolarHBondContact O-N 2.92Å; Y261-K265 WeakPolarHBondContact OH-CD 3.34Å; Y261-K265 WeakPolarHBondContact OH-CE 3.49Å; Y261-K265 PolarHBondContact OH-NZ 3.16Å; Q263-K265 VanDerWaalsContact C-N 3.35Å; Q263-K265 PolarHBondContact O-N 3.25Å; K265-K269 WeakPolarHBondContact O-CB 3.32Å; K265-K269 PolarHBondContact O-N 3.34Å
266	K	97.6	Very high	97.7	Very high	110 Å²	110	57.8 Å²	57.8	48%	0.478	27%	0.27	S	S	.	.	H	α-helix	trans	-64.9	-47.5	178.2	-175.8	-176.2	174.7	-165.9	0	110.3	K262 Q263 V264 K269 H270 T296	K262-K266 WeakPolarHBondContact O-CB 3.39Å; K262-K266 PolarHBondContact O-N 3.36Å; K262-K266 VanDerWaalsContact O-N 3.1Å; Q263-K266 PolarHBondContact O-N 3.45Å; V264-K266 VanDerWaalsContact C-N 3.34Å; V264-K266 PolarHBondContact O-N 2.88Å; K266-K269 PolarHBondContact O-N 3.47Å; K266-H270 PolarHBondContact O-CD2 2.93Å; K266-H270 PolarHBondContact O-N 2.84Å; K266-H270 VanDerWaalsContact O-N 3.11Å; K266-T296 HydrophobicContact CD-CG2 3.98Å; K266-T296 HydrophobicContact CG-CG2 4.3Å
267	L	97.6	Very high	97.7	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-52.3	178.5	-169.9	69.4	0	0	0	111.6	Y232 Q263 V264 K269 H270 I271 V293 T296 E297 Y303	Y232-L267 HydrophobicContact CE2-CD2 3.66Å; Q263-L267 WeakPolarHBondContact O-CB 3.33Å; Q263-L267 PolarHBondContact O-N 3Å; V264-L267 PolarHBondContact O-N 3.29Å; L267-K269 VanDerWaalsContact C-N 3.28Å; L267-K269 PolarHBondContact O-N 3.28Å; L267-H270 WeakPolarHBondContact O-CB 3.39Å; L267-H270 PolarHBondContact O-N 3.37Å; L267-I271 HydrophobicContact CG-CD1 4.16Å; L267-I271 PolarHBondContact O-N 3.2Å; L267-V293 HydrophobicContact CD1-CB 4.41Å; L267-V293 HydrophobicContact CD1-CG1 3.69Å; L267-T296 HydrophobicContact CD1-CG2 4.32Å; L267-E297 HydrophobicContact CD1-CB 3.91Å; L267-E297 HydrophobicContact CD2-CB 4.24Å; L267-Y303 HydrophobicContact CD2-CD1 3.93Å; L267-Y303 HydrophobicContact CD2-CD2 3.79Å; L267-Y303 HydrophobicContact CD2-CE1 3.66Å; L267-Y303 HydrophobicContact CD2-CE2 3.51Å; L267-Y303 HydrophobicContact CD2-CG 4Å; L267-Y303 VanDerWaalsContact CD2-CZ 3.44Å
268	N	97.9	Very high	97.7	Very high	9 Å²	9	54.8 Å²	54.8	5%	0.048	26%	0.256	C	S	.	.	H	α-helix	trans	-56.7	-41	177.9	-173	83.1	0	0	0	112	H237 L241 V264 H270 I271 Q272	H237-N268 PolarHBondContact ND1-OD1 3.05Å; L241-N268 HydrophobicContact CD2-CB 4.07Å; V264-N268 WeakPolarHBondContact O-CB 3.35Å; V264-N268 PolarHBondContact O-N 3.36Å; N268-H270 PolarHBondContact O-N 2.94Å; N268-I271 PolarHBondContact O-N 3.48Å; N268-Q272 PolarHBondContact ND2-NE2 3.46Å; N268-Q272 VanDerWaalsContact ND2-NE2 3.13Å; N268-Q272 PolarHBondContact ND2-OE1 3.47Å; N268-Q272 VanDerWaalsContact ND2-OE1 3.11Å; N268-Q272 WeakPolarHBondContact O-CB 3.42Å; N268-Q272 WeakPolarHBondContact O-CG 3.39Å; N268-Q272 PolarHBondContact O-N 3.16Å
269	K	97.9	Very high	97.7	Very high	157 Å²	157	56.7 Å²	56.7	68%	0.683	27%	0.269	S	S	*	.	H	α-helix	trans	-63.7	-39.8	176.4	-175.3	179.7	-179	-179.6	0	112.2	K265 K266 L267 S273	K265-K269 WeakPolarHBondContact O-CB 3.32Å; K265-K269 PolarHBondContact O-N 3.34Å; K266-K269 PolarHBondContact O-N 3.47Å; L267-K269 VanDerWaalsContact C-N 3.28Å; L267-K269 PolarHBondContact O-N 3.28Å; K269-S273 WeakPolarHBondContact O-CB 3.27Å; K269-S273 PolarHBondContact O-N 3.32Å
270	H	97.9	Very high	97.7	Very high	37 Å²	37	58.2 Å²	58.2	17%	0.171	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-44.7	176.6	-74.6	-63.5	0	0	0	111.5	K266 L267 N268 A274 V293	K266-H270 PolarHBondContact O-CD2 2.93Å; K266-H270 PolarHBondContact O-N 2.84Å; K266-H270 VanDerWaalsContact O-N 3.11Å; L267-H270 WeakPolarHBondContact O-CB 3.39Å; L267-H270 PolarHBondContact O-N 3.37Å; N268-H270 PolarHBondContact O-N 2.94Å; H270-A274 WeakPolarHBondContact O-CB 3.03Å; H270-A274 PolarHBondContact O-N 3.34Å; H270-V293 HydrophobicContact CB-CG2 3.61Å
271	I	98	Very high	97.6	Very high	5 Å²	5	64 Å²	64	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-51.3	180	-62.2	170.3	0	0	0	110.9	H237 L267 N268 S273 A274 E275 V293 Y303	H237-I271 VanDerWaalsContact CD2-CD1 3.45Å; H237-I271 WeakPolarHBondContact CD2-CD1 3.45Å; L267-I271 HydrophobicContact CG-CD1 4.16Å; L267-I271 PolarHBondContact O-N 3.2Å; N268-I271 PolarHBondContact O-N 3.48Å; I271-S273 VanDerWaalsContact C-N 3.32Å; I271-S273 PolarHBondContact O-N 2.88Å; I271-A274 WeakPolarHBondContact O-CB 3.39Å; I271-A274 PolarHBondContact O-N 3.07Å; I271-E275 PolarHBondContact O-N 3.31Å; I271-V293 HydrophobicContact CD1-CG1 4.24Å; I271-V293 HydrophobicContact CG1-CG1 4.04Å; I271-V293 HydrophobicContact CG1-CG2 3.67Å; I271-Y303 HydrophobicContact CD1-CD1 4.11Å; I271-Y303 HydrophobicContact CD1-CE1 4.24Å
272	Q	97.8	Very high	97.5	Very high	79 Å²	79	67.7 Å²	67.7	37%	0.369	31%	0.308	S	S	.	.	H	α-helix	trans	-59.4	-43.3	178.7	-73.4	-178.9	-18	0	0	111.8	E238 N268 A274 E275 E276	E238-Q272 PolarHBondContact OE1-NE2 3.46Å; E238-Q272 VanDerWaalsContact OE1-NE2 3.13Å; N268-Q272 PolarHBondContact ND2-NE2 3.46Å; N268-Q272 VanDerWaalsContact ND2-NE2 3.13Å; N268-Q272 PolarHBondContact ND2-OE1 3.47Å; N268-Q272 VanDerWaalsContact ND2-OE1 3.11Å; N268-Q272 WeakPolarHBondContact O-CB 3.42Å; N268-Q272 WeakPolarHBondContact O-CG 3.39Å; N268-Q272 PolarHBondContact O-N 3.16Å; Q272-A274 VanDerWaalsContact C-N 3.27Å; Q272-A274 PolarHBondContact O-N 2.72Å; Q272-E275 PolarHBondContact O-N 3.46Å; Q272-E276 WeakPolarHBondContact O-CG 3.02Å; Q272-E276 PolarHBondContact O-N 3.07Å
273	S	98	Very high	97.4	Very high	31 Å²	31	64.3 Å²	64.3	22%	0.217	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-32.3	175.4	177.8	0	0	0	0	112.7	K269 I271 L277	K269-S273 WeakPolarHBondContact O-CB 3.27Å; K269-S273 PolarHBondContact O-N 3.32Å; I271-S273 VanDerWaalsContact C-N 3.32Å; I271-S273 PolarHBondContact O-N 2.88Å; S273-L277 VanDerWaalsContact O-CD1 3.31Å; S273-L277 WeakPolarHBondContact O-CD1 3.4Å; S273-L277 WeakPolarHBondContact O-CG 3.4Å; S273-L277 PolarHBondContact O-N 3.09Å
274	A	98	Very high	97.3	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-72.3	-44.4	178.5	0	0	0	0	0	111.2	H270 I271 Q272 E276 L277 I278 K289 Y290	H270-A274 WeakPolarHBondContact O-CB 3.03Å; H270-A274 PolarHBondContact O-N 3.34Å; I271-A274 WeakPolarHBondContact O-CB 3.39Å; I271-A274 PolarHBondContact O-N 3.07Å; Q272-A274 VanDerWaalsContact C-N 3.27Å; Q272-A274 PolarHBondContact O-N 2.72Å; A274-E276 VanDerWaalsContact C-N 3.35Å; A274-E276 PolarHBondContact O-N 3Å; A274-L277 WeakPolarHBondContact O-CB 3.37Å; A274-L277 PolarHBondContact O-N 3.44Å; A274-L277 VanDerWaalsContact O-N 3.13Å; A274-I278 WeakPolarHBondContact O-CG1 3.36Å; A274-I278 PolarHBondContact O-N 3.24Å; A274-K289 HydrophobicContact CB-CB 3.64Å; A274-K289 HydrophobicContact CB-CG 4.48Å; A274-Y290 HydrophobicContact CB-CD1 4.39Å; A274-Y290 HydrophobicContact CB-CD2 3.73Å; A274-Y290 HydrophobicContact CB-CE1 4.07Å; A274-Y290 HydrophobicContact CB-CE2 3.31Å; A274-Y290 HydrophobicContact CB-CG 4.23Å
275	E	97.4	Very high	97.3	Very high	51 Å²	51	66.2 Å²	66.2	24%	0.238	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-38.9	175.6	-68.5	-63.1	167.1	0	0	112	I271 Q272 L277 I278 Q279 Y290 R310	I271-E275 PolarHBondContact O-N 3.31Å; Q272-E275 PolarHBondContact O-N 3.46Å; E275-L277 VanDerWaalsContact C-N 3.3Å; E275-L277 PolarHBondContact O-N 2.71Å; E275-I278 PolarHBondContact O-N 3.33Å; E275-Q279 WeakPolarHBondContact O-CG 3.49Å; E275-Q279 PolarHBondContact O-N 2.93Å; E275-Y290 WeakPolarHBondContact CG-OH 3.31Å; E275-Y290 PolarHBondContact OE1-OH 3.06Å; E275-R310 IonicContact OE1-CZ 3.38Å; E275-R310 IonicContact OE1-NE 3.13Å; E275-R310 PolarHBondContact OE1-NE 3.42Å; E275-R310 IonicContact OE1-NH2 3.76Å; E275-R310 IonicContact OE2-CZ 2.65Å; E275-R310 IonicContact OE2-NE 3.69Å; E275-R310 IonicContact OE2-NH2 3.25Å; E275-R310 PolarHBondContact OE2-NH2 3.33Å
276	E	98.1	Very high	97.2	Very high	105 Å²	105	61.4 Å²	61.4	49%	0.491	29%	0.29	S	S	.	.	H	α-helix	trans	-60.1	-38.3	172.1	-75.6	173.4	-173.6	0	0	112.4	Q272 A274 Q279 Q280	Q272-E276 WeakPolarHBondContact O-CG 3.02Å; Q272-E276 PolarHBondContact O-N 3.07Å; A274-E276 VanDerWaalsContact C-N 3.35Å; A274-E276 PolarHBondContact O-N 3Å; E276-Q279 PolarHBondContact O-N 2.71Å; E276-Q280 VanDerWaalsContact O-CG 3.32Å; E276-Q280 WeakPolarHBondContact O-CG 2.79Å; E276-Q280 PolarHBondContact O-N 3.04Å; E276-Q280 VanDerWaalsContact O-N 3.15Å
277	L	98.1	Very high	97.2	Very high	15 Å²	15	56.4 Å²	56.4	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-70.5	-36.9	177.6	-72.9	163.3	0	0	0	112	S273 A274 E275 Q279 Q280 Q281 R282 D285 A286 K289	S273-L277 VanDerWaalsContact O-CD1 3.31Å; S273-L277 WeakPolarHBondContact O-CD1 3.4Å; S273-L277 WeakPolarHBondContact O-CG 3.4Å; S273-L277 PolarHBondContact O-N 3.09Å; A274-L277 WeakPolarHBondContact O-CB 3.37Å; A274-L277 PolarHBondContact O-N 3.44Å; A274-L277 VanDerWaalsContact O-N 3.13Å; E275-L277 VanDerWaalsContact C-N 3.3Å; E275-L277 PolarHBondContact O-N 2.71Å; L277-Q279 VanDerWaalsContact C-N 3.32Å; L277-Q280 CarbonylContact O-C 3.45Å; L277-Q280 PolarHBondContact O-N 3.24Å; L277-Q280 VanDerWaalsContact O-N 3.16Å; L277-Q281 PolarHBondContact O-N 3.02Å; L277-Q281 VanDerWaalsContact O-N 3.17Å; L277-R282 HydrophobicContact CB-CB 4.41Å; L277-R282 HydrophobicContact CD2-CB 4.01Å; L277-R282 PolarHBondContact O-N 3.05Å; L277-D285 HydrophobicContact CD1-CB 3.87Å; L277-D285 HydrophobicContact CD2-CB 4.02Å; L277-D285 HydrophobicContact CG-CB 4.45Å; L277-A286 HydrophobicContact CB-CB 3.93Å; L277-K289 HydrophobicContact CD1-CG 3.75Å
278	I	96.8	Very high	97.1	Very high	17 Å²	17	59.4 Å²	59.4	9%	0.087	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-44.4	172.6	-68.4	174.8	0	0	0	110.1	A274 E275 Q280 Q281 Y283 A286 Y290 C314	A274-I278 WeakPolarHBondContact O-CG1 3.36Å; A274-I278 PolarHBondContact O-N 3.24Å; E275-I278 PolarHBondContact O-N 3.33Å; I278-Q280 PolarHBondContact O-N 3.47Å; I278-Q281 PolarHBondContact O-N 3.21Å; I278-Y283 HydrophobicContact CG2-CE1 4.36Å; I278-A286 HydrophobicContact CD1-CB 4.49Å; I278-A286 HydrophobicContact CG1-CB 3.72Å; I278-Y290 HydrophobicContact CD1-CE2 3.86Å; I278-C314 VanDerWaalsContact CD1-SG 3.59Å
279	Q	96.5	Very high	97.1	Very high	156 Å²	156	62.6 Å²	62.6	73%	0.729	30%	0.303	S	S	*	.	H	α-helix	trans	-61.6	-31.7	176.2	-68.8	173.8	10.7	0	0	112.6	E275 E276 L277 Q281	E275-Q279 WeakPolarHBondContact O-CG 3.49Å; E275-Q279 PolarHBondContact O-N 2.93Å; E276-Q279 PolarHBondContact O-N 2.71Å; L277-Q279 VanDerWaalsContact C-N 3.32Å; Q279-Q281 VanDerWaalsContact C-N 3.26Å; Q279-Q281 PolarHBondContact O-N 2.93Å
280	Q	97.1	Very high	97.2	Very high	112 Å²	112	55.1 Å²	55.1	52%	0.523	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	4.1	174.6	-66.3	169.8	25.4	0	0	113.6	E276 L277 I278 R282	E276-Q280 VanDerWaalsContact O-CG 3.32Å; E276-Q280 WeakPolarHBondContact O-CG 2.79Å; E276-Q280 PolarHBondContact O-N 3.04Å; E276-Q280 VanDerWaalsContact O-N 3.15Å; L277-Q280 CarbonylContact O-C 3.45Å; L277-Q280 PolarHBondContact O-N 3.24Å; L277-Q280 VanDerWaalsContact O-N 3.16Å; I278-Q280 PolarHBondContact O-N 3.47Å; Q280-R282 HydrophobicContact CB-CG 4.27Å; Q280-R282 PolarHBondContact O-N 2.95Å
281	Q	95.5	Very high	97.1	Very high	145 Å²	145	56.1 Å²	56.1	68%	0.678	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	24.3	-176.3	-54.6	174.8	11.5	0	0	113.8	L277 I278 Q279 Y283	L277-Q281 PolarHBondContact O-N 3.02Å; L277-Q281 VanDerWaalsContact O-N 3.17Å; I278-Q281 PolarHBondContact O-N 3.21Å; Q279-Q281 VanDerWaalsContact C-N 3.26Å; Q279-Q281 PolarHBondContact O-N 2.93Å; Q281-Y283 HydrophobicContact CB-CE2 3.97Å; Q281-Y283 WeakPolarHBondContact O-CD2 3.24Å; Q281-Y283 PolarHBondContact O-N 3.17Å
282	R	96.5	Very high	97.1	Very high	121 Å²	121	57.6 Å²	57.6	46%	0.457	29%	0.286	S	S	.	.			trans	-94.7	68.7	177.6	-69.7	175.5	61.1	-173.9	3.5	110.3	L277 Q280 D285 A286	L277-R282 HydrophobicContact CB-CB 4.41Å; L277-R282 HydrophobicContact CD2-CB 4.01Å; L277-R282 PolarHBondContact O-N 3.05Å; Q280-R282 HydrophobicContact CB-CG 4.27Å; Q280-R282 PolarHBondContact O-N 2.95Å; R282-D285 HydrophobicContact CB-CB 4.37Å; R282-D285 IonicContact CZ-OD2 3.19Å; R282-D285 IonicContact NE-OD2 2.71Å; R282-D285 PolarHBondContact NE-OD2 3.36Å; R282-D285 IonicContact NH2-OD2 2.66Å; R282-D285 PolarHBondContact NH2-OD2 2.86Å; R282-D285 PolarHBondContact O-N 3.44Å; R282-A286 PolarHBondContact O-N 3.47Å; R282-A286 VanDerWaalsContact O-N 3.1Å
283	Y	96.1	Very high	97.1	Very high	43 Å²	43	53.9 Å²	53.9	17%	0.169	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-46.1	-169.8	-59.5	-66.3	0	0	0	114	I278 Q281 D285 A286 V287 C314 Q317	I278-Y283 HydrophobicContact CG2-CE1 4.36Å; Q281-Y283 HydrophobicContact CB-CE2 3.97Å; Q281-Y283 WeakPolarHBondContact O-CD2 3.24Å; Q281-Y283 PolarHBondContact O-N 3.17Å; Y283-D285 VanDerWaalsContact C-N 3.3Å; Y283-D285 PolarHBondContact O-N 3.27Å; Y283-A286 WeakPolarHBondContact O-CB 3.27Å; Y283-A286 PolarHBondContact O-N 2.96Å; Y283-V287 WeakPolarHBondContact O-CG2 3.35Å; Y283-V287 PolarHBondContact O-N 3.25Å; Y283-C314 HydrophobicContact CD1-CB 4.15Å; Y283-Q317 HydrophobicContact CD1-CB 4.08Å; Y283-Q317 HydrophobicContact CD2-CB 4Å; Y283-Q317 HydrophobicContact CE1-CB 3.78Å; Y283-Q317 HydrophobicContact CE1-CG 4.1Å; Y283-Q317 HydrophobicContact CE2-CB 3.72Å; Y283-Q317 HydrophobicContact CG-CB 4.18Å
284	G	95.1	Very high	97	Very high	24 Å²	24	54.6 Å²	54.6	25%	0.247	27%	0.269	C	S	.	.	H	α-helix	trans	-60.3	-36	177.7	0	0	0	0	0	114.3	S288 E318	G284-S288 PolarHBondContact O-N 2.94Å; G284-S288 PolarHBondContact O-OG 3.28Å; G284-E318 PolarHBondContact N-OE1 3.48Å
285	D	96.4	Very high	97	Very high	73 Å²	73	62 Å²	62	39%	0.39	30%	0.301	S	S	.	.	H	α-helix	trans	-69.3	-39.4	174	-69	-44.1	0	0	0	111.4	L277 R282 Y283 S288 K289	L277-D285 HydrophobicContact CD1-CB 3.87Å; L277-D285 HydrophobicContact CD2-CB 4.02Å; L277-D285 HydrophobicContact CG-CB 4.45Å; R282-D285 HydrophobicContact CB-CB 4.37Å; R282-D285 IonicContact CZ-OD2 3.19Å; R282-D285 IonicContact NE-OD2 2.71Å; R282-D285 PolarHBondContact NE-OD2 3.36Å; R282-D285 IonicContact NH2-OD2 2.66Å; R282-D285 PolarHBondContact NH2-OD2 2.86Å; R282-D285 PolarHBondContact O-N 3.44Å; Y283-D285 VanDerWaalsContact C-N 3.3Å; Y283-D285 PolarHBondContact O-N 3.27Å; D285-S288 WeakPolarHBondContact O-CB 3.49Å; D285-S288 PolarHBondContact O-N 3.29Å; D285-K289 WeakPolarHBondContact O-CG 3.38Å; D285-K289 PolarHBondContact O-N 3.15Å; D285-K289 VanDerWaalsContact O-N 3.08Å
286	A	97.6	Very high	96.9	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-43.4	176.2	0	0	0	0	0	111.8	L277 I278 R282 Y283 S288 K289 Y290	L277-A286 HydrophobicContact CB-CB 3.93Å; I278-A286 HydrophobicContact CD1-CB 4.49Å; I278-A286 HydrophobicContact CG1-CB 3.72Å; R282-A286 PolarHBondContact O-N 3.47Å; R282-A286 VanDerWaalsContact O-N 3.1Å; Y283-A286 WeakPolarHBondContact O-CB 3.27Å; Y283-A286 PolarHBondContact O-N 2.96Å; A286-S288 VanDerWaalsContact C-N 3.31Å; A286-S288 PolarHBondContact O-N 3.42Å; A286-K289 WeakPolarHBondContact O-CB 3.48Å; A286-K289 PolarHBondContact O-N 3.41Å; A286-Y290 VanDerWaalsContact O-CD2 3.32Å; A286-Y290 WeakPolarHBondContact O-CD2 3.41Å; A286-Y290 PolarHBondContact O-N 2.85Å
287	V	96.8	Very high	96.8	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-55.2	-48.2	173.7	171.2	0	0	0	0	110.4	Y283 K289 Y290 E291 I311 C314 L315	Y283-V287 WeakPolarHBondContact O-CG2 3.35Å; Y283-V287 PolarHBondContact O-N 3.25Å; V287-K289 VanDerWaalsContact C-N 3.25Å; V287-K289 PolarHBondContact O-N 3.09Å; V287-Y290 PolarHBondContact O-N 3.49Å; V287-E291 WeakPolarHBondContact O-CG 3.37Å; V287-E291 PolarHBondContact O-N 3.48Å; V287-I311 HydrophobicContact CG1-CG1 4.37Å; V287-I311 HydrophobicContact CG1-CG2 4.08Å; V287-I311 HydrophobicContact CG2-CG2 4.3Å; V287-C314 HydrophobicContact CG2-CB 3.5Å; V287-C314 VanDerWaalsContact CG2-CB 3.5Å; V287-L315 HydrophobicContact CG2-CD2 4.2Å; V287-L315 HydrophobicContact CG2-CG 4.2Å
288	S	96.7	Very high	96.7	Very high	63 Å²	63	59.6 Å²	59.6	44%	0.441	30%	0.298	S	S	.	.	H	α-helix	trans	-60.1	-34.1	178	-59.7	0	0	0	0	112.8	G284 D285 A286 S292	G284-S288 PolarHBondContact O-N 2.94Å; G284-S288 PolarHBondContact O-OG 3.28Å; D285-S288 WeakPolarHBondContact O-CB 3.49Å; D285-S288 PolarHBondContact O-N 3.29Å; A286-S288 VanDerWaalsContact C-N 3.31Å; A286-S288 PolarHBondContact O-N 3.42Å; S288-S292 PolarHBondContact O-N 3.26Å; S288-S292 PolarHBondContact O-OG 2.9Å
289	K	98	Very high	96.6	Very high	77 Å²	77	65.4 Å²	65.4	34%	0.335	33%	0.329	S	S	.	.	H	α-helix	trans	-71.1	-44.9	174.5	-69.1	-63.3	-177	-175.4	0	112.2	A274 L277 D285 A286 V287 E291 S292 V293	A274-K289 HydrophobicContact CB-CB 3.64Å; A274-K289 HydrophobicContact CB-CG 4.48Å; L277-K289 HydrophobicContact CD1-CG 3.75Å; D285-K289 WeakPolarHBondContact O-CG 3.38Å; D285-K289 PolarHBondContact O-N 3.15Å; D285-K289 VanDerWaalsContact O-N 3.08Å; A286-K289 WeakPolarHBondContact O-CB 3.48Å; A286-K289 PolarHBondContact O-N 3.41Å; V287-K289 VanDerWaalsContact C-N 3.25Å; V287-K289 PolarHBondContact O-N 3.09Å; K289-E291 VanDerWaalsContact C-N 3.33Å; K289-E291 PolarHBondContact O-N 3.07Å; K289-S292 CarbonylContact O-C 3.57Å; K289-S292 WeakPolarHBondContact O-CA 3.45Å; K289-S292 VanDerWaalsContact O-CB 3.23Å; K289-S292 WeakPolarHBondContact O-CB 3.41Å; K289-S292 PolarHBondContact O-N 3.35Å; K289-V293 PolarHBondContact O-N 3.44Å
290	Y	98.1	Very high	96.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66.2	-33.8	176.5	-78.4	-66.3	0	0	0	113	A274 E275 I278 A286 V287 S292 V293 I294 A307 R310 I311	A274-Y290 HydrophobicContact CB-CD1 4.39Å; A274-Y290 HydrophobicContact CB-CD2 3.73Å; A274-Y290 HydrophobicContact CB-CE1 4.07Å; A274-Y290 HydrophobicContact CB-CE2 3.31Å; A274-Y290 HydrophobicContact CB-CG 4.23Å; E275-Y290 WeakPolarHBondContact CG-OH 3.31Å; E275-Y290 PolarHBondContact OE1-OH 3.06Å; I278-Y290 HydrophobicContact CD1-CE2 3.86Å; A286-Y290 VanDerWaalsContact O-CD2 3.32Å; A286-Y290 WeakPolarHBondContact O-CD2 3.41Å; A286-Y290 PolarHBondContact O-N 2.85Å; V287-Y290 PolarHBondContact O-N 3.49Å; Y290-S292 PolarHBondContact O-N 3.06Å; Y290-V293 HydrophobicContact CD1-CG2 4.3Å; Y290-V293 WeakPolarHBondContact O-CA 3.34Å; Y290-V293 VanDerWaalsContact O-CB 3.27Å; Y290-V293 WeakPolarHBondContact O-CB 3.27Å; Y290-V293 PolarHBondContact O-N 3.18Å; Y290-I294 WeakPolarHBondContact O-CG1 3.32Å; Y290-I294 PolarHBondContact O-N 2.7Å; Y290-A307 HydrophobicContact CD1-CB 3.89Å; Y290-A307 HydrophobicContact CG-CB 4.4Å; Y290-R310 HydrophobicContact CD1-CB 4.28Å; Y290-R310 HydrophobicContact CD2-CB 3.86Å; Y290-R310 HydrophobicContact CE1-CB 3.89Å; Y290-R310 HydrophobicContact CE1-CG 3.95Å; Y290-R310 HydrophobicContact CE2-CB 3.45Å; Y290-R310 VanDerWaalsContact CE2-CB 3.45Å; Y290-R310 HydrophobicContact CE2-CG 4.18Å; Y290-R310 HydrophobicContact CG-CB 4.27Å; Y290-R310 VanDerWaalsContact CZ-CB 3.47Å; Y290-I311 HydrophobicContact CG-CG1 4.36Å
291	E	97.1	Very high	96.3	Very high	58 Å²	58	57.2 Å²	57.2	27%	0.271	30%	0.3	S	S	.	.	H	α-helix	trans	-61.1	-35.4	169	-72.7	178.8	-172.1	0	0	111.9	V287 K289 V293 I294 K295 I311 R324	V287-E291 WeakPolarHBondContact O-CG 3.37Å; V287-E291 PolarHBondContact O-N 3.48Å; K289-E291 VanDerWaalsContact C-N 3.33Å; K289-E291 PolarHBondContact O-N 3.07Å; E291-V293 VanDerWaalsContact C-N 3.33Å; E291-I294 PolarHBondContact O-N 3.32Å; E291-K295 VanDerWaalsContact O-CG 3.28Å; E291-K295 WeakPolarHBondContact O-CG 3.25Å; E291-K295 PolarHBondContact O-N 3.27Å; E291-I311 HydrophobicContact CG-CD1 4.25Å; E291-R324 IonicContact OE1-CZ 3.77Å; E291-R324 IonicContact OE1-NH2 3.09Å; E291-R324 PolarHBondContact OE1-NH2 3.45Å
292	S	97.4	Very high	96.3	Very high	36 Å²	36	54.4 Å²	54.4	25%	0.252	29%	0.287	S	S	.	.	H	α-helix	trans	-69.7	-29.8	174	-55.5	0	0	0	0	112.4	S288 K289 Y290 T296	S288-S292 PolarHBondContact O-N 3.26Å; S288-S292 PolarHBondContact O-OG 2.9Å; K289-S292 CarbonylContact O-C 3.57Å; K289-S292 WeakPolarHBondContact O-CA 3.45Å; K289-S292 VanDerWaalsContact O-CB 3.23Å; K289-S292 WeakPolarHBondContact O-CB 3.41Å; K289-S292 PolarHBondContact O-N 3.35Å; Y290-S292 PolarHBondContact O-N 3.06Å; S292-T296 VanDerWaalsContact O-CB 3.29Å; S292-T296 WeakPolarHBondContact O-CB 3.35Å; S292-T296 PolarHBondContact O-N 3.49Å; S292-T296 PolarHBondContact O-OG1 3.2Å
293	V	97.9	Very high	96.3	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-52.6	171.4	174.6	0	0	0	0	109.4	L267 H270 I271 K289 Y290 E291 K295 T296 E297 A307	L267-V293 HydrophobicContact CD1-CB 4.41Å; L267-V293 HydrophobicContact CD1-CG1 3.69Å; H270-V293 HydrophobicContact CB-CG2 3.61Å; I271-V293 HydrophobicContact CD1-CG1 4.24Å; I271-V293 HydrophobicContact CG1-CG1 4.04Å; I271-V293 HydrophobicContact CG1-CG2 3.67Å; K289-V293 PolarHBondContact O-N 3.44Å; Y290-V293 HydrophobicContact CD1-CG2 4.3Å; Y290-V293 WeakPolarHBondContact O-CA 3.34Å; Y290-V293 VanDerWaalsContact O-CB 3.27Å; Y290-V293 WeakPolarHBondContact O-CB 3.27Å; Y290-V293 PolarHBondContact O-N 3.18Å; E291-V293 VanDerWaalsContact C-N 3.33Å; V293-K295 VanDerWaalsContact C-N 3.28Å; V293-K295 PolarHBondContact O-N 3.29Å; V293-T296 PolarHBondContact O-N 2.91Å; V293-E297 PolarHBondContact O-N 3.43Å; V293-A307 HydrophobicContact CG1-CB 4.4Å
294	I	96.7	Very high	96.2	Very high	45 Å²	45	48.1 Å²	48.1	23%	0.231	27%	0.267	C	S	.	.	H	α-helix	trans	-58.9	-40	178.9	-60.7	169.9	0	0	0	111.2	Y290 E291 E297 A307 K308 I311	Y290-I294 WeakPolarHBondContact O-CG1 3.32Å; Y290-I294 PolarHBondContact O-N 2.7Å; E291-I294 PolarHBondContact O-N 3.32Å; I294-E297 CarbonylContact O-C 3.56Å; I294-A307 HydrophobicContact CD1-CB 3.87Å; I294-A307 HydrophobicContact CG1-CB 3.6Å; I294-K308 HydrophobicContact CD1-CG 4.26Å; I294-I311 HydrophobicContact CD1-CD1 4.11Å
295	K	96.4	Very high	96.1	Very high	156 Å²	156	49.6 Å²	49.6	68%	0.678	27%	0.267	S	S	*	.	H	α-helix	trans	-68.6	-32.7	176.1	-71.7	169.5	-172.4	168.5	0	113.2	E291 V293	E291-K295 VanDerWaalsContact O-CG 3.28Å; E291-K295 WeakPolarHBondContact O-CG 3.25Å; E291-K295 PolarHBondContact O-N 3.27Å; V293-K295 VanDerWaalsContact C-N 3.28Å; V293-K295 PolarHBondContact O-N 3.29Å
296	T	95.9	Very high	96.1	Very high	21 Å²	21	49.2 Å²	49.2	13%	0.129	26%	0.263	C	S	.	.	H	α-helix	trans	-79.3	-35.1	-178.2	-61.3	0	0	0	0	111.5	Q263 K266 L267 S292 V293	Q263-T296 PolarHBondContact NE2-O 2.97Å; K266-T296 HydrophobicContact CD-CG2 3.98Å; K266-T296 HydrophobicContact CG-CG2 4.3Å; L267-T296 HydrophobicContact CD1-CG2 4.32Å; S292-T296 VanDerWaalsContact O-CB 3.29Å; S292-T296 WeakPolarHBondContact O-CB 3.35Å; S292-T296 PolarHBondContact O-N 3.49Å; S292-T296 PolarHBondContact O-OG1 3.2Å; V293-T296 PolarHBondContact O-N 2.91Å
297	E	95.9	Very high	96	Very high	15 Å²	15	49.3 Å²	49.3	7%	0.07	26%	0.263	C	S	.	.			trans	-133.8	89	176.2	-175.1	49.1	-106.5	0	0	111.5	Y232 Q263 L267 V293 I294 N299 V300 Y303	Y232-E297 HydrophobicContact CE1-CG 4.24Å; Y232-E297 VanDerWaalsContact OH-CD 3.25Å; Y232-E297 VanDerWaalsContact OH-CG 3.31Å; Y232-E297 WeakPolarHBondContact OH-CG 3.48Å; Y232-E297 PolarHBondContact OH-OE2 3.44Å; Q263-E297 PolarHBondContact NE2-OE2 3.46Å; L267-E297 HydrophobicContact CD1-CB 3.91Å; L267-E297 HydrophobicContact CD2-CB 4.24Å; V293-E297 PolarHBondContact O-N 3.43Å; I294-E297 CarbonylContact O-C 3.56Å; E297-N299 WeakPolarHBondContact OE1-CA 3.07Å; E297-N299 VanDerWaalsContact OE1-CB 3.31Å; E297-N299 WeakPolarHBondContact OE1-CB 3.12Å; E297-N299 PolarHBondContact OE1-N 3.22Å; E297-V300 HydrophobicContact CG-CB 3.94Å; E297-V300 HydrophobicContact CG-CG2 4.08Å; E297-V300 PolarHBondContact OE1-N 2.83Å; E297-Y303 HydrophobicContact CB-CD2 4.23Å; E297-Y303 HydrophobicContact CG-CD2 3.63Å; E297-Y303 HydrophobicContact CG-CE2 4.22Å
298	P	95.3	Very high	96	Very high	85 Å²	85	52.1 Å²	52.1	55%	0.552	28%	0.275	S	S	*	.			trans	-87.1	-14.9	178.4	33.6	-34.9	0	0	0	113.8
299	N	94.7	Very high	96	Very high	138 Å²	138	50.8 Å²	50.8	74%	0.738	26%	0.262	S	S	*	.	S	Bend	trans	-92	-22.4	-168.3	-55.4	-56.8	0	0	0	113.2	E297 P301	E297-N299 WeakPolarHBondContact OE1-CA 3.07Å; E297-N299 VanDerWaalsContact OE1-CB 3.31Å; E297-N299 WeakPolarHBondContact OE1-CB 3.12Å; E297-N299 PolarHBondContact OE1-N 3.22Å; N299-P301 WeakPolarHBondContact O-CD 3.23Å
300	V	95.3	Very high	96	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.03	26%	0.255	C	S	.	.			trans	-98.5	107.7	179.8	177.8	0	0	0	0	109.3	Y232 E297 Q302 Y303	Y232-V300 HydrophobicContact CD1-CG2 4.16Å; Y232-V300 HydrophobicContact CE1-CG2 3.85Å; E297-V300 HydrophobicContact CG-CB 3.94Å; E297-V300 HydrophobicContact CG-CG2 4.08Å; E297-V300 PolarHBondContact OE1-N 2.83Å; V300-Q302 HydrophobicContact CG1-CB 4.23Å; V300-Q302 PolarHBondContact O-N 3.38Å; V300-Q302 VanDerWaalsContact O-N 3.15Å; V300-Y303 HydrophobicContact CB-CD2 3.78Å; V300-Y303 HydrophobicContact CB-CE2 4.22Å; V300-Y303 HydrophobicContact CG1-CD2 3.7Å; V300-Y303 HydrophobicContact CG1-CE2 3.92Å; V300-Y303 PolarHBondContact O-N 3.05Å
301	P	93.8	Very high	95.9	Very high	92 Å²	92	49.9 Å²	49.9	60%	0.597	26%	0.257	S	S	*	.	H	α-helix	trans	-58.9	-31.1	-172.7	-26.7	35.8	0	0	0	114.3	N299 Y303 S304 H305	N299-P301 WeakPolarHBondContact O-CD 3.23Å; P301-Y303 VanDerWaalsContact C-N 3.31Å; P301-Y303 PolarHBondContact O-N 3.13Å; P301-S304 PolarHBondContact O-N 3.42Å; P301-H305 WeakPolarHBondContact O-CB 3.37Å; P301-H305 PolarHBondContact O-N 3.18Å
302	Q	94.1	Very high	95.8	Very high	86 Å²	86	47.1 Å²	47.1	40%	0.402	24%	0.244	S	C	.	.	H	α-helix	trans	-56.9	-43.8	-178.9	-67.8	76	2.5	0	0	111.4	H233 V300 H306	H233-Q302 PolarHBondContact O-NE2 3.34Å; H233-Q302 PolarHBondContact O-OE1 3.39Å; V300-Q302 HydrophobicContact CG1-CB 4.23Å; V300-Q302 PolarHBondContact O-N 3.38Å; V300-Q302 VanDerWaalsContact O-N 3.15Å; Q302-H306 VanDerWaalsContact O-CB 3.3Å; Q302-H306 WeakPolarHBondContact O-CB 3.43Å; Q302-H306 PolarHBondContact O-N 2.86Å
303	Y	96.2	Very high	95.8	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-69.9	-39.4	178.1	-66.6	-58.8	0	0	0	112.3	Y232 G235 H237 L267 I271 E297 V300 P301 A307	Y232-Y303 HydrophobicContact CD1-CE2 4.44Å; Y232-Y303 HydrophobicContact CD2-CE2 4.06Å; Y232-Y303 WeakPolarHBondContact CD2-OH 3.26Å; Y232-Y303 HydrophobicContact CE1-CE2 4.24Å; Y232-Y303 AromaticContact CE2-CE2 3.88Å; Y232-Y303 HydrophobicContact CE2-CE2 3.88Å; Y232-Y303 HydrophobicContact CG-CE2 4.37Å; Y232-Y303 AromaticContact CZ-CE2 3.98Å; Y232-Y303 VanDerWaalsContact O-CE2 3.3Å; Y232-Y303 WeakPolarHBondContact O-CE2 3.5Å; Y232-Y303 PolarHBondContact O-OH 3.02Å; Y232-Y303 VanDerWaalsContact O-OH 3.14Å; G235-Y303 VanDerWaalsContact O-CE1 3.31Å; G235-Y303 WeakPolarHBondContact O-CE1 3.44Å; H237-Y303 HydrophobicContact CB-CE1 3.97Å; L267-Y303 HydrophobicContact CD2-CD1 3.93Å; L267-Y303 HydrophobicContact CD2-CD2 3.79Å; L267-Y303 HydrophobicContact CD2-CE1 3.66Å; L267-Y303 HydrophobicContact CD2-CE2 3.51Å; L267-Y303 HydrophobicContact CD2-CG 4Å; L267-Y303 VanDerWaalsContact CD2-CZ 3.44Å; I271-Y303 HydrophobicContact CD1-CD1 4.11Å; I271-Y303 HydrophobicContact CD1-CE1 4.24Å; E297-Y303 HydrophobicContact CB-CD2 4.23Å; E297-Y303 HydrophobicContact CG-CD2 3.63Å; E297-Y303 HydrophobicContact CG-CE2 4.22Å; V300-Y303 HydrophobicContact CB-CD2 3.78Å; V300-Y303 HydrophobicContact CB-CE2 4.22Å; V300-Y303 HydrophobicContact CG1-CD2 3.7Å; V300-Y303 HydrophobicContact CG1-CE2 3.92Å; V300-Y303 PolarHBondContact O-N 3.05Å; P301-Y303 VanDerWaalsContact C-N 3.31Å; P301-Y303 PolarHBondContact O-N 3.13Å; Y303-A307 WeakPolarHBondContact O-CB 3.34Å; Y303-A307 PolarHBondContact O-N 3.29Å
304	S	94.8	Very high	95.7	Very high	27 Å²	27	47.4 Å²	47.4	19%	0.189	24%	0.241	C	C	.	.	H	α-helix	trans	-66.4	-41.5	176.4	-178.9	0	0	0	0	111.8	P301 K308	P301-S304 PolarHBondContact O-N 3.42Å; S304-K308 WeakPolarHBondContact O-CB 3.24Å; S304-K308 VanDerWaalsContact O-CG 3.29Å; S304-K308 WeakPolarHBondContact O-CG 3.37Å; S304-K308 PolarHBondContact O-N 3.13Å
305	H	94	Very high	95.6	Very high	56 Å²	56	45.5 Å²	45.5	26%	0.259	23%	0.232	S	C	.	.	H	α-helix	trans	-65	-51.5	179.8	-178.8	82.8	0	0	0	110.4	P301 A307 K308 E309 S335	P301-H305 WeakPolarHBondContact O-CB 3.37Å; P301-H305 PolarHBondContact O-N 3.18Å; H305-A307 PolarHBondContact O-N 3.47Å; H305-K308 PolarHBondContact O-N 3.44Å; H305-E309 PolarHBondContact O-N 2.99Å; H305-S335 PolarHBondContact CE1-OG 3.33Å; H305-S335 PolarHBondContact ND1-OG 3.35Å
306	H	95.1	Very high	95.4	Very high	65 Å²	65	38.2 Å²	38.2	30%	0.301	20%	0.2	S	C	.	.	H	α-helix	trans	-60.6	-43.8	177.3	-176.5	59.5	0	0	0	112.1	Q302 K308 E309 R310	Q302-H306 VanDerWaalsContact O-CB 3.3Å; Q302-H306 WeakPolarHBondContact O-CB 3.43Å; Q302-H306 PolarHBondContact O-N 2.86Å; H306-K308 VanDerWaalsContact C-N 3.33Å; H306-K308 PolarHBondContact O-N 3.48Å; H306-E309 IonicContact ND1-OE2 3.66Å; H306-E309 WeakPolarHBondContact O-CB 3.49Å; H306-E309 PolarHBondContact O-N 2.89Å; H306-R310 WeakPolarHBondContact O-CG 3.04Å; H306-R310 PolarHBondContact O-N 2.98Å
307	A	96.9	Very high	95.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-41.7	176.5	0	0	0	0	0	112.3	Y290 V293 I294 Y303 H305 R310 I311	Y290-A307 HydrophobicContact CD1-CB 3.89Å; Y290-A307 HydrophobicContact CG-CB 4.4Å; V293-A307 HydrophobicContact CG1-CB 4.4Å; I294-A307 HydrophobicContact CD1-CB 3.87Å; I294-A307 HydrophobicContact CG1-CB 3.6Å; Y303-A307 WeakPolarHBondContact O-CB 3.34Å; Y303-A307 PolarHBondContact O-N 3.29Å; H305-A307 PolarHBondContact O-N 3.47Å; A307-R310 PolarHBondContact O-N 3.41Å; A307-I311 WeakPolarHBondContact O-CB 3.49Å; A307-I311 WeakPolarHBondContact O-CD1 3.44Å; A307-I311 WeakPolarHBondContact O-CG1 3.35Å; A307-I311 PolarHBondContact O-N 2.96Å
308	K	96.2	Very high	95	Very high	63 Å²	63	42.5 Å²	42.5	27%	0.274	22%	0.219	S	C	.	.	H	α-helix	trans	-67	-38.9	176.8	-73.3	-178.1	-178.9	-164.2	0	112.6	I294 S304 H305 H306 I311 C312 V328 E331 V332	I294-K308 HydrophobicContact CD1-CG 4.26Å; S304-K308 WeakPolarHBondContact O-CB 3.24Å; S304-K308 VanDerWaalsContact O-CG 3.29Å; S304-K308 WeakPolarHBondContact O-CG 3.37Å; S304-K308 PolarHBondContact O-N 3.13Å; H305-K308 PolarHBondContact O-N 3.44Å; H306-K308 VanDerWaalsContact C-N 3.33Å; H306-K308 PolarHBondContact O-N 3.48Å; K308-I311 PolarHBondContact O-N 3.25Å; K308-C312 WeakPolarHBondContact O-CB 3.4Å; K308-C312 PolarHBondContact O-N 3.36Å; K308-V328 HydrophobicContact CB-CG1 4.28Å; K308-E331 IonicContact NZ-OE2 3.65Å; K308-E331 PolarHBondContact NZ-OE2 3.19Å; K308-V332 HydrophobicContact CB-CG2 3.54Å
309	E	96.4	Very high	94.6	Very high	35 Å²	35	43.8 Å²	43.8	16%	0.164	22%	0.218	C	C	.	.	H	α-helix	trans	-56.9	-49.7	173.1	176.2	-174.9	-160.3	0	0	110.5	H305 H306 I311 C312 H313 V332 N339 V342	H305-E309 PolarHBondContact O-N 2.99Å; H306-E309 IonicContact ND1-OE2 3.66Å; H306-E309 WeakPolarHBondContact O-CB 3.49Å; H306-E309 PolarHBondContact O-N 2.89Å; E309-I311 PolarHBondContact O-N 3.19Å; E309-C312 WeakPolarHBondContact O-CB 3.37Å; E309-C312 PolarHBondContact O-N 2.83Å; E309-H313 PolarHBondContact O-N 3.25Å; E309-H313 VanDerWaalsContact O-N 3.09Å; E309-V332 HydrophobicContact CB-CG1 4.39Å; E309-N339 PolarHBondContact OE1-ND2 3.02Å; E309-V342 HydrophobicContact CB-CG2 4.42Å; E309-V342 HydrophobicContact CG-CG2 3.78Å
310	R	97.1	Very high	94	Very high	52 Å²	52	45 Å²	45	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-68.6	-33.9	178.9	-55.8	-55.7	-74.2	150.2	-1.3	113	E275 Y290 H306 A307 H313 C314	E275-R310 IonicContact OE1-CZ 3.38Å; E275-R310 IonicContact OE1-NE 3.13Å; E275-R310 PolarHBondContact OE1-NE 3.42Å; E275-R310 IonicContact OE1-NH2 3.76Å; E275-R310 IonicContact OE2-CZ 2.65Å; E275-R310 IonicContact OE2-NE 3.69Å; E275-R310 IonicContact OE2-NH2 3.25Å; E275-R310 PolarHBondContact OE2-NH2 3.33Å; Y290-R310 HydrophobicContact CD1-CB 4.28Å; Y290-R310 HydrophobicContact CD2-CB 3.86Å; Y290-R310 HydrophobicContact CE1-CB 3.89Å; Y290-R310 HydrophobicContact CE1-CG 3.95Å; Y290-R310 HydrophobicContact CE2-CB 3.45Å; Y290-R310 VanDerWaalsContact CE2-CB 3.45Å; Y290-R310 HydrophobicContact CE2-CG 4.18Å; Y290-R310 HydrophobicContact CG-CB 4.27Å; Y290-R310 VanDerWaalsContact CZ-CB 3.47Å; H306-R310 WeakPolarHBondContact O-CG 3.04Å; H306-R310 PolarHBondContact O-N 2.98Å; A307-R310 PolarHBondContact O-N 3.41Å; R310-H313 PolarHBondContact O-N 3.34Å; R310-C314 PolarHBondContact O-N 2.91Å; R310-C314 PolarHBondContact O-SG 3.36Å
311	I	96.8	Very high	93.7	Very high	7 Å²	7	48.1 Å²	48.1	4%	0.036	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-45.4	173.2	-71.3	163.9	0	0	0	110.9	V287 Y290 E291 I294 A307 K308 E309 H313 C314 L315 V328	V287-I311 HydrophobicContact CG1-CG1 4.37Å; V287-I311 HydrophobicContact CG1-CG2 4.08Å; V287-I311 HydrophobicContact CG2-CG2 4.3Å; Y290-I311 HydrophobicContact CG-CG1 4.36Å; E291-I311 HydrophobicContact CG-CD1 4.25Å; I294-I311 HydrophobicContact CD1-CD1 4.11Å; A307-I311 WeakPolarHBondContact O-CB 3.49Å; A307-I311 WeakPolarHBondContact O-CD1 3.44Å; A307-I311 WeakPolarHBondContact O-CG1 3.35Å; A307-I311 PolarHBondContact O-N 2.96Å; K308-I311 PolarHBondContact O-N 3.25Å; E309-I311 PolarHBondContact O-N 3.19Å; I311-H313 VanDerWaalsContact C-N 3.3Å; I311-H313 PolarHBondContact O-N 3.01Å; I311-C314 PolarHBondContact O-N 2.94Å; I311-L315 HydrophobicContact CG2-CD1 3.68Å; I311-L315 HydrophobicContact CG2-CG 4.15Å; I311-L315 WeakPolarHBondContact O-CG 3.28Å; I311-L315 PolarHBondContact O-N 3.35Å; I311-V328 HydrophobicContact CB-CG1 4.41Å; I311-V328 HydrophobicContact CG2-CG1 4.07Å
312	C	95.9	Very high	93.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-53.5	-50.3	174.8	160.1	0	0	0	0	110.5	K308 E309 C314 L315 A316 V328 C329	K308-C312 WeakPolarHBondContact O-CB 3.4Å; K308-C312 PolarHBondContact O-N 3.36Å; E309-C312 WeakPolarHBondContact O-CB 3.37Å; E309-C312 PolarHBondContact O-N 2.83Å; C312-C314 PolarHBondContact O-N 3.32Å; C312-L315 PolarHBondContact O-N 2.75Å; C312-A316 WeakPolarHBondContact O-CB 3.39Å; C312-A316 PolarHBondContact O-N 2.65Å; C312-V328 HydrophobicContact CB-CG1 4.22Å; C312-C329 HydrophobicContact CB-CB 4.01Å; C312-C329 WeakPolarHBondContact CB-SG 3.2Å; C312-C329 VanDerWaalsContact SG-CA 3.59Å; C312-C329 WeakPolarHBondContact SG-CB 3.36Å; C312-C329 CovalentContact SG-SG 2.02Å; C312-C329 PolarHBondContact SG-SG 3.41Å
313	H	95.7	Very high	93.5	Very high	43 Å²	43	44.6 Å²	44.6	20%	0.199	22%	0.221	C	C	.	.	H	α-helix	trans	-56.5	-49.7	176.3	-179.5	64.3	0	0	0	112.6	E309 R310 I311 L315 A316 Q317 D345	E309-H313 PolarHBondContact O-N 3.25Å; E309-H313 VanDerWaalsContact O-N 3.09Å; R310-H313 PolarHBondContact O-N 3.34Å; I311-H313 VanDerWaalsContact C-N 3.3Å; I311-H313 PolarHBondContact O-N 3.01Å; H313-L315 PolarHBondContact O-N 3.25Å; H313-A316 PolarHBondContact O-N 2.94Å; H313-Q317 WeakPolarHBondContact O-CG 3.06Å; H313-Q317 PolarHBondContact O-N 3.26Å; H313-Q317 VanDerWaalsContact O-N 3.1Å; H313-D345 VanDerWaalsContact CA-OD2 3.26Å; H313-D345 WeakPolarHBondContact CA-OD2 3.42Å; H313-D345 VanDerWaalsContact CB-OD2 3.29Å; H313-D345 WeakPolarHBondContact CB-OD2 3.44Å; H313-D345 IonicContact CE1-OD1 3.76Å; H313-D345 IonicContact CG-OD2 2.84Å; H313-D345 IonicContact ND1-OD1 2.66Å; H313-D345 PolarHBondContact ND1-OD1 2.96Å; H313-D345 VanDerWaalsContact ND1-OD1 3.09Å; H313-D345 IonicContact ND1-OD2 3.57Å; H313-D345 PolarHBondContact ND1-OD2 3.18Å; H313-D345 VanDerWaalsContact ND1-OD2 3.13Å
314	C	96.4	Very high	93.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-43.7	-179.9	-67.3	0	0	0	0	112.6	I278 Y283 V287 R310 I311 C312 Q317 E318	I278-C314 VanDerWaalsContact CD1-SG 3.59Å; Y283-C314 HydrophobicContact CD1-CB 4.15Å; V287-C314 HydrophobicContact CG2-CB 3.5Å; V287-C314 VanDerWaalsContact CG2-CB 3.5Å; R310-C314 PolarHBondContact O-N 2.91Å; R310-C314 PolarHBondContact O-SG 3.36Å; I311-C314 PolarHBondContact O-N 2.94Å; C312-C314 PolarHBondContact O-N 3.32Å; C314-Q317 PolarHBondContact O-N 3.21Å; C314-E318 WeakPolarHBondContact O-CB 3.12Å; C314-E318 PolarHBondContact O-N 2.86Å
315	L	95.1	Very high	93.5	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-67.8	-37.9	-179.2	-69.1	172.3	0	0	0	112.1	V287 I311 C312 H313 Q317 E318 Q319 R324 A325 V328	V287-L315 HydrophobicContact CG2-CD2 4.2Å; V287-L315 HydrophobicContact CG2-CG 4.2Å; I311-L315 HydrophobicContact CG2-CD1 3.68Å; I311-L315 HydrophobicContact CG2-CG 4.15Å; I311-L315 WeakPolarHBondContact O-CG 3.28Å; I311-L315 PolarHBondContact O-N 3.35Å; C312-L315 PolarHBondContact O-N 2.75Å; H313-L315 PolarHBondContact O-N 3.25Å; L315-Q317 VanDerWaalsContact C-N 3.33Å; L315-E318 PolarHBondContact O-N 3.07Å; L315-Q319 PolarHBondContact O-N 2.76Å; L315-R324 HydrophobicContact CD1-CB 4.43Å; L315-R324 HydrophobicContact CD1-CG 3.87Å; L315-A325 HydrophobicContact CB-CB 3.72Å; L315-V328 HydrophobicContact CD1-CG2 4.28Å
316	A	92.9	Very high	93.5	Very high	2 Å²	2	45.8 Å²	45.8	2%	0.017	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-40.2	174.6	0	0	0	0	0	111.7	C312 H313 Q319 D345	C312-A316 WeakPolarHBondContact O-CB 3.39Å; C312-A316 PolarHBondContact O-N 2.65Å; H313-A316 PolarHBondContact O-N 2.94Å; A316-Q319 WeakPolarHBondContact O-CG 3.2Å; A316-D345 HydrophobicContact CB-CB 3.81Å; A316-D345 WeakPolarHBondContact CB-O 3.49Å
317	Q	92.7	Very high	93.6	Very high	66 Å²	66	46 Å²	46	31%	0.308	23%	0.227	S	C	.	.	H	α-helix	trans	-73.6	-32.2	177.9	-64.6	-55.6	-51.3	0	0	113.7	Y283 H313 C314 L315 E348	Y283-Q317 HydrophobicContact CD1-CB 4.08Å; Y283-Q317 HydrophobicContact CD2-CB 4Å; Y283-Q317 HydrophobicContact CE1-CB 3.78Å; Y283-Q317 HydrophobicContact CE1-CG 4.1Å; Y283-Q317 HydrophobicContact CE2-CB 3.72Å; Y283-Q317 HydrophobicContact CG-CB 4.18Å; H313-Q317 WeakPolarHBondContact O-CG 3.06Å; H313-Q317 PolarHBondContact O-N 3.26Å; H313-Q317 VanDerWaalsContact O-N 3.1Å; C314-Q317 PolarHBondContact O-N 3.21Å; L315-Q317 VanDerWaalsContact C-N 3.33Å; Q317-E348 PolarHBondContact NE2-OE2 2.68Å
318	E	90.6	Very high	93.6	Very high	61 Å²	61	46.9 Å²	46.9	29%	0.285	23%	0.232	S	C	.	.	H	α-helix	trans	-73.5	-27.8	-179.7	-170.7	164.6	-137.9	0	0	113	G284 C314 L315 Q320	G284-E318 PolarHBondContact N-OE1 3.48Å; C314-E318 WeakPolarHBondContact O-CB 3.12Å; C314-E318 PolarHBondContact O-N 2.86Å; L315-E318 PolarHBondContact O-N 3.07Å; E318-Q320 HydrophobicContact CG-CB 4.25Å; E318-Q320 HydrophobicContact CG-CG 4.06Å; E318-Q320 PolarHBondContact O-N 2.71Å
319	Q	86.9	Confident	93.6	Very high	112 Å²	112	43.9 Å²	43.9	52%	0.523	22%	0.219	S	C	.	.			trans	58.5	8.3	176.3	-51.5	-175	4.1	0	0	115.8	L315 A316 L352	L315-Q319 PolarHBondContact O-N 2.76Å; A316-Q319 WeakPolarHBondContact O-CG 3.2Å; Q319-L352 HydrophobicContact CB-CD1 3.81Å; Q319-L352 HydrophobicContact CG-CD1 3.58Å
320	Q	80.8	Confident	93.6	Very high	162 Å²	162	43.4 Å²	43.4	76%	0.757	22%	0.22	S	C	*	.	S	Bend	trans	-86.7	-36.8	-179.6	-69.2	-177.7	6.3	0	0	113.2	E318	E318-Q320 HydrophobicContact CG-CB 4.25Å; E318-Q320 HydrophobicContact CG-CG 4.06Å; E318-Q320 PolarHBondContact O-N 2.71Å
321	D	88.7	Confident	93.5	Very high	71 Å²	71	44.6 Å²	44.6	38%	0.38	23%	0.228	S	C	.	.			trans	-124.6	70.1	-176.3	-167.5	-5.4	0	0	0	111.1	S323 R324 A325	D321-S323 VanDerWaalsContact C-N 3.34Å; D321-S323 PolarHBondContact O-N 3.22Å; D321-R324 HydrophobicContact CB-CB 4.2Å; D321-R324 PolarHBondContact O-N 3.34Å; D321-R324 VanDerWaalsContact OD1-CB 3.24Å; D321-R324 WeakPolarHBondContact OD1-CB 3.34Å; D321-R324 PolarHBondContact OD1-N 3.09Å; D321-R324 VanDerWaalsContact OD2-CB 3.23Å; D321-R324 WeakPolarHBondContact OD2-CB 3.38Å; D321-R324 VanDerWaalsContact OD2-CD 3.29Å; D321-R324 WeakPolarHBondContact OD2-CD 3.27Å; D321-A325 PolarHBondContact O-N 3.49Å
322	V	92.3	Very high	93.5	Very high	24 Å²	24	44.3 Å²	44.3	15%	0.145	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-39.6	-174.5	-178.7	0	0	0	0	112	R324 A325 I326 A349 L352 D353	V322-R324 PolarHBondContact O-N 3.45Å; V322-A325 WeakPolarHBondContact O-CB 3.4Å; V322-A325 PolarHBondContact O-N 2.97Å; V322-I326 HydrophobicContact CG1-CD1 4.04Å; V322-I326 WeakPolarHBondContact O-CG1 3.24Å; V322-I326 PolarHBondContact O-N 3.25Å; V322-A349 HydrophobicContact CG1-CB 4.11Å; V322-A349 WeakPolarHBondContact CG1-O 3.47Å; V322-L352 HydrophobicContact CG1-CB 4.13Å; V322-L352 HydrophobicContact CG2-CB 3.9Å; V322-L352 HydrophobicContact CG2-CD1 4.16Å; V322-D353 HydrophobicContact CG1-CB 3.94Å
323	S	93	Very high	93.5	Very high	81 Å²	81	44.9 Å²	44.9	57%	0.566	23%	0.229	S	C	*	.	H	α-helix	trans	-63.6	-41.9	179.4	-178.4	0	0	0	0	111.8	D321 I326 T327	D321-S323 VanDerWaalsContact C-N 3.34Å; D321-S323 PolarHBondContact O-N 3.22Å; S323-I326 PolarHBondContact O-N 3.36Å; S323-T327 PolarHBondContact O-N 3.21Å; S323-T327 PolarHBondContact O-OG1 2.8Å
324	R	94.7	Very high	93.4	Very high	88 Å²	88	50.4 Å²	50.4	33%	0.332	26%	0.255	S	S	.	.	H	α-helix	trans	-66.7	-39.9	174.8	-171.6	-175.1	172.1	-166.7	-2.6	111.6	E291 L315 D321 V322 T327 V328	E291-R324 IonicContact OE1-CZ 3.77Å; E291-R324 IonicContact OE1-NH2 3.09Å; E291-R324 PolarHBondContact OE1-NH2 3.45Å; L315-R324 HydrophobicContact CD1-CB 4.43Å; L315-R324 HydrophobicContact CD1-CG 3.87Å; D321-R324 HydrophobicContact CB-CB 4.2Å; D321-R324 PolarHBondContact O-N 3.34Å; D321-R324 VanDerWaalsContact OD1-CB 3.24Å; D321-R324 WeakPolarHBondContact OD1-CB 3.34Å; D321-R324 PolarHBondContact OD1-N 3.09Å; D321-R324 VanDerWaalsContact OD2-CB 3.23Å; D321-R324 WeakPolarHBondContact OD2-CB 3.38Å; D321-R324 VanDerWaalsContact OD2-CD 3.29Å; D321-R324 WeakPolarHBondContact OD2-CD 3.27Å; V322-R324 PolarHBondContact O-N 3.45Å; R324-T327 PolarHBondContact O-N 3.02Å; R324-V328 HydrophobicContact CG-CG2 4.36Å; R324-V328 WeakPolarHBondContact O-CG2 3.44Å; R324-V328 PolarHBondContact O-N 3.33Å
325	A	94.6	Very high	93.2	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-55.7	-53.6	174.6	0	0	0	0	0	110.7	L315 D321 V322 T327 V328 C329 A349	L315-A325 HydrophobicContact CB-CB 3.72Å; D321-A325 PolarHBondContact O-N 3.49Å; V322-A325 WeakPolarHBondContact O-CB 3.4Å; V322-A325 PolarHBondContact O-N 2.97Å; A325-T327 VanDerWaalsContact C-N 3.29Å; A325-T327 PolarHBondContact O-N 3.23Å; A325-V328 PolarHBondContact O-N 3.25Å; A325-C329 WeakPolarHBondContact O-CB 3.31Å; A325-C329 PolarHBondContact O-N 3.14Å; A325-C329 PolarHBondContact O-SG 3.49Å; A325-A349 HydrophobicContact CB-CB 4.06Å
326	I	95.9	Very high	93.1	Very high	22 Å²	22	56.5 Å²	56.5	11%	0.113	29%	0.294	C	S	.	.	H	α-helix	trans	-56	-44	178.6	-66.8	164.7	0	0	0	111.3	V322 S323 S330 A349 Y350 D353	V322-I326 HydrophobicContact CG1-CD1 4.04Å; V322-I326 WeakPolarHBondContact O-CG1 3.24Å; V322-I326 PolarHBondContact O-N 3.25Å; S323-I326 PolarHBondContact O-N 3.36Å; I326-S330 WeakPolarHBondContact O-CB 3.18Å; I326-S330 PolarHBondContact O-N 3Å; I326-S330 PolarHBondContact O-OG 3.33Å; I326-A349 HydrophobicContact CG1-CB 3.77Å; I326-Y350 HydrophobicContact CB-CE1 4.43Å; I326-Y350 HydrophobicContact CD1-CD1 3.64Å; I326-Y350 HydrophobicContact CD1-CE1 3.81Å; I326-Y350 HydrophobicContact CG1-CD1 4.01Å; I326-Y350 HydrophobicContact CG1-CE1 3.98Å; I326-Y350 HydrophobicContact CG2-CD1 4.42Å; I326-Y350 HydrophobicContact CG2-CE1 3.55Å; I326-D353 HydrophobicContact CD1-CB 4.11Å
327	T	96.4	Very high	93.1	Very high	71 Å²	71	60.1 Å²	60.1	44%	0.436	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-53.1	-179.7	-56.4	0	0	0	0	111.3	S323 R324 A325 S330 E331	S323-T327 PolarHBondContact O-N 3.21Å; S323-T327 PolarHBondContact O-OG1 2.8Å; R324-T327 PolarHBondContact O-N 3.02Å; A325-T327 VanDerWaalsContact C-N 3.29Å; A325-T327 PolarHBondContact O-N 3.23Å; T327-S330 PolarHBondContact O-N 2.9Å; T327-E331 PolarHBondContact O-N 2.91Å
328	V	96.2	Very high	93.1	Very high	18 Å²	18	62.7 Å²	62.7	11%	0.109	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-45.7	-178.1	176.7	0	0	0	0	111	K308 I311 C312 L315 R324 A325 S330 E331 V332	K308-V328 HydrophobicContact CB-CG1 4.28Å; I311-V328 HydrophobicContact CB-CG1 4.41Å; I311-V328 HydrophobicContact CG2-CG1 4.07Å; C312-V328 HydrophobicContact CB-CG1 4.22Å; L315-V328 HydrophobicContact CD1-CG2 4.28Å; R324-V328 HydrophobicContact CG-CG2 4.36Å; R324-V328 WeakPolarHBondContact O-CG2 3.44Å; R324-V328 PolarHBondContact O-N 3.33Å; A325-V328 PolarHBondContact O-N 3.25Å; V328-S330 VanDerWaalsContact C-N 3.26Å; V328-S330 PolarHBondContact O-N 2.92Å; V328-E331 WeakPolarHBondContact O-CB 3.46Å; V328-E331 PolarHBondContact O-N 2.94Å; V328-V332 WeakPolarHBondContact O-CG2 3.49Å; V328-V332 PolarHBondContact O-N 3.39Å; V328-V332 VanDerWaalsContact O-N 3.13Å
329	C	96.5	Very high	93.3	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-38.2	177.2	-57.9	0	0	0	0	111.5	C312 A325 V332 L333 V342 R346	C312-C329 HydrophobicContact CB-CB 4.01Å; C312-C329 WeakPolarHBondContact CB-SG 3.2Å; C312-C329 VanDerWaalsContact SG-CA 3.59Å; C312-C329 WeakPolarHBondContact SG-CB 3.36Å; C312-C329 CovalentContact SG-SG 2.02Å; C312-C329 PolarHBondContact SG-SG 3.41Å; A325-C329 WeakPolarHBondContact O-CB 3.31Å; A325-C329 PolarHBondContact O-N 3.14Å; A325-C329 PolarHBondContact O-SG 3.49Å; C329-V332 PolarHBondContact O-N 3.17Å; C329-L333 WeakPolarHBondContact O-CG 3.21Å; C329-L333 PolarHBondContact O-N 3.22Å; C329-V342 HydrophobicContact CB-CG1 3.85Å; C329-R346 HydrophobicContact CB-CB 3.73Å; C329-R346 HydrophobicContact CB-CG 3.88Å
330	S	96.4	Very high	93.7	Very high	26 Å²	26	56.6 Å²	56.6	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-37.4	176.5	-61.8	0	0	0	0	113	I326 T327 V328 V332 L333 Q334 R346	I326-S330 WeakPolarHBondContact O-CB 3.18Å; I326-S330 PolarHBondContact O-N 3Å; I326-S330 PolarHBondContact O-OG 3.33Å; T327-S330 PolarHBondContact O-N 2.9Å; V328-S330 VanDerWaalsContact C-N 3.26Å; V328-S330 PolarHBondContact O-N 2.92Å; S330-V332 VanDerWaalsContact C-N 3.32Å; S330-V332 PolarHBondContact O-N 2.99Å; S330-L333 PolarHBondContact O-N 3.35Å; S330-Q334 WeakPolarHBondContact O-CG 3.33Å; S330-Q334 PolarHBondContact O-N 3.23Å; S330-R346 WeakPolarHBondContact OG-CD 3.39Å; S330-R346 PolarHBondContact OG-NH1 2.88Å
331	E	95.7	Very high	94.3	Very high	76 Å²	76	53.3 Å²	53.3	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-61.4	-40.4	172	-70.3	179.9	-162.8	0	0	111.9	K308 T327 V328 Q334	K308-E331 IonicContact NZ-OE2 3.65Å; K308-E331 PolarHBondContact NZ-OE2 3.19Å; T327-E331 PolarHBondContact O-N 2.91Å; V328-E331 WeakPolarHBondContact O-CB 3.46Å; V328-E331 PolarHBondContact O-N 2.94Å; E331-Q334 PolarHBondContact O-N 3.32Å
332	V	95.8	Very high	94.7	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-45.9	176.9	-178.3	0	0	0	0	110.7	K308 E309 V328 C329 S330 Q334 S335 D336 V342	K308-V332 HydrophobicContact CB-CG2 3.54Å; E309-V332 HydrophobicContact CB-CG1 4.39Å; V328-V332 WeakPolarHBondContact O-CG2 3.49Å; V328-V332 PolarHBondContact O-N 3.39Å; V328-V332 VanDerWaalsContact O-N 3.13Å; C329-V332 PolarHBondContact O-N 3.17Å; S330-V332 VanDerWaalsContact C-N 3.32Å; S330-V332 PolarHBondContact O-N 2.99Å; V332-Q334 PolarHBondContact O-N 3.36Å; V332-S335 PolarHBondContact O-N 3.11Å; V332-S335 PolarHBondContact O-OG 3.39Å; V332-D336 PolarHBondContact O-N 2.95Å; V332-V342 HydrophobicContact CB-CG1 4.14Å; V332-V342 HydrophobicContact CG1-CG1 4.32Å; V332-V342 HydrophobicContact CG1-CG2 3.93Å
333	L	95.9	Very high	94.9	Very high	13 Å²	13	49 Å²	49	7%	0.068	27%	0.267	C	S	.	.	H	α-helix	trans	-69	-17.1	-180	-67	168.8	0	0	0	114	C329 S330 S335 D336 P337 N339 V342 L343	C329-L333 WeakPolarHBondContact O-CG 3.21Å; C329-L333 PolarHBondContact O-N 3.22Å; S330-L333 PolarHBondContact O-N 3.35Å; L333-S335 VanDerWaalsContact C-N 3.29Å; L333-D336 WeakPolarHBondContact CD2-O 3.41Å; L333-P337 VanDerWaalsContact O-CA 3.26Å; L333-P337 WeakPolarHBondContact O-CA 3.14Å; L333-P337 WeakPolarHBondContact O-CG 3.44Å; L333-N339 HydrophobicContact CD2-CB 4.29Å; L333-V342 HydrophobicContact CD1-CG1 3.88Å; L333-V342 HydrophobicContact CD2-CB 4.03Å; L333-V342 HydrophobicContact CD2-CG1 3.91Å; L333-V342 HydrophobicContact CG-CB 4.27Å; L333-V342 HydrophobicContact CG-CG1 3.58Å; L333-L343 HydrophobicContact CD1-CD2 3.78Å; L333-L343 HydrophobicContact CD1-CG 4.3Å; L333-L343 HydrophobicContact CD2-CD2 3.98Å; L333-L343 HydrophobicContact CD2-CG 3.83Å
334	Q	94.8	Very high	95.1	Very high	159 Å²	159	46 Å²	46	74%	0.743	24%	0.244	S	C	*	.	H	α-helix	trans	-66.1	-35.1	167.6	-75.3	170.5	13.5	0	0	111.7	S330 E331 V332	S330-Q334 WeakPolarHBondContact O-CG 3.33Å; S330-Q334 PolarHBondContact O-N 3.23Å; E331-Q334 PolarHBondContact O-N 3.32Å; V332-Q334 PolarHBondContact O-N 3.36Å
335	S	91.5	Very high	95.2	Very high	77 Å²	77	42.4 Å²	42.4	54%	0.538	23%	0.231	S	C	.	.	H	α-helix	trans	-90.3	-34.2	178.9	54.5	0	0	0	0	113.6	H305 V332 L333	H305-S335 PolarHBondContact CE1-OG 3.33Å; H305-S335 PolarHBondContact ND1-OG 3.35Å; V332-S335 PolarHBondContact O-N 3.11Å; V332-S335 PolarHBondContact O-OG 3.39Å; L333-S335 VanDerWaalsContact C-N 3.29Å
336	D	92.4	Very high	95.3	Very high	55 Å²	55	44 Å²	44	29%	0.294	24%	0.237	S	C	.	.			trans	-133.7	82.3	178	-176.6	5.8	0	0	0	110.3	V332 L333 Q338 N339	V332-D336 PolarHBondContact O-N 2.95Å; L333-D336 WeakPolarHBondContact CD2-O 3.41Å; D336-Q338 PolarHBondContact O-N 3.13Å; D336-Q338 VanDerWaalsContact O-N 3.11Å; D336-Q338 PolarHBondContact OD1-N 3.08Å; D336-N339 HydrophobicContact CB-CB 4.38Å; D336-N339 PolarHBondContact O-N 3.22Å; D336-N339 PolarHBondContact OD1-N 2.88Å; D336-N339 WeakPolarHBondContact OD2-CB 3.21Å
337	P	93.9	Very high	95.3	Very high	78 Å²	78	43 Å²	43	51%	0.506	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.8	-175.6	-21.5	32.5	0	0	0	114.5	L333	L333-P337 VanDerWaalsContact O-CA 3.26Å; L333-P337 WeakPolarHBondContact O-CA 3.14Å; L333-P337 WeakPolarHBondContact O-CG 3.44Å
338	Q	92.9	Very high	95.2	Very high	120 Å²	120	42.8 Å²	42.8	56%	0.561	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.3	3.3	-172.8	-54.5	-174.5	7.6	0	0	112.2	D336 V340 H369	D336-Q338 PolarHBondContact O-N 3.13Å; D336-Q338 VanDerWaalsContact O-N 3.11Å; D336-Q338 PolarHBondContact OD1-N 3.08Å; Q338-V340 PolarHBondContact O-N 2.92Å; Q338-H369 VanDerWaalsContact CD-CE1 3.42Å; Q338-H369 WeakPolarHBondContact CG-NE2 3.26Å; Q338-H369 PolarHBondContact OE1-CE1 2.85Å
339	N	94.5	Very high	95.2	Very high	17 Å²	17	42 Å²	42	9%	0.091	22%	0.221	C	C	.	.			trans	-66.5	100.8	179.4	-167.9	-44.4	0	0	0	111	E309 L333 D336 N341 V342 L343	E309-N339 PolarHBondContact OE1-ND2 3.02Å; L333-N339 HydrophobicContact CD2-CB 4.29Å; D336-N339 HydrophobicContact CB-CB 4.38Å; D336-N339 PolarHBondContact O-N 3.22Å; D336-N339 PolarHBondContact OD1-N 2.88Å; D336-N339 WeakPolarHBondContact OD2-CB 3.21Å; N339-N341 VanDerWaalsContact C-N 3.29Å; N339-N341 PolarHBondContact O-N 3.28Å; N339-N341 WeakPolarHBondContact OD1-CB 3.49Å; N339-N341 PolarHBondContact OD1-N 3.38Å; N339-N341 VanDerWaalsContact OD1-N 3.08Å; N339-V342 HydrophobicContact CB-CB 4.15Å; N339-V342 HydrophobicContact CB-CG2 4.12Å; N339-V342 PolarHBondContact O-N 2.9Å; N339-V342 PolarHBondContact OD1-N 3.49Å; N339-V342 VanDerWaalsContact OD1-N 3.15Å; N339-L343 WeakPolarHBondContact O-CG 3.31Å; N339-L343 PolarHBondContact O-N 3.41Å
340	V	94.9	Very high	95.2	Very high	29 Å²	29	43.3 Å²	43.3	18%	0.176	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-37.8	-177.5	178.3	0	0	0	0	112.2	Q338 K344 A366 H369 I376	Q338-V340 PolarHBondContact O-N 2.92Å; V340-K344 HydrophobicContact CG1-CD 3.93Å; V340-K344 WeakPolarHBondContact O-CD 3.37Å; V340-K344 VanDerWaalsContact O-CG 3.25Å; V340-K344 WeakPolarHBondContact O-CG 3.45Å; V340-K344 PolarHBondContact O-N 2.89Å; V340-K344 VanDerWaalsContact O-N 3.11Å; V340-A366 HydrophobicContact CG1-CB 4.35Å; V340-H369 HydrophobicContact CG2-CB 3.76Å; V340-I376 HydrophobicContact CG1-CD1 3.82Å
341	N	94.1	Very high	95	Very high	92 Å²	92	42.8 Å²	42.8	49%	0.492	22%	0.221	S	C	.	.	H	α-helix	trans	-66.3	-47	-178.9	-62.7	-36.8	0	0	0	110.6	N339 K344 D345	N339-N341 VanDerWaalsContact C-N 3.29Å; N339-N341 PolarHBondContact O-N 3.28Å; N339-N341 WeakPolarHBondContact OD1-CB 3.49Å; N339-N341 PolarHBondContact OD1-N 3.38Å; N339-N341 VanDerWaalsContact OD1-N 3.08Å; N341-K344 WeakPolarHBondContact O-CB 3.47Å; N341-K344 PolarHBondContact O-N 3.38Å; N341-D345 PolarHBondContact O-N 3.16Å
342	V	96.7	Very high	94.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68.1	-37.2	-179.5	-179.9	0	0	0	0	111.6	E309 C329 V332 L333 N339 K344 D345 R346	E309-V342 HydrophobicContact CB-CG2 4.42Å; E309-V342 HydrophobicContact CG-CG2 3.78Å; C329-V342 HydrophobicContact CB-CG1 3.85Å; V332-V342 HydrophobicContact CB-CG1 4.14Å; V332-V342 HydrophobicContact CG1-CG1 4.32Å; V332-V342 HydrophobicContact CG1-CG2 3.93Å; L333-V342 HydrophobicContact CD1-CG1 3.88Å; L333-V342 HydrophobicContact CD2-CB 4.03Å; L333-V342 HydrophobicContact CD2-CG1 3.91Å; L333-V342 HydrophobicContact CG-CB 4.27Å; L333-V342 HydrophobicContact CG-CG1 3.58Å; N339-V342 HydrophobicContact CB-CB 4.15Å; N339-V342 HydrophobicContact CB-CG2 4.12Å; N339-V342 PolarHBondContact O-N 2.9Å; N339-V342 PolarHBondContact OD1-N 3.49Å; N339-V342 VanDerWaalsContact OD1-N 3.15Å; V342-K344 VanDerWaalsContact C-N 3.31Å; V342-K344 PolarHBondContact O-N 2.88Å; V342-D345 PolarHBondContact O-N 3.3Å; V342-R346 VanDerWaalsContact O-CB 3.32Å; V342-R346 WeakPolarHBondContact O-CB 3.48Å; V342-R346 PolarHBondContact O-N 3.14Å
343	L	97.1	Very high	94.8	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-59.8	-42.1	172.8	-73.7	166.7	0	0	0	111.4	L333 N339 A347 D362 T365 A366	L333-L343 HydrophobicContact CD1-CD2 3.78Å; L333-L343 HydrophobicContact CD1-CG 4.3Å; L333-L343 HydrophobicContact CD2-CD2 3.98Å; L333-L343 HydrophobicContact CD2-CG 3.83Å; N339-L343 WeakPolarHBondContact O-CG 3.31Å; N339-L343 PolarHBondContact O-N 3.41Å; L343-A347 VanDerWaalsContact O-CB 3.26Å; L343-A347 WeakPolarHBondContact O-CB 3.42Å; L343-A347 PolarHBondContact O-N 2.65Å; L343-D362 HydrophobicContact CD2-CB 4.26Å; L343-T365 HydrophobicContact CD1-CG2 3.88Å; L343-T365 HydrophobicContact CD2-CG2 4.47Å; L343-A366 HydrophobicContact CB-CB 3.95Å; L343-A366 HydrophobicContact CD1-CB 4.07Å
344	K	96	Very high	94.6	Very high	19 Å²	19	52.4 Å²	52.4	8%	0.083	27%	0.27	C	S	.	.	H	α-helix	trans	-65.9	-48.5	176.9	-70.6	161.6	63.8	175.1	0	111.7	V340 N341 V342 R346 A347 E348 Y363 D373 I376	V340-K344 HydrophobicContact CG1-CD 3.93Å; V340-K344 WeakPolarHBondContact O-CD 3.37Å; V340-K344 VanDerWaalsContact O-CG 3.25Å; V340-K344 WeakPolarHBondContact O-CG 3.45Å; V340-K344 PolarHBondContact O-N 2.89Å; V340-K344 VanDerWaalsContact O-N 3.11Å; N341-K344 WeakPolarHBondContact O-CB 3.47Å; N341-K344 PolarHBondContact O-N 3.38Å; V342-K344 VanDerWaalsContact C-N 3.31Å; V342-K344 PolarHBondContact O-N 2.88Å; K344-R346 VanDerWaalsContact C-N 3.32Å; K344-R346 PolarHBondContact O-N 3.21Å; K344-A347 PolarHBondContact O-N 2.67Å; K344-E348 WeakPolarHBondContact O-CG 3.44Å; K344-E348 PolarHBondContact O-N 2.75Å; K344-Y363 HydrophobicContact CG-CE1 4.31Å; K344-D373 IonicContact NZ-OD2 3.48Å; K344-D373 PolarHBondContact NZ-OD2 3.13Å; K344-I376 HydrophobicContact CD-CD1 4.34Å; K344-I376 HydrophobicContact CD-CG1 3.89Å; K344-I376 HydrophobicContact CG-CG1 4.08Å
345	D	96.4	Very high	94.6	Very high	13 Å²	13	48 Å²	48	7%	0.07	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-40.3	178.9	-71.3	-35.2	0	0	0	111.3	H313 A316 N341 V342 E348 A349	H313-D345 VanDerWaalsContact CA-OD2 3.26Å; H313-D345 WeakPolarHBondContact CA-OD2 3.42Å; H313-D345 VanDerWaalsContact CB-OD2 3.29Å; H313-D345 WeakPolarHBondContact CB-OD2 3.44Å; H313-D345 IonicContact CE1-OD1 3.76Å; H313-D345 IonicContact CG-OD2 2.84Å; H313-D345 IonicContact ND1-OD1 2.66Å; H313-D345 PolarHBondContact ND1-OD1 2.96Å; H313-D345 VanDerWaalsContact ND1-OD1 3.09Å; H313-D345 IonicContact ND1-OD2 3.57Å; H313-D345 PolarHBondContact ND1-OD2 3.18Å; H313-D345 VanDerWaalsContact ND1-OD2 3.13Å; A316-D345 HydrophobicContact CB-CB 3.81Å; A316-D345 WeakPolarHBondContact CB-O 3.49Å; N341-D345 PolarHBondContact O-N 3.16Å; V342-D345 PolarHBondContact O-N 3.3Å; D345-E348 PolarHBondContact O-N 3.35Å; D345-A349 PolarHBondContact O-N 3.25Å; D345-A349 VanDerWaalsContact O-N 3.1Å
346	R	97.3	Very high	94.7	Very high	35 Å²	35	45.9 Å²	45.9	13%	0.132	23%	0.23	C	C	.	.	H	α-helix	trans	-69.8	-39.7	176.1	-164.3	173.5	67.5	-177.9	-4.8	112.6	C329 S330 V342 K344 E348 A349 Y350 D362	C329-R346 HydrophobicContact CB-CB 3.73Å; C329-R346 HydrophobicContact CB-CG 3.88Å; S330-R346 WeakPolarHBondContact OG-CD 3.39Å; S330-R346 PolarHBondContact OG-NH1 2.88Å; V342-R346 VanDerWaalsContact O-CB 3.32Å; V342-R346 WeakPolarHBondContact O-CB 3.48Å; V342-R346 PolarHBondContact O-N 3.14Å; K344-R346 VanDerWaalsContact C-N 3.32Å; K344-R346 PolarHBondContact O-N 3.21Å; R346-E348 VanDerWaalsContact C-N 3.32Å; R346-E348 PolarHBondContact O-N 2.85Å; R346-A349 WeakPolarHBondContact O-CB 3.49Å; R346-A349 PolarHBondContact O-N 2.54Å; R346-Y350 HydrophobicContact CG-CD2 4.05Å; R346-Y350 HydrophobicContact CG-CE2 3.65Å; R346-Y350 WeakPolarHBondContact O-CD2 3.42Å; R346-Y350 PolarHBondContact O-N 3.37Å; R346-D362 IonicContact CZ-OD1 3.65Å; R346-D362 IonicContact CZ-OD2 2.82Å; R346-D362 IonicContact NE-OD1 2.86Å; R346-D362 IonicContact NE-OD2 3.59Å; R346-D362 PolarHBondContact NE-OD2 3.09Å; R346-D362 IonicContact NH2-OD1 3.54Å; R346-D362 PolarHBondContact NH2-OD1 2.92Å; R346-D362 IonicContact NH2-OD2 2.68Å; R346-D362 PolarHBondContact NH2-OD2 3.41Å
347	A	96.4	Very high	94.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-41.1	174.8	0	0	0	0	0	111.5	L343 K344 A349 Y350 L351 A359 D362 Y363	L343-A347 VanDerWaalsContact O-CB 3.26Å; L343-A347 WeakPolarHBondContact O-CB 3.42Å; L343-A347 PolarHBondContact O-N 2.65Å; K344-A347 PolarHBondContact O-N 2.67Å; A347-A349 VanDerWaalsContact C-N 3.33Å; A347-A349 PolarHBondContact O-N 2.86Å; A347-Y350 PolarHBondContact O-N 2.77Å; A347-L351 WeakPolarHBondContact O-CG 3.31Å; A347-L351 PolarHBondContact O-N 2.99Å; A347-A359 HydrophobicContact CB-CB 4.5Å; A347-D362 HydrophobicContact CB-CB 3.86Å; A347-Y363 HydrophobicContact CB-CD1 4.12Å; A347-Y363 HydrophobicContact CB-CD2 3.8Å; A347-Y363 HydrophobicContact CB-CE1 3.85Å; A347-Y363 HydrophobicContact CB-CE2 3.52Å; A347-Y363 HydrophobicContact CB-CG 4.08Å
348	E	94.5	Very high	94.9	Very high	67 Å²	67	49.4 Å²	49.4	31%	0.313	24%	0.238	S	C	.	.	H	α-helix	trans	-61	-41.5	173.2	-73.2	-178.3	-173.7	0	0	111.9	Q317 K344 D345 R346 L351 L352	Q317-E348 PolarHBondContact NE2-OE2 2.68Å; K344-E348 WeakPolarHBondContact O-CG 3.44Å; K344-E348 PolarHBondContact O-N 2.75Å; D345-E348 PolarHBondContact O-N 3.35Å; R346-E348 VanDerWaalsContact C-N 3.32Å; R346-E348 PolarHBondContact O-N 2.85Å; E348-L351 WeakPolarHBondContact O-CB 3.29Å; E348-L351 PolarHBondContact O-N 3.46Å; E348-L352 WeakPolarHBondContact O-CG 3.4Å; E348-L352 PolarHBondContact O-N 3.01Å
349	A	95.3	Very high	95.1	Very high	2 Å²	2	43.7 Å²	43.7	2%	0.017	21%	0.211	C	C	.	.	H	α-helix	trans	-63.2	-43.8	174.2	0	0	0	0	0	112.1	V322 A325 I326 D345 R346 A347 L351 L352 D353	V322-A349 HydrophobicContact CG1-CB 4.11Å; V322-A349 WeakPolarHBondContact CG1-O 3.47Å; A325-A349 HydrophobicContact CB-CB 4.06Å; I326-A349 HydrophobicContact CG1-CB 3.77Å; D345-A349 PolarHBondContact O-N 3.25Å; D345-A349 VanDerWaalsContact O-N 3.1Å; R346-A349 WeakPolarHBondContact O-CB 3.49Å; R346-A349 PolarHBondContact O-N 2.54Å; A347-A349 VanDerWaalsContact C-N 3.33Å; A347-A349 PolarHBondContact O-N 2.86Å; A349-L351 VanDerWaalsContact C-N 3.31Å; A349-L351 PolarHBondContact O-N 3.39Å; A349-L352 WeakPolarHBondContact O-CB 3.29Å; A349-L352 PolarHBondContact O-N 3.49Å; A349-L352 VanDerWaalsContact O-N 3.1Å; A349-D353 PolarHBondContact O-N 3.39Å
350	Y	96.5	Very high	95.2	Very high	26 Å²	26	43.8 Å²	43.8	10%	0.102	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-35.6	175.1	-76	-47	0	0	0	113.3	I326 R346 A347 L352 D353 E354 Q355 E358 D362	I326-Y350 HydrophobicContact CB-CE1 4.43Å; I326-Y350 HydrophobicContact CD1-CD1 3.64Å; I326-Y350 HydrophobicContact CD1-CE1 3.81Å; I326-Y350 HydrophobicContact CG1-CD1 4.01Å; I326-Y350 HydrophobicContact CG1-CE1 3.98Å; I326-Y350 HydrophobicContact CG2-CD1 4.42Å; I326-Y350 HydrophobicContact CG2-CE1 3.55Å; R346-Y350 HydrophobicContact CG-CD2 4.05Å; R346-Y350 HydrophobicContact CG-CE2 3.65Å; R346-Y350 WeakPolarHBondContact O-CD2 3.42Å; R346-Y350 PolarHBondContact O-N 3.37Å; A347-Y350 PolarHBondContact O-N 2.77Å; Y350-L352 VanDerWaalsContact C-N 3.27Å; Y350-L352 PolarHBondContact O-N 2.86Å; Y350-D353 CarbonylContact O-C 3.57Å; Y350-D353 PolarHBondContact O-N 3.37Å; Y350-E354 PolarHBondContact O-N 2.97Å; Y350-E354 VanDerWaalsContact O-N 3.1Å; Y350-Q355 HydrophobicContact CD1-CB 3.82Å; Y350-Q355 HydrophobicContact CD1-CG 4.43Å; Y350-Q355 HydrophobicContact CG-CB 4.31Å; Y350-Q355 PolarHBondContact O-N 3.16Å; Y350-E358 HydrophobicContact CD1-CB 4.08Å; Y350-E358 HydrophobicContact CD2-CB 3.81Å; Y350-E358 HydrophobicContact CE1-CB 4.16Å; Y350-E358 HydrophobicContact CE2-CB 3.88Å; Y350-E358 HydrophobicContact CG-CB 3.92Å; Y350-D362 WeakPolarHBondContact CE2-OD2 3.41Å
351	L	93.1	Very high	95.3	Very high	16 Å²	16	49 Å²	49	8%	0.084	23%	0.232	C	C	.	.	H	α-helix	trans	-62.3	-35.4	173.6	-71.3	-179.3	0	0	0	112.4	A347 E348 A349 E354 Y356 A359 Y363 K382 A383 L386	A347-L351 WeakPolarHBondContact O-CG 3.31Å; A347-L351 PolarHBondContact O-N 2.99Å; E348-L351 WeakPolarHBondContact O-CB 3.29Å; E348-L351 PolarHBondContact O-N 3.46Å; A349-L351 VanDerWaalsContact C-N 3.31Å; A349-L351 PolarHBondContact O-N 3.39Å; L351-E354 PolarHBondContact O-N 2.92Å; L351-Y356 HydrophobicContact CD2-CD1 3.94Å; L351-A359 HydrophobicContact CD2-CB 3.71Å; L351-A359 HydrophobicContact CG-CB 3.91Å; L351-Y363 HydrophobicContact CD1-CE2 4.25Å; L351-K382 HydrophobicContact CD1-CD 4.19Å; L351-A383 HydrophobicContact CD2-CB 3.71Å; L351-L386 HydrophobicContact CD2-CD1 4.15Å
352	L	92.4	Very high	95.4	Very high	77 Å²	77	45 Å²	45	40%	0.403	21%	0.211	S	C	.	.	H	α-helix	trans	-74.7	-30.5	176.1	-65.6	168.8	0	0	0	112.3	Q319 V322 E348 A349 Y350 E354	Q319-L352 HydrophobicContact CB-CD1 3.81Å; Q319-L352 HydrophobicContact CG-CD1 3.58Å; V322-L352 HydrophobicContact CG1-CB 4.13Å; V322-L352 HydrophobicContact CG2-CB 3.9Å; V322-L352 HydrophobicContact CG2-CD1 4.16Å; E348-L352 WeakPolarHBondContact O-CG 3.4Å; E348-L352 PolarHBondContact O-N 3.01Å; A349-L352 WeakPolarHBondContact O-CB 3.29Å; A349-L352 PolarHBondContact O-N 3.49Å; A349-L352 VanDerWaalsContact O-N 3.1Å; Y350-L352 VanDerWaalsContact C-N 3.27Å; Y350-L352 PolarHBondContact O-N 2.86Å; L352-E354 VanDerWaalsContact C-N 3.25Å; L352-E354 PolarHBondContact O-N 3.13Å
353	D	93.8	Very high	95.4	Very high	73 Å²	73	45.3 Å²	45.3	39%	0.39	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	4.9	174.6	-157.6	52.7	0	0	0	113.3	V322 I326 A349 Y350 Q355	V322-D353 HydrophobicContact CG1-CB 3.94Å; I326-D353 HydrophobicContact CD1-CB 4.11Å; A349-D353 PolarHBondContact O-N 3.39Å; Y350-D353 CarbonylContact O-C 3.57Å; Y350-D353 PolarHBondContact O-N 3.37Å; D353-Q355 HydrophobicContact CB-CG 4.3Å; D353-Q355 PolarHBondContact O-N 3.47Å; D353-Q355 VanDerWaalsContact OD2-CD 3.25Å; D353-Q355 PolarHBondContact OD2-NE2 2.93Å
354	E	92.3	Very high	95.3	Very high	142 Å²	142	48.7 Å²	48.7	66%	0.664	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	20	-176.4	-51.4	-172.9	166	0	0	114.7	Y350 L351 L352 Y356	Y350-E354 PolarHBondContact O-N 2.97Å; Y350-E354 VanDerWaalsContact O-N 3.1Å; L351-E354 PolarHBondContact O-N 2.92Å; L352-E354 VanDerWaalsContact C-N 3.25Å; L352-E354 PolarHBondContact O-N 3.13Å; E354-Y356 VanDerWaalsContact C-N 3.33Å; E354-Y356 HydrophobicContact CB-CE1 4.47Å; E354-Y356 HydrophobicContact CB-CE2 4.02Å; E354-Y356 WeakPolarHBondContact CG-OH 3.34Å; E354-Y356 WeakPolarHBondContact O-CD2 3.47Å; E354-Y356 WeakPolarHBondContact O-CE2 3.39Å; E354-Y356 PolarHBondContact O-N 3.3Å; E354-Y356 VanDerWaalsContact O-N 3.16Å
355	Q	93.8	Very high	95.3	Very high	65 Å²	65	49.6 Å²	49.6	30%	0.304	24%	0.235	S	C	.	.			trans	-87.5	68	175.1	-67.7	-170.1	6.2	0	0	110.4	Y350 D353 E357 E358 A359	Y350-Q355 HydrophobicContact CD1-CB 3.82Å; Y350-Q355 HydrophobicContact CD1-CG 4.43Å; Y350-Q355 HydrophobicContact CG-CB 4.31Å; Y350-Q355 PolarHBondContact O-N 3.16Å; D353-Q355 HydrophobicContact CB-CG 4.3Å; D353-Q355 PolarHBondContact O-N 3.47Å; D353-Q355 VanDerWaalsContact OD2-CD 3.25Å; D353-Q355 PolarHBondContact OD2-NE2 2.93Å; Q355-E357 PolarHBondContact O-N 3.25Å; Q355-E358 HydrophobicContact CB-CB 4.3Å; Q355-E358 HydrophobicContact CB-CG 4.45Å; Q355-E358 WeakPolarHBondContact CB-OE2 3.47Å; Q355-E358 PolarHBondContact O-N 2.87Å; Q355-A359 PolarHBondContact O-N 3.15Å; Q355-A359 VanDerWaalsContact O-N 3.08Å
356	Y	93.9	Very high	95.2	Very high	33 Å²	33	49 Å²	49	13%	0.129	23%	0.231	C	C	.	.	H	α-helix	trans	-68.8	-31.5	-169.2	-51.2	-63.6	0	0	0	114	L351 E354 A359 I360 L386	L351-Y356 HydrophobicContact CD2-CD1 3.94Å; E354-Y356 VanDerWaalsContact C-N 3.33Å; E354-Y356 HydrophobicContact CB-CE1 4.47Å; E354-Y356 HydrophobicContact CB-CE2 4.02Å; E354-Y356 WeakPolarHBondContact CG-OH 3.34Å; E354-Y356 WeakPolarHBondContact O-CD2 3.47Å; E354-Y356 WeakPolarHBondContact O-CE2 3.39Å; E354-Y356 PolarHBondContact O-N 3.3Å; E354-Y356 VanDerWaalsContact O-N 3.16Å; Y356-A359 PolarHBondContact O-N 3.01Å; Y356-I360 WeakPolarHBondContact O-CD1 3.39Å; Y356-I360 VanDerWaalsContact O-CG1 3.24Å; Y356-I360 WeakPolarHBondContact O-CG1 3.45Å; Y356-I360 PolarHBondContact O-N 2.94Å; Y356-L386 HydrophobicContact CD1-CB 3.7Å; Y356-L386 HydrophobicContact CD1-CD1 4.45Å; Y356-L386 HydrophobicContact CE1-CB 3.58Å; Y356-L386 HydrophobicContact CE1-CD1 4.06Å; Y356-L386 HydrophobicContact CE1-CG 4.33Å; Y356-L386 HydrophobicContact CG-CB 4.39Å
357	E	94.8	Very high	95.1	Very high	129 Å²	129	52.4 Å²	52.4	60%	0.603	24%	0.244	S	C	*	.	H	α-helix	trans	-67.7	-42.6	179.5	-65.8	-178.4	-176.6	0	0	110.5	Q355 I360 K361 L387	Q355-E357 PolarHBondContact O-N 3.25Å; E357-I360 PolarHBondContact O-N 3.29Å; E357-K361 PolarHBondContact O-N 3.26Å; E357-L387 HydrophobicContact CG-CD1 4Å; E357-L387 HydrophobicContact CG-CD2 4.45Å
358	E	96.8	Very high	94.9	Very high	78 Å²	78	59.2 Å²	59.2	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-65	-42.3	175.5	-64.2	82.9	171.7	0	0	111.5	Y350 Q355 I360 K361 D362	Y350-E358 HydrophobicContact CD1-CB 4.08Å; Y350-E358 HydrophobicContact CD2-CB 3.81Å; Y350-E358 HydrophobicContact CE1-CB 4.16Å; Y350-E358 HydrophobicContact CE2-CB 3.88Å; Y350-E358 HydrophobicContact CG-CB 3.92Å; Q355-E358 HydrophobicContact CB-CB 4.3Å; Q355-E358 HydrophobicContact CB-CG 4.45Å; Q355-E358 WeakPolarHBondContact CB-OE2 3.47Å; Q355-E358 PolarHBondContact O-N 2.87Å; E358-I360 PolarHBondContact O-N 2.97Å; E358-K361 WeakPolarHBondContact O-CB 3.48Å; E358-K361 PolarHBondContact O-N 3.24Å; E358-D362 PolarHBondContact O-N 3.37Å
359	A	96.4	Very high	94.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.1	-43.1	174.9	0	0	0	0	0	112.6	A347 L351 Q355 Y356 K361 D362 Y363 A383	A347-A359 HydrophobicContact CB-CB 4.5Å; L351-A359 HydrophobicContact CD2-CB 3.71Å; L351-A359 HydrophobicContact CG-CB 3.91Å; Q355-A359 PolarHBondContact O-N 3.15Å; Q355-A359 VanDerWaalsContact O-N 3.08Å; Y356-A359 PolarHBondContact O-N 3.01Å; A359-K361 VanDerWaalsContact C-N 3.35Å; A359-D362 PolarHBondContact O-N 3.13Å; A359-Y363 WeakPolarHBondContact O-CD2 3.3Å; A359-Y363 PolarHBondContact O-N 3.31Å; A359-Y363 VanDerWaalsContact O-N 3.09Å; A359-A383 HydrophobicContact CB-CB 4.42Å
360	I	97	Very high	94.4	Very high	19 Å²	19	61.6 Å²	61.6	10%	0.097	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-46.2	176.5	-72	164.5	0	0	0	110.2	Y356 E357 E358 D362 Y363 E364 L380 A383 Q384 L387	Y356-I360 WeakPolarHBondContact O-CD1 3.39Å; Y356-I360 VanDerWaalsContact O-CG1 3.24Å; Y356-I360 WeakPolarHBondContact O-CG1 3.45Å; Y356-I360 PolarHBondContact O-N 2.94Å; E357-I360 PolarHBondContact O-N 3.29Å; E358-I360 PolarHBondContact O-N 2.97Å; I360-D362 VanDerWaalsContact C-N 3.34Å; I360-D362 PolarHBondContact O-N 3.26Å; I360-Y363 PolarHBondContact O-N 3.01Å; I360-E364 HydrophobicContact CG2-CG 4.28Å; I360-E364 WeakPolarHBondContact O-CG 3.21Å; I360-E364 PolarHBondContact O-N 3.47Å; I360-L380 HydrophobicContact CB-CD1 4.35Å; I360-L380 HydrophobicContact CG1-CD1 4.44Å; I360-L380 HydrophobicContact CG2-CD1 3.85Å; I360-A383 HydrophobicContact CD1-CB 4.49Å; I360-A383 HydrophobicContact CG1-CB 3.62Å; I360-Q384 HydrophobicContact CD1-CG 3.93Å; I360-Q384 HydrophobicContact CG1-CG 4.17Å; I360-L387 HydrophobicContact CD1-CB 4.17Å; I360-L387 HydrophobicContact CD1-CD2 3.59Å; I360-L387 HydrophobicContact CD1-CG 4.5Å
361	K	96.9	Very high	93.4	Very high	140 Å²	140	67.7 Å²	67.7	61%	0.609	32%	0.32	S	S	*	.	H	α-helix	trans	-58	-45.9	179.2	-175.2	-178.3	178.2	-177.1	0	111.9	E357 E358 A359 E364 T365	E357-K361 PolarHBondContact O-N 3.26Å; E358-K361 WeakPolarHBondContact O-CB 3.48Å; E358-K361 PolarHBondContact O-N 3.24Å; A359-K361 VanDerWaalsContact C-N 3.35Å; K361-E364 PolarHBondContact O-N 3.23Å; K361-T365 PolarHBondContact O-N 2.58Å; K361-T365 PolarHBondContact O-OG1 2.91Å; K361-T365 VanDerWaalsContact O-OG1 3.11Å
362	D	96.9	Very high	93	Very high	7 Å²	7	73.5 Å²	73.5	4%	0.037	35%	0.352	C	S	.	.	H	α-helix	trans	-63.6	-42	178.1	-83.3	-1.1	0	0	0	112.1	L343 R346 A347 Y350 E358 A359 I360 E364 T365 A366	L343-D362 HydrophobicContact CD2-CB 4.26Å; R346-D362 IonicContact CZ-OD1 3.65Å; R346-D362 IonicContact CZ-OD2 2.82Å; R346-D362 IonicContact NE-OD1 2.86Å; R346-D362 IonicContact NE-OD2 3.59Å; R346-D362 PolarHBondContact NE-OD2 3.09Å; R346-D362 IonicContact NH2-OD1 3.54Å; R346-D362 PolarHBondContact NH2-OD1 2.92Å; R346-D362 IonicContact NH2-OD2 2.68Å; R346-D362 PolarHBondContact NH2-OD2 3.41Å; A347-D362 HydrophobicContact CB-CB 3.86Å; Y350-D362 WeakPolarHBondContact CE2-OD2 3.41Å; E358-D362 PolarHBondContact O-N 3.37Å; A359-D362 PolarHBondContact O-N 3.13Å; I360-D362 VanDerWaalsContact C-N 3.34Å; I360-D362 PolarHBondContact O-N 3.26Å; D362-E364 VanDerWaalsContact C-N 3.35Å; D362-E364 PolarHBondContact O-N 3.29Å; D362-T365 PolarHBondContact O-N 3.06Å; D362-A366 VanDerWaalsContact O-CB 3.3Å; D362-A366 WeakPolarHBondContact O-CB 3.45Å; D362-A366 PolarHBondContact O-N 2.96Å
363	Y	96.9	Very high	93	Very high	7 Å²	7	71.6 Å²	71.6	3%	0.027	34%	0.342	C	S	.	.	H	α-helix	trans	-66.6	-34.1	174.7	-76.7	-53.4	0	0	0	113.1	K344 A347 L351 A359 I360 A366 R367 I376 G379 A383	K344-Y363 HydrophobicContact CG-CE1 4.31Å; A347-Y363 HydrophobicContact CB-CD1 4.12Å; A347-Y363 HydrophobicContact CB-CD2 3.8Å; A347-Y363 HydrophobicContact CB-CE1 3.85Å; A347-Y363 HydrophobicContact CB-CE2 3.52Å; A347-Y363 HydrophobicContact CB-CG 4.08Å; L351-Y363 HydrophobicContact CD1-CE2 4.25Å; A359-Y363 WeakPolarHBondContact O-CD2 3.3Å; A359-Y363 PolarHBondContact O-N 3.31Å; A359-Y363 VanDerWaalsContact O-N 3.09Å; I360-Y363 PolarHBondContact O-N 3.01Å; Y363-A366 PolarHBondContact O-N 2.98Å; Y363-R367 WeakPolarHBondContact O-CB 3.41Å; Y363-R367 PolarHBondContact O-N 3.34Å; Y363-I376 HydrophobicContact CD1-CG2 4.23Å; Y363-I376 VanDerWaalsContact O-CG2 3.29Å; Y363-I376 WeakPolarHBondContact O-CG2 3.41Å; Y363-G379 VanDerWaalsContact CE2-C 3.48Å; Y363-A383 HydrophobicContact CD2-CB 4.37Å; Y363-A383 HydrophobicContact CE2-CB 4.5Å
364	E	95.1	Very high	92.9	Very high	74 Å²	74	76.6 Å²	76.6	35%	0.346	36%	0.355	S	S	.	.	H	α-helix	trans	-66.4	-46.6	174.8	-74.7	-179.1	159.4	0	0	111.5	I360 K361 D362 A366 R367 E368 L380	I360-E364 HydrophobicContact CG2-CG 4.28Å; I360-E364 WeakPolarHBondContact O-CG 3.21Å; I360-E364 PolarHBondContact O-N 3.47Å; K361-E364 PolarHBondContact O-N 3.23Å; D362-E364 VanDerWaalsContact C-N 3.35Å; D362-E364 PolarHBondContact O-N 3.29Å; E364-A366 VanDerWaalsContact C-N 3.31Å; E364-A366 PolarHBondContact O-N 3.4Å; E364-R367 WeakPolarHBondContact O-CB 3.44Å; E364-R367 PolarHBondContact O-N 3.19Å; E364-R367 VanDerWaalsContact O-N 3.15Å; E364-E368 PolarHBondContact O-N 3.34Å; E364-E368 VanDerWaalsContact O-N 3.14Å; E364-L380 HydrophobicContact CG-CD1 4.01Å
365	T	95	Very high	92.9	Very high	39 Å²	39	75.3 Å²	75.3	24%	0.239	35%	0.349	C	S	.	.	H	α-helix	trans	-60.6	-42	173.4	-54.4	0	0	0	0	111	L343 K361 D362 R367 E368 H369	L343-T365 HydrophobicContact CD1-CG2 3.88Å; L343-T365 HydrophobicContact CD2-CG2 4.47Å; K361-T365 PolarHBondContact O-N 2.58Å; K361-T365 PolarHBondContact O-OG1 2.91Å; K361-T365 VanDerWaalsContact O-OG1 3.11Å; D362-T365 PolarHBondContact O-N 3.06Å; T365-R367 VanDerWaalsContact C-N 3.29Å; T365-R367 PolarHBondContact O-N 3.15Å; T365-E368 PolarHBondContact O-N 3.08Å; T365-H369 PolarHBondContact O-CD2 3.35Å; T365-H369 VanDerWaalsContact O-CD2 3.28Å
366	A	94.9	Very high	93	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.9	-36	176.5	0	0	0	0	0	112.2	V340 L343 D362 Y363 E364 H369 S370 I376	V340-A366 HydrophobicContact CG1-CB 4.35Å; L343-A366 HydrophobicContact CB-CB 3.95Å; L343-A366 HydrophobicContact CD1-CB 4.07Å; D362-A366 VanDerWaalsContact O-CB 3.3Å; D362-A366 WeakPolarHBondContact O-CB 3.45Å; D362-A366 PolarHBondContact O-N 2.96Å; Y363-A366 PolarHBondContact O-N 2.98Å; E364-A366 VanDerWaalsContact C-N 3.31Å; E364-A366 PolarHBondContact O-N 3.4Å; A366-H369 PolarHBondContact O-N 3.13Å; A366-S370 PolarHBondContact O-N 2.88Å; A366-S370 VanDerWaalsContact O-N 3.13Å; A366-I376 HydrophobicContact CB-CD1 3.79Å; A366-I376 HydrophobicContact CB-CG1 4.33Å; A366-I376 HydrophobicContact CB-CG2 4.38Å
367	R	94.8	Very high	93	Very high	107 Å²	107	74.8 Å²	74.8	40%	0.404	35%	0.346	S	S	.	.	H	α-helix	trans	-67.7	-34.3	178.2	-173.6	179.5	64.4	-171.2	-5	112.6	Y363 E364 T365 H369 S370 I376 L380	Y363-R367 WeakPolarHBondContact O-CB 3.41Å; Y363-R367 PolarHBondContact O-N 3.34Å; E364-R367 WeakPolarHBondContact O-CB 3.44Å; E364-R367 PolarHBondContact O-N 3.19Å; E364-R367 VanDerWaalsContact O-N 3.15Å; T365-R367 VanDerWaalsContact C-N 3.29Å; T365-R367 PolarHBondContact O-N 3.15Å; R367-H369 PolarHBondContact O-N 3.41Å; R367-S370 CarbonylContact O-C 3.15Å; R367-S370 VanDerWaalsContact O-C 3.31Å; R367-S370 PolarHBondContact O-N 3.34Å; R367-I376 HydrophobicContact CB-CG2 3.91Å; R367-L380 VanDerWaalsContact NH1-CD2 3.34Å
368	E	92.6	Very high	93	Very high	142 Å²	142	73.3 Å²	73.3	66%	0.664	34%	0.34	S	S	*	.	H	α-helix	trans	-62.1	-29.9	175.8	-69.9	175.9	-174.4	0	0	112.3	E364 T365	E364-E368 PolarHBondContact O-N 3.34Å; E364-E368 VanDerWaalsContact O-N 3.14Å; T365-E368 PolarHBondContact O-N 3.08Å
369	H	89.7	Confident	92.8	Very high	81 Å²	81	70 Å²	70	38%	0.375	33%	0.326	S	S	.	.	H	α-helix	trans	-98	-6.1	179	-62.4	-62.6	0	0	0	113.7	Q338 V340 T365 A366 R367	Q338-H369 VanDerWaalsContact CD-CE1 3.42Å; Q338-H369 WeakPolarHBondContact CG-NE2 3.26Å; Q338-H369 PolarHBondContact OE1-CE1 2.85Å; V340-H369 HydrophobicContact CG2-CB 3.76Å; T365-H369 PolarHBondContact O-CD2 3.35Å; T365-H369 VanDerWaalsContact O-CD2 3.28Å; A366-H369 PolarHBondContact O-N 3.13Å; R367-H369 PolarHBondContact O-N 3.41Å
370	S	88.6	Confident	92.8	Very high	38 Å²	38	70.4 Å²	70.4	27%	0.266	33%	0.328	S	S	.	.			trans	-151.4	84.5	179.1	-170.5	0	0	0	0	111.9	A366 R367 N372 D373	A366-S370 PolarHBondContact O-N 2.88Å; A366-S370 VanDerWaalsContact O-N 3.13Å; R367-S370 CarbonylContact O-C 3.15Å; R367-S370 VanDerWaalsContact O-C 3.31Å; R367-S370 PolarHBondContact O-N 3.34Å; S370-N372 PolarHBondContact O-N 3.02Å; S370-D373 WeakPolarHBondContact OG-CB 3.45Å
371	E	76.5	Confident	92.7	Very high	155 Å²	155	75 Å²	75	72%	0.724	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.7	-170.3	-65.5	-174.2	158.9	0	0	114.6	K377	E371-K377 PolarHBondContact O-NZ 2.95Å
372	N	83.5	Confident	92.6	Very high	138 Å²	138	73.5 Å²	73.5	74%	0.738	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	14.4	-172.9	-73.1	-44.1	0	0	0	116	S370 R374 K377	S370-N372 PolarHBondContact O-N 3.02Å; N372-R374 PolarHBondContact O-N 3.44Å; N372-K377 PolarHBondContact OD1-NZ 3.41Å
373	D	91.9	Very high	92.5	Very high	37 Å²	37	73.2 Å²	73.2	20%	0.198	34%	0.341	C	S	.	.			trans	-72.3	118.7	173.9	-170.9	-14.8	0	0	0	111.1	K344 S370 Q375 I376 K377	K344-D373 IonicContact NZ-OD2 3.48Å; K344-D373 PolarHBondContact NZ-OD2 3.13Å; S370-D373 WeakPolarHBondContact OG-CB 3.45Å; D373-Q375 VanDerWaalsContact C-N 3.3Å; D373-Q375 PolarHBondContact O-N 2.96Å; D373-Q375 WeakPolarHBondContact OD1-CB 3.45Å; D373-Q375 PolarHBondContact OD1-N 2.66Å; D373-I376 HydrophobicContact CB-CB 4.28Å; D373-I376 HydrophobicContact CB-CD1 3.69Å; D373-I376 HydrophobicContact CB-CG1 3.83Å; D373-I376 PolarHBondContact O-N 3.43Å; D373-K377 PolarHBondContact O-N 2.93Å
374	R	92.9	Very high	92.4	Very high	177 Å²	177	76.4 Å²	76.4	67%	0.668	36%	0.357	S	S	*	.	H	α-helix	trans	-62.4	-37.1	177.4	-167	-176.6	76.6	-165.1	-4	111.8	N372 I376 K377 E378	N372-R374 PolarHBondContact O-N 3.44Å; R374-I376 VanDerWaalsContact C-N 3.33Å; R374-I376 PolarHBondContact O-N 3.16Å; R374-K377 PolarHBondContact O-N 3.39Å; R374-E378 WeakPolarHBondContact CD-OE1 3.28Å; R374-E378 HydrophobicContact CG-CG 4.28Å; R374-E378 VanDerWaalsContact CG-OE1 3.28Å; R374-E378 WeakPolarHBondContact CG-OE1 3.5Å; R374-E378 IonicContact CZ-OE1 3.86Å; R374-E378 IonicContact NE-OE1 3.67Å; R374-E378 PolarHBondContact NE-OE1 3.43Å; R374-E378 WeakPolarHBondContact O-CB 3.45Å; R374-E378 WeakPolarHBondContact O-CG 3.23Å; R374-E378 PolarHBondContact O-N 2.88Å
375	Q	92.6	Very high	92.2	Very high	116 Å²	116	80.5 Å²	80.5	54%	0.542	37%	0.369	S	S	.	.	H	α-helix	trans	-65.9	-37.3	-178.2	-66.1	-179.7	-34.4	0	0	111.4	D373 G379	D373-Q375 VanDerWaalsContact C-N 3.3Å; D373-Q375 PolarHBondContact O-N 2.96Å; D373-Q375 WeakPolarHBondContact OD1-CB 3.45Å; D373-Q375 PolarHBondContact OD1-N 2.66Å; Q375-G379 PolarHBondContact O-N 3.34Å
376	I	94.4	Very high	92	Very high	1 Å²	1	80.9 Å²	80.9	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-66.8	-43.4	176.6	-60	176.2	0	0	0	110.3	V340 K344 Y363 A366 R367 D373 R374 G379 L380	V340-I376 HydrophobicContact CG1-CD1 3.82Å; K344-I376 HydrophobicContact CD-CD1 4.34Å; K344-I376 HydrophobicContact CD-CG1 3.89Å; K344-I376 HydrophobicContact CG-CG1 4.08Å; Y363-I376 HydrophobicContact CD1-CG2 4.23Å; Y363-I376 VanDerWaalsContact O-CG2 3.29Å; Y363-I376 WeakPolarHBondContact O-CG2 3.41Å; A366-I376 HydrophobicContact CB-CD1 3.79Å; A366-I376 HydrophobicContact CB-CG1 4.33Å; A366-I376 HydrophobicContact CB-CG2 4.38Å; R367-I376 HydrophobicContact CB-CG2 3.91Å; D373-I376 HydrophobicContact CB-CB 4.28Å; D373-I376 HydrophobicContact CB-CD1 3.69Å; D373-I376 HydrophobicContact CB-CG1 3.83Å; D373-I376 PolarHBondContact O-N 3.43Å; R374-I376 VanDerWaalsContact C-N 3.33Å; R374-I376 PolarHBondContact O-N 3.16Å; I376-G379 PolarHBondContact O-N 3.08Å; I376-L380 VanDerWaalsContact O-CB 3.26Å; I376-L380 WeakPolarHBondContact O-CB 3.43Å; I376-L380 PolarHBondContact O-N 3.29Å
377	K	94.1	Very high	91.8	Very high	85 Å²	85	82.4 Å²	82.4	37%	0.37	38%	0.377	S	S	.	.	H	α-helix	trans	-62.5	-49.7	177.7	-67.8	175.7	-176.7	174.5	0	111.4	E371 N372 D373 R374 G379 L380 E381	E371-K377 PolarHBondContact O-NZ 2.95Å; N372-K377 PolarHBondContact OD1-NZ 3.41Å; D373-K377 PolarHBondContact O-N 2.93Å; R374-K377 PolarHBondContact O-N 3.39Å; K377-G379 PolarHBondContact O-N 3.01Å; K377-L380 PolarHBondContact O-N 2.85Å; K377-E381 WeakPolarHBondContact O-CG 3.44Å; K377-E381 PolarHBondContact O-N 3.3Å
378	E	94.6	Very high	91.5	Very high	99 Å²	99	83.6 Å²	83.6	46%	0.463	39%	0.385	S	S	.	.	H	α-helix	trans	-61.8	-41.7	177.4	-71.9	172	-175.5	0	0	111.9	R374 K382	R374-E378 WeakPolarHBondContact CD-OE1 3.28Å; R374-E378 HydrophobicContact CG-CG 4.28Å; R374-E378 VanDerWaalsContact CG-OE1 3.28Å; R374-E378 WeakPolarHBondContact CG-OE1 3.5Å; R374-E378 IonicContact CZ-OE1 3.86Å; R374-E378 IonicContact NE-OE1 3.67Å; R374-E378 PolarHBondContact NE-OE1 3.43Å; R374-E378 WeakPolarHBondContact O-CB 3.45Å; R374-E378 WeakPolarHBondContact O-CG 3.23Å; R374-E378 PolarHBondContact O-N 2.88Å; E378-K382 VanDerWaalsContact O-CB 3.3Å; E378-K382 WeakPolarHBondContact O-CB 3.22Å; E378-K382 PolarHBondContact O-N 3.49Å
379	G	94.2	Very high	91	Very high	7 Å²	7	83.3 Å²	83.3	7%	0.072	38%	0.384	C	S	.	.	H	α-helix	trans	-63.2	-45.8	176.4	0	0	0	0	0	112.8	Y363 Q375 I376 K377 K382 A383	Y363-G379 VanDerWaalsContact CE2-C 3.48Å; Q375-G379 PolarHBondContact O-N 3.34Å; I376-G379 PolarHBondContact O-N 3.08Å; K377-G379 PolarHBondContact O-N 3.01Å; G379-K382 WeakPolarHBondContact O-CB 3.48Å; G379-K382 PolarHBondContact O-N 3.18Å; G379-A383 WeakPolarHBondContact O-CB 3.3Å; G379-A383 PolarHBondContact O-N 2.88Å
380	L	95.4	Very high	90.7	Very high	10 Å²	10	82.6 Å²	82.6	5%	0.052	39%	0.388	C	S	.	.	H	α-helix	trans	-62.9	-46.4	177.2	-175.3	66.7	0	0	0	111.7	I360 E364 R367 I376 K377 K382 A383 Q384	I360-L380 HydrophobicContact CB-CD1 4.35Å; I360-L380 HydrophobicContact CG1-CD1 4.44Å; I360-L380 HydrophobicContact CG2-CD1 3.85Å; E364-L380 HydrophobicContact CG-CD1 4.01Å; R367-L380 VanDerWaalsContact NH1-CD2 3.34Å; I376-L380 VanDerWaalsContact O-CB 3.26Å; I376-L380 WeakPolarHBondContact O-CB 3.43Å; I376-L380 PolarHBondContact O-N 3.29Å; K377-L380 PolarHBondContact O-N 2.85Å; L380-K382 VanDerWaalsContact C-N 3.31Å; L380-K382 PolarHBondContact O-N 3Å; L380-A383 PolarHBondContact O-N 2.94Å; L380-Q384 WeakPolarHBondContact O-CB 3.41Å; L380-Q384 VanDerWaalsContact O-CG 3.31Å; L380-Q384 WeakPolarHBondContact O-CG 3.48Å; L380-Q384 PolarHBondContact O-N 3.19Å
381	E	94.8	Very high	90.3	Very high	114 Å²	114	86.1 Å²	86.1	53%	0.533	40%	0.4	S	S	.	.	H	α-helix	trans	-61.6	-40.3	176	-74.2	179.2	-168.7	0	0	111.9	K377 R385	K377-E381 WeakPolarHBondContact O-CG 3.44Å; K377-E381 PolarHBondContact O-N 3.3Å; E381-R385 VanDerWaalsContact O-CB 3.28Å; E381-R385 WeakPolarHBondContact O-CB 3.23Å; E381-R385 PolarHBondContact O-N 2.97Å
382	K	94.8	Very high	90.4	Very high	110 Å²	110	84.4 Å²	84.4	48%	0.478	39%	0.391	S	S	.	.	H	α-helix	trans	-62.5	-47.7	174.7	-179.9	-174.9	174.1	-168.8	0	110.9	L351 E378 G379 L380 R385 L386	L351-K382 HydrophobicContact CD1-CD 4.19Å; E378-K382 VanDerWaalsContact O-CB 3.3Å; E378-K382 WeakPolarHBondContact O-CB 3.22Å; E378-K382 PolarHBondContact O-N 3.49Å; G379-K382 WeakPolarHBondContact O-CB 3.48Å; G379-K382 PolarHBondContact O-N 3.18Å; L380-K382 VanDerWaalsContact C-N 3.31Å; L380-K382 PolarHBondContact O-N 3Å; K382-R385 PolarHBondContact O-N 3.39Å; K382-L386 HydrophobicContact CG-CD1 4.04Å; K382-L386 WeakPolarHBondContact O-CG 3.32Å; K382-L386 PolarHBondContact O-N 2.92Å
383	A	95.3	Very high	90.1	Very high	0 Å²	0	82.5 Å²	82.5	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-61.6	-46.5	179.7	0	0	0	0	0	111.8	L351 A359 I360 Y363 G379 L380 R385 L386 L387	L351-A383 HydrophobicContact CD2-CB 3.71Å; A359-A383 HydrophobicContact CB-CB 4.42Å; I360-A383 HydrophobicContact CD1-CB 4.49Å; I360-A383 HydrophobicContact CG1-CB 3.62Å; Y363-A383 HydrophobicContact CD2-CB 4.37Å; Y363-A383 HydrophobicContact CE2-CB 4.5Å; G379-A383 WeakPolarHBondContact O-CB 3.3Å; G379-A383 PolarHBondContact O-N 2.88Å; L380-A383 PolarHBondContact O-N 2.94Å; A383-R385 PolarHBondContact O-N 3.38Å; A383-L386 PolarHBondContact O-N 3.26Å; A383-L387 WeakPolarHBondContact O-CB 3.36Å; A383-L387 PolarHBondContact O-N 3.49Å
384	Q	94.1	Very high	89.8	Confident	75 Å²	75	83.6 Å²	83.6	35%	0.35	38%	0.379	S	S	.	.	H	α-helix	trans	-63	-39.4	176.5	-71.9	176.7	-6.4	0	0	112.5	I360 L380 L387 K388	I360-Q384 HydrophobicContact CD1-CG 3.93Å; I360-Q384 HydrophobicContact CG1-CG 4.17Å; L380-Q384 WeakPolarHBondContact O-CB 3.41Å; L380-Q384 VanDerWaalsContact O-CG 3.31Å; L380-Q384 WeakPolarHBondContact O-CG 3.48Å; L380-Q384 PolarHBondContact O-N 3.19Å; Q384-L387 PolarHBondContact O-N 3.42Å; Q384-K388 WeakPolarHBondContact O-CB 3.47Å; Q384-K388 WeakPolarHBondContact O-CG 3.34Å; Q384-K388 PolarHBondContact O-N 3.2Å
385	R	92.4	Very high	89.5	Confident	159 Å²	159	75.2 Å²	75.2	60%	0.6	35%	0.347	S	S	*	.	H	α-helix	trans	-64.4	-44.1	176.1	-171	-172.7	-54.2	150.9	7.4	111.5	E381 K382 A383 K388 Q389	E381-R385 VanDerWaalsContact O-CB 3.28Å; E381-R385 WeakPolarHBondContact O-CB 3.23Å; E381-R385 PolarHBondContact O-N 2.97Å; K382-R385 PolarHBondContact O-N 3.39Å; A383-R385 PolarHBondContact O-N 3.38Å; R385-K388 PolarHBondContact O-N 2.91Å; R385-Q389 WeakPolarHBondContact O-CB 3.41Å; R385-Q389 PolarHBondContact O-N 3.1Å
386	L	90.4	Very high	89.3	Confident	48 Å²	48	69.9 Å²	69.9	25%	0.251	32%	0.322	S	S	.	.	H	α-helix	trans	-66.3	-40.3	177.3	-71.5	169.5	0	0	0	111.6	L351 Y356 K382 A383 Q389 S390	L351-L386 HydrophobicContact CD2-CD1 4.15Å; Y356-L386 HydrophobicContact CD1-CB 3.7Å; Y356-L386 HydrophobicContact CD1-CD1 4.45Å; Y356-L386 HydrophobicContact CE1-CB 3.58Å; Y356-L386 HydrophobicContact CE1-CD1 4.06Å; Y356-L386 HydrophobicContact CE1-CG 4.33Å; Y356-L386 HydrophobicContact CG-CB 4.39Å; K382-L386 HydrophobicContact CG-CD1 4.04Å; K382-L386 WeakPolarHBondContact O-CG 3.32Å; K382-L386 PolarHBondContact O-N 2.92Å; A383-L386 PolarHBondContact O-N 3.26Å; L386-Q389 PolarHBondContact O-N 3.46Å; L386-S390 WeakPolarHBondContact O-CB 3.26Å; L386-S390 PolarHBondContact O-N 2.92Å
387	L	91.1	Very high	89	Confident	31 Å²	31	78 Å²	78	16%	0.162	36%	0.357	C	S	.	.	H	α-helix	trans	-58.1	-51.4	172.7	-179.1	64.9	0	0	0	110.9	E357 I360 A383 Q384 Q389 S390 Q391	E357-L387 HydrophobicContact CG-CD1 4Å; E357-L387 HydrophobicContact CG-CD2 4.45Å; I360-L387 HydrophobicContact CD1-CB 4.17Å; I360-L387 HydrophobicContact CD1-CD2 3.59Å; I360-L387 HydrophobicContact CD1-CG 4.5Å; A383-L387 WeakPolarHBondContact O-CB 3.36Å; A383-L387 PolarHBondContact O-N 3.49Å; Q384-L387 PolarHBondContact O-N 3.42Å; L387-Q389 VanDerWaalsContact C-N 3.29Å; L387-Q389 PolarHBondContact O-N 3.07Å; L387-S390 PolarHBondContact O-N 3.25Å; L387-S390 VanDerWaalsContact O-N 3.09Å; L387-S390 PolarHBondContact O-OG 3.47Å; L387-Q391 HydrophobicContact CD1-CG 4.35Å; L387-Q391 WeakPolarHBondContact O-CG 3.32Å; L387-Q391 PolarHBondContact O-N 3.08Å
388	K	86.7	Confident	88.7	Confident	133 Å²	133	75.9 Å²	75.9	58%	0.578	35%	0.35	S	S	*	.	H	α-helix	trans	-58.6	-40.2	176.5	-73.8	-179.8	178.6	-170.2	0	112.3	Q384 R385 Q391 K392	Q384-K388 WeakPolarHBondContact O-CB 3.47Å; Q384-K388 WeakPolarHBondContact O-CG 3.34Å; Q384-K388 PolarHBondContact O-N 3.2Å; R385-K388 PolarHBondContact O-N 2.91Å; K388-Q391 PolarHBondContact O-N 3.24Å; K388-K392 PolarHBondContact O-N 3.14Å
389	Q	82.7	Confident	88.4	Confident	135 Å²	135	71.4 Å²	71.4	63%	0.631	33%	0.329	S	S	*	.	H	α-helix	trans	-66.1	-38	176.4	-174.1	175.2	1	0	0	112.2	R385 L386 L387 K392	R385-Q389 WeakPolarHBondContact O-CB 3.41Å; R385-Q389 PolarHBondContact O-N 3.1Å; L386-Q389 PolarHBondContact O-N 3.46Å; L387-Q389 VanDerWaalsContact C-N 3.29Å; L387-Q389 PolarHBondContact O-N 3.07Å; Q389-K392 PolarHBondContact O-N 3.15Å
390	S	83.5	Confident	88.1	Confident	67 Å²	67	74 Å²	74	47%	0.469	36%	0.356	S	S	.	.	H	α-helix	trans	-69.4	-33.5	177.3	77.8	0	0	0	0	112.6	L386 L387	L386-S390 WeakPolarHBondContact O-CB 3.26Å; L386-S390 PolarHBondContact O-N 2.92Å; L387-S390 PolarHBondContact O-N 3.25Å; L387-S390 VanDerWaalsContact O-N 3.09Å; L387-S390 PolarHBondContact O-OG 3.47Å
391	Q	79.6	Confident	87.9	Confident	112 Å²	112	75.1 Å²	75.1	52%	0.523	36%	0.362	S	S	.	.	H	α-helix	trans	-79.4	-22.9	177.6	-69.3	175.3	-8.8	0	0	112.5	L387 K388 R393	L387-Q391 HydrophobicContact CD1-CG 4.35Å; L387-Q391 WeakPolarHBondContact O-CG 3.32Å; L387-Q391 PolarHBondContact O-N 3.08Å; K388-Q391 PolarHBondContact O-N 3.24Å; Q391-R393 PolarHBondContact O-N 3.4Å; Q391-R393 VanDerWaalsContact O-N 3.14Å
392	K	78.8	Confident	87.6	Confident	119 Å²	119	77.7 Å²	77.7	52%	0.517	37%	0.371	S	S	.	.			trans	-63.9	114.6	178.8	-171.3	167.9	-172	159	0	110.7	K388 Q389 G461	K388-K392 PolarHBondContact O-N 3.14Å; Q389-K392 PolarHBondContact O-N 3.15Å; K392-G461 PolarHBondContact NZ-O 3.26Å
393	R	78.4	Confident	87.2	Confident	97 Å²	97	79.6 Å²	79.6	37%	0.366	38%	0.375	S	S	.	.			trans	-79.5	127.2	180	-65.6	174.1	174.7	-165.8	-12.8	110	Q391 Y395 I398 D441 F458	Q391-R393 PolarHBondContact O-N 3.4Å; Q391-R393 VanDerWaalsContact O-N 3.14Å; R393-Y395 HydrophobicContact CB-CE1 4.07Å; R393-I398 HydrophobicContact CB-CD1 4.41Å; R393-D441 IonicContact CZ-OD1 2.75Å; R393-D441 IonicContact NH1-OD1 3.89Å; R393-D441 IonicContact NH2-OD1 3.4Å; R393-F458 WeakPolarHBondContact O-CE2 3.24Å; R393-F458 WeakPolarHBondContact O-CZ 3.23Å
394	D	84.7	Confident	86.8	Confident	61 Å²	61	85.5 Å²	85.5	33%	0.326	41%	0.411	S	S	.	.			trans	-98.1	94.1	170.3	-173.7	-17.3	0	0	0	110	Y396 K397 I398	D394-Y396 PolarHBondContact O-N 2.88Å; D394-Y396 WeakPolarHBondContact OD1-CB 3.36Å; D394-Y396 PolarHBondContact OD1-N 3.41Å; D394-K397 HydrophobicContact CB-CB 3.77Å; D394-K397 PolarHBondContact O-N 3.21Å; D394-K397 VanDerWaalsContact O-N 3.1Å; D394-K397 PolarHBondContact OD1-N 2.77Å; D394-K397 VanDerWaalsContact OD1-N 3.09Å; D394-I398 WeakPolarHBondContact O-CG1 3.36Å; D394-I398 PolarHBondContact O-N 3.08Å
395	Y	87.6	Confident	86.6	Confident	0 Å²	0	82.1 Å²	82.1	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-59.1	-32.4	-179	-59	-59.8	0	0	0	113.4	R393 I398 L399 Q444 A445 V448 F458 D463 M465	R393-Y395 HydrophobicContact CB-CE1 4.07Å; Y395-I398 HydrophobicContact CD1-CD1 4.12Å; Y395-L399 PolarHBondContact O-N 3.45Å; Y395-L399 VanDerWaalsContact O-N 3.17Å; Y395-Q444 HydrophobicContact CE1-CB 4.5Å; Y395-A445 VanDerWaalsContact CD1-CA 3.48Å; Y395-A445 HydrophobicContact CD1-CB 3.75Å; Y395-A445 HydrophobicContact CG-CB 4.24Å; Y395-V448 HydrophobicContact CD2-CB 4.09Å; Y395-V448 HydrophobicContact CD2-CG1 3.72Å; Y395-V448 HydrophobicContact CD2-CG2 4.39Å; Y395-V448 HydrophobicContact CE1-CG2 4.47Å; Y395-V448 HydrophobicContact CE2-CB 4.21Å; Y395-V448 HydrophobicContact CE2-CG1 3.89Å; Y395-V448 HydrophobicContact CE2-CG2 4.02Å; Y395-V448 HydrophobicContact CG-CB 4.44Å; Y395-V448 HydrophobicContact CG-CG1 4.46Å; Y395-F458 HydrophobicContact CD2-CD1 4.03Å; Y395-F458 AromaticContact CD2-CD2 3.52Å; Y395-F458 HydrophobicContact CD2-CD2 3.52Å; Y395-F458 AromaticContact CD2-CE1 3.84Å; Y395-F458 HydrophobicContact CD2-CE1 3.84Å; Y395-F458 AromaticContact CD2-CE2 3.32Å; Y395-F458 HydrophobicContact CD2-CE2 3.32Å; Y395-F458 AromaticContact CD2-CG 3.87Å; Y395-F458 HydrophobicContact CD2-CG 3.87Å; Y395-F458 AromaticContact CD2-CZ 3.5Å; Y395-F458 HydrophobicContact CD2-CZ 3.5Å; Y395-F458 VanDerWaalsContact CD2-CZ 3.5Å; Y395-F458 AromaticContact CE2-CD2 3.57Å; Y395-F458 HydrophobicContact CE2-CD2 3.57Å; Y395-F458 AromaticContact CE2-CE2 3.49Å; Y395-F458 HydrophobicContact CE2-CE2 3.49Å; Y395-F458 VanDerWaalsContact CE2-CE2 3.49Å; Y395-F458 HydrophobicContact CE2-CG 4.27Å; Y395-F458 HydrophobicContact CE2-CZ 4.15Å; Y395-F458 HydrophobicContact CG-CE2 4.43Å; Y395-F458 HydrophobicContact CG-CZ 4.28Å; Y395-D463 VanDerWaalsContact CE2-OD1 3.3Å; Y395-D463 WeakPolarHBondContact CE2-OD1 3.46Å; Y395-D463 VanDerWaalsContact OH-CG 3.3Å; Y395-D463 PolarHBondContact OH-OD1 3.1Å; Y395-D463 PolarHBondContact OH-OD2 3.4Å; Y395-M465 WeakPolarHBondContact OH-CB 3.45Å
396	Y	87.9	Confident	86.4	Confident	4 Å²	4	81 Å²	81	2%	0.016	40%	0.398	C	S	.	.	H	α-helix	trans	-70.4	-40.4	176.5	-65.1	-77.9	0	0	0	111.1	D394 L399 G400 I401 R403 L449 R455 F458 D459	D394-Y396 PolarHBondContact O-N 2.88Å; D394-Y396 WeakPolarHBondContact OD1-CB 3.36Å; D394-Y396 PolarHBondContact OD1-N 3.41Å; Y396-L399 PolarHBondContact O-N 3.08Å; Y396-G400 PolarHBondContact O-N 3.19Å; Y396-I401 HydrophobicContact CD1-CD1 4.13Å; Y396-I401 HydrophobicContact CD1-CG1 4.15Å; Y396-I401 PolarHBondContact O-N 3.45Å; Y396-R403 HydrophobicContact CD1-CG 4.41Å; Y396-R403 HydrophobicContact CD2-CG 3.78Å; Y396-R403 HydrophobicContact CE1-CB 4.45Å; Y396-R403 HydrophobicContact CE2-CB 4.45Å; Y396-R403 HydrophobicContact CE2-CG 3.91Å; Y396-R403 HydrophobicContact CG-CG 4.04Å; Y396-L449 HydrophobicContact CD1-CD1 3.84Å; Y396-L449 HydrophobicContact CD1-CD2 4.14Å; Y396-L449 HydrophobicContact CD2-CD2 4.23Å; Y396-L449 HydrophobicContact CE1-CD1 4.04Å; Y396-L449 HydrophobicContact CE1-CD2 3.65Å; Y396-L449 HydrophobicContact CE1-CG 4.44Å; Y396-L449 HydrophobicContact CE2-CD2 3.77Å; Y396-L449 HydrophobicContact CG-CD1 4.26Å; Y396-L449 HydrophobicContact CG-CD2 4.4Å; Y396-L449 VanDerWaalsContact CZ-CD2 3.46Å; Y396-R455 PolarHBondContact OH-NE 2.83Å; Y396-F458 HydrophobicContact CD2-CD1 4.25Å; Y396-F458 AromaticContact CD2-CE1 3.66Å; Y396-F458 HydrophobicContact CD2-CE1 3.66Å; Y396-F458 AromaticContact CE2-CD1 3.73Å; Y396-F458 HydrophobicContact CE2-CD1 3.73Å; Y396-F458 AromaticContact CE2-CE1 3.62Å; Y396-F458 HydrophobicContact CE2-CE1 3.62Å; Y396-D459 VanDerWaalsContact CE2-OD1 3.22Å; Y396-D459 WeakPolarHBondContact CE2-OD1 3.37Å; Y396-D459 VanDerWaalsContact OH-CG 3.27Å; Y396-D459 PolarHBondContact OH-OD1 3.24Å; Y396-D459 PolarHBondContact OH-OD2 3.45Å; Y396-D459 VanDerWaalsContact OH-OD2 3.1Å
397	K	88.1	Confident	86.4	Confident	172 Å²	172	84.5 Å²	84.5	75%	0.748	41%	0.411	S	S	*	.	H	α-helix	trans	-66.9	-39.4	174.9	-168.7	178.5	-179.7	-176.9	0	111.9	D394 L399 G400	D394-K397 HydrophobicContact CB-CB 3.77Å; D394-K397 PolarHBondContact O-N 3.21Å; D394-K397 VanDerWaalsContact O-N 3.1Å; D394-K397 PolarHBondContact OD1-N 2.77Å; D394-K397 VanDerWaalsContact OD1-N 3.09Å; K397-L399 PolarHBondContact O-N 2.74Å; K397-G400 PolarHBondContact O-N 3.28Å
398	I	87.6	Confident	86.3	Confident	40 Å²	40	91.7 Å²	91.7	21%	0.205	44%	0.441	C	S	.	.	H	α-helix	trans	-57.1	-48.9	175.4	-70.1	162.3	0	0	0	110.3	R393 D394 Y395 G400 Q417 D441 I442 A445	R393-I398 HydrophobicContact CB-CD1 4.41Å; D394-I398 WeakPolarHBondContact O-CG1 3.36Å; D394-I398 PolarHBondContact O-N 3.08Å; Y395-I398 HydrophobicContact CD1-CD1 4.12Å; I398-G400 VanDerWaalsContact C-N 3.35Å; I398-Q417 PolarHBondContact O-NE2 3.46Å; I398-Q417 PolarHBondContact O-OE1 3.39Å; I398-D441 HydrophobicContact CD1-CB 4.22Å; I398-D441 HydrophobicContact CG2-CB 4.26Å; I398-I442 HydrophobicContact CG2-CG1 4.1Å; I398-A445 HydrophobicContact CB-CB 4.29Å; I398-A445 HydrophobicContact CG2-CB 4Å
399	L	87.8	Confident	86.5	Confident	5 Å²	5	90.3 Å²	90.3	3%	0.026	44%	0.437	C	S	.	.	H	α-helix	trans	-81.4	-10	178.8	-69.6	179.6	0	0	0	114.3	Y395 Y396 K397 I401 I410 A413 Q417 I442 A445 L449	Y395-L399 PolarHBondContact O-N 3.45Å; Y395-L399 VanDerWaalsContact O-N 3.17Å; Y396-L399 PolarHBondContact O-N 3.08Å; K397-L399 PolarHBondContact O-N 2.74Å; L399-I401 HydrophobicContact CB-CD1 4.12Å; L399-I401 HydrophobicContact CB-CG1 3.92Å; L399-I401 HydrophobicContact CD1-CD1 4.35Å; L399-I410 HydrophobicContact CD1-CG2 3.93Å; L399-A413 HydrophobicContact CB-CB 4.48Å; L399-Q417 VanDerWaalsContact C-NE2 3.27Å; L399-Q417 PolarHBondContact O-NE2 2.79Å; L399-I442 HydrophobicContact CD2-CG2 3.95Å; L399-A445 HydrophobicContact CD1-CB 3.93Å; L399-A445 HydrophobicContact CD2-CB 4.39Å; L399-A445 HydrophobicContact CG-CB 3.77Å; L399-L449 HydrophobicContact CD1-CD1 4.01Å
400	G	88.4	Confident	86.8	Confident	63 Å²	63	83.9 Å²	83.9	65%	0.649	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	34.9	179.1	0	0	0	0	0	113.7	Y396 K397 I398	Y396-G400 PolarHBondContact O-N 3.19Å; K397-G400 PolarHBondContact O-N 3.28Å; I398-G400 VanDerWaalsContact C-N 3.35Å
401	I	90.8	Very high	87.2	Confident	33 Å²	33	82.5 Å²	82.5	17%	0.169	40%	0.396	C	S	.	.			trans	-121.9	158.4	-174.9	53.6	168.2	0	0	0	111.6	Y396 L399 A405 I410 A413 L449	Y396-I401 HydrophobicContact CD1-CD1 4.13Å; Y396-I401 HydrophobicContact CD1-CG1 4.15Å; Y396-I401 PolarHBondContact O-N 3.45Å; L399-I401 HydrophobicContact CB-CD1 4.12Å; L399-I401 HydrophobicContact CB-CG1 3.92Å; L399-I401 HydrophobicContact CD1-CD1 4.35Å; I401-A405 HydrophobicContact CB-CB 4.13Å; I401-A405 HydrophobicContact CD1-CB 4.15Å; I401-I410 HydrophobicContact CD1-CB 4.22Å; I401-I410 HydrophobicContact CD1-CG1 3.61Å; I401-I410 HydrophobicContact CD1-CG2 4.27Å; I401-A413 HydrophobicContact CG2-CB 3.52Å; I401-L449 HydrophobicContact CD1-CD1 3.98Å
402	K	88.9	Confident	87.8	Confident	167 Å²	167	84.9 Å²	84.9	73%	0.726	40%	0.404	S	S	*	.			trans	-78.6	154.1	175.6	-64	-176.6	180	-178.7	0	110.5	T404 A405	K402-T404 PolarHBondContact O-N 3.02Å; K402-T404 VanDerWaalsContact O-N 3.13Å; K402-A405 WeakPolarHBondContact O-CB 3.41Å; K402-A405 PolarHBondContact O-N 3.12Å
403	R	86.1	Confident	88.4	Confident	151 Å²	151	80 Å²	80	57%	0.57	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.7	175.3	-66.1	-167.5	175.9	-157.8	-1.4	113.9	Y396 A405 R455	Y396-R403 HydrophobicContact CD1-CG 4.41Å; Y396-R403 HydrophobicContact CD2-CG 3.78Å; Y396-R403 HydrophobicContact CE1-CB 4.45Å; Y396-R403 HydrophobicContact CE2-CB 4.45Å; Y396-R403 HydrophobicContact CE2-CG 3.91Å; Y396-R403 HydrophobicContact CG-CG 4.04Å; R403-A405 VanDerWaalsContact C-N 3.26Å; R403-A405 PolarHBondContact O-N 2.96Å; R403-R455 PolarHBondContact O-NH2 2.82Å
404	T	88.3	Confident	89.1	Confident	123 Å²	123	78 Å²	78	76%	0.755	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	0.3	176.1	56.5	0	0	0	0	114.1	K402	K402-T404 PolarHBondContact O-N 3.02Å; K402-T404 VanDerWaalsContact O-N 3.13Å
405	A	88	Confident	89.4	Confident	5 Å²	5	83.5 Å²	83.5	4%	0.041	40%	0.395	C	S	.	.			trans	-62.9	138.2	-174.7	0	0	0	0	0	112.4	I401 K402 R403 E409 I410 R455	I401-A405 HydrophobicContact CB-CB 4.13Å; I401-A405 HydrophobicContact CD1-CB 4.15Å; K402-A405 WeakPolarHBondContact O-CB 3.41Å; K402-A405 PolarHBondContact O-N 3.12Å; R403-A405 VanDerWaalsContact C-N 3.26Å; R403-A405 PolarHBondContact O-N 2.96Å; A405-E409 VanDerWaalsContact CA-OE2 3.27Å; A405-E409 WeakPolarHBondContact CA-OE2 3.42Å; A405-E409 HydrophobicContact CB-CB 4.35Å; A405-I410 HydrophobicContact CB-CG1 4.27Å; A405-R455 PolarHBondContact O-NH1 3.13Å; A405-R455 PolarHBondContact O-NH2 2.91Å
406	Q	89.3	Confident	89.6	Confident	135 Å²	135	90.8 Å²	90.8	63%	0.631	43%	0.427	S	S	*	.			trans	-80.6	157.4	177.7	-64.4	-171.3	5.3	0	0	111.3	K408 E409 I410	Q406-K408 PolarHBondContact O-N 3.34Å; Q406-E409 PolarHBondContact N-OE2 3.04Å; Q406-E409 WeakPolarHBondContact O-CA 3.46Å; Q406-E409 WeakPolarHBondContact O-CB 3.35Å; Q406-E409 PolarHBondContact O-N 3.49Å; Q406-I410 WeakPolarHBondContact O-CG1 3.47Å; Q406-I410 PolarHBondContact O-N 3.06Å; Q406-I410 VanDerWaalsContact O-N 3.1Å
407	K	89.3	Confident	89.8	Confident	122 Å²	122	92.4 Å²	92.4	53%	0.53	44%	0.435	S	S	.	.	H	α-helix	trans	-50.3	-37.7	-179.1	-171.2	168.9	178.6	154.2	0	113.6	I410 V411 T450	K407-I410 PolarHBondContact O-N 3.32Å; K407-V411 WeakPolarHBondContact O-CG2 3.39Å; K407-V411 PolarHBondContact O-N 2.7Å; K407-V411 VanDerWaalsContact O-N 3.11Å; K407-T450 WeakPolarHBondContact CE-O 3.46Å; K407-T450 HydrophobicContact CG-CG2 4.37Å; K407-T450 PolarHBondContact NZ-O 2.84Å
408	K	89.7	Confident	89.9	Confident	182 Å²	182	84.8 Å²	84.8	79%	0.791	40%	0.403	S	S	*	.	H	α-helix	trans	-64.3	-38.2	176.5	-69.4	-177.5	178.4	177.9	0	112.8	Q406 K412	Q406-K408 PolarHBondContact O-N 3.34Å; K408-K412 WeakPolarHBondContact O-CB 3.41Å; K408-K412 PolarHBondContact O-N 2.72Å; K408-K412 VanDerWaalsContact O-N 3.08Å
409	E	90.3	Very high	90.1	Very high	104 Å²	104	90.1 Å²	90.1	49%	0.486	43%	0.428	S	S	.	.	H	α-helix	trans	-71.9	-38.3	179	-61.3	176.3	154.7	0	0	111.3	A405 Q406 K412 A413	A405-E409 VanDerWaalsContact CA-OE2 3.27Å; A405-E409 WeakPolarHBondContact CA-OE2 3.42Å; A405-E409 HydrophobicContact CB-CB 4.35Å; Q406-E409 PolarHBondContact N-OE2 3.04Å; Q406-E409 WeakPolarHBondContact O-CA 3.46Å; Q406-E409 WeakPolarHBondContact O-CB 3.35Å; Q406-E409 PolarHBondContact O-N 3.49Å; E409-K412 PolarHBondContact O-N 3.43Å; E409-A413 WeakPolarHBondContact O-CB 3.47Å; E409-A413 PolarHBondContact O-N 2.94Å
410	I	90.6	Very high	90.2	Very high	0 Å²	0	95.2 Å²	95.2	0%	0	45%	0.451	C	S	.	.	H	α-helix	trans	-60.7	-48.9	175.2	-58.4	166.4	0	0	0	110.3	L399 I401 A405 Q406 K407 K412 A413 Y414 L449 T450	L399-I410 HydrophobicContact CD1-CG2 3.93Å; I401-I410 HydrophobicContact CD1-CB 4.22Å; I401-I410 HydrophobicContact CD1-CG1 3.61Å; I401-I410 HydrophobicContact CD1-CG2 4.27Å; A405-I410 HydrophobicContact CB-CG1 4.27Å; Q406-I410 WeakPolarHBondContact O-CG1 3.47Å; Q406-I410 PolarHBondContact O-N 3.06Å; Q406-I410 VanDerWaalsContact O-N 3.1Å; K407-I410 PolarHBondContact O-N 3.32Å; I410-K412 VanDerWaalsContact C-N 3.3Å; I410-K412 PolarHBondContact O-N 3.11Å; I410-A413 PolarHBondContact O-N 3.48Å; I410-Y414 WeakPolarHBondContact O-CB 3.31Å; I410-Y414 PolarHBondContact O-N 3.13Å; I410-L449 HydrophobicContact CD1-CB 4.12Å; I410-L449 WeakPolarHBondContact CD1-O 3.47Å; I410-L449 HydrophobicContact CG2-CB 3.9Å; I410-T450 HydrophobicContact CB-CG2 4.4Å; I410-T450 HydrophobicContact CG2-CG2 3.81Å
411	V	91.1	Very high	90.3	Very high	38 Å²	38	95 Å²	95	23%	0.23	43%	0.431	C	S	.	.	H	α-helix	trans	-64.1	-36.6	177.9	174.6	0	0	0	0	111.5	K407 R415 T450	K407-V411 WeakPolarHBondContact O-CG2 3.39Å; K407-V411 PolarHBondContact O-N 2.7Å; K407-V411 VanDerWaalsContact O-N 3.11Å; V411-R415 WeakPolarHBondContact O-CG 3.47Å; V411-R415 PolarHBondContact O-N 2.93Å; V411-T450 HydrophobicContact CG2-CG2 4Å
412	K	92.4	Very high	90.3	Very high	161 Å²	161	96.7 Å²	96.7	70%	0.7	44%	0.438	S	S	*	.	H	α-helix	trans	-66.4	-44.5	176.1	-172.4	-179.8	-179.5	-178.7	0	111.8	K408 E409 I410 R415 K416	K408-K412 WeakPolarHBondContact O-CB 3.41Å; K408-K412 PolarHBondContact O-N 2.72Å; K408-K412 VanDerWaalsContact O-N 3.08Å; E409-K412 PolarHBondContact O-N 3.43Å; I410-K412 VanDerWaalsContact C-N 3.3Å; I410-K412 PolarHBondContact O-N 3.11Å; K412-R415 PolarHBondContact O-N 3.02Å; K412-K416 PolarHBondContact O-N 3.34Å
413	A	90.6	Very high	90.3	Very high	17 Å²	17	89.2 Å²	89.2	14%	0.14	41%	0.406	C	S	.	.	H	α-helix	trans	-64	-44	176.7	0	0	0	0	0	111.5	L399 I401 E409 I410 R415 K416 Q417	L399-A413 HydrophobicContact CB-CB 4.48Å; I401-A413 HydrophobicContact CG2-CB 3.52Å; E409-A413 WeakPolarHBondContact O-CB 3.47Å; E409-A413 PolarHBondContact O-N 2.94Å; I410-A413 PolarHBondContact O-N 3.48Å; A413-R415 PolarHBondContact O-N 3.1Å; A413-K416 PolarHBondContact O-N 3.31Å; A413-Q417 WeakPolarHBondContact O-CB 3.38Å; A413-Q417 WeakPolarHBondContact O-CG 3.46Å; A413-Q417 PolarHBondContact O-N 3.41Å
414	Y	93.3	Very high	90.3	Very high	55 Å²	55	88 Å²	88	22%	0.216	41%	0.411	C	S	.	.	H	α-helix	trans	-54.8	-52.1	172.6	165.1	-100.8	0	0	0	111.9	I410 K416 Q417 A418 I442 V443 K446	I410-Y414 WeakPolarHBondContact O-CB 3.31Å; I410-Y414 PolarHBondContact O-N 3.13Å; Y414-K416 VanDerWaalsContact C-N 3.27Å; Y414-K416 PolarHBondContact O-N 3.1Å; Y414-Q417 PolarHBondContact O-N 3.49Å; Y414-A418 HydrophobicContact CD2-CB 4.37Å; Y414-A418 HydrophobicContact CE1-CB 4.45Å; Y414-A418 HydrophobicContact CE2-CB 3.98Å; Y414-A418 WeakPolarHBondContact O-CB 3.46Å; Y414-A418 PolarHBondContact O-N 3.48Å; Y414-I442 HydrophobicContact CD2-CG2 3.64Å; Y414-I442 HydrophobicContact CE2-CG2 3.98Å; Y414-V443 HydrophobicContact CE2-CG2 4.13Å; Y414-K446 HydrophobicContact CD1-CG 4.11Å; Y414-K446 HydrophobicContact CD2-CB 3.48Å; Y414-K446 VanDerWaalsContact CD2-CB 3.48Å; Y414-K446 HydrophobicContact CD2-CD 4.45Å; Y414-K446 HydrophobicContact CD2-CG 3.84Å; Y414-K446 HydrophobicContact CE2-CB 4.09Å; Y414-K446 HydrophobicContact CE2-CD 4.48Å; Y414-K446 HydrophobicContact CE2-CG 4.35Å; Y414-K446 HydrophobicContact CG-CB 3.8Å; Y414-K446 HydrophobicContact CG-CD 4.5Å; Y414-K446 HydrophobicContact CG-CG 3.71Å
415	R	91.5	Very high	90.3	Very high	176 Å²	176	86.6 Å²	86.6	66%	0.664	40%	0.399	S	S	*	.	H	α-helix	trans	-57.7	-41.9	-179.2	-74.5	176.8	-172.6	179.1	1.4	112	V411 K412 A413 Q419	V411-R415 WeakPolarHBondContact O-CG 3.47Å; V411-R415 PolarHBondContact O-N 2.93Å; K412-R415 PolarHBondContact O-N 3.02Å; A413-R415 PolarHBondContact O-N 3.1Å; R415-Q419 VanDerWaalsContact O-CB 3.31Å; R415-Q419 WeakPolarHBondContact O-CB 3.32Å; R415-Q419 PolarHBondContact O-N 3.14Å
416	K	92.7	Very high	90.3	Very high	153 Å²	153	88.6 Å²	88.6	67%	0.665	41%	0.407	S	S	*	.	H	α-helix	trans	-64.4	-47.7	177.9	-174.2	-178.8	177.4	-174.9	0	111.6	K412 A413 Y414 Q420	K412-K416 PolarHBondContact O-N 3.34Å; A413-K416 PolarHBondContact O-N 3.31Å; Y414-K416 VanDerWaalsContact C-N 3.27Å; Y414-K416 PolarHBondContact O-N 3.1Å; K416-Q420 WeakPolarHBondContact O-CB 3.49Å; K416-Q420 PolarHBondContact O-N 3.29Å; K416-Q420 VanDerWaalsContact O-N 3.14Å
417	Q	90.8	Very high	90	Very high	39 Å²	39	91.5 Å²	91.5	18%	0.182	42%	0.421	C	S	.	.	H	α-helix	trans	-70.2	-41.5	-179	-72.8	-126	19.5	0	0	112.7	I398 L399 A413 Y414 Q419 Q420 W421 I442	I398-Q417 PolarHBondContact O-NE2 3.46Å; I398-Q417 PolarHBondContact O-OE1 3.39Å; L399-Q417 VanDerWaalsContact C-NE2 3.27Å; L399-Q417 PolarHBondContact O-NE2 2.79Å; A413-Q417 WeakPolarHBondContact O-CB 3.38Å; A413-Q417 WeakPolarHBondContact O-CG 3.46Å; A413-Q417 PolarHBondContact O-N 3.41Å; Y414-Q417 PolarHBondContact O-N 3.49Å; Q417-Q419 VanDerWaalsContact C-N 3.35Å; Q417-Q419 PolarHBondContact O-N 3.12Å; Q417-Q420 PolarHBondContact O-N 3.3Å; Q417-W421 PolarHBondContact O-N 2.89Å; Q417-I442 HydrophobicContact CB-CD1 3.94Å; Q417-I442 HydrophobicContact CB-CG1 4.22Å; Q417-I442 HydrophobicContact CB-CG2 4.06Å
418	A	90.8	Very high	90.1	Very high	11 Å²	11	89.3 Å²	89.3	9%	0.091	41%	0.414	C	S	.	.	H	α-helix	trans	-63.4	-39.6	176.4	0	0	0	0	0	111.7	Y414 Q420 H422 F439 I442	Y414-A418 HydrophobicContact CD2-CB 4.37Å; Y414-A418 HydrophobicContact CE1-CB 4.45Å; Y414-A418 HydrophobicContact CE2-CB 3.98Å; Y414-A418 WeakPolarHBondContact O-CB 3.46Å; Y414-A418 PolarHBondContact O-N 3.48Å; A418-Q420 VanDerWaalsContact C-N 3.35Å; A418-H422 WeakPolarHBondContact O-CB 3.45Å; A418-H422 PolarHBondContact O-N 3.47Å; A418-H422 VanDerWaalsContact O-N 3.12Å; A418-F439 HydrophobicContact CB-CE2 3.83Å; A418-F439 WeakPolarHBondContact O-CE2 3.31Å; A418-I442 HydrophobicContact CB-CG2 4.41Å
419	Q	91.3	Very high	89.9	Confident	153 Å²	153	85.6 Å²	85.6	72%	0.715	41%	0.409	S	S	*	.	H	α-helix	trans	-66.5	-37.2	174.1	-174.2	178.3	8.5	0	0	112	R415 Q417 N425	R415-Q419 VanDerWaalsContact O-CB 3.31Å; R415-Q419 WeakPolarHBondContact O-CB 3.32Å; R415-Q419 PolarHBondContact O-N 3.14Å; Q417-Q419 VanDerWaalsContact C-N 3.35Å; Q417-Q419 PolarHBondContact O-N 3.12Å; Q419-N425 PolarHBondContact O-ND2 2.96Å
420	Q	89.7	Confident	89.6	Confident	111 Å²	111	85 Å²	85	52%	0.519	41%	0.412	S	S	.	.	H	α-helix	trans	-71.9	-45	-179.7	-176.7	175.8	4.4	0	0	112.2	K416 Q417 A418 N425	K416-Q420 WeakPolarHBondContact O-CB 3.49Å; K416-Q420 PolarHBondContact O-N 3.29Å; K416-Q420 VanDerWaalsContact O-N 3.14Å; Q417-Q420 PolarHBondContact O-N 3.3Å; A418-Q420 VanDerWaalsContact C-N 3.35Å; Q420-N425 PolarHBondContact O-ND2 3.45Å; Q420-N425 VanDerWaalsContact O-ND2 3.16Å
421	W	90.5	Very high	89.3	Confident	60 Å²	60	89.9 Å²	89.9	23%	0.227	44%	0.435	C	S	.	.	S	Bend	trans	-98.3	16.9	-174	-67.9	101.9	0	0	0	113.7	Q417 F426 A435 K438 I442	Q417-W421 PolarHBondContact O-N 2.89Å; W421-F426 HydrophobicContact CE3-CE2 4.34Å; W421-F426 AromaticContact CE3-CZ 3.91Å; W421-F426 HydrophobicContact CE3-CZ 3.91Å; W421-F426 HydrophobicContact CZ3-CZ 4.1Å; W421-A435 HydrophobicContact CE3-CB 4.25Å; W421-K438 HydrophobicContact CD2-CB 4.33Å; W421-K438 HydrophobicContact CD2-CD 3.8Å; W421-K438 HydrophobicContact CE3-CB 4.31Å; W421-K438 HydrophobicContact CE3-CD 3.61Å; W421-K438 HydrophobicContact CG-CB 4.49Å; W421-K438 HydrophobicContact CH2-CD 3.73Å; W421-K438 HydrophobicContact CZ2-CD 3.87Å; W421-K438 VanDerWaalsContact CZ2-NZ 3.33Å; W421-K438 HydrophobicContact CZ3-CD 3.58Å; W421-I442 HydrophobicContact CB-CD1 3.79Å; W421-I442 HydrophobicContact CG-CD1 3.96Å
422	H	91.2	Very high	89.2	Confident	68 Å²	68	91.9 Å²	91.9	32%	0.315	44%	0.44	S	S	.	.			trans	-62.4	131.1	175.5	-161.4	-92.5	0	0	0	110.2	A418 D424 N425 F426 F439	A418-H422 WeakPolarHBondContact O-CB 3.45Å; A418-H422 PolarHBondContact O-N 3.47Å; A418-H422 VanDerWaalsContact O-N 3.12Å; H422-D424 IonicContact CE1-OD2 2.83Å; H422-D424 PolarHBondContact CE1-OD2 3.12Å; H422-D424 WeakPolarHBondContact ND1-CB 3.41Å; H422-D424 PolarHBondContact ND1-N 2.86Å; H422-D424 IonicContact ND1-OD2 2.84Å; H422-D424 PolarHBondContact ND1-OD2 3.41Å; H422-D424 PolarHBondContact O-N 3.35Å; H422-N425 WeakPolarHBondContact O-CB 3.21Å; H422-N425 PolarHBondContact O-N 3.01Å; H422-F426 WeakPolarHBondContact O-CD2 3.46Å; H422-F439 AromaticContact CD2-CE2 3.8Å; H422-F439 AromaticContact CD2-CZ 3.91Å
423	P	88	Confident	88.9	Confident	10 Å²	10	90.8 Å²	90.8	7%	0.065	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-55.8	-28.1	-177.1	-29.1	36.6	0	0	0	114.6	N425 F426 K432 E436	P423-N425 PolarHBondContact O-N 3.41Å; P423-F426 PolarHBondContact O-N 2.88Å; P423-K432 HydrophobicContact CB-CG 4.33Å; P423-E436 HydrophobicContact CB-CG 3.84Å; P423-E436 HydrophobicContact CG-CG 3.63Å
424	D	87.4	Confident	88.6	Confident	124 Å²	124	96.4 Å²	96.4	66%	0.663	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-68.5	-16	178.2	-63.5	-15.6	0	0	0	113.9	H422 F426	H422-D424 IonicContact CE1-OD2 2.83Å; H422-D424 PolarHBondContact CE1-OD2 3.12Å; H422-D424 WeakPolarHBondContact ND1-CB 3.41Å; H422-D424 PolarHBondContact ND1-N 2.86Å; H422-D424 IonicContact ND1-OD2 2.84Å; H422-D424 PolarHBondContact ND1-OD2 3.41Å; H422-D424 PolarHBondContact O-N 3.35Å; D424-F426 PolarHBondContact O-N 3.34Å
425	N	87.1	Confident	88.2	Confident	95 Å²	95	93.8 Å²	93.8	51%	0.508	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-77.8	-10.2	176.8	-64.3	-17.4	0	0	0	112.9	Q419 Q420 H422 P423	Q419-N425 PolarHBondContact O-ND2 2.96Å; Q420-N425 PolarHBondContact O-ND2 3.45Å; Q420-N425 VanDerWaalsContact O-ND2 3.16Å; H422-N425 WeakPolarHBondContact O-CB 3.21Å; H422-N425 PolarHBondContact O-N 3.01Å; P423-N425 PolarHBondContact O-N 3.41Å
426	F	89.6	Confident	88	Confident	47 Å²	47	88.8 Å²	88.8	21%	0.206	43%	0.431	C	S	.	.			trans	-119.2	122.2	-173.3	-56.5	-88.7	0	0	0	110.7	W421 H422 P423 D424 E431 K432 A435	W421-F426 HydrophobicContact CE3-CE2 4.34Å; W421-F426 AromaticContact CE3-CZ 3.91Å; W421-F426 HydrophobicContact CE3-CZ 3.91Å; W421-F426 HydrophobicContact CZ3-CZ 4.1Å; H422-F426 WeakPolarHBondContact O-CD2 3.46Å; P423-F426 PolarHBondContact O-N 2.88Å; D424-F426 PolarHBondContact O-N 3.34Å; F426-E431 HydrophobicContact CB-CB 4.41Å; F426-E431 HydrophobicContact CD1-CB 4.16Å; F426-K432 HydrophobicContact CB-CB 4.27Å; F426-A435 HydrophobicContact CD2-CB 3.33Å; F426-A435 HydrophobicContact CE2-CB 3.38Å; F426-A435 HydrophobicContact CG-CB 4.03Å; F426-A435 HydrophobicContact CZ-CB 4.1Å
427	Q	83.1	Confident	87.8	Confident	196 Å²	196	88.2 Å²	88.2	92%	0.916	43%	0.428	S	S	*	.			trans	-91.3	-28.2	-178.5	-64.3	179.7	3.8	0	0	112.8
428	D	90.9	Very high	87.5	Confident	75 Å²	75	90.8 Å²	90.8	40%	0.401	44%	0.439	S	S	.	.	S	Bend	trans	-73.1	126.1	176.5	178.5	-3.8	0	0	0	110.6	V430 E431 K432	D428-V430 PolarHBondContact O-N 2.76Å; D428-V430 PolarHBondContact OD1-N 2.87Å; D428-E431 HydrophobicContact CB-CB 4.18Å; D428-E431 HydrophobicContact CB-CG 4.17Å; D428-E431 PolarHBondContact O-N 2.99Å; D428-K432 VanDerWaalsContact O-CB 3.23Å; D428-K432 WeakPolarHBondContact O-CB 3.44Å; D428-K432 PolarHBondContact O-N 3.39Å
429	P	84.2	Confident	87.6	Confident	105 Å²	105	92.4 Å²	92.4	68%	0.682	44%	0.444	S	S	*	.	H	α-helix	trans	-51.3	-36.1	175.6	-27.3	33.8	0	0	0	115.2	K433	P429-K433 PolarHBondContact O-N 3.12Å
430	V	83.9	Confident	87.4	Confident	90 Å²	90	89.4 Å²	89.4	55%	0.545	43%	0.432	S	S	.	.	H	α-helix	trans	-74.5	-44.8	-178	179.4	0	0	0	0	110.8	D428 K433 K434	D428-V430 PolarHBondContact O-N 2.76Å; D428-V430 PolarHBondContact OD1-N 2.87Å; V430-K433 PolarHBondContact O-N 3.08Å; V430-K434 PolarHBondContact O-N 3.34Å
431	E	85.9	Confident	87.3	Confident	104 Å²	104	86.1 Å²	86.1	49%	0.486	42%	0.418	S	S	.	.	H	α-helix	trans	-68.4	-38.8	176.8	-64.6	-164.8	152.3	0	0	111.9	F426 D428 K433 K434 A435	F426-E431 HydrophobicContact CB-CB 4.41Å; F426-E431 HydrophobicContact CD1-CB 4.16Å; D428-E431 HydrophobicContact CB-CB 4.18Å; D428-E431 HydrophobicContact CB-CG 4.17Å; D428-E431 PolarHBondContact O-N 2.99Å; E431-K433 VanDerWaalsContact C-N 3.33Å; E431-K433 PolarHBondContact O-N 3.47Å; E431-K434 WeakPolarHBondContact O-CB 3.47Å; E431-K434 PolarHBondContact O-N 2.98Å; E431-K434 VanDerWaalsContact O-N 3.12Å; E431-A435 WeakPolarHBondContact O-CB 3.28Å; E431-A435 PolarHBondContact O-N 3.48Å
432	K	88.6	Confident	87.3	Confident	79 Å²	79	83.3 Å²	83.3	34%	0.343	41%	0.408	S	S	.	.	H	α-helix	trans	-58	-45.2	175.1	-174.2	174	-179.1	174.4	0	111.5	P423 F426 D428 K434 A435 E436	P423-K432 HydrophobicContact CB-CG 4.33Å; F426-K432 HydrophobicContact CB-CB 4.27Å; D428-K432 VanDerWaalsContact O-CB 3.23Å; D428-K432 WeakPolarHBondContact O-CB 3.44Å; D428-K432 PolarHBondContact O-N 3.39Å; K432-K434 VanDerWaalsContact C-N 3.33Å; K432-K434 PolarHBondContact O-N 2.92Å; K432-A435 PolarHBondContact O-N 3Å; K432-E436 VanDerWaalsContact O-CG 3.32Å; K432-E436 WeakPolarHBondContact O-CG 3.39Å; K432-E436 PolarHBondContact O-N 3.15Å
433	K	85.2	Confident	87.3	Confident	138 Å²	138	82.4 Å²	82.4	60%	0.6	41%	0.407	S	S	*	.	H	α-helix	trans	-63.9	-35	176.2	-167.3	174.6	-174.9	176.9	0	112.9	P429 V430 E431 K437	P429-K433 PolarHBondContact O-N 3.12Å; V430-K433 PolarHBondContact O-N 3.08Å; E431-K433 VanDerWaalsContact C-N 3.33Å; E431-K433 PolarHBondContact O-N 3.47Å; K433-K437 PolarHBondContact O-N 2.68Å
434	K	84.9	Confident	87.4	Confident	135 Å²	135	84.2 Å²	84.2	59%	0.587	41%	0.414	S	S	*	.	H	α-helix	trans	-69.1	-41.1	173.2	-71.8	180	-179	177.2	0	111.6	V430 E431 K432 K437 K438	V430-K434 PolarHBondContact O-N 3.34Å; E431-K434 WeakPolarHBondContact O-CB 3.47Å; E431-K434 PolarHBondContact O-N 2.98Å; E431-K434 VanDerWaalsContact O-N 3.12Å; K432-K434 VanDerWaalsContact C-N 3.33Å; K432-K434 PolarHBondContact O-N 2.92Å; K434-K437 PolarHBondContact O-N 2.93Å; K434-K438 PolarHBondContact O-N 3.26Å; K434-K438 VanDerWaalsContact O-N 3.14Å
435	A	85.6	Confident	87.5	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-65.4	-41.3	176.9	0	0	0	0	0	111.6	W421 F426 E431 K432 K437 K438 F439	W421-A435 HydrophobicContact CE3-CB 4.25Å; F426-A435 HydrophobicContact CD2-CB 3.33Å; F426-A435 HydrophobicContact CE2-CB 3.38Å; F426-A435 HydrophobicContact CG-CB 4.03Å; F426-A435 HydrophobicContact CZ-CB 4.1Å; E431-A435 WeakPolarHBondContact O-CB 3.28Å; E431-A435 PolarHBondContact O-N 3.48Å; K432-A435 PolarHBondContact O-N 3Å; A435-K437 PolarHBondContact O-N 3.4Å; A435-K438 PolarHBondContact O-N 2.86Å; A435-F439 VanDerWaalsContact O-CB 3.28Å; A435-F439 WeakPolarHBondContact O-CB 3.42Å; A435-F439 PolarHBondContact O-N 2.84Å
436	E	87.6	Confident	87.8	Confident	72 Å²	72	77.4 Å²	77.4	34%	0.336	37%	0.374	S	S	.	.	H	α-helix	trans	-56.7	-48.4	173.9	-76.4	169.8	-174.8	0	0	112	P423 K432 K438 F439 I440	P423-E436 HydrophobicContact CB-CG 3.84Å; P423-E436 HydrophobicContact CG-CG 3.63Å; K432-E436 VanDerWaalsContact O-CG 3.32Å; K432-E436 WeakPolarHBondContact O-CG 3.39Å; K432-E436 PolarHBondContact O-N 3.15Å; E436-K438 PolarHBondContact O-N 3.25Å; E436-F439 PolarHBondContact O-N 3.5Å; E436-I440 VanDerWaalsContact O-CG1 3.3Å; E436-I440 WeakPolarHBondContact O-CG1 3.05Å; E436-I440 PolarHBondContact O-N 2.92Å
437	K	86.8	Confident	87.8	Confident	140 Å²	140	80 Å²	80	61%	0.609	39%	0.387	S	S	*	.	H	α-helix	trans	-58.2	-49	175.7	-74.4	-172.8	175.3	-169.5	0	112	K433 K434 A435 F439 I440 D441	K433-K437 PolarHBondContact O-N 2.68Å; K434-K437 PolarHBondContact O-N 2.93Å; A435-K437 PolarHBondContact O-N 3.4Å; K437-F439 VanDerWaalsContact C-N 3.31Å; K437-F439 PolarHBondContact O-N 3.08Å; K437-I440 WeakPolarHBondContact O-CB 3.36Å; K437-I440 PolarHBondContact O-N 3.3Å; K437-D441 PolarHBondContact O-N 2.8Å; K437-D441 VanDerWaalsContact O-N 3.12Å
438	K	86.2	Confident	88.2	Confident	93 Å²	93	70.8 Å²	70.8	40%	0.404	34%	0.344	S	S	.	.	H	α-helix	trans	-63.1	-37.7	178.2	-75.1	-173.4	175.4	-175	0	112.6	W421 K434 A435 E436 I440 D441 I442	W421-K438 HydrophobicContact CD2-CB 4.33Å; W421-K438 HydrophobicContact CD2-CD 3.8Å; W421-K438 HydrophobicContact CE3-CB 4.31Å; W421-K438 HydrophobicContact CE3-CD 3.61Å; W421-K438 HydrophobicContact CG-CB 4.49Å; W421-K438 HydrophobicContact CH2-CD 3.73Å; W421-K438 HydrophobicContact CZ2-CD 3.87Å; W421-K438 VanDerWaalsContact CZ2-NZ 3.33Å; W421-K438 HydrophobicContact CZ3-CD 3.58Å; K434-K438 PolarHBondContact O-N 3.26Å; K434-K438 VanDerWaalsContact O-N 3.14Å; A435-K438 PolarHBondContact O-N 2.86Å; E436-K438 PolarHBondContact O-N 3.25Å; K438-I440 VanDerWaalsContact C-N 3.34Å; K438-D441 PolarHBondContact O-N 3.26Å; K438-I442 VanDerWaalsContact O-CD1 3.31Å; K438-I442 WeakPolarHBondContact O-CD1 3.45Å; K438-I442 WeakPolarHBondContact O-CG1 3.37Å; K438-I442 PolarHBondContact O-N 2.93Å
439	F	90.9	Very high	88.1	Confident	46 Å²	46	67.3 Å²	67.3	20%	0.202	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-41	178.5	-168.9	-95.6	0	0	0	111.3	A418 H422 A435 E436 K437 I442 V443	A418-F439 HydrophobicContact CB-CE2 3.83Å; A418-F439 WeakPolarHBondContact O-CE2 3.31Å; H422-F439 AromaticContact CD2-CE2 3.8Å; H422-F439 AromaticContact CD2-CZ 3.91Å; A435-F439 VanDerWaalsContact O-CB 3.28Å; A435-F439 WeakPolarHBondContact O-CB 3.42Å; A435-F439 PolarHBondContact O-N 2.84Å; E436-F439 PolarHBondContact O-N 3.5Å; K437-F439 VanDerWaalsContact C-N 3.31Å; K437-F439 PolarHBondContact O-N 3.08Å; F439-I442 PolarHBondContact O-N 2.95Å; F439-V443 HydrophobicContact CD1-CG2 4.12Å; F439-V443 HydrophobicContact CE1-CG2 3.85Å; F439-V443 HydrophobicContact CZ-CG2 4.34Å; F439-V443 WeakPolarHBondContact O-CG2 3.22Å; F439-V443 PolarHBondContact O-N 3.38Å
440	I	87.6	Confident	88.4	Confident	89 Å²	89	63.2 Å²	63.2	46%	0.456	30%	0.298	S	S	.	.	H	α-helix	trans	-58.8	-48.3	172.9	-66.3	162.8	0	0	0	110.4	E436 K437 K438 I442 V443 Q444	E436-I440 VanDerWaalsContact O-CG1 3.3Å; E436-I440 WeakPolarHBondContact O-CG1 3.05Å; E436-I440 PolarHBondContact O-N 2.92Å; K437-I440 WeakPolarHBondContact O-CB 3.36Å; K437-I440 PolarHBondContact O-N 3.3Å; K438-I440 VanDerWaalsContact C-N 3.34Å; I440-I442 VanDerWaalsContact C-N 3.32Å; I440-I442 PolarHBondContact O-N 3.29Å; I440-V443 PolarHBondContact O-N 3.19Å; I440-Q444 HydrophobicContact CG2-CG 4.49Å; I440-Q444 WeakPolarHBondContact O-CG 3.45Å; I440-Q444 PolarHBondContact O-N 3.1Å
441	D	87.9	Confident	88.7	Confident	42 Å²	42	62 Å²	62	23%	0.225	29%	0.289	C	S	.	.	H	α-helix	trans	-60.9	-39.6	178.6	-65	-29.5	0	0	0	112	R393 I398 K437 K438 A445	R393-D441 IonicContact CZ-OD1 2.75Å; R393-D441 IonicContact NH1-OD1 3.89Å; R393-D441 IonicContact NH2-OD1 3.4Å; I398-D441 HydrophobicContact CD1-CB 4.22Å; I398-D441 HydrophobicContact CG2-CB 4.26Å; K437-D441 PolarHBondContact O-N 2.8Å; K437-D441 VanDerWaalsContact O-N 3.12Å; K438-D441 PolarHBondContact O-N 3.26Å; D441-A445 VanDerWaalsContact O-CB 3.27Å; D441-A445 WeakPolarHBondContact O-CB 3.22Å; D441-A445 PolarHBondContact O-N 3.34Å
442	I	91	Very high	88.8	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-41.8	177.3	-70.9	158.6	0	0	0	111.4	I398 L399 Y414 Q417 A418 W421 K438 F439 I440 K446	I398-I442 HydrophobicContact CG2-CG1 4.1Å; L399-I442 HydrophobicContact CD2-CG2 3.95Å; Y414-I442 HydrophobicContact CD2-CG2 3.64Å; Y414-I442 HydrophobicContact CE2-CG2 3.98Å; Q417-I442 HydrophobicContact CB-CD1 3.94Å; Q417-I442 HydrophobicContact CB-CG1 4.22Å; Q417-I442 HydrophobicContact CB-CG2 4.06Å; A418-I442 HydrophobicContact CB-CG2 4.41Å; W421-I442 HydrophobicContact CB-CD1 3.79Å; W421-I442 HydrophobicContact CG-CD1 3.96Å; K438-I442 VanDerWaalsContact O-CD1 3.31Å; K438-I442 WeakPolarHBondContact O-CD1 3.45Å; K438-I442 WeakPolarHBondContact O-CG1 3.37Å; K438-I442 PolarHBondContact O-N 2.93Å; F439-I442 PolarHBondContact O-N 2.95Å; I440-I442 VanDerWaalsContact C-N 3.32Å; I440-I442 PolarHBondContact O-N 3.29Å; I442-K446 PolarHBondContact O-N 3.05Å; I442-K446 VanDerWaalsContact O-N 3.1Å
443	V	91.9	Very high	88.8	Confident	49 Å²	49	64.4 Å²	64.4	30%	0.297	31%	0.31	S	S	.	.	H	α-helix	trans	-66.1	-47.3	178.2	171.9	0	0	0	0	110.5	Y414 F439 I440 A445 K446 E447	Y414-V443 HydrophobicContact CE2-CG2 4.13Å; F439-V443 HydrophobicContact CD1-CG2 4.12Å; F439-V443 HydrophobicContact CE1-CG2 3.85Å; F439-V443 HydrophobicContact CZ-CG2 4.34Å; F439-V443 WeakPolarHBondContact O-CG2 3.22Å; F439-V443 PolarHBondContact O-N 3.38Å; I440-V443 PolarHBondContact O-N 3.19Å; V443-A445 VanDerWaalsContact C-N 3.35Å; V443-A445 PolarHBondContact O-N 3.03Å; V443-K446 PolarHBondContact O-N 2.87Å; V443-K446 VanDerWaalsContact O-N 3.17Å; V443-E447 PolarHBondContact O-N 3.34Å
444	Q	88.9	Confident	88.9	Confident	47 Å²	47	60.1 Å²	60.1	22%	0.22	29%	0.293	C	S	.	.	H	α-helix	trans	-61.9	-42.1	177.4	-71.8	175.9	-22.1	0	0	111.7	Y395 I440 K446 E447 V448 M465	Y395-Q444 HydrophobicContact CE1-CB 4.5Å; I440-Q444 HydrophobicContact CG2-CG 4.49Å; I440-Q444 WeakPolarHBondContact O-CG 3.45Å; I440-Q444 PolarHBondContact O-N 3.1Å; Q444-K446 VanDerWaalsContact C-N 3.3Å; Q444-K446 PolarHBondContact O-N 3.15Å; Q444-E447 PolarHBondContact O-N 3.37Å; Q444-V448 WeakPolarHBondContact O-CG2 3.1Å; Q444-V448 PolarHBondContact O-N 3.04Å; Q444-M465 HydrophobicContact CG-CE 4.45Å
445	A	89.6	Confident	89	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.4	-40.3	174.8	0	0	0	0	0	112.3	Y395 I398 L399 D441 V443 L449	Y395-A445 VanDerWaalsContact CD1-CA 3.48Å; Y395-A445 HydrophobicContact CD1-CB 3.75Å; Y395-A445 HydrophobicContact CG-CB 4.24Å; I398-A445 HydrophobicContact CB-CB 4.29Å; I398-A445 HydrophobicContact CG2-CB 4Å; L399-A445 HydrophobicContact CD1-CB 3.93Å; L399-A445 HydrophobicContact CD2-CB 4.39Å; L399-A445 HydrophobicContact CG-CB 3.77Å; D441-A445 VanDerWaalsContact O-CB 3.27Å; D441-A445 WeakPolarHBondContact O-CB 3.22Å; D441-A445 PolarHBondContact O-N 3.34Å; V443-A445 VanDerWaalsContact C-N 3.35Å; V443-A445 PolarHBondContact O-N 3.03Å; A445-L449 VanDerWaalsContact O-CB 3.24Å; A445-L449 WeakPolarHBondContact O-CB 2.88Å; A445-L449 WeakPolarHBondContact O-CG 3.33Å; A445-L449 PolarHBondContact O-N 2.82Å
446	K	92.8	Very high	89	Confident	76 Å²	76	61.7 Å²	61.7	33%	0.33	30%	0.3	S	S	.	.	H	α-helix	trans	-67.2	-40.8	176	173	-100.3	173.1	-178.5	0	111.5	Y414 I442 V443 Q444 T450	Y414-K446 HydrophobicContact CD1-CG 4.11Å; Y414-K446 HydrophobicContact CD2-CB 3.48Å; Y414-K446 VanDerWaalsContact CD2-CB 3.48Å; Y414-K446 HydrophobicContact CD2-CD 4.45Å; Y414-K446 HydrophobicContact CD2-CG 3.84Å; Y414-K446 HydrophobicContact CE2-CB 4.09Å; Y414-K446 HydrophobicContact CE2-CD 4.48Å; Y414-K446 HydrophobicContact CE2-CG 4.35Å; Y414-K446 HydrophobicContact CG-CB 3.8Å; Y414-K446 HydrophobicContact CG-CD 4.5Å; Y414-K446 HydrophobicContact CG-CG 3.71Å; I442-K446 PolarHBondContact O-N 3.05Å; I442-K446 VanDerWaalsContact O-N 3.1Å; V443-K446 PolarHBondContact O-N 2.87Å; V443-K446 VanDerWaalsContact O-N 3.17Å; Q444-K446 VanDerWaalsContact C-N 3.3Å; Q444-K446 PolarHBondContact O-N 3.15Å; K446-T450 HydrophobicContact CG-CG2 4.17Å; K446-T450 VanDerWaalsContact O-CB 3.26Å; K446-T450 WeakPolarHBondContact O-CB 3.29Å; K446-T450 WeakPolarHBondContact O-CG2 3.02Å; K446-T450 PolarHBondContact O-N 3.11Å; K446-T450 VanDerWaalsContact O-N 3.07Å; K446-T450 PolarHBondContact O-OG1 3.01Å
447	E	91.1	Very high	88.9	Confident	103 Å²	103	62.8 Å²	62.8	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-54.4	178.2	-173.1	167.9	-159.5	0	0	111.3	V443 Q444 L449 T450 D451 M465	V443-E447 PolarHBondContact O-N 3.34Å; Q444-E447 PolarHBondContact O-N 3.37Å; E447-L449 PolarHBondContact O-N 3.16Å; E447-T450 PolarHBondContact O-N 3.41Å; E447-D451 PolarHBondContact O-N 3.28Å; E447-M465 HydrophobicContact CG-CE 4.44Å; E447-M465 VanDerWaalsContact OE2-CE 3.32Å; E447-M465 WeakPolarHBondContact OE2-CE 3.37Å
448	V	89.8	Confident	88.8	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-61.1	-43.9	-179.8	174.2	0	0	0	0	112.1	Y395 Q444 M454 R455 F458 P464 M465	Y395-V448 HydrophobicContact CD2-CB 4.09Å; Y395-V448 HydrophobicContact CD2-CG1 3.72Å; Y395-V448 HydrophobicContact CD2-CG2 4.39Å; Y395-V448 HydrophobicContact CE1-CG2 4.47Å; Y395-V448 HydrophobicContact CE2-CB 4.21Å; Y395-V448 HydrophobicContact CE2-CG1 3.89Å; Y395-V448 HydrophobicContact CE2-CG2 4.02Å; Y395-V448 HydrophobicContact CG-CB 4.44Å; Y395-V448 HydrophobicContact CG-CG1 4.46Å; Q444-V448 WeakPolarHBondContact O-CG2 3.1Å; Q444-V448 PolarHBondContact O-N 3.04Å; V448-M454 HydrophobicContact CG1-CB 4.41Å; V448-R455 WeakPolarHBondContact O-CA 3.45Å; V448-R455 PolarHBondContact O-N 2.92Å; V448-R455 VanDerWaalsContact O-N 3.11Å; V448-F458 HydrophobicContact CG1-CB 3.98Å; V448-F458 HydrophobicContact CG1-CG 4.26Å; V448-P464 HydrophobicContact CG1-CG 4.01Å; V448-M465 HydrophobicContact CG2-CG 3.41Å; V448-M465 VanDerWaalsContact CG2-CG 3.41Å; V448-M465 HydrophobicContact CG2-SD 4.41Å
449	L	90	Very high	88.7	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-83.9	-14.2	-173.6	-61.8	-177.7	0	0	0	114.5	Y396 L399 I401 I410 A445 E447 R455 F458	Y396-L449 HydrophobicContact CD1-CD1 3.84Å; Y396-L449 HydrophobicContact CD1-CD2 4.14Å; Y396-L449 HydrophobicContact CD2-CD2 4.23Å; Y396-L449 HydrophobicContact CE1-CD1 4.04Å; Y396-L449 HydrophobicContact CE1-CD2 3.65Å; Y396-L449 HydrophobicContact CE1-CG 4.44Å; Y396-L449 HydrophobicContact CE2-CD2 3.77Å; Y396-L449 HydrophobicContact CG-CD1 4.26Å; Y396-L449 HydrophobicContact CG-CD2 4.4Å; Y396-L449 VanDerWaalsContact CZ-CD2 3.46Å; L399-L449 HydrophobicContact CD1-CD1 4.01Å; I401-L449 HydrophobicContact CD1-CD1 3.98Å; I410-L449 HydrophobicContact CD1-CB 4.12Å; I410-L449 WeakPolarHBondContact CD1-O 3.47Å; I410-L449 HydrophobicContact CG2-CB 3.9Å; A445-L449 VanDerWaalsContact O-CB 3.24Å; A445-L449 WeakPolarHBondContact O-CB 2.88Å; A445-L449 WeakPolarHBondContact O-CG 3.33Å; A445-L449 PolarHBondContact O-N 2.82Å; E447-L449 PolarHBondContact O-N 3.16Å; L449-R455 HydrophobicContact CD2-CG 4.38Å; L449-F458 HydrophobicContact CD2-CD1 4.24Å
450	T	89.3	Confident	88.4	Confident	19 Å²	19	58.8 Å²	58.8	12%	0.117	30%	0.295	C	S	.	.	H	α-helix	trans	-96.8	-18.9	178.3	60.2	0	0	0	0	113.9	K407 I410 V411 K446 E447	K407-T450 WeakPolarHBondContact CE-O 3.46Å; K407-T450 HydrophobicContact CG-CG2 4.37Å; K407-T450 PolarHBondContact NZ-O 2.84Å; I410-T450 HydrophobicContact CB-CG2 4.4Å; I410-T450 HydrophobicContact CG2-CG2 3.81Å; V411-T450 HydrophobicContact CG2-CG2 4Å; K446-T450 HydrophobicContact CG-CG2 4.17Å; K446-T450 VanDerWaalsContact O-CB 3.26Å; K446-T450 WeakPolarHBondContact O-CB 3.29Å; K446-T450 WeakPolarHBondContact O-CG2 3.02Å; K446-T450 PolarHBondContact O-N 3.11Å; K446-T450 VanDerWaalsContact O-N 3.07Å; K446-T450 PolarHBondContact O-OG1 3.01Å; E447-T450 PolarHBondContact O-N 3.41Å
451	D	90.9	Very high	87.8	Confident	66 Å²	66	56.4 Å²	56.4	35%	0.353	29%	0.292	S	S	.	.	S	Bend	trans	-83.6	121.9	168.8	-174	-66	0	0	0	110.2	E447 E453 M454 R455	E447-D451 PolarHBondContact O-N 3.28Å; D451-E453 VanDerWaalsContact C-N 3.34Å; D451-E453 PolarHBondContact O-N 3.45Å; D451-E453 WeakPolarHBondContact OD1-CA 3.24Å; D451-E453 WeakPolarHBondContact OD1-CB 3.36Å; D451-E453 PolarHBondContact OD1-N 3.11Å; D451-M454 HydrophobicContact CB-CB 3.98Å; D451-M454 HydrophobicContact CB-CG 3.94Å; D451-M454 PolarHBondContact OD1-N 3.32Å; D451-R455 WeakPolarHBondContact O-CB 3.42Å; D451-R455 PolarHBondContact O-N 2.99Å
452	P	87.6	Confident	87.3	Confident	96 Å²	96	60.6 Å²	60.6	62%	0.623	31%	0.31	S	S	*	.	H	α-helix	trans	-60.8	-36.9	-177.8	-23.5	34.2	0	0	0	114.5	Q456	P452-Q456 VanDerWaalsContact O-CB 3.3Å; P452-Q456 WeakPolarHBondContact O-CB 3.46Å; P452-Q456 PolarHBondContact O-N 3.35Å
453	E	88.8	Confident	86.8	Confident	136 Å²	136	61.4 Å²	61.4	64%	0.636	32%	0.315	S	S	*	.	H	α-helix	trans	-75.9	-45.1	-177.3	-64.3	-175.7	-179.8	0	0	110.6	D451 R455 Q456 K457	D451-E453 VanDerWaalsContact C-N 3.34Å; D451-E453 PolarHBondContact O-N 3.45Å; D451-E453 WeakPolarHBondContact OD1-CA 3.24Å; D451-E453 WeakPolarHBondContact OD1-CB 3.36Å; D451-E453 PolarHBondContact OD1-N 3.11Å; E453-R455 VanDerWaalsContact C-N 3.34Å; E453-R455 PolarHBondContact O-N 2.84Å; E453-Q456 PolarHBondContact O-N 2.68Å; E453-K457 WeakPolarHBondContact O-CG 3.43Å; E453-K457 PolarHBondContact O-N 3.49Å
454	M	86.7	Confident	86.1	Confident	49 Å²	49	59.9 Å²	59.9	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-65.4	-40.1	177.4	-59.3	-68.4	-103.7	0	0	111	V448 D451 Q456 K457 F458 P464 M465	V448-M454 HydrophobicContact CG1-CB 4.41Å; D451-M454 HydrophobicContact CB-CB 3.98Å; D451-M454 HydrophobicContact CB-CG 3.94Å; D451-M454 PolarHBondContact OD1-N 3.32Å; M454-Q456 PolarHBondContact O-N 3.38Å; M454-K457 PolarHBondContact O-N 3.29Å; M454-F458 WeakPolarHBondContact O-CB 3.38Å; M454-F458 PolarHBondContact O-N 3.42Å; M454-P464 HydrophobicContact CB-CB 4.21Å; M454-P464 HydrophobicContact CB-CG 4.08Å; M454-P464 HydrophobicContact CE-CB 3.53Å; M454-P464 HydrophobicContact CG-CB 4.46Å; M454-P464 WeakPolarHBondContact O-CG 3.31Å; M454-P464 HydrophobicContact SD-CB 3.5Å; M454-P464 WeakPolarHBondContact SD-CB 3.47Å; M454-P464 HydrophobicContact SD-CG 4.29Å; M454-M465 HydrophobicContact CE-SD 4.21Å
455	R	87.4	Confident	85.5	Confident	47 Å²	47	59.8 Å²	59.8	18%	0.177	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-42.9	174.6	-177.2	178	178.1	172.5	0.8	111.7	Y396 R403 A405 V448 L449 D451 E453 F458 D459	Y396-R455 PolarHBondContact OH-NE 2.83Å; R403-R455 PolarHBondContact O-NH2 2.82Å; A405-R455 PolarHBondContact O-NH1 3.13Å; A405-R455 PolarHBondContact O-NH2 2.91Å; V448-R455 WeakPolarHBondContact O-CA 3.45Å; V448-R455 PolarHBondContact O-N 2.92Å; V448-R455 VanDerWaalsContact O-N 3.11Å; L449-R455 HydrophobicContact CD2-CG 4.38Å; D451-R455 WeakPolarHBondContact O-CB 3.42Å; D451-R455 PolarHBondContact O-N 2.99Å; E453-R455 VanDerWaalsContact C-N 3.34Å; E453-R455 PolarHBondContact O-N 2.84Å; R455-F458 PolarHBondContact O-N 3.08Å; R455-D459 IonicContact NE-OD2 2.71Å; R455-D459 WeakPolarHBondContact O-CB 3.38Å; R455-D459 VanDerWaalsContact O-CG 3.23Å; R455-D459 PolarHBondContact O-N 3.14Å
456	Q	86.6	Confident	84.6	Confident	121 Å²	121	62.6 Å²	62.6	57%	0.565	32%	0.321	S	S	*	.	H	α-helix	trans	-64.6	-42.1	178.4	-173.9	175.8	8.5	0	0	111.7	P452 E453 M454 D459 N460	P452-Q456 VanDerWaalsContact O-CB 3.3Å; P452-Q456 WeakPolarHBondContact O-CB 3.46Å; P452-Q456 PolarHBondContact O-N 3.35Å; E453-Q456 PolarHBondContact O-N 2.68Å; M454-Q456 PolarHBondContact O-N 3.38Å; Q456-D459 PolarHBondContact O-N 3.43Å; Q456-N460 WeakPolarHBondContact O-CB 3.31Å; Q456-N460 PolarHBondContact O-N 2.92Å; Q456-N460 PolarHBondContact O-ND2 3.37Å
457	K	85.1	Confident	83.1	Confident	94 Å²	94	63.8 Å²	63.8	41%	0.409	34%	0.336	S	S	.	.	H	α-helix	trans	-58.5	-47.8	173	-72.7	175.4	-176	177.8	0	111.5	E453 M454 D459 N460 G461 E462 P464	E453-K457 WeakPolarHBondContact O-CG 3.43Å; E453-K457 PolarHBondContact O-N 3.49Å; M454-K457 PolarHBondContact O-N 3.29Å; K457-D459 PolarHBondContact O-N 2.93Å; K457-N460 CarbonylContact O-C 3.52Å; K457-N460 WeakPolarHBondContact O-CB 3.41Å; K457-N460 PolarHBondContact O-N 3.34Å; K457-G461 PolarHBondContact O-N 3.14Å; K457-E462 CarbonylContact C-O 3.51Å; K457-E462 PolarHBondContact O-N 3.14Å; K457-E462 VanDerWaalsContact O-O 3.06Å; K457-P464 HydrophobicContact CB-CG 4.03Å
458	F	85.4	Confident	81.6	Confident	12 Å²	12	65.4 Å²	65.4	5%	0.053	34%	0.344	C	S	.	.	H	α-helix	trans	-60.7	-43.7	176.4	-174.2	-108.2	0	0	0	113.1	R393 Y395 Y396 V448 L449 M454 R455 N460 G461 E462 P464	R393-F458 WeakPolarHBondContact O-CE2 3.24Å; R393-F458 WeakPolarHBondContact O-CZ 3.23Å; Y395-F458 HydrophobicContact CD2-CD1 4.03Å; Y395-F458 AromaticContact CD2-CD2 3.52Å; Y395-F458 HydrophobicContact CD2-CD2 3.52Å; Y395-F458 AromaticContact CD2-CE1 3.84Å; Y395-F458 HydrophobicContact CD2-CE1 3.84Å; Y395-F458 AromaticContact CD2-CE2 3.32Å; Y395-F458 HydrophobicContact CD2-CE2 3.32Å; Y395-F458 AromaticContact CD2-CG 3.87Å; Y395-F458 HydrophobicContact CD2-CG 3.87Å; Y395-F458 AromaticContact CD2-CZ 3.5Å; Y395-F458 HydrophobicContact CD2-CZ 3.5Å; Y395-F458 VanDerWaalsContact CD2-CZ 3.5Å; Y395-F458 AromaticContact CE2-CD2 3.57Å; Y395-F458 HydrophobicContact CE2-CD2 3.57Å; Y395-F458 AromaticContact CE2-CE2 3.49Å; Y395-F458 HydrophobicContact CE2-CE2 3.49Å; Y395-F458 VanDerWaalsContact CE2-CE2 3.49Å; Y395-F458 HydrophobicContact CE2-CG 4.27Å; Y395-F458 HydrophobicContact CE2-CZ 4.15Å; Y395-F458 HydrophobicContact CG-CE2 4.43Å; Y395-F458 HydrophobicContact CG-CZ 4.28Å; Y396-F458 HydrophobicContact CD2-CD1 4.25Å; Y396-F458 AromaticContact CD2-CE1 3.66Å; Y396-F458 HydrophobicContact CD2-CE1 3.66Å; Y396-F458 AromaticContact CE2-CD1 3.73Å; Y396-F458 HydrophobicContact CE2-CD1 3.73Å; Y396-F458 AromaticContact CE2-CE1 3.62Å; Y396-F458 HydrophobicContact CE2-CE1 3.62Å; V448-F458 HydrophobicContact CG1-CB 3.98Å; V448-F458 HydrophobicContact CG1-CG 4.26Å; L449-F458 HydrophobicContact CD2-CD1 4.24Å; M454-F458 WeakPolarHBondContact O-CB 3.38Å; M454-F458 PolarHBondContact O-N 3.42Å; R455-F458 PolarHBondContact O-N 3.08Å; F458-N460 VanDerWaalsContact C-N 3.28Å; F458-N460 PolarHBondContact O-N 2.85Å; F458-G461 PolarHBondContact O-N 3.04Å; F458-E462 WeakPolarHBondContact CA-O 3.22Å; F458-E462 PolarHBondContact N-O 3.3Å; F458-P464 HydrophobicContact CB-CG 4.2Å
459	D	84	Confident	79.9	Confident	63 Å²	63	68.3 Å²	68.3	34%	0.337	37%	0.365	S	S	.	.	H	α-helix	trans	-67.4	-29.6	177.9	-72.7	-22.1	0	0	0	112.2	Y396 R455 Q456 K457 G461	Y396-D459 VanDerWaalsContact CE2-OD1 3.22Å; Y396-D459 WeakPolarHBondContact CE2-OD1 3.37Å; Y396-D459 VanDerWaalsContact OH-CG 3.27Å; Y396-D459 PolarHBondContact OH-OD1 3.24Å; Y396-D459 PolarHBondContact OH-OD2 3.45Å; Y396-D459 VanDerWaalsContact OH-OD2 3.1Å; R455-D459 IonicContact NE-OD2 2.71Å; R455-D459 WeakPolarHBondContact O-CB 3.38Å; R455-D459 VanDerWaalsContact O-CG 3.23Å; R455-D459 PolarHBondContact O-N 3.14Å; Q456-D459 PolarHBondContact O-N 3.43Å; K457-D459 PolarHBondContact O-N 2.93Å; D459-G461 PolarHBondContact O-N 3.12Å
460	N	83.9	Confident	78.1	Confident	120 Å²	120	75.3 Å²	75.3	64%	0.642	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.3	172	-68.6	-17.1	0	0	0	113.4	Q456 K457 F458	Q456-N460 WeakPolarHBondContact O-CB 3.31Å; Q456-N460 PolarHBondContact O-N 2.92Å; Q456-N460 PolarHBondContact O-ND2 3.37Å; K457-N460 CarbonylContact O-C 3.52Å; K457-N460 WeakPolarHBondContact O-CB 3.41Å; K457-N460 PolarHBondContact O-N 3.34Å; F458-N460 VanDerWaalsContact C-N 3.28Å; F458-N460 PolarHBondContact O-N 2.85Å
461	G	75.1	Confident	75.9	Confident	39 Å²	39	83 Å²	83	40%	0.402	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.1	-3.2	173.6	0	0	0	0	0	115.4	K392 K457 F458 D459	K392-G461 PolarHBondContact NZ-O 3.26Å; K457-G461 PolarHBondContact O-N 3.14Å; F458-G461 PolarHBondContact O-N 3.04Å; D459-G461 PolarHBondContact O-N 3.12Å
462	E	78.1	Confident	73.3	Confident	130 Å²	130	83.4 Å²	83.4	61%	0.607	45%	0.451	S	S	*	.			trans	-93	118.7	177.1	-64.5	175.9	-175.2	0	0	110.1	K457 F458 P464	K457-E462 CarbonylContact C-O 3.51Å; K457-E462 PolarHBondContact O-N 3.14Å; K457-E462 VanDerWaalsContact O-O 3.06Å; F458-E462 WeakPolarHBondContact CA-O 3.22Å; F458-E462 PolarHBondContact N-O 3.3Å; E462-P464 WeakPolarHBondContact O-CD 3.47Å
463	D	79.2	Confident	70.7	Confident	20 Å²	20	82 Å²	82	11%	0.107	45%	0.454	C	S	.	.			trans	-79	112.9	177.9	-177.7	-7	0	0	0	110.5	Y395 M465 D466 S469	Y395-D463 VanDerWaalsContact CE2-OD1 3.3Å; Y395-D463 WeakPolarHBondContact CE2-OD1 3.46Å; Y395-D463 VanDerWaalsContact OH-CG 3.3Å; Y395-D463 PolarHBondContact OH-OD1 3.1Å; Y395-D463 PolarHBondContact OH-OD2 3.4Å; D463-M465 PolarHBondContact O-N 3.31Å; D463-M465 VanDerWaalsContact O-N 3.14Å; D463-M465 PolarHBondContact OD1-N 2.87Å; D463-D466 HydrophobicContact CB-CB 3.9Å; D463-D466 WeakPolarHBondContact O-CB 3.36Å; D463-D466 PolarHBondContact O-N 2.91Å; D463-D466 VanDerWaalsContact O-N 3.13Å; D463-S469 PolarHBondContact O-OG 2.74Å
464	P	78.8	Confident	67.8	Low	17 Å²	17	84.7 Å²	84.7	11%	0.11	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.3	-174.4	-14.7	29.4	0	0	0	114.2	V448 M454 K457 F458 E462	V448-P464 HydrophobicContact CG1-CG 4.01Å; M454-P464 HydrophobicContact CB-CB 4.21Å; M454-P464 HydrophobicContact CB-CG 4.08Å; M454-P464 HydrophobicContact CE-CB 3.53Å; M454-P464 HydrophobicContact CG-CB 4.46Å; M454-P464 WeakPolarHBondContact O-CG 3.31Å; M454-P464 HydrophobicContact SD-CB 3.5Å; M454-P464 WeakPolarHBondContact SD-CB 3.47Å; M454-P464 HydrophobicContact SD-CG 4.29Å; K457-P464 HydrophobicContact CB-CG 4.03Å; F458-P464 HydrophobicContact CB-CG 4.2Å; E462-P464 WeakPolarHBondContact O-CD 3.47Å
465	M	75.3	Confident	65.2	Low	45 Å²	45	91.1 Å²	91.1	22%	0.222	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	13.8	178.5	-53.5	-67.8	-111.6	0	0	111.8	Y395 Q444 E447 V448 M454 D463 P467	Y395-M465 WeakPolarHBondContact OH-CB 3.45Å; Q444-M465 HydrophobicContact CG-CE 4.45Å; E447-M465 HydrophobicContact CG-CE 4.44Å; E447-M465 VanDerWaalsContact OE2-CE 3.32Å; E447-M465 WeakPolarHBondContact OE2-CE 3.37Å; V448-M465 HydrophobicContact CG2-CG 3.41Å; V448-M465 VanDerWaalsContact CG2-CG 3.41Å; V448-M465 HydrophobicContact CG2-SD 4.41Å; M454-M465 HydrophobicContact CE-SD 4.21Å; D463-M465 PolarHBondContact O-N 3.31Å; D463-M465 VanDerWaalsContact O-N 3.14Å; D463-M465 PolarHBondContact OD1-N 2.87Å; M465-P467 WeakPolarHBondContact O-CD 3.49Å
466	D	69.9	Low	62.4	Low	58 Å²	58	97.7 Å²	97.7	31%	0.31	53%	0.528	S	S	.	.			trans	-69.2	122.5	174	-179.4	1.3	0	0	0	110.3	D463 E468 S469	D463-D466 HydrophobicContact CB-CB 3.9Å; D463-D466 WeakPolarHBondContact O-CB 3.36Å; D463-D466 PolarHBondContact O-N 2.91Å; D463-D466 VanDerWaalsContact O-N 3.13Å; D466-E468 PolarHBondContact O-N 3.2Å; D466-E468 PolarHBondContact OD1-N 3.38Å; D466-E468 VanDerWaalsContact OD1-N 3.1Å; D466-S469 PolarHBondContact O-N 3.39Å; D466-S469 VanDerWaalsContact O-N 3.16Å; D466-S469 PolarHBondContact O-OG 2.8Å
467	P	61.8	Low	59.8	Low	101 Å²	101	99 Å²	99	66%	0.656	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-32	178.2	-24.9	33.5	0	0	0	114.7	M465	M465-P467 WeakPolarHBondContact O-CD 3.49Å
468	E	58.9	Low	57	Low	138 Å²	138	103.7 Å²	103.7	65%	0.645	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-32.1	179.7	-72	-170.6	159	0	0	112.1	D466 Q470 Q471	D466-E468 PolarHBondContact O-N 3.2Å; D466-E468 PolarHBondContact OD1-N 3.38Å; D466-E468 VanDerWaalsContact OD1-N 3.1Å; E468-Q470 PolarHBondContact O-N 3.3Å; E468-Q471 PolarHBondContact O-N 3.46Å
469	S	54.4	Low	54.4	Low	62 Å²	62	111.8 Å²	111.8	43%	0.434	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67	-20.5	177.9	75.3	0	0	0	0	113.8	D463 D466	D463-S469 PolarHBondContact O-OG 2.74Å; D466-S469 PolarHBondContact O-N 3.39Å; D466-S469 VanDerWaalsContact O-N 3.16Å; D466-S469 PolarHBondContact O-OG 2.8Å
470	Q	52.1	Low	51.8	Low	148 Å²	148	113.5 Å²	113.5	69%	0.692	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-10.5	176.3	-69.8	-172	7.1	0	0	114.2	E468	E468-Q470 PolarHBondContact O-N 3.3Å
471	Q	43.9	Very low	49.2	Very low	182 Å²	182	111.6 Å²	111.6	85%	0.85	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-11.2	177.1	-83.1	-175.3	3	0	0	114.4	E468	E468-Q471 PolarHBondContact O-N 3.46Å
472	G	36.1	Very low	47.1	Very low	74 Å²	74	119.8 Å²	119.8	76%	0.763	65%	0.648	S	S	*	*	S	Bend	trans	-105.8	10.6	-170.3	0	0	0	0	0	117.4
473	G	32.2	Very low	44.8	Very low	66 Å²	66	122.4 Å²	122.4	68%	0.68	66%	0.66	S	S	*	*	S	Bend	trans	-118.5	120.9	-174.3	0	0	0	0	0	113.8
474	H	28.9	Very low	42.4	Very low	193 Å²	193	124.6 Å²	124.6	89%	0.894	69%	0.687	S	S	*	*			trans	-27.5	136.5	173.6	-92.5	-69.9	0	0	0	117	Q476	H474-Q476 PolarHBondContact O-N 2.92Å
475	H	32.6	Very low	40.2	Very low	184 Å²	184	132.5 Å²	132.5	85%	0.852	72%	0.72	S	S	*	*			trans	-39.9	103.9	157	-90.8	-79.6	0	0	0	112.3
476	Q	28.7	Very low	38.2	Very low	185 Å²	185	136.3 Å²	136.3	86%	0.864	74%	0.742	S	S	*	*			trans	-127.8	121.7	144.2	-92.8	-164.1	-6.1	0	0	108.6	H474 F478	H474-Q476 PolarHBondContact O-N 2.92Å; Q476-F478 PolarHBondContact O-N 3.4Å
477	N	31.9	Very low	36.7	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	75%	0.752	S	S	*	*			trans	-48.7	106	174.8	-85.5	-6.4	0	0	0	111.2
478	F	26	Very low	35.6	Very low	193 Å²	193	140.7 Å²	140.7	85%	0.846	76%	0.756	S	S	*	*			trans	-120.8	80.6	152.5	-141.4	-94.8	0	0	0	108.5	Q476 S480	Q476-F478 PolarHBondContact O-N 3.4Å; F478-S480 VanDerWaalsContact C-N 3.34Å; F478-S480 PolarHBondContact O-N 3.04Å
479	H	30.3	Very low	34.2	Very low	182 Å²	182	138.4 Å²	138.4	84%	0.843	76%	0.756	S	S	*	*			trans	-71.5	93.9	164.2	-108.4	-46.8	0	0	0	108.4
480	S	29.6	Very low	33.4	Very low	99 Å²	99	141.4 Å²	141.4	69%	0.692	78%	0.776	S	S	*	*	S	Bend	trans	-160.9	108.1	151.1	-100.1	0	0	0	0	111.6	F478	F478-S480 VanDerWaalsContact C-N 3.34Å; F478-S480 PolarHBondContact O-N 3.04Å
481	G	29.9	Very low	32.3	Very low	80 Å²	80	136.7 Å²	136.7	83%	0.825	77%	0.768	S	S	*	*			trans	72.9	43.7	140.4	0	0	0	0	0	118.8	Q483	G481-Q483 VanDerWaalsContact C-N 3.32Å; G481-Q483 PolarHBondContact O-N 2.84Å
482	F	30.4	Very low	31.9	Very low	210 Å²	210	138 Å²	138	92%	0.921	77%	0.774	S	S	*	*			trans	-90.5	75.2	160.6	-143.2	-96.3	0	0	0	109.8
483	Q	29.9	Very low	31.6	Very low	185 Å²	185	142.6 Å²	142.6	86%	0.864	77%	0.773	S	S	*	*			trans	-83.6	121.3	167.4	-146.8	174.2	6.5	0	0	106.7	G481 F485	G481-Q483 VanDerWaalsContact C-N 3.32Å; G481-Q483 PolarHBondContact O-N 2.84Å; Q483-F485 PolarHBondContact O-N 3.45Å; Q483-F485 VanDerWaalsContact O-N 3.08Å
484	G	29.3	Very low	31.4	Very low	66 Å²	66	147.3 Å²	147.3	68%	0.68	78%	0.783	S	S	*	*			trans	-43.9	115.5	-174.6	0	0	0	0	0	112.9	N486	G484-N486 VanDerWaalsContact C-N 3.34Å; G484-N486 PolarHBondContact O-N 2.95Å
485	F	33.1	Very low	31.7	Very low	183 Å²	183	145.9 Å²	145.9	80%	0.803	77%	0.774	S	S	*	*			trans	-75.2	92.3	172.5	-170.4	-99.6	0	0	0	108.2	Q483 P487	Q483-F485 PolarHBondContact O-N 3.45Å; Q483-F485 VanDerWaalsContact O-N 3.08Å; F485-P487 HydrophobicContact CD1-CB 4.37Å; F485-P487 HydrophobicContact CD1-CG 4.41Å; F485-P487 HydrophobicContact CE1-CB 3.77Å; F485-P487 HydrophobicContact CE1-CG 4.15Å; F485-P487 HydrophobicContact CZ-CB 4.24Å; F485-P487 WeakPolarHBondContact O-CD 3.26Å
486	N	32.4	Very low	31.6	Very low	125 Å²	125	146.6 Å²	146.6	67%	0.668	78%	0.775	S	S	*	*			trans	-102.9	96.7	172.6	-147	11.8	0	0	0	106.6	G484 F488 S489	G484-N486 VanDerWaalsContact C-N 3.34Å; G484-N486 PolarHBondContact O-N 2.95Å; N486-F488 PolarHBondContact O-N 3Å; N486-S489 PolarHBondContact O-N 3.21Å
487	P	38.4	Very low	31.8	Very low	80 Å²	80	145.7 Å²	145.7	52%	0.519	77%	0.768	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.4	3.2	-168.2	25.9	-31	0	0	0	114.4	F485	F485-P487 HydrophobicContact CD1-CB 4.37Å; F485-P487 HydrophobicContact CD1-CG 4.41Å; F485-P487 HydrophobicContact CE1-CB 3.77Å; F485-P487 HydrophobicContact CE1-CG 4.15Å; F485-P487 HydrophobicContact CZ-CB 4.24Å; F485-P487 WeakPolarHBondContact O-CD 3.26Å
488	F	38.8	Very low	31.7	Very low	171 Å²	171	146.3 Å²	146.3	75%	0.75	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	22.1	-178.3	-63	-75	0	0	0	114.4	N486 S490	N486-F488 PolarHBondContact O-N 3Å; F488-S490 PolarHBondContact O-N 2.98Å
489	S	29.1	Very low	32.3	Very low	91 Å²	91	147.1 Å²	147.1	64%	0.636	77%	0.771	S	S	*	*	S	Bend	trans	-73.9	120.5	167.1	-169.9	0	0	0	0	110	N486 G491	N486-S489 PolarHBondContact O-N 3.21Å; S489-G491 PolarHBondContact O-N 3.4Å
490	S	38	Very low	32.6	Very low	124 Å²	124	151.3 Å²	151.3	87%	0.867	79%	0.79	S	S	*	*	S	Bend	trans	-48.3	90.7	-174.2	53.5	0	0	0	0	115.6	F488	F488-S490 PolarHBondContact O-N 2.98Å
491	G	29.8	Very low	32.8	Very low	50 Å²	50	153.9 Å²	153.9	52%	0.515	80%	0.795	S	S	.	*			trans	-144.9	120.1	165.8	0	0	0	0	0	110.2	S489 F493	S489-G491 PolarHBondContact O-N 3.4Å; G491-F493 PolarHBondContact O-N 3.23Å
492	Q	33.6	Very low	32.9	Very low	208 Å²	208	157.8 Å²	157.8	97%	0.972	79%	0.794	S	S	*	*			trans	-55.3	106.9	178.8	-80.1	163.8	-54.2	0	0	111.4
493	F	31.1	Very low	33.1	Very low	171 Å²	171	154.9 Å²	154.9	75%	0.75	79%	0.787	S	S	*	*			trans	-101.5	107.2	164.5	-87.9	-86	0	0	0	109.6	G491 F495	G491-F493 PolarHBondContact O-N 3.23Å; F493-F495 HydrophobicContact CB-CD2 4.2Å; F493-F495 HydrophobicContact CB-CE2 3.74Å; F493-F495 HydrophobicContact CB-CZ 4.41Å; F493-F495 HydrophobicContact CG-CE2 4.49Å; F493-F495 PolarHBondContact O-N 2.97Å
494	N	28	Very low	33.3	Very low	165 Å²	165	153.1 Å²	153.1	88%	0.882	78%	0.782	S	S	*	*			trans	-78.7	109.2	167.1	-118.3	-9.4	0	0	0	108.4
495	F	35.6	Very low	33.5	Very low	164 Å²	164	158.6 Å²	158.6	72%	0.719	79%	0.789	S	S	*	*			trans	-90.3	108.2	172.6	-76.9	-84.2	0	0	0	110.2	F493	F493-F495 HydrophobicContact CB-CD2 4.2Å; F493-F495 HydrophobicContact CB-CE2 3.74Å; F493-F495 HydrophobicContact CB-CZ 4.41Å; F493-F495 HydrophobicContact CG-CE2 4.49Å; F493-F495 PolarHBondContact O-N 2.97Å
496	K	28.8	Very low	33.5	Very low	199 Å²	199	156.9 Å²	156.9	87%	0.865	79%	0.788	S	S	*	*			trans	-82.9	117.6	164.2	-77.6	-174.9	176	-178.7	0	108.9
497	F	33	Very low	33.6	Very low	165 Å²	165	159.2 Å²	159.2	72%	0.724	80%	0.796	S	S	*	*			trans	-83.9	118.5	166.1	-76.2	-88	0	0	0	109.2	Y499	F497-Y499 HydrophobicContact CB-CD2 4.45Å; F497-Y499 HydrophobicContact CB-CE2 4.26Å
498	N	31.1	Very low	33.3	Very low	161 Å²	161	165.3 Å²	165.3	86%	0.861	82%	0.817	S	S	*	*			trans	-90.9	113.8	159.7	-85.5	-4.1	0	0	0	107.9
499	Y	38.4	Very low	32.8	Very low	211 Å²	211	164.8 Å²	164.8	83%	0.827	82%	0.823	S	S	*	*			trans	-80.7	128	163.4	-78.9	-91.7	0	0	0	108.4	F497	F497-Y499 HydrophobicContact CB-CD2 4.45Å; F497-Y499 HydrophobicContact CB-CE2 4.26Å
500	Q	37.1	Very low	33.1	Very low	269 Å²	269	171.5 Å²	171.5	100%	1.257	84%	0.84	S	S	*	*			trans	-119.6	0	150.5	-84.7	-170.1	-17.3	0	0	108

Retrieved 500 of 500 residues in 1061.7 ms (Link to these results)

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