A0A077ZF50_TRITR Loading...

Polyprenyl synt and ABC tran domain containing pr otein

AlphaFold DB , UniProt , Accession A0A077ZF50, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 428 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	G	29.9	Very low	27.8	Very low	130 Å²	130	125.9 Å²	125.9	100%	1.34	67%	0.669	S	S	*	*				0	158.7	0	0	0	0	0	0	110.7
2	K	21.6	Very low	28.4	Very low	203 Å²	203	118.8 Å²	118.8	88%	0.883	63%	0.629	S	S	*	*			trans	-122	114.6	165.8	-73	179.5	177.8	175.9	0	106.9	V4	K2-V4 PolarHBondContact O-N 2.76Å
3	F	24.6	Very low	28.8	Very low	203 Å²	203	110.8 Å²	110.8	89%	0.89	59%	0.587	S	S	*	*			trans	-71.1	123.7	176.3	-79.2	-88.9	0	0	0	109.8
4	V	23.8	Very low	29.2	Very low	128 Å²	128	108.7 Å²	108.7	78%	0.776	57%	0.57	S	S	*	*			trans	-82.1	119.7	176.8	177	0	0	0	0	108.9	K2 L6	K2-V4 PolarHBondContact O-N 2.76Å; V4-L6 PolarHBondContact O-N 3.3Å
5	Q	23.9	Very low	29.7	Very low	138 Å²	138	103.9 Å²	103.9	65%	0.645	54%	0.542	S	S	*	.			trans	-74.1	91.7	-176.7	-170	-177.6	48.4	0	0	111.3	R7	Q5-R7 VanDerWaalsContact C-N 3.34Å; Q5-R7 PolarHBondContact O-N 3.21Å
6	L	25	Very low	29.8	Very low	154 Å²	154	101.3 Å²	101.3	81%	0.806	53%	0.529	S	S	*	.			trans	-68.4	85.2	175.2	-76.5	174.9	0	0	0	112	V4 I8	V4-L6 PolarHBondContact O-N 3.3Å; L6-I8 PolarHBondContact O-N 2.71Å; L6-I8 VanDerWaalsContact O-N 3.07Å
7	R	24.3	Very low	30	Very low	171 Å²	171	101.4 Å²	101.4	65%	0.645	52%	0.521	S	S	*	.			trans	-78.3	86.7	175.2	-168.2	179.6	-65.9	174	2.3	111.1	Q5	Q5-R7 VanDerWaalsContact C-N 3.34Å; Q5-R7 PolarHBondContact O-N 3.21Å
8	I	31.6	Very low	30.2	Very low	78 Å²	78	106 Å²	106	40%	0.4	54%	0.536	S	S	.	.			trans	-67.1	134.2	168.5	-56.9	175.9	0	0	0	108.6	L6 Q12 L13 I78	L6-I8 PolarHBondContact O-N 2.71Å; L6-I8 VanDerWaalsContact O-N 3.07Å; I8-Q12 HydrophobicContact CG2-CB 4.17Å; I8-L13 HydrophobicContact CG2-CD1 3.71Å; I8-L13 HydrophobicContact CG2-CG 4.16Å; I8-I78 HydrophobicContact CB-CD1 4.04Å; I8-I78 HydrophobicContact CG2-CD1 4.36Å
9	T	32	Very low	30.4	Very low	51 Å²	51	105.3 Å²	105.3	31%	0.313	53%	0.529	S	S	.	.			trans	-95.9	150.8	175.3	67.6	0	0	0	0	111.4	E11 Q12	T9-E11 PolarHBondContact O-N 3.16Å; T9-Q12 WeakPolarHBondContact O-CB 3.32Å; T9-Q12 PolarHBondContact O-N 2.83Å; T9-Q12 WeakPolarHBondContact OG1-CG 3.47Å; T9-Q12 PolarHBondContact OG1-NE2 3.27Å
10	P	32.2	Very low	30.3	Very low	30 Å²	30	109.5 Å²	109.5	20%	0.195	54%	0.538	C	S	.	.	H	α-helix	trans	-55.9	-27.8	-179.4	-22.9	29.6	0	0	0	114.1	Q12 L13 K14 I78 L86	P10-Q12 VanDerWaalsContact C-N 3.3Å; P10-Q12 PolarHBondContact O-N 3.1Å; P10-L13 PolarHBondContact O-N 2.78Å; P10-K14 PolarHBondContact O-N 3.4Å; P10-K14 VanDerWaalsContact O-N 3.09Å; P10-I78 HydrophobicContact CB-CG2 4.38Å; P10-I78 HydrophobicContact CG-CG2 3.87Å; P10-I78 WeakPolarHBondContact CG-O 3.44Å; P10-L86 HydrophobicContact CB-CD1 3.48Å; P10-L86 VanDerWaalsContact CB-CD1 3.48Å; P10-L86 HydrophobicContact CB-CD2 3.62Å; P10-L86 HydrophobicContact CB-CG 4.05Å; P10-L86 HydrophobicContact CG-CD1 4.21Å
11	E	37.4	Very low	30.3	Very low	99 Å²	99	109.7 Å²	109.7	46%	0.463	55%	0.548	S	S	.	.	H	α-helix	trans	-72.2	-19.8	177.6	-50.6	-168.1	110	0	0	114.3	T9 K351	T9-E11 PolarHBondContact O-N 3.16Å; E11-K351 IonicContact OE1-NZ 2.67Å; E11-K351 PolarHBondContact OE1-NZ 3.41Å; E11-K351 WeakPolarHBondContact OE2-CD 3.31Å; E11-K351 IonicContact OE2-NZ 2.68Å; E11-K351 PolarHBondContact OE2-NZ 3.31Å
12	Q	34.6	Very low	30.1	Very low	40 Å²	40	110.2 Å²	110.2	19%	0.187	51%	0.514	C	S	.	.	H	α-helix	trans	-78	-40.1	174.4	-62.5	169.1	36.4	0	0	109.5	I8 T9 P10 K15 L16 R352	I8-Q12 HydrophobicContact CG2-CB 4.17Å; T9-Q12 WeakPolarHBondContact O-CB 3.32Å; T9-Q12 PolarHBondContact O-N 2.83Å; T9-Q12 WeakPolarHBondContact OG1-CG 3.47Å; T9-Q12 PolarHBondContact OG1-NE2 3.27Å; P10-Q12 VanDerWaalsContact C-N 3.3Å; P10-Q12 PolarHBondContact O-N 3.1Å; Q12-K15 PolarHBondContact O-N 3.11Å; Q12-L16 PolarHBondContact O-N 2.94Å; Q12-R352 HydrophobicContact CG-CB 4.34Å
13	L	33.5	Very low	30.3	Very low	16 Å²	16	105.3 Å²	105.3	8%	0.084	50%	0.504	C	S	.	.	H	α-helix	trans	-65.3	-44.9	174.7	-75.3	138.6	0	0	0	112.2	I8 P10 K15 L16 I78 I90 L93	I8-L13 HydrophobicContact CG2-CD1 3.71Å; I8-L13 HydrophobicContact CG2-CG 4.16Å; P10-L13 PolarHBondContact O-N 2.78Å; L13-K15 PolarHBondContact O-N 3.09Å; L13-L16 HydrophobicContact CD2-CD1 4.46Å; L13-L16 PolarHBondContact O-N 3.4Å; L13-L16 VanDerWaalsContact O-N 3.07Å; L13-I78 HydrophobicContact CD1-CD1 3.82Å; L13-I78 HydrophobicContact CD1-CG2 3.77Å; L13-I90 HydrophobicContact CB-CG1 4.18Å; L13-I90 HydrophobicContact CD1-CD1 3.79Å; L13-I90 HydrophobicContact CD1-CG1 3.91Å; L13-I90 HydrophobicContact CD1-CG2 4.48Å; L13-I90 HydrophobicContact CD2-CG1 4.35Å; L13-I90 HydrophobicContact CG-CG1 4.35Å; L13-L93 HydrophobicContact CD2-CD1 3.65Å; L13-L93 HydrophobicContact CD2-CD2 3.74Å; L13-L93 HydrophobicContact CD2-CG 4.21Å
14	K	34.1	Very low	30.4	Very low	81 Å²	81	100.6 Å²	100.6	35%	0.352	50%	0.496	S	S	.	.	H	α-helix	trans	-58	-7.8	173.4	-87.2	-170.4	168.7	-177.4	0	115.8	P10 L86 E89	P10-K14 PolarHBondContact O-N 3.4Å; P10-K14 VanDerWaalsContact O-N 3.09Å; K14-L86 HydrophobicContact CD-CD2 3.82Å; K14-L86 VanDerWaalsContact CE-CD2 3.48Å; K14-L86 HydrophobicContact CG-CD2 3.8Å; K14-E89 WeakPolarHBondContact CE-OE1 3.36Å; K14-E89 WeakPolarHBondContact CE-OE2 3.37Å; K14-E89 IonicContact NZ-OE2 2.81Å
15	K	36.5	Very low	30.4	Very low	36 Å²	36	96 Å²	96	16%	0.157	48%	0.475	C	S	.	.	H	α-helix	trans	-103.5	-28.7	174.7	-75.9	178.7	168	-162.7	0	114.6	Q12 L13 W17 K18 K351 R352 Y353	Q12-K15 PolarHBondContact O-N 3.11Å; L13-K15 PolarHBondContact O-N 3.09Å; K15-W17 PolarHBondContact O-N 3.33Å; K15-K18 PolarHBondContact O-N 2.96Å; K15-K351 VanDerWaalsContact NZ-C 3.3Å; K15-K351 PolarHBondContact NZ-O 3.37Å; K15-R352 WeakPolarHBondContact CD-O 3.49Å; K15-R352 WeakPolarHBondContact CE-O 3.43Å; K15-R352 PolarHBondContact NZ-O 3.04Å; K15-Y353 HydrophobicContact CD-CD1 4.05Å; K15-Y353 HydrophobicContact CD-CE1 4.2Å; K15-Y353 HydrophobicContact CD-CG 4.42Å; K15-Y353 VanDerWaalsContact NZ-CD1 3.35Å; K15-Y353 VanDerWaalsContact NZ-CG 3.32Å
16	L	31.4	Very low	30.4	Very low	62 Å²	62	93 Å²	93	33%	0.325	48%	0.481	S	S	.	.	H	α-helix	trans	-59.4	-31.9	170.1	-66.5	169.9	0	0	0	110.5	Q12 L13 L93	Q12-L16 PolarHBondContact O-N 2.94Å; L13-L16 HydrophobicContact CD2-CD1 4.46Å; L13-L16 PolarHBondContact O-N 3.4Å; L13-L16 VanDerWaalsContact O-N 3.07Å; L16-L93 HydrophobicContact CB-CD1 4.18Å; L16-L93 HydrophobicContact CD1-CD1 4.1Å
17	W	33	Very low	30.3	Very low	103 Å²	103	92 Å²	92	39%	0.39	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-24.1	-176.4	-87.8	34.1	0	0	0	116.7	K15 K19 E89 E92 L93	K15-W17 PolarHBondContact O-N 3.33Å; W17-K19 PolarHBondContact O-N 2.94Å; W17-E89 HydrophobicContact CE3-CB 4.25Å; W17-E89 HydrophobicContact CE3-CG 4.08Å; W17-E89 HydrophobicContact CH2-CB 4.18Å; W17-E89 HydrophobicContact CH2-CG 4.38Å; W17-E89 WeakPolarHBondContact CZ2-O 3.38Å; W17-E89 HydrophobicContact CZ3-CB 4.02Å; W17-E89 HydrophobicContact CZ3-CG 3.8Å; W17-E92 HydrophobicContact CH2-CB 3.68Å; W17-E92 WeakPolarHBondContact CH2-OE2 3.49Å; W17-E92 HydrophobicContact CZ2-CB 3.74Å; W17-L93 HydrophobicContact CZ2-CB 4.3Å
18	K	33.7	Very low	30.3	Very low	185 Å²	185	95 Å²	95	80%	0.804	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	28.5	-171.1	-68.7	-163.9	172.8	-167	0	115	K15	K15-K18 PolarHBondContact O-N 2.96Å
19	K	34	Very low	30	Very low	93 Å²	93	96.2 Å²	96.2	40%	0.404	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137	17.8	-163.9	-100.2	173.9	162.6	-73.9	0	117.8	W17 V356	W17-K19 PolarHBondContact O-N 2.94Å; K19-V356 HydrophobicContact CB-CB 4.07Å; K19-V356 HydrophobicContact CD-CB 3.91Å; K19-V356 HydrophobicContact CD-CG2 4.26Å; K19-V356 PolarHBondContact NZ-O 2.67Å
20	R	28.1	Very low	29.7	Very low	188 Å²	188	97.3 Å²	97.3	71%	0.709	52%	0.519	S	S	*	.			trans	-130.2	135.4	159.7	-67.8	-170.7	-173.6	-114.4	5.6	110.6
21	P	30.5	Very low	29.6	Very low	114 Å²	114	104.4 Å²	104.4	74%	0.74	55%	0.55	S	S	*	.			trans	-83.4	151.3	175.5	34.1	-34.1	0	0	0	111.9
22	F	25.8	Very low	29.1	Very low	141 Å²	141	105.8 Å²	105.8	62%	0.618	56%	0.56	S	S	*	*			trans	-88.7	113.5	163.9	-88.7	-62.8	0	0	0	109	P311 L313	F22-P311 HydrophobicContact CB-CB 3.85Å; F22-P311 HydrophobicContact CB-CG 3.64Å; F22-P311 HydrophobicContact CD1-CB 3.3Å; F22-P311 HydrophobicContact CD1-CG 4.08Å; F22-P311 HydrophobicContact CE1-CB 4Å; F22-P311 HydrophobicContact CG-CB 3.83Å; F22-P311 HydrophobicContact CG-CG 4.22Å; F22-L313 HydrophobicContact CB-CD2 4.35Å
23	C	27	Very low	28.8	Very low	101 Å²	101	108.1 Å²	108.1	68%	0.682	57%	0.571	S	S	*	*			trans	-84.2	121	179.2	-63	0	0	0	0	111.4	G310 P311	C23-G310 VanDerWaalsContact O-O 3.14Å; C23-P311 WeakPolarHBondContact O-CD 3.32Å; C23-P311 VanDerWaalsContact O-CG 3.23Å; C23-P311 WeakPolarHBondContact O-CG 3.31Å
24	S	26	Very low	28.7	Very low	103 Å²	103	115.7 Å²	115.7	72%	0.72	60%	0.603	S	S	*	*			trans	-66.2	133.5	-161.8	52.1	0	0	0	0	118.5
25	G	24.5	Very low	28.5	Very low	33 Å²	33	122.2 Å²	122.2	34%	0.34	63%	0.625	S	S	.	*			trans	173.2	126.7	174.5	0	0	0	0	0	110.1	G310 P311	G25-G310 WeakPolarHBondContact CA-O 3.47Å; G25-G310 PolarHBondContact N-O 2.91Å; G25-G310 CarbonylContact O-C 3.6Å; G25-P311 WeakPolarHBondContact O-CD 3.42Å
26	G	23	Very low	28.1	Very low	74 Å²	74	126.6 Å²	126.6	76%	0.763	65%	0.648	S	S	*	*			trans	-111.5	138	-169.9	0	0	0	0	0	114.1
27	C	23.8	Very low	28	Very low	133 Å²	133	132 Å²	132	90%	0.899	66%	0.664	S	S	*	*			trans	-150.1	142.4	159.4	-140.1	0	0	0	0	111.5
28	Y	23.2	Very low	28	Very low	233 Å²	233	133.1 Å²	133.1	91%	0.914	68%	0.678	S	S	*	*			trans	-86.8	127.6	-177.1	-85.7	-112.6	0	0	0	111.4
29	V	26.5	Very low	27.9	Very low	104 Å²	104	127.7 Å²	127.7	63%	0.63	66%	0.657	S	S	*	*			trans	-134.8	139.4	157.1	-173.9	0	0	0	0	108.8	E33	V29-E33 HydrophobicContact CG1-CG 4.15Å; V29-E33 WeakPolarHBondContact CG1-OE1 3.46Å
30	S	26	Very low	27.7	Very low	74 Å²	74	131.4 Å²	131.4	52%	0.517	67%	0.67	S	S	.	*			trans	-72.3	160.5	-163.4	76.2	0	0	0	0	115.4	N32 E33	S30-N32 PolarHBondContact O-N 3.49Å; S30-E33 PolarHBondContact O-N 2.98Å
31	E	28.5	Very low	27.8	Very low	180 Å²	180	128.7 Å²	128.7	84%	0.841	67%	0.669	S	S	*	*	H	α-helix	trans	-61.2	-12.1	-179.6	-66.6	-179.7	103.7	0	0	114.8
32	N	27.3	Very low	27.9	Very low	127 Å²	127	128.1 Å²	128.1	68%	0.679	66%	0.659	S	S	*	*	H	α-helix	trans	-72.6	-28.9	177.1	-73.7	-29.2	0	0	0	113.7	S30	S30-N32 PolarHBondContact O-N 3.49Å
33	E	28.6	Very low	28.1	Very low	89 Å²	89	126.5 Å²	126.5	42%	0.416	65%	0.649	S	S	.	*	H	α-helix	trans	-75.4	-30.6	-179.2	-78.6	-163.7	-161	0	0	113.6	V29 S30 R35 M36 R37	V29-E33 HydrophobicContact CG1-CG 4.15Å; V29-E33 WeakPolarHBondContact CG1-OE1 3.46Å; S30-E33 PolarHBondContact O-N 2.98Å; E33-R35 PolarHBondContact O-N 2.9Å; E33-M36 PolarHBondContact O-N 3.25Å; E33-R37 PolarHBondContact O-N 3.01Å; E33-R37 IonicContact OE2-NH2 3.82Å; E33-R37 PolarHBondContact OE2-NH2 3.43Å
34	K	31	Very low	28.2	Very low	176 Å²	176	123.4 Å²	123.4	77%	0.765	63%	0.628	S	S	*	*	H	α-helix	trans	-64.7	-27	178.8	-91.8	-177.9	174	173.6	0	112.8	M36	K34-M36 VanDerWaalsContact C-N 3.31Å
35	R	29.5	Very low	28.4	Very low	217 Å²	217	122 Å²	122	82%	0.819	62%	0.615	S	S	*	*	H	α-helix	trans	-76.2	-15.4	170.9	-96.5	-177.1	172	165	-1.4	114.1	E33	E33-R35 PolarHBondContact O-N 2.9Å
36	M	29.2	Very low	28.7	Very low	129 Å²	129	125.7 Å²	125.7	64%	0.635	63%	0.626	S	S	*	*	H	α-helix	trans	-85.6	-45.1	176.9	-67.5	-170.3	177.6	0	0	112.2	E33 K34 D38 D39 Y40	E33-M36 PolarHBondContact O-N 3.25Å; K34-M36 VanDerWaalsContact C-N 3.31Å; M36-D38 PolarHBondContact O-N 3.44Å; M36-D39 PolarHBondContact O-N 3Å; M36-Y40 WeakPolarHBondContact O-CB 3.47Å; M36-Y40 PolarHBondContact O-N 2.95Å
37	R	29.3	Very low	29.1	Very low	176 Å²	176	127.6 Å²	127.6	66%	0.664	62%	0.615	S	S	*	*	H	α-helix	trans	-64.6	-45.1	-169.9	-61.4	-169.6	-168.4	-160	2.9	114	E33 L41	E33-R37 PolarHBondContact O-N 3.01Å; E33-R37 IonicContact OE2-NH2 3.82Å; E33-R37 PolarHBondContact OE2-NH2 3.43Å; R37-L41 WeakPolarHBondContact O-CB 3.24Å; R37-L41 PolarHBondContact O-N 3.01Å
38	D	33.5	Very low	29.3	Very low	125 Å²	125	130.9 Å²	130.9	67%	0.668	61%	0.609	S	S	*	*	H	α-helix	trans	-70.1	-37.6	-178	-62	-16.1	0	0	0	112	M36 I42	M36-D38 PolarHBondContact O-N 3.44Å; D38-I42 WeakPolarHBondContact O-CG1 3.35Å
39	D	30.6	Very low	29.7	Very low	71 Å²	71	126.8 Å²	126.8	38%	0.38	60%	0.596	S	S	.	*	H	α-helix	trans	-74.1	-42.4	176.9	-123.8	-1.9	0	0	0	111	M36 R43	M36-D39 PolarHBondContact O-N 3Å; D39-R43 WeakPolarHBondContact O-CB 3.48Å; D39-R43 VanDerWaalsContact O-CG 3.28Å; D39-R43 WeakPolarHBondContact O-CG 3.41Å; D39-R43 PolarHBondContact O-N 3.41Å; D39-R43 IonicContact OD1-CZ 3.88Å; D39-R43 VanDerWaalsContact OD1-CZ 3.24Å; D39-R43 IonicContact OD1-NE 2.84Å; D39-R43 IonicContact OD1-NH1 2.88Å; D39-R43 IonicContact OD1-NH2 3.57Å; D39-R43 PolarHBondContact OD1-NH2 3.38Å; D39-R43 IonicContact OD2-CZ 2.9Å; D39-R43 IonicContact OD2-NH1 3.56Å; D39-R43 PolarHBondContact OD2-NH1 3.14Å; D39-R43 IonicContact OD2-NH2 2.69Å; D39-R43 PolarHBondContact OD2-NH2 3.38Å
40	Y	29.2	Very low	29.8	Very low	171 Å²	171	130.4 Å²	130.4	67%	0.671	61%	0.606	S	S	*	*	H	α-helix	trans	-77.8	-30.6	-173.5	-149.4	-93.4	0	0	0	113.2	M36 S44	M36-Y40 WeakPolarHBondContact O-CB 3.47Å; M36-Y40 PolarHBondContact O-N 2.95Å; Y40-S44 WeakPolarHBondContact O-CB 3.45Å; Y40-S44 PolarHBondContact O-N 3.49Å; Y40-S44 PolarHBondContact O-OG 2.94Å
41	L	31.4	Very low	29.8	Very low	131 Å²	131	133.8 Å²	133.8	69%	0.686	62%	0.617	S	S	*	*	H	α-helix	trans	-73.2	-36.4	174.2	-153.7	79.1	0	0	0	111.6	R37 V45	R37-L41 WeakPolarHBondContact O-CB 3.24Å; R37-L41 PolarHBondContact O-N 3.01Å; L41-V45 WeakPolarHBondContact O-CG2 3.49Å
42	I	32.3	Very low	29.7	Very low	102 Å²	102	133.6 Å²	133.6	52%	0.523	62%	0.616	S	S	.	*	H	α-helix	trans	-76.3	-42.5	177	-66	177	0	0	0	110.6	D38 V45 L46	D38-I42 WeakPolarHBondContact O-CG1 3.35Å; I42-V45 PolarHBondContact O-N 3.22Å; I42-L46 HydrophobicContact CG2-CD1 3.77Å; I42-L46 WeakPolarHBondContact O-CB 3.46Å; I42-L46 VanDerWaalsContact O-CG 3.29Å; I42-L46 WeakPolarHBondContact O-CG 3.28Å; I42-L46 PolarHBondContact O-N 3.38Å
43	R	28.7	Very low	29.5	Very low	108 Å²	108	137.1 Å²	137.1	41%	0.408	63%	0.629	S	S	.	*	H	α-helix	trans	-67.3	-44.7	174.7	-78.4	-178.5	-179.7	127.1	30	113.2	D39 V45 L46 E47	D39-R43 WeakPolarHBondContact O-CB 3.48Å; D39-R43 VanDerWaalsContact O-CG 3.28Å; D39-R43 WeakPolarHBondContact O-CG 3.41Å; D39-R43 PolarHBondContact O-N 3.41Å; D39-R43 IonicContact OD1-CZ 3.88Å; D39-R43 VanDerWaalsContact OD1-CZ 3.24Å; D39-R43 IonicContact OD1-NE 2.84Å; D39-R43 IonicContact OD1-NH1 2.88Å; D39-R43 IonicContact OD1-NH2 3.57Å; D39-R43 PolarHBondContact OD1-NH2 3.38Å; D39-R43 IonicContact OD2-CZ 2.9Å; D39-R43 IonicContact OD2-NH1 3.56Å; D39-R43 PolarHBondContact OD2-NH1 3.14Å; D39-R43 IonicContact OD2-NH2 2.69Å; D39-R43 PolarHBondContact OD2-NH2 3.38Å; R43-V45 PolarHBondContact O-N 3.48Å; R43-V45 VanDerWaalsContact O-N 3.07Å; R43-L46 CarbonylContact O-C 3.59Å; R43-L46 PolarHBondContact O-N 2.69Å; R43-E47 HydrophobicContact CB-CG 4.05Å; R43-E47 WeakPolarHBondContact CD-OE1 3.31Å; R43-E47 HydrophobicContact CG-CG 4.24Å; R43-E47 WeakPolarHBondContact CG-OE1 3.12Å; R43-E47 IonicContact NE-OE1 3.11Å; R43-E47 WeakPolarHBondContact O-CB 3.44Å; R43-E47 PolarHBondContact O-N 3.35Å
44	S	30.4	Very low	29.2	Very low	36 Å²	36	138.5 Å²	138.5	25%	0.252	64%	0.643	S	S	.	*	H	α-helix	trans	-64	-17.9	179.5	61.6	0	0	0	0	114.1	Y40 R48	Y40-S44 WeakPolarHBondContact O-CB 3.45Å; Y40-S44 PolarHBondContact O-N 3.49Å; Y40-S44 PolarHBondContact O-OG 2.94Å; S44-R48 WeakPolarHBondContact O-CB 3.46Å; S44-R48 WeakPolarHBondContact O-CD 3.27Å; S44-R48 VanDerWaalsContact O-CG 3.24Å; S44-R48 WeakPolarHBondContact O-CG 3.42Å
45	V	30.8	Very low	28.8	Very low	73 Å²	73	137.3 Å²	137.3	44%	0.442	65%	0.645	S	S	.	*	H	α-helix	trans	-92.1	-18.3	173.3	174.2	0	0	0	0	113	L41 I42 R43	L41-V45 WeakPolarHBondContact O-CG2 3.49Å; I42-V45 PolarHBondContact O-N 3.22Å; R43-V45 PolarHBondContact O-N 3.48Å; R43-V45 VanDerWaalsContact O-N 3.07Å
46	L	30.4	Very low	28.5	Very low	110 Å²	110	135.6 Å²	135.6	58%	0.576	65%	0.649	S	S	*	*	H	α-helix	trans	-105.9	-47.2	-178.9	-67.4	174.9	0	0	0	113.4	I42 R43 R48 K49	I42-L46 HydrophobicContact CG2-CD1 3.77Å; I42-L46 WeakPolarHBondContact O-CB 3.46Å; I42-L46 VanDerWaalsContact O-CG 3.29Å; I42-L46 WeakPolarHBondContact O-CG 3.28Å; I42-L46 PolarHBondContact O-N 3.38Å; R43-L46 CarbonylContact O-C 3.59Å; R43-L46 PolarHBondContact O-N 2.69Å; L46-R48 VanDerWaalsContact C-N 3.34Å; L46-R48 PolarHBondContact O-N 3.21Å; L46-K49 WeakPolarHBondContact O-CB 2.72Å; L46-K49 PolarHBondContact O-N 3.11Å
47	E	29.8	Very low	28.2	Very low	115 Å²	115	134 Å²	134	54%	0.537	66%	0.656	S	S	.	*	G	3₁₀ helix	trans	-71.4	-27.9	-179.4	-62	179.8	164.6	0	0	112.1	R43 K49 E50	R43-E47 HydrophobicContact CB-CG 4.05Å; R43-E47 WeakPolarHBondContact CD-OE1 3.31Å; R43-E47 HydrophobicContact CG-CG 4.24Å; R43-E47 WeakPolarHBondContact CG-OE1 3.12Å; R43-E47 IonicContact NE-OE1 3.11Å; R43-E47 WeakPolarHBondContact O-CB 3.44Å; R43-E47 PolarHBondContact O-N 3.35Å; E47-K49 PolarHBondContact O-N 3.23Å; E47-E50 PolarHBondContact O-N 3.18Å
48	R	29.3	Very low	28	Very low	201 Å²	201	131 Å²	131	76%	0.758	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-72.8	15.7	170.1	-66.5	-169.9	178.8	-164.1	1.5	114	S44 L46	S44-R48 WeakPolarHBondContact O-CB 3.46Å; S44-R48 WeakPolarHBondContact O-CD 3.27Å; S44-R48 VanDerWaalsContact O-CG 3.24Å; S44-R48 WeakPolarHBondContact O-CG 3.42Å; L46-R48 VanDerWaalsContact C-N 3.34Å; L46-R48 PolarHBondContact O-N 3.21Å
49	K	30.4	Very low	27.8	Very low	148 Å²	148	133.5 Å²	133.5	64%	0.643	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-116.3	2.1	174.2	-69.9	-173.3	173.2	-179.8	0	114.6	L46 E47	L46-K49 WeakPolarHBondContact O-CB 2.72Å; L46-K49 PolarHBondContact O-N 3.11Å; E47-K49 PolarHBondContact O-N 3.23Å
50	E	29.1	Very low	28.1	Very low	179 Å²	179	134.9 Å²	134.9	84%	0.836	67%	0.669	S	S	*	*	S	Bend	trans	-98.3	2.9	172.9	-61.4	-163.1	135.1	0	0	113.2	E47	E47-E50 PolarHBondContact O-N 3.18Å
51	L	26	Very low	29	Very low	145 Å²	145	128 Å²	128	76%	0.759	65%	0.645	S	S	*	*	S	Bend	trans	-128.9	155.9	175.5	-75.1	165.1	0	0	0	110.7
52	E	26.1	Very low	30.2	Very low	176 Å²	176	124.1 Å²	124.1	82%	0.822	63%	0.629	S	S	*	*			trans	67.5	83.8	176.2	-60.8	-175.3	171.5	0	0	116.1	T54	E52-T54 PolarHBondContact O-N 3.28Å; E52-T54 VanDerWaalsContact O-N 3.07Å
53	Q	23.1	Very low	31.7	Very low	201 Å²	201	119.3 Å²	119.3	94%	0.939	60%	0.604	S	S	*	*			trans	-66	90.5	157.9	-65.8	173.7	-25.6	0	0	110.6
54	T	23.4	Very low	33.4	Very low	118 Å²	118	115.9 Å²	115.9	72%	0.724	60%	0.6	S	S	*	*			trans	-153.2	159.8	163.2	7	0	0	0	0	112	E52	E52-T54 PolarHBondContact O-N 3.28Å; E52-T54 VanDerWaalsContact O-N 3.07Å
55	D	22.5	Very low	35.1	Very low	151 Å²	151	119 Å²	119	81%	0.807	62%	0.62	S	S	*	*	S	Bend	trans	-66.4	165.2	-173.6	-65.7	-80.9	0	0	0	115.2
56	M	23.4	Very low	37.1	Very low	181 Å²	181	116.1 Å²	116.1	89%	0.892	60%	0.603	S	S	*	*			trans	76.6	40.8	178.6	-52.1	-172.9	-68.6	0	0	117	V58	M56-V58 PolarHBondContact O-N 3.16Å
57	A	22.6	Very low	39.3	Very low	95 Å²	95	111.3 Å²	111.3	79%	0.785	58%	0.578	S	S	*	*			trans	-60.2	108.8	163.9	0	0	0	0	0	111.7	K59	A57-K59 PolarHBondContact O-N 3.36Å
58	V	25.7	Very low	41.5	Very low	115 Å²	115	110.8 Å²	110.8	70%	0.697	58%	0.579	S	S	*	*			trans	-60.2	111.3	173.7	177.6	0	0	0	0	109.3	M56 L60	M56-V58 PolarHBondContact O-N 3.16Å; V58-L60 PolarHBondContact O-N 3.23Å
59	K	29.1	Very low	43.5	Very low	177 Å²	177	105 Å²	105	77%	0.77	56%	0.563	S	S	*	*			trans	-68	96	171.5	-77.9	-172.9	175.6	-176.2	0	109.5	A57	A57-K59 PolarHBondContact O-N 3.36Å
60	L	35.5	Very low	45.4	Very low	99 Å²	99	98.9 Å²	98.9	52%	0.518	54%	0.537	S	S	.	.			trans	-43.5	129.5	148.6	-87	153.1	0	0	0	107.8	V58 S62	V58-L60 PolarHBondContact O-N 3.23Å; L60-S62 PolarHBondContact O-N 3.41Å
61	P	48.2	Very low	47.6	Very low	27 Å²	27	91.9 Å²	91.9	18%	0.175	50%	0.504	C	S	.	.			trans	-60.9	129.4	-173.7	26.9	-34.8	0	0	0	108.2	I63 A64 S107 I284	P61-I63 HydrophobicContact CB-CG2 4Å; P61-I63 HydrophobicContact CG-CG2 4.24Å; P61-I63 PolarHBondContact O-N 3.47Å; P61-A64 WeakPolarHBondContact O-CB 3.28Å; P61-A64 PolarHBondContact O-N 3.34Å; P61-S107 WeakPolarHBondContact CB-OG 3.5Å; P61-I284 HydrophobicContact CG-CD1 4.17Å
62	S	58.1	Low	50	Low	50 Å²	50	90.5 Å²	90.5	35%	0.35	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.4	-160.4	85.6	0	0	0	0	113.9	L60 A64 C65 L110	L60-S62 PolarHBondContact O-N 3.41Å; S62-A64 VanDerWaalsContact C-N 3.32Å; S62-A64 PolarHBondContact O-N 2.74Å; S62-C65 WeakPolarHBondContact O-CB 3.48Å; S62-C65 PolarHBondContact O-N 3.3Å; S62-L110 WeakPolarHBondContact OG-CD2 3.46Å
63	I	63.5	Low	52.1	Low	0 Å²	0	85.1 Å²	85.1	0%	0	47%	0.471	C	S	.	.	H	α-helix	trans	-51.4	-41.9	164.4	-168.8	169.4	0	0	0	113.5	P61 C65 S66 F67 L103 G106 L110 S129 W133 E136	P61-I63 HydrophobicContact CB-CG2 4Å; P61-I63 HydrophobicContact CG-CG2 4.24Å; P61-I63 PolarHBondContact O-N 3.47Å; I63-C65 PolarHBondContact O-N 3.1Å; I63-C65 VanDerWaalsContact O-N 3.16Å; I63-S66 PolarHBondContact O-N 3.2Å; I63-S66 PolarHBondContact O-OG 3.12Å; I63-F67 PolarHBondContact O-N 3.24Å; I63-L103 HydrophobicContact CG2-CD1 4.42Å; I63-G106 VanDerWaalsContact CD1-CA 3.49Å; I63-L110 HydrophobicContact CB-CD2 4.42Å; I63-S129 WeakPolarHBondContact CA-OG 3.47Å; I63-W133 HydrophobicContact CD1-CD2 4.33Å; I63-W133 HydrophobicContact CD1-CG 4.36Å; I63-W133 HydrophobicContact CG1-CD2 4.06Å; I63-W133 HydrophobicContact CG1-CG 4.09Å; I63-W133 HydrophobicContact CG1-CZ2 3.99Å; I63-W133 VanDerWaalsContact CG1-NE1 3.35Å; I63-W133 PolarHBondContact O-NE1 3.28Å; I63-E136 HydrophobicContact CD1-CG 4.41Å
64	A	64.8	Low	54.3	Low	37 Å²	37	77.4 Å²	77.4	31%	0.306	44%	0.436	S	S	.	.	H	α-helix	trans	-56.9	-36.2	179.2	0	0	0	0	0	112.2	P61 S62 S66 F67	P61-A64 WeakPolarHBondContact O-CB 3.28Å; P61-A64 PolarHBondContact O-N 3.34Å; S62-A64 VanDerWaalsContact C-N 3.32Å; S62-A64 PolarHBondContact O-N 2.74Å; A64-S66 VanDerWaalsContact C-N 3.33Å; A64-S66 PolarHBondContact O-N 2.91Å; A64-F67 WeakPolarHBondContact O-CB 3.49Å; A64-F67 PolarHBondContact O-N 2.89Å
65	C	66.2	Low	56.4	Low	101 Å²	101	72.8 Å²	72.8	68%	0.682	41%	0.406	S	S	*	.	H	α-helix	trans	-70.4	-24.8	179.6	-58.6	0	0	0	0	113.6	S62 I63	S62-C65 WeakPolarHBondContact O-CB 3.48Å; S62-C65 PolarHBondContact O-N 3.3Å; I63-C65 PolarHBondContact O-N 3.1Å; I63-C65 VanDerWaalsContact O-N 3.16Å
66	S	71.1	Confident	58.7	Low	13 Å²	13	70.9 Å²	70.9	9%	0.091	39%	0.393	C	S	.	.	H	α-helix	trans	-90.5	-6.2	179	68.7	0	0	0	0	113.8	I63 A64 N68 L69 V70 S129 W133	I63-S66 PolarHBondContact O-N 3.2Å; I63-S66 PolarHBondContact O-OG 3.12Å; A64-S66 VanDerWaalsContact C-N 3.33Å; A64-S66 PolarHBondContact O-N 2.91Å; S66-N68 VanDerWaalsContact C-N 3.33Å; S66-N68 PolarHBondContact O-N 3.39Å; S66-L69 WeakPolarHBondContact O-CB 3.4Å; S66-L69 PolarHBondContact O-N 3.26Å; S66-V70 PolarHBondContact O-N 3.46Å; S66-S129 WeakPolarHBondContact CB-OG 3.5Å; S66-S129 PolarHBondContact OG-OG 2.6Å; S66-W133 PolarHBondContact OG-NE1 2.91Å
67	F	78	Confident	60.8	Low	8 Å²	8	67.3 Å²	67.3	4%	0.035	38%	0.377	C	S	.	.	H	α-helix	trans	-51.4	-49.8	-179.5	179.3	-110.8	0	0	0	112.5	I63 A64 L69 V70 K71 L94 D95 L98 L99 W133	I63-F67 PolarHBondContact O-N 3.24Å; A64-F67 WeakPolarHBondContact O-CB 3.49Å; A64-F67 PolarHBondContact O-N 2.89Å; F67-L69 PolarHBondContact O-N 2.97Å; F67-V70 PolarHBondContact O-N 2.95Å; F67-V70 VanDerWaalsContact O-N 3.17Å; F67-K71 HydrophobicContact CD1-CD 4.31Å; F67-K71 HydrophobicContact CE1-CB 4.39Å; F67-K71 HydrophobicContact CE1-CD 3.62Å; F67-K71 HydrophobicContact CZ-CB 4.4Å; F67-K71 HydrophobicContact CZ-CD 4Å; F67-K71 WeakPolarHBondContact O-CB 3.3Å; F67-K71 PolarHBondContact O-N 3.47Å; F67-L94 HydrophobicContact CZ-CB 4.38Å; F67-D95 VanDerWaalsContact CE1-OD1 3.32Å; F67-D95 WeakPolarHBondContact CE1-OD1 3.48Å; F67-L98 HydrophobicContact CE2-CB 3.73Å; F67-L98 HydrophobicContact CE2-CD1 3.84Å; F67-L98 HydrophobicContact CE2-CG 4.42Å; F67-L98 HydrophobicContact CZ-CB 4.36Å; F67-L99 HydrophobicContact CD1-CD1 4.32Å; F67-L99 HydrophobicContact CD1-CD2 3.8Å; F67-L99 HydrophobicContact CD1-CG 4.37Å; F67-L99 HydrophobicContact CD2-CD2 4.17Å; F67-L99 HydrophobicContact CE1-CD1 3.75Å; F67-L99 HydrophobicContact CE1-CD2 3.78Å; F67-L99 HydrophobicContact CE1-CG 3.85Å; F67-L99 HydrophobicContact CE2-CD2 4.17Å; F67-L99 HydrophobicContact CE2-CG 4.46Å; F67-L99 HydrophobicContact CG-CD2 3.98Å; F67-L99 HydrophobicContact CZ-CD1 4.22Å; F67-L99 HydrophobicContact CZ-CD2 3.97Å; F67-L99 HydrophobicContact CZ-CG 3.89Å; F67-W133 HydrophobicContact CB-CH2 4.22Å; F67-W133 HydrophobicContact CB-CZ2 3.52Å; F67-W133 HydrophobicContact CD2-CD2 4.18Å; F67-W133 AromaticContact CD2-CE2 3.92Å; F67-W133 HydrophobicContact CD2-CE3 4.08Å; F67-W133 AromaticContact CD2-CH2 3.57Å; F67-W133 HydrophobicContact CD2-CH2 3.57Å; F67-W133 AromaticContact CD2-CZ2 3.66Å; F67-W133 HydrophobicContact CD2-CZ2 3.66Å; F67-W133 AromaticContact CD2-CZ3 3.79Å; F67-W133 HydrophobicContact CD2-CZ3 3.79Å; F67-W133 HydrophobicContact CE2-CH2 4.35Å; F67-W133 HydrophobicContact CE2-CZ3 4.27Å; F67-W133 HydrophobicContact CG-CH2 4.21Å; F67-W133 AromaticContact CG-CZ2 3.99Å; F67-W133 HydrophobicContact CG-CZ2 3.99Å
68	N	75	Confident	62.7	Low	105 Å²	105	63.7 Å²	63.7	56%	0.561	34%	0.344	S	S	*	.	H	α-helix	trans	-62.4	-30.1	-179	-73.7	-35.8	0	0	0	112.9	S66 K72	S66-N68 VanDerWaalsContact C-N 3.33Å; S66-N68 PolarHBondContact O-N 3.39Å; N68-K72 WeakPolarHBondContact O-CB 3.32Å; N68-K72 PolarHBondContact O-N 3.42Å
69	L	72.2	Confident	64.5	Low	80 Å²	80	58.8 Å²	58.8	42%	0.419	32%	0.315	S	S	.	.	H	α-helix	trans	-72	-47.3	174.5	-178.8	64.4	0	0	0	110.9	S66 F67 K72 V73	S66-L69 WeakPolarHBondContact O-CB 3.4Å; S66-L69 PolarHBondContact O-N 3.26Å; F67-L69 PolarHBondContact O-N 2.97Å; L69-K72 PolarHBondContact O-N 3.12Å; L69-V73 WeakPolarHBondContact O-CG2 3.33Å; L69-V73 PolarHBondContact O-N 3.18Å
70	V	70.4	Confident	66.1	Low	18 Å²	18	58.2 Å²	58.2	11%	0.109	31%	0.313	C	S	.	.	H	α-helix	trans	-64.3	-47.1	178.4	174.5	0	0	0	0	111.2	S66 F67 K72 V73 I74 Q130 W133 L137	S66-V70 PolarHBondContact O-N 3.46Å; F67-V70 PolarHBondContact O-N 2.95Å; F67-V70 VanDerWaalsContact O-N 3.17Å; V70-K72 VanDerWaalsContact C-N 3.33Å; V70-K72 PolarHBondContact O-N 3.29Å; V70-V73 PolarHBondContact O-N 3.09Å; V70-I74 HydrophobicContact CG1-CD1 3.74Å; V70-I74 HydrophobicContact CG1-CG1 4.38Å; V70-I74 VanDerWaalsContact O-CG1 3.31Å; V70-I74 WeakPolarHBondContact O-CG1 3.42Å; V70-I74 PolarHBondContact O-N 3.26Å; V70-Q130 HydrophobicContact CG2-CB 4.37Å; V70-Q130 HydrophobicContact CG2-CG 3.94Å; V70-W133 HydrophobicContact CB-CB 4.34Å; V70-W133 HydrophobicContact CB-CG 4.29Å; V70-W133 HydrophobicContact CG1-CB 3.98Å; V70-W133 HydrophobicContact CG1-CG 4.36Å; V70-W133 HydrophobicContact CG2-CB 3.95Å; V70-W133 HydrophobicContact CG2-CG 3.97Å; V70-L137 HydrophobicContact CG1-CD1 3.98Å
71	K	75.4	Confident	67.1	Low	32 Å²	32	58.8 Å²	58.8	14%	0.139	33%	0.325	C	S	.	.	H	α-helix	trans	-53.7	-47.6	173.1	174.9	179	174.4	-177.2	0	111.7	F67 I74 I75 S91 L94 D95	F67-K71 HydrophobicContact CD1-CD 4.31Å; F67-K71 HydrophobicContact CE1-CB 4.39Å; F67-K71 HydrophobicContact CE1-CD 3.62Å; F67-K71 HydrophobicContact CZ-CB 4.4Å; F67-K71 HydrophobicContact CZ-CD 4Å; F67-K71 WeakPolarHBondContact O-CB 3.3Å; F67-K71 PolarHBondContact O-N 3.47Å; K71-I74 PolarHBondContact O-N 2.93Å; K71-I75 HydrophobicContact CG-CD1 3.83Å; K71-I75 WeakPolarHBondContact O-CB 3.48Å; K71-I75 VanDerWaalsContact O-CG1 3.25Å; K71-I75 WeakPolarHBondContact O-CG1 3.39Å; K71-I75 PolarHBondContact O-N 2.83Å; K71-S91 WeakPolarHBondContact CE-OG 3.27Å; K71-S91 PolarHBondContact NZ-OG 2.79Å; K71-L94 HydrophobicContact CB-CD1 4.43Å; K71-L94 HydrophobicContact CG-CD1 3.98Å; K71-D95 WeakPolarHBondContact CE-OD1 3.31Å; K71-D95 IonicContact NZ-OD1 3.24Å; K71-D95 PolarHBondContact NZ-OD1 2.94Å; K71-D95 IonicContact NZ-OD2 3.64Å; K71-D95 PolarHBondContact NZ-OD2 3.05Å
72	K	75.4	Confident	67.5	Low	117 Å²	117	64.5 Å²	64.5	51%	0.509	35%	0.354	S	S	.	.	H	α-helix	trans	-59	-50.8	175	177.7	178	173.7	-179	0	111.5	N68 L69 V70 I74 I75 E76	N68-K72 WeakPolarHBondContact O-CB 3.32Å; N68-K72 PolarHBondContact O-N 3.42Å; L69-K72 PolarHBondContact O-N 3.12Å; V70-K72 VanDerWaalsContact C-N 3.33Å; V70-K72 PolarHBondContact O-N 3.29Å; K72-I74 VanDerWaalsContact C-N 3.33Å; K72-I74 PolarHBondContact O-N 3.43Å; K72-I75 PolarHBondContact O-N 2.89Å; K72-E76 WeakPolarHBondContact CE-OE1 3.28Å; K72-E76 WeakPolarHBondContact CE-OE2 3.35Å; K72-E76 HydrophobicContact CG-CG 4.28Å; K72-E76 IonicContact NZ-OE1 3.84Å; K72-E76 WeakPolarHBondContact O-CB 3.41Å; K72-E76 WeakPolarHBondContact O-CG 3.32Å; K72-E76 PolarHBondContact O-N 2.67Å
73	V	70.4	Confident	67.6	Low	63 Å²	63	64.6 Å²	64.6	38%	0.382	35%	0.352	S	S	.	.	H	α-helix	trans	-60.7	-39.4	179.8	169.7	0	0	0	0	112.1	L69 V70 N77	L69-V73 WeakPolarHBondContact O-CG2 3.33Å; L69-V73 PolarHBondContact O-N 3.18Å; V70-V73 PolarHBondContact O-N 3.09Å; V73-N77 WeakPolarHBondContact O-CB 3.49Å; V73-N77 PolarHBondContact O-N 2.92Å; V73-N77 PolarHBondContact O-ND2 3.03Å
74	I	68.9	Low	67.7	Low	39 Å²	39	71.5 Å²	71.5	20%	0.2	39%	0.388	C	S	.	.	H	α-helix	trans	-64.3	-48.8	175.4	-69.1	166.7	0	0	0	110.6	V70 K71 K72 E76 N77 I78 L94 L137	V70-I74 HydrophobicContact CG1-CD1 3.74Å; V70-I74 HydrophobicContact CG1-CG1 4.38Å; V70-I74 VanDerWaalsContact O-CG1 3.31Å; V70-I74 WeakPolarHBondContact O-CG1 3.42Å; V70-I74 PolarHBondContact O-N 3.26Å; K71-I74 PolarHBondContact O-N 2.93Å; K72-I74 VanDerWaalsContact C-N 3.33Å; K72-I74 PolarHBondContact O-N 3.43Å; I74-E76 PolarHBondContact O-N 3.41Å; I74-N77 PolarHBondContact O-N 2.87Å; I74-I78 HydrophobicContact CG2-CD1 3.69Å; I74-I78 VanDerWaalsContact O-CG1 3.29Å; I74-I78 WeakPolarHBondContact O-CG1 3.28Å; I74-I78 PolarHBondContact O-N 2.99Å; I74-I78 VanDerWaalsContact O-N 3.1Å; I74-L94 HydrophobicContact CB-CD1 4.23Å; I74-L94 HydrophobicContact CD1-CD2 4.2Å; I74-L94 HydrophobicContact CG2-CD1 3.91Å; I74-L94 HydrophobicContact CG2-CD2 4.42Å; I74-L137 HydrophobicContact CD1-CD1 3.64Å; I74-L137 HydrophobicContact CD1-CD2 3.94Å; I74-L137 HydrophobicContact CD1-CG 4.47Å
75	I	68.7	Low	67.6	Low	21 Å²	21	76.2 Å²	76.2	11%	0.108	40%	0.401	C	S	.	.	H	α-helix	trans	-61	-45.4	179.1	-71.9	169.2	0	0	0	110.7	K71 K72 N77 I78 C79 T87 I90 L94	K71-I75 HydrophobicContact CG-CD1 3.83Å; K71-I75 WeakPolarHBondContact O-CB 3.48Å; K71-I75 VanDerWaalsContact O-CG1 3.25Å; K71-I75 WeakPolarHBondContact O-CG1 3.39Å; K71-I75 PolarHBondContact O-N 2.83Å; K72-I75 PolarHBondContact O-N 2.89Å; I75-N77 VanDerWaalsContact C-N 3.34Å; I75-N77 PolarHBondContact O-N 2.91Å; I75-I78 PolarHBondContact O-N 3.25Å; I75-C79 WeakPolarHBondContact O-CA 3.37Å; I75-C79 VanDerWaalsContact O-CB 3.32Å; I75-C79 WeakPolarHBondContact O-CB 3.38Å; I75-C79 PolarHBondContact O-N 3.32Å; I75-T87 HydrophobicContact CG2-CG2 3.74Å; I75-I90 HydrophobicContact CG1-CB 4.43Å; I75-I90 HydrophobicContact CG1-CG2 3.89Å; I75-L94 HydrophobicContact CD1-CD1 4.46Å; I75-L94 HydrophobicContact CG1-CD1 4.2Å
76	E	69.3	Low	67.6	Low	111 Å²	111	72.5 Å²	72.5	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-65.3	-32.1	178.4	-71.9	175.5	151.6	0	0	113.2	K72 I74	K72-E76 WeakPolarHBondContact CE-OE1 3.28Å; K72-E76 WeakPolarHBondContact CE-OE2 3.35Å; K72-E76 HydrophobicContact CG-CG 4.28Å; K72-E76 IonicContact NZ-OE1 3.84Å; K72-E76 WeakPolarHBondContact O-CB 3.41Å; K72-E76 WeakPolarHBondContact O-CG 3.32Å; K72-E76 PolarHBondContact O-N 2.67Å; I74-E76 PolarHBondContact O-N 3.41Å
77	N	67.8	Low	67.6	Low	106 Å²	106	74.4 Å²	74.4	57%	0.567	39%	0.386	S	S	*	.	H	α-helix	trans	-76.4	-25.5	175.9	-86.3	-86.1	0	0	0	113.7	V73 I74 I75	V73-N77 WeakPolarHBondContact O-CB 3.49Å; V73-N77 PolarHBondContact O-N 2.92Å; V73-N77 PolarHBondContact O-ND2 3.03Å; I74-N77 PolarHBondContact O-N 2.87Å; I75-N77 VanDerWaalsContact C-N 3.34Å; I75-N77 PolarHBondContact O-N 2.91Å
78	I	63.7	Low	67.4	Low	19 Å²	19	80.2 Å²	80.2	10%	0.097	41%	0.411	C	S	.	.	H	α-helix	trans	-99.6	-48.5	-175.4	-62.2	176.2	0	0	0	111	I8 P10 L13 I74 I75 K80 I90	I8-I78 HydrophobicContact CB-CD1 4.04Å; I8-I78 HydrophobicContact CG2-CD1 4.36Å; P10-I78 HydrophobicContact CB-CG2 4.38Å; P10-I78 HydrophobicContact CG-CG2 3.87Å; P10-I78 WeakPolarHBondContact CG-O 3.44Å; L13-I78 HydrophobicContact CD1-CD1 3.82Å; L13-I78 HydrophobicContact CD1-CG2 3.77Å; I74-I78 HydrophobicContact CG2-CD1 3.69Å; I74-I78 VanDerWaalsContact O-CG1 3.29Å; I74-I78 WeakPolarHBondContact O-CG1 3.28Å; I74-I78 PolarHBondContact O-N 2.99Å; I74-I78 VanDerWaalsContact O-N 3.1Å; I75-I78 PolarHBondContact O-N 3.25Å; I78-K80 PolarHBondContact O-N 2.95Å; I78-I90 HydrophobicContact CB-CD1 4.4Å; I78-I90 HydrophobicContact CG2-CD1 3.66Å
79	C	63.3	Low	67	Low	11 Å²	11	76.7 Å²	76.7	7%	0.074	39%	0.392	C	S	.	.	S	Bend	trans	-85.6	89.2	171.8	-69.9	0	0	0	0	110.6	I75 S81 T87	I75-C79 WeakPolarHBondContact O-CA 3.37Å; I75-C79 VanDerWaalsContact O-CB 3.32Å; I75-C79 WeakPolarHBondContact O-CB 3.38Å; I75-C79 PolarHBondContact O-N 3.32Å; C79-S81 PolarHBondContact O-N 3.1Å; C79-T87 PolarHBondContact SG-N 3.49Å; C79-T87 PolarHBondContact SG-OG1 2.92Å
80	K	62.9	Low	66.8	Low	166 Å²	166	73 Å²	73	72%	0.722	37%	0.372	S	S	*	.			trans	-60	120	161.1	-67.9	-173.2	174.5	-169.9	0	109.4	I78 D82	I78-K80 PolarHBondContact O-N 2.95Å; K80-D82 VanDerWaalsContact C-N 3.27Å; K80-D82 PolarHBondContact O-N 3.09Å
81	S	56	Low	67	Low	111 Å²	111	73.4 Å²	73.4	78%	0.776	38%	0.375	S	S	*	.	S	Bend	trans	42.9	-61.6	165.6	-52.9	0	0	0	0	119	C79	C79-S81 PolarHBondContact O-N 3.1Å
82	D	55.6	Low	66.9	Low	147 Å²	147	75.9 Å²	75.9	79%	0.786	39%	0.387	S	S	*	.	S	Bend	trans	-108.8	10.6	-150.2	-49.2	-54	0	0	0	114	K80	K80-D82 VanDerWaalsContact C-N 3.27Å; K80-D82 PolarHBondContact O-N 3.09Å
83	T	61.4	Low	66.3	Low	52 Å²	52	71.1 Å²	71.1	32%	0.319	37%	0.368	S	S	.	.			trans	-117.9	56.9	-168.1	51.8	0	0	0	0	114.4	F85 L86 T87	T83-F85 PolarHBondContact O-N 2.9Å; T83-L86 HydrophobicContact CG2-CD1 4.05Å; T83-L86 WeakPolarHBondContact O-CB 3.4Å; T83-L86 PolarHBondContact O-N 3.06Å; T83-T87 PolarHBondContact O-N 3.44Å; T83-T87 PolarHBondContact O-OG1 3.05Å
84	I	65.6	Low	66.1	Low	145 Å²	145	68.6 Å²	68.6	74%	0.744	35%	0.352	S	S	*	.	H	α-helix	trans	-45.2	-40.6	178.6	-60.5	171.4	0	0	0	113.3	T87 K88	I84-T87 WeakPolarHBondContact O-CB 3.44Å; I84-T87 PolarHBondContact O-N 3.39Å; I84-K88 PolarHBondContact O-N 3Å
85	F	62	Low	66.2	Low	135 Å²	135	68.8 Å²	68.8	59%	0.592	35%	0.353	S	S	*	.	H	α-helix	trans	-62.5	-44.7	178.2	-175.1	-90.8	0	0	0	112.8	T83 K88 E89	T83-F85 PolarHBondContact O-N 2.9Å; F85-K88 PolarHBondContact O-N 2.99Å; F85-E89 HydrophobicContact CD1-CG 4.33Å; F85-E89 VanDerWaalsContact CD1-OE2 3.28Å; F85-E89 WeakPolarHBondContact CD1-OE2 3.39Å; F85-E89 HydrophobicContact CE1-CG 4.02Å; F85-E89 VanDerWaalsContact CE1-OE1 3.28Å; F85-E89 WeakPolarHBondContact CE1-OE1 3.49Å; F85-E89 WeakPolarHBondContact CE1-OE2 3.29Å; F85-E89 PolarHBondContact O-N 3.2Å; F85-E89 VanDerWaalsContact O-N 3.13Å
86	L	66.2	Low	65.9	Low	23 Å²	23	74 Å²	74	12%	0.12	37%	0.373	C	S	.	.	H	α-helix	trans	-69.7	-36.5	177.5	-80.7	158	0	0	0	111.4	P10 K14 T83 K88 E89 I90	P10-L86 HydrophobicContact CB-CD1 3.48Å; P10-L86 VanDerWaalsContact CB-CD1 3.48Å; P10-L86 HydrophobicContact CB-CD2 3.62Å; P10-L86 HydrophobicContact CB-CG 4.05Å; P10-L86 HydrophobicContact CG-CD1 4.21Å; K14-L86 HydrophobicContact CD-CD2 3.82Å; K14-L86 VanDerWaalsContact CE-CD2 3.48Å; K14-L86 HydrophobicContact CG-CD2 3.8Å; T83-L86 HydrophobicContact CG2-CD1 4.05Å; T83-L86 WeakPolarHBondContact O-CB 3.4Å; T83-L86 PolarHBondContact O-N 3.06Å; L86-K88 PolarHBondContact O-N 3.33Å; L86-E89 WeakPolarHBondContact CD2-OE2 3.22Å; L86-E89 PolarHBondContact O-N 2.86Å; L86-I90 HydrophobicContact CB-CD1 4.37Å; L86-I90 WeakPolarHBondContact O-CB 3.43Å; L86-I90 WeakPolarHBondContact O-CD1 3.39Å; L86-I90 WeakPolarHBondContact O-CG1 3.23Å; L86-I90 PolarHBondContact O-N 2.96Å
87	T	70.5	Confident	65.4	Low	53 Å²	53	72 Å²	72	33%	0.325	37%	0.366	S	S	.	.	H	α-helix	trans	-54	-40.1	172.4	-65.5	0	0	0	0	111.5	I75 C79 T83 I84 S91	I75-T87 HydrophobicContact CG2-CG2 3.74Å; C79-T87 PolarHBondContact SG-N 3.49Å; C79-T87 PolarHBondContact SG-OG1 2.92Å; T83-T87 PolarHBondContact O-N 3.44Å; T83-T87 PolarHBondContact O-OG1 3.05Å; I84-T87 WeakPolarHBondContact O-CB 3.44Å; I84-T87 PolarHBondContact O-N 3.39Å; T87-S91 WeakPolarHBondContact O-CB 2.9Å; T87-S91 PolarHBondContact O-N 3.39Å
88	K	75.1	Confident	65.2	Low	130 Å²	130	67.3 Å²	67.3	57%	0.565	34%	0.34	S	S	*	.	H	α-helix	trans	-71.4	-50.9	175.8	-175.6	173.2	175	174.9	0	113	I84 F85 L86 I90 S91 E92	I84-K88 PolarHBondContact O-N 3Å; F85-K88 PolarHBondContact O-N 2.99Å; L86-K88 PolarHBondContact O-N 3.33Å; K88-I90 VanDerWaalsContact C-N 3.26Å; K88-I90 PolarHBondContact O-N 3.01Å; K88-S91 WeakPolarHBondContact O-CB 3.16Å; K88-S91 PolarHBondContact O-N 3.37Å; K88-E92 WeakPolarHBondContact CE-OE1 3.17Å; K88-E92 IonicContact NZ-OE1 3.29Å; K88-E92 PolarHBondContact O-N 2.89Å
89	E	67.2	Low	65.3	Low	32 Å²	32	70.5 Å²	70.5	15%	0.15	36%	0.357	C	S	.	.	H	α-helix	trans	-57.9	-39	178.2	-69.3	174.7	123.9	0	0	112.1	K14 W17 F85 L86 L93	K14-E89 WeakPolarHBondContact CE-OE1 3.36Å; K14-E89 WeakPolarHBondContact CE-OE2 3.37Å; K14-E89 IonicContact NZ-OE2 2.81Å; W17-E89 HydrophobicContact CE3-CB 4.25Å; W17-E89 HydrophobicContact CE3-CG 4.08Å; W17-E89 HydrophobicContact CH2-CB 4.18Å; W17-E89 HydrophobicContact CH2-CG 4.38Å; W17-E89 WeakPolarHBondContact CZ2-O 3.38Å; W17-E89 HydrophobicContact CZ3-CB 4.02Å; W17-E89 HydrophobicContact CZ3-CG 3.8Å; F85-E89 HydrophobicContact CD1-CG 4.33Å; F85-E89 VanDerWaalsContact CD1-OE2 3.28Å; F85-E89 WeakPolarHBondContact CD1-OE2 3.39Å; F85-E89 HydrophobicContact CE1-CG 4.02Å; F85-E89 VanDerWaalsContact CE1-OE1 3.28Å; F85-E89 WeakPolarHBondContact CE1-OE1 3.49Å; F85-E89 WeakPolarHBondContact CE1-OE2 3.29Å; F85-E89 PolarHBondContact O-N 3.2Å; F85-E89 VanDerWaalsContact O-N 3.13Å; L86-E89 WeakPolarHBondContact CD2-OE2 3.22Å; L86-E89 PolarHBondContact O-N 2.86Å; E89-L93 WeakPolarHBondContact O-CB 3.33Å; E89-L93 PolarHBondContact O-N 3.39Å
90	I	67.2	Low	64.8	Low	3 Å²	3	72.6 Å²	72.6	2%	0.015	38%	0.381	C	S	.	.	H	α-helix	trans	-74.7	-36.4	-180	-62.2	167.5	0	0	0	111	L13 I75 I78 L86 K88 L93 L94	L13-I90 HydrophobicContact CB-CG1 4.18Å; L13-I90 HydrophobicContact CD1-CD1 3.79Å; L13-I90 HydrophobicContact CD1-CG1 3.91Å; L13-I90 HydrophobicContact CD1-CG2 4.48Å; L13-I90 HydrophobicContact CD2-CG1 4.35Å; L13-I90 HydrophobicContact CG-CG1 4.35Å; I75-I90 HydrophobicContact CG1-CB 4.43Å; I75-I90 HydrophobicContact CG1-CG2 3.89Å; I78-I90 HydrophobicContact CB-CD1 4.4Å; I78-I90 HydrophobicContact CG2-CD1 3.66Å; L86-I90 HydrophobicContact CB-CD1 4.37Å; L86-I90 WeakPolarHBondContact O-CB 3.43Å; L86-I90 WeakPolarHBondContact O-CD1 3.39Å; L86-I90 WeakPolarHBondContact O-CG1 3.23Å; L86-I90 PolarHBondContact O-N 2.96Å; K88-I90 VanDerWaalsContact C-N 3.26Å; K88-I90 PolarHBondContact O-N 3.01Å; I90-L93 PolarHBondContact O-N 3.44Å; I90-L94 HydrophobicContact CG2-CD1 4.02Å; I90-L94 HydrophobicContact CG2-CG 4.46Å; I90-L94 VanDerWaalsContact O-CG 3.27Å; I90-L94 WeakPolarHBondContact O-CG 3.25Å; I90-L94 PolarHBondContact O-N 2.99Å
91	S	74.4	Confident	64.4	Low	25 Å²	25	66.4 Å²	66.4	18%	0.175	36%	0.364	C	S	.	.	H	α-helix	trans	-55	-57.5	168.9	177.4	0	0	0	0	110.5	K71 T87 K88 L93 L94 D95	K71-S91 WeakPolarHBondContact CE-OG 3.27Å; K71-S91 PolarHBondContact NZ-OG 2.79Å; T87-S91 WeakPolarHBondContact O-CB 2.9Å; T87-S91 PolarHBondContact O-N 3.39Å; K88-S91 WeakPolarHBondContact O-CB 3.16Å; K88-S91 PolarHBondContact O-N 3.37Å; S91-L93 PolarHBondContact O-N 2.91Å; S91-L94 PolarHBondContact O-N 2.9Å; S91-L94 VanDerWaalsContact O-N 3.08Å; S91-D95 WeakPolarHBondContact O-CB 3.47Å; S91-D95 PolarHBondContact O-N 3.18Å; S91-D95 PolarHBondContact OG-OD2 3.32Å
92	E	72.3	Confident	64.2	Low	84 Å²	84	65.4 Å²	65.4	39%	0.393	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-30.3	-177.4	-70.8	175.6	179.8	0	0	112.1	W17 K88 Y96	W17-E92 HydrophobicContact CH2-CB 3.68Å; W17-E92 WeakPolarHBondContact CH2-OE2 3.49Å; W17-E92 HydrophobicContact CZ2-CB 3.74Å; K88-E92 WeakPolarHBondContact CE-OE1 3.17Å; K88-E92 IonicContact NZ-OE1 3.29Å; K88-E92 PolarHBondContact O-N 2.89Å; E92-Y96 WeakPolarHBondContact O-CB 3.45Å; E92-Y96 PolarHBondContact O-N 3.17Å
93	L	64.2	Low	64.5	Low	18 Å²	18	59.4 Å²	59.4	9%	0.094	31%	0.313	C	S	.	.	H	α-helix	trans	-65.2	-48.8	171.3	-178.7	138.2	0	0	0	112	L13 L16 W17 E89 I90 S91 D95 Y96 N97	L13-L93 HydrophobicContact CD2-CD1 3.65Å; L13-L93 HydrophobicContact CD2-CD2 3.74Å; L13-L93 HydrophobicContact CD2-CG 4.21Å; L16-L93 HydrophobicContact CB-CD1 4.18Å; L16-L93 HydrophobicContact CD1-CD1 4.1Å; W17-L93 HydrophobicContact CZ2-CB 4.3Å; E89-L93 WeakPolarHBondContact O-CB 3.33Å; E89-L93 PolarHBondContact O-N 3.39Å; I90-L93 PolarHBondContact O-N 3.44Å; S91-L93 PolarHBondContact O-N 2.91Å; L93-D95 VanDerWaalsContact C-N 3.35Å; L93-Y96 PolarHBondContact O-N 3.4Å; L93-N97 PolarHBondContact O-N 3.36Å; L93-N97 PolarHBondContact O-ND2 3.04Å
94	L	66.7	Low	64.4	Low	9 Å²	9	61.2 Å²	61.2	5%	0.047	32%	0.32	C	S	.	.	H	α-helix	trans	-64.9	-45.1	-178.8	-68.1	167	0	0	0	109.5	F67 K71 I74 I75 I90 S91 Y96 N97 L98 L137	F67-L94 HydrophobicContact CZ-CB 4.38Å; K71-L94 HydrophobicContact CB-CD1 4.43Å; K71-L94 HydrophobicContact CG-CD1 3.98Å; I74-L94 HydrophobicContact CB-CD1 4.23Å; I74-L94 HydrophobicContact CD1-CD2 4.2Å; I74-L94 HydrophobicContact CG2-CD1 3.91Å; I74-L94 HydrophobicContact CG2-CD2 4.42Å; I75-L94 HydrophobicContact CD1-CD1 4.46Å; I75-L94 HydrophobicContact CG1-CD1 4.2Å; I90-L94 HydrophobicContact CG2-CD1 4.02Å; I90-L94 HydrophobicContact CG2-CG 4.46Å; I90-L94 VanDerWaalsContact O-CG 3.27Å; I90-L94 WeakPolarHBondContact O-CG 3.25Å; I90-L94 PolarHBondContact O-N 2.99Å; S91-L94 PolarHBondContact O-N 2.9Å; S91-L94 VanDerWaalsContact O-N 3.08Å; L94-Y96 PolarHBondContact O-N 3.16Å; L94-N97 PolarHBondContact O-N 3.13Å; L94-L98 HydrophobicContact CB-CD1 4.06Å; L94-L98 HydrophobicContact CD2-CD1 3.6Å; L94-L98 HydrophobicContact CG-CD1 4.45Å; L94-L98 VanDerWaalsContact O-CB 3.24Å; L94-L98 WeakPolarHBondContact O-CB 3.3Å; L94-L98 PolarHBondContact O-N 3.41Å; L94-L137 HydrophobicContact CD2-CD2 4.06Å
95	D	70.6	Confident	64.1	Low	44 Å²	44	58.2 Å²	58.2	24%	0.235	30%	0.3	C	S	.	.	H	α-helix	trans	-57.4	-49.6	176.2	-63.5	-35.9	0	0	0	111.7	F67 K71 S91 L93 N97 L99	F67-D95 VanDerWaalsContact CE1-OD1 3.32Å; F67-D95 WeakPolarHBondContact CE1-OD1 3.48Å; K71-D95 WeakPolarHBondContact CE-OD1 3.31Å; K71-D95 IonicContact NZ-OD1 3.24Å; K71-D95 PolarHBondContact NZ-OD1 2.94Å; K71-D95 IonicContact NZ-OD2 3.64Å; K71-D95 PolarHBondContact NZ-OD2 3.05Å; S91-D95 WeakPolarHBondContact O-CB 3.47Å; S91-D95 PolarHBondContact O-N 3.18Å; S91-D95 PolarHBondContact OG-OD2 3.32Å; L93-D95 VanDerWaalsContact C-N 3.35Å; D95-N97 PolarHBondContact O-N 2.98Å; D95-L99 HydrophobicContact CB-CD1 4.29Å; D95-L99 VanDerWaalsContact O-CB 3.3Å; D95-L99 WeakPolarHBondContact O-CB 3.49Å; D95-L99 PolarHBondContact O-N 2.98Å
96	Y	61.7	Low	64.1	Low	131 Å²	131	51.8 Å²	51.8	51%	0.514	27%	0.271	S	S	.	.	H	α-helix	trans	-66.2	-32.8	-176.3	-178.9	-90.1	0	0	0	114.5	E92 L93 L94	E92-Y96 WeakPolarHBondContact O-CB 3.45Å; E92-Y96 PolarHBondContact O-N 3.17Å; L93-Y96 PolarHBondContact O-N 3.4Å; L94-Y96 PolarHBondContact O-N 3.16Å
97	N	59.1	Low	63.9	Low	69 Å²	69	51.8 Å²	51.8	37%	0.369	27%	0.273	S	S	.	.	H	α-helix	trans	-99.3	-29.1	-173.6	-64.2	-85.5	0	0	0	113.5	L93 L94 D95 V140	L93-N97 PolarHBondContact O-N 3.36Å; L93-N97 PolarHBondContact O-ND2 3.04Å; L94-N97 PolarHBondContact O-N 3.13Å; D95-N97 PolarHBondContact O-N 2.98Å; N97-V140 HydrophobicContact CB-CB 4.44Å; N97-V140 HydrophobicContact CB-CG1 3.58Å; N97-V140 HydrophobicContact CB-CG2 3.93Å; N97-V140 WeakPolarHBondContact O-CG2 3.23Å
98	L	63.5	Low	63.5	Low	7 Å²	7	52.7 Å²	52.7	4%	0.037	28%	0.275	C	S	.	.	H	α-helix	trans	-100	-26.7	-175	-64.6	158.4	0	0	0	113.3	F67 L94 W133 E136 L137 V140	F67-L98 HydrophobicContact CE2-CB 3.73Å; F67-L98 HydrophobicContact CE2-CD1 3.84Å; F67-L98 HydrophobicContact CE2-CG 4.42Å; F67-L98 HydrophobicContact CZ-CB 4.36Å; L94-L98 HydrophobicContact CB-CD1 4.06Å; L94-L98 HydrophobicContact CD2-CD1 3.6Å; L94-L98 HydrophobicContact CG-CD1 4.45Å; L94-L98 VanDerWaalsContact O-CB 3.24Å; L94-L98 WeakPolarHBondContact O-CB 3.3Å; L94-L98 PolarHBondContact O-N 3.41Å; L98-W133 HydrophobicContact CB-CZ3 4Å; L98-W133 HydrophobicContact CD2-CE3 4.35Å; L98-W133 HydrophobicContact CD2-CZ3 4.26Å; L98-E136 HydrophobicContact CD2-CB 4.27Å; L98-L137 HydrophobicContact CD1-CD2 3.61Å; L98-L137 HydrophobicContact CD1-CG 4.22Å; L98-L137 HydrophobicContact CD2-CD2 4.04Å; L98-L137 HydrophobicContact CD2-CG 4.02Å; L98-L137 HydrophobicContact CG-CD2 4.42Å; L98-V140 HydrophobicContact CD2-CB 4.08Å; L98-V140 HydrophobicContact CD2-CG2 3.56Å; L98-V140 HydrophobicContact CG-CG2 4.04Å
99	L	65.6	Low	63.1	Low	85 Å²	85	48.5 Å²	48.5	45%	0.445	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	143.6	176.3	-55.4	178.9	0	0	0	110.7	F67 D95 G101	F67-L99 HydrophobicContact CD1-CD1 4.32Å; F67-L99 HydrophobicContact CD1-CD2 3.8Å; F67-L99 HydrophobicContact CD1-CG 4.37Å; F67-L99 HydrophobicContact CD2-CD2 4.17Å; F67-L99 HydrophobicContact CE1-CD1 3.75Å; F67-L99 HydrophobicContact CE1-CD2 3.78Å; F67-L99 HydrophobicContact CE1-CG 3.85Å; F67-L99 HydrophobicContact CE2-CD2 4.17Å; F67-L99 HydrophobicContact CE2-CG 4.46Å; F67-L99 HydrophobicContact CG-CD2 3.98Å; F67-L99 HydrophobicContact CZ-CD1 4.22Å; F67-L99 HydrophobicContact CZ-CD2 3.97Å; F67-L99 HydrophobicContact CZ-CG 3.89Å; D95-L99 HydrophobicContact CB-CD1 4.29Å; D95-L99 VanDerWaalsContact O-CB 3.3Å; D95-L99 WeakPolarHBondContact O-CB 3.49Å; D95-L99 PolarHBondContact O-N 2.98Å; L99-G101 VanDerWaalsContact C-N 3.32Å
100	G	53.5	Low	62.9	Low	56 Å²	56	47.3 Å²	47.3	58%	0.577	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-5.3	-175.1	0	0	0	0	0	114.7
101	G	53.5	Low	62.8	Low	35 Å²	35	49.2 Å²	49.2	36%	0.361	27%	0.267	S	S	.	.	S	Bend	trans	-69.3	160.4	161.9	0	0	0	0	0	111.8	L99 L103	L99-G101 VanDerWaalsContact C-N 3.32Å; G101-L103 PolarHBondContact O-N 2.93Å
102	K	52.7	Low	62.2	Low	90 Å²	90	50.8 Å²	50.8	39%	0.391	27%	0.273	S	S	.	.			trans	-71	-9.9	174.4	-61.2	-177	-177.7	172.2	0	113.7	I104 H283	K102-I104 HydrophobicContact CB-CD1 3.79Å; K102-I104 HydrophobicContact CB-CG1 3.74Å; K102-I104 HydrophobicContact CD-CD1 3.79Å; K102-I104 HydrophobicContact CG-CD1 4.46Å; K102-I104 PolarHBondContact O-N 3.17Å; K102-I104 VanDerWaalsContact O-N 3.17Å; K102-H283 PolarHBondContact NZ-CE1 3.5Å; K102-H283 VanDerWaalsContact NZ-CE1 3.26Å; K102-H283 PolarHBondContact NZ-NE2 2.85Å; K102-H283 VanDerWaalsContact NZ-NE2 3.17Å
103	L	62.4	Low	62.1	Low	21 Å²	21	48.6 Å²	48.6	11%	0.11	26%	0.262	C	S	.	.			trans	52.2	32.6	-178.9	-56.2	177.9	0	0	0	114.6	I63 G101 S107 W133 E136	I63-L103 HydrophobicContact CG2-CD1 4.42Å; G101-L103 PolarHBondContact O-N 2.93Å; L103-S107 WeakPolarHBondContact O-CB 3.48Å; L103-S107 PolarHBondContact O-N 3.23Å; L103-S107 PolarHBondContact O-OG 3.07Å; L103-W133 HydrophobicContact CD1-CH2 3.88Å; L103-W133 HydrophobicContact CD1-CZ2 4.3Å; L103-W133 HydrophobicContact CD2-CH2 3.56Å; L103-W133 HydrophobicContact CD2-CZ3 3.7Å; L103-W133 HydrophobicContact CG-CH2 4.4Å; L103-E136 WeakPolarHBondContact CA-OE1 3.24Å; L103-E136 HydrophobicContact CD2-CG 4.02Å
104	I	57.8	Low	62.4	Low	90 Å²	90	51.2 Å²	51.2	46%	0.462	27%	0.274	S	S	.	.	H	α-helix	trans	-66.7	-39.8	-171.2	-70	169.7	0	0	0	111.7	K102 S107 L108 E136	K102-I104 HydrophobicContact CB-CD1 3.79Å; K102-I104 HydrophobicContact CB-CG1 3.74Å; K102-I104 HydrophobicContact CD-CD1 3.79Å; K102-I104 HydrophobicContact CG-CD1 4.46Å; K102-I104 PolarHBondContact O-N 3.17Å; K102-I104 VanDerWaalsContact O-N 3.17Å; I104-S107 PolarHBondContact O-N 3.48Å; I104-L108 WeakPolarHBondContact O-CB 3.49Å; I104-L108 PolarHBondContact O-N 3.46Å; I104-E136 PolarHBondContact N-OE1 2.82Å
105	R	61	Low	62.5	Low	83 Å²	83	51.9 Å²	51.9	31%	0.313	28%	0.281	S	S	.	.	H	α-helix	trans	-75.1	-43.8	-170.2	-57.9	-166.3	179	103.8	-6.8	110.5	L108 L109 E136 D139 E175	R105-L108 PolarHBondContact O-N 2.72Å; R105-L109 PolarHBondContact O-N 2.99Å; R105-L109 VanDerWaalsContact O-N 3.1Å; R105-E136 WeakPolarHBondContact CA-OE1 3.25Å; R105-E136 PolarHBondContact N-OE1 3.23Å; R105-D139 IonicContact CZ-OD1 3.58Å; R105-D139 IonicContact NH1-OD1 2.67Å; R105-D139 PolarHBondContact NH1-OD1 3.1Å; R105-D139 IonicContact NH1-OD2 2.74Å; R105-E175 IonicContact CZ-OE1 3.67Å; R105-E175 IonicContact NH2-OE1 3.6Å; R105-E175 PolarHBondContact NH2-OE1 3.03Å
106	G	60.3	Low	62.4	Low	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-69.1	-35	172.5	0	0	0	0	0	113.6	I63 L110 T135 E136	I63-G106 VanDerWaalsContact CD1-CA 3.49Å; G106-L110 WeakPolarHBondContact O-CB 3.48Å; G106-L110 PolarHBondContact O-N 3.27Å; G106-T135 PolarHBondContact N-OG1 2.95Å; G106-E136 PolarHBondContact N-OE1 3.4Å
107	S	63	Low	63.2	Low	22 Å²	22	50.3 Å²	50.3	15%	0.154	28%	0.284	C	S	.	.	H	α-helix	trans	-71.5	-34.7	175.2	-60.3	0	0	0	0	112.9	P61 L103 I104 S111	P61-S107 WeakPolarHBondContact CB-OG 3.5Å; L103-S107 WeakPolarHBondContact O-CB 3.48Å; L103-S107 PolarHBondContact O-N 3.23Å; L103-S107 PolarHBondContact O-OG 3.07Å; I104-S107 PolarHBondContact O-N 3.48Å; S107-S111 VanDerWaalsContact O-CB 3.27Å; S107-S111 WeakPolarHBondContact O-CB 3.41Å; S107-S111 PolarHBondContact O-N 2.87Å; S107-S111 PolarHBondContact O-OG 3.19Å
108	L	61.5	Low	64.1	Low	72 Å²	72	51.6 Å²	51.6	38%	0.377	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-50.7	172.4	172.6	61.7	0	0	0	110.8	I104 R105 L110 S111 I112 F281	I104-L108 WeakPolarHBondContact O-CB 3.49Å; I104-L108 PolarHBondContact O-N 3.46Å; R105-L108 PolarHBondContact O-N 2.72Å; L108-L110 VanDerWaalsContact C-N 3.32Å; L108-L110 PolarHBondContact O-N 2.86Å; L108-S111 PolarHBondContact O-N 3.28Å; L108-S111 VanDerWaalsContact O-N 3.16Å; L108-I112 HydrophobicContact CD1-CD1 3.72Å; L108-I112 HydrophobicContact CD1-CG1 4.19Å; L108-I112 HydrophobicContact CG-CD1 3.97Å; L108-I112 WeakPolarHBondContact O-CG1 3.22Å; L108-I112 PolarHBondContact O-N 3.11Å; L108-F281 HydrophobicContact CD1-CD1 4.39Å; L108-F281 HydrophobicContact CD1-CE1 3.43Å; L108-F281 VanDerWaalsContact CD1-CE1 3.43Å; L108-F281 HydrophobicContact CD1-CZ 3.78Å
109	L	66.4	Low	65	Low	42 Å²	42	59.2 Å²	59.2	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-56.4	-47	176.9	-174.5	153.7	0	0	0	111.5	R105 I112 F113 A128 L131 T135	R105-L109 PolarHBondContact O-N 2.99Å; R105-L109 VanDerWaalsContact O-N 3.1Å; L109-I112 PolarHBondContact O-N 2.83Å; L109-F113 WeakPolarHBondContact O-CB 3.07Å; L109-F113 PolarHBondContact O-N 2.83Å; L109-A128 WeakPolarHBondContact CD2-O 3.41Å; L109-L131 HydrophobicContact CD1-CB 4.5Å; L109-L131 HydrophobicContact CD1-CD2 3.98Å; L109-L131 HydrophobicContact CD1-CG 3.81Å; L109-L131 HydrophobicContact CD2-CB 4.32Å; L109-L131 HydrophobicContact CD2-CD2 4.31Å; L109-L131 HydrophobicContact CD2-CG 4.38Å; L109-T135 HydrophobicContact CD1-CG2 3.95Å
110	L	64.6	Low	65.8	Low	7 Å²	7	55.5 Å²	55.5	4%	0.037	32%	0.318	C	S	.	.	H	α-helix	trans	-62.2	-42	176.8	175.7	68.9	0	0	0	112.2	S62 I63 G106 L108 F113 E114	S62-L110 WeakPolarHBondContact OG-CD2 3.46Å; I63-L110 HydrophobicContact CB-CD2 4.42Å; G106-L110 WeakPolarHBondContact O-CB 3.48Å; G106-L110 PolarHBondContact O-N 3.27Å; L108-L110 VanDerWaalsContact C-N 3.32Å; L108-L110 PolarHBondContact O-N 2.86Å; L110-F113 WeakPolarHBondContact O-CB 3.23Å; L110-F113 PolarHBondContact O-N 3.09Å; L110-E114 HydrophobicContact CD1-CG 4.3Å; L110-E114 WeakPolarHBondContact O-CG 3.32Å; L110-E114 PolarHBondContact O-N 3.22Å
111	S	63.5	Low	67.2	Low	43 Å²	43	55 Å²	55	30%	0.301	31%	0.305	S	S	.	.	H	α-helix	trans	-67.9	-39	-179.2	-63.7	0	0	0	0	112.2	S107 L108 A115	S107-S111 VanDerWaalsContact O-CB 3.27Å; S107-S111 WeakPolarHBondContact O-CB 3.41Å; S107-S111 PolarHBondContact O-N 2.87Å; S107-S111 PolarHBondContact O-OG 3.19Å; L108-S111 PolarHBondContact O-N 3.28Å; L108-S111 VanDerWaalsContact O-N 3.16Å; S111-A115 WeakPolarHBondContact O-CB 3.45Å; S111-A115 PolarHBondContact O-N 2.8Å
112	I	62.7	Low	68.4	Low	58 Å²	58	56.3 Å²	56.3	30%	0.297	31%	0.313	S	S	.	.	H	α-helix	trans	-64.7	-42.4	171.5	-68.1	167.6	0	0	0	110.1	L108 L109 A115 L116	L108-I112 HydrophobicContact CD1-CD1 3.72Å; L108-I112 HydrophobicContact CD1-CG1 4.19Å; L108-I112 HydrophobicContact CG-CD1 3.97Å; L108-I112 WeakPolarHBondContact O-CG1 3.22Å; L108-I112 PolarHBondContact O-N 3.11Å; L109-I112 PolarHBondContact O-N 2.83Å; I112-A115 PolarHBondContact O-N 3.27Å; I112-L116 HydrophobicContact CG2-CD1 3.69Å; I112-L116 HydrophobicContact CG2-CG 4.28Å; I112-L116 WeakPolarHBondContact O-CB 3.01Å; I112-L116 VanDerWaalsContact O-CG 3.31Å; I112-L116 WeakPolarHBondContact O-CG 3.26Å; I112-L116 PolarHBondContact O-N 3.08Å
113	F	70.2	Confident	69.4	Low	39 Å²	39	58 Å²	58	17%	0.171	32%	0.322	C	S	.	.	H	α-helix	trans	-63.3	-46.7	176.7	175.7	-90.9	0	0	0	112.7	L109 L110 A115 L116 C117 S120 M124 R125 A128	L109-F113 WeakPolarHBondContact O-CB 3.07Å; L109-F113 PolarHBondContact O-N 2.83Å; L110-F113 WeakPolarHBondContact O-CB 3.23Å; L110-F113 PolarHBondContact O-N 3.09Å; F113-A115 VanDerWaalsContact C-N 3.27Å; F113-A115 PolarHBondContact O-N 3.38Å; F113-L116 PolarHBondContact O-N 3.45Å; F113-C117 HydrophobicContact CD2-CB 4.49Å; F113-C117 HydrophobicContact CE1-CB 4.42Å; F113-C117 HydrophobicContact CE2-CB 4.01Å; F113-C117 HydrophobicContact CZ-CB 3.96Å; F113-C117 WeakPolarHBondContact O-CA 3.24Å; F113-C117 WeakPolarHBondContact O-CB 3.38Å; F113-C117 PolarHBondContact O-N 3.3Å; F113-S120 WeakPolarHBondContact CE1-OG 3.42Å; F113-M124 HydrophobicContact CE2-CE 4.43Å; F113-M124 HydrophobicContact CZ-CB 3.88Å; F113-M124 HydrophobicContact CZ-CE 4.34Å; F113-R125 HydrophobicContact CE1-CG 3.78Å; F113-A128 HydrophobicContact CB-CB 4.05Å; F113-A128 HydrophobicContact CD1-CB 3.5Å; F113-A128 HydrophobicContact CD2-CB 3.8Å; F113-A128 HydrophobicContact CE1-CB 3.91Å; F113-A128 HydrophobicContact CE2-CB 4.16Å; F113-A128 HydrophobicContact CG-CB 3.46Å; F113-A128 VanDerWaalsContact CG-CB 3.46Å; F113-A128 HydrophobicContact CZ-CB 4.22Å
114	E	71.2	Confident	70	Confident	73 Å²	73	60.7 Å²	60.7	34%	0.341	34%	0.335	S	S	.	.	H	α-helix	trans	-63.5	-33.6	177.4	-72.9	-174.2	-172.7	0	0	111.6	L110 P118	L110-E114 HydrophobicContact CD1-CG 4.3Å; L110-E114 WeakPolarHBondContact O-CG 3.32Å; L110-E114 PolarHBondContact O-N 3.22Å; E114-P118 WeakPolarHBondContact O-CA 3.28Å
115	A	67.4	Low	70.7	Confident	22 Å²	22	62 Å²	62	18%	0.182	34%	0.335	C	S	.	.	H	α-helix	trans	-72.7	-40.6	175	0	0	0	0	0	113.7	S111 I112 F113 A275	S111-A115 WeakPolarHBondContact O-CB 3.45Å; S111-A115 PolarHBondContact O-N 2.8Å; I112-A115 PolarHBondContact O-N 3.27Å; F113-A115 VanDerWaalsContact C-N 3.27Å; F113-A115 PolarHBondContact O-N 3.38Å; A115-A275 HydrophobicContact CB-CB 4.05Å; A115-A275 VanDerWaalsContact O-CB 3.25Å; A115-A275 WeakPolarHBondContact O-CB 3.49Å
116	L	69.8	Low	71.3	Confident	95 Å²	95	60 Å²	60	50%	0.497	33%	0.333	S	S	.	.	H	α-helix	trans	-78.2	-29.9	178.7	-69.6	175	0	0	0	113	I112 F113 P118 V276	I112-L116 HydrophobicContact CG2-CD1 3.69Å; I112-L116 HydrophobicContact CG2-CG 4.28Å; I112-L116 WeakPolarHBondContact O-CB 3.01Å; I112-L116 VanDerWaalsContact O-CG 3.31Å; I112-L116 WeakPolarHBondContact O-CG 3.26Å; I112-L116 PolarHBondContact O-N 3.08Å; F113-L116 PolarHBondContact O-N 3.45Å; L116-P118 VanDerWaalsContact C-CD 3.48Å; L116-V276 HydrophobicContact CD2-CG2 3.8Å; L116-V276 HydrophobicContact CG-CG2 4.09Å
117	C	78.2	Confident	71.8	Confident	47 Å²	47	66 Å²	66	32%	0.318	36%	0.362	S	S	.	.			trans	-130.7	62.8	-175.1	-66.6	0	0	0	0	111.6	F113 N119 S120	F113-C117 HydrophobicContact CD2-CB 4.49Å; F113-C117 HydrophobicContact CE1-CB 4.42Å; F113-C117 HydrophobicContact CE2-CB 4.01Å; F113-C117 HydrophobicContact CZ-CB 3.96Å; F113-C117 WeakPolarHBondContact O-CA 3.24Å; F113-C117 WeakPolarHBondContact O-CB 3.38Å; F113-C117 PolarHBondContact O-N 3.3Å; C117-N119 VanDerWaalsContact C-N 3.26Å; C117-N119 PolarHBondContact O-N 2.91Å; C117-S120 WeakPolarHBondContact O-CB 3.22Å; C117-S120 PolarHBondContact O-N 2.94Å; C117-S120 VanDerWaalsContact O-N 3.08Å; C117-S120 PolarHBondContact O-OG 3.19Å
118	P	77.3	Confident	72.1	Confident	96 Å²	96	65.4 Å²	65.4	62%	0.623	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-31.2	-176.6	24.8	-34.9	0	0	0	113.1	E114 L116 S120	E114-P118 WeakPolarHBondContact O-CA 3.28Å; L116-P118 VanDerWaalsContact C-CD 3.48Å; P118-S120 VanDerWaalsContact C-N 3.27Å; P118-S120 PolarHBondContact O-N 3.3Å
119	N	82.3	Confident	72.5	Confident	167 Å²	167	62.2 Å²	62.2	89%	0.893	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	24.5	177.5	-62.4	-24.8	0	0	0	112.9	C117	C117-N119 VanDerWaalsContact C-N 3.26Å; C117-N119 PolarHBondContact O-N 2.91Å
120	S	81.6	Confident	72.6	Confident	7 Å²	7	64.1 Å²	64.1	5%	0.049	35%	0.349	C	S	.	.			trans	-68.6	141.7	-176.6	46	0	0	0	0	113.2	F113 C117 P118 R125	F113-S120 WeakPolarHBondContact CE1-OG 3.42Å; C117-S120 WeakPolarHBondContact O-CB 3.22Å; C117-S120 PolarHBondContact O-N 2.94Å; C117-S120 VanDerWaalsContact O-N 3.08Å; C117-S120 PolarHBondContact O-OG 3.19Å; P118-S120 VanDerWaalsContact C-N 3.27Å; P118-S120 PolarHBondContact O-N 3.3Å; S120-R125 PolarHBondContact O-NE 3.36Å; S120-R125 PolarHBondContact O-NH2 3.43Å; S120-R125 WeakPolarHBondContact OG-CG 3.44Å
121	S	83.9	Confident	72.7	Confident	45 Å²	45	68.1 Å²	68.1	32%	0.315	37%	0.37	S	S	.	.			trans	-66.8	167.9	175.5	87	0	0	0	0	112.1	E123 M124 R125	S121-E123 VanDerWaalsContact C-N 3.26Å; S121-E123 WeakPolarHBondContact CB-OE2 3.43Å; S121-E123 PolarHBondContact O-N 2.77Å; S121-E123 PolarHBondContact OG-N 2.7Å; S121-E123 PolarHBondContact OG-OE2 2.88Å; S121-M124 PolarHBondContact O-N 3.34Å; S121-M124 PolarHBondContact OG-N 3.43Å; S121-R125 PolarHBondContact O-N 3.06Å; S121-R125 PolarHBondContact O-NE 3.23Å
122	A	78	Confident	72.7	Confident	64 Å²	64	66 Å²	66	53%	0.529	36%	0.356	S	S	.	.	H	α-helix	trans	-64	-34.9	177	0	0	0	0	0	111.7	S126	A122-S126 WeakPolarHBondContact O-CB 3.3Å; A122-S126 PolarHBondContact O-N 2.81Å
123	E	75.4	Confident	73	Confident	124 Å²	124	63.3 Å²	63.3	58%	0.579	34%	0.342	S	S	*	.	H	α-helix	trans	-66.2	-46.7	177.1	-54.4	69	-147.7	0	0	110.7	S121 R125 S126 Q127	S121-E123 VanDerWaalsContact C-N 3.26Å; S121-E123 WeakPolarHBondContact CB-OE2 3.43Å; S121-E123 PolarHBondContact O-N 2.77Å; S121-E123 PolarHBondContact OG-N 2.7Å; S121-E123 PolarHBondContact OG-OE2 2.88Å; E123-R125 PolarHBondContact O-N 2.81Å; E123-S126 WeakPolarHBondContact O-CB 3.31Å; E123-S126 PolarHBondContact O-N 3.42Å; E123-Q127 WeakPolarHBondContact O-CG 3.28Å; E123-Q127 PolarHBondContact O-N 3.36Å
124	M	73.1	Confident	72.8	Confident	78 Å²	78	63.7 Å²	63.7	38%	0.384	35%	0.352	S	S	.	.	H	α-helix	trans	-63.7	-41.7	177.3	-64	177.9	70.9	0	0	111.8	F113 S121 S126 Q127 A128	F113-M124 HydrophobicContact CE2-CE 4.43Å; F113-M124 HydrophobicContact CZ-CB 3.88Å; F113-M124 HydrophobicContact CZ-CE 4.34Å; S121-M124 PolarHBondContact O-N 3.34Å; S121-M124 PolarHBondContact OG-N 3.43Å; M124-S126 VanDerWaalsContact C-N 3.34Å; M124-Q127 PolarHBondContact O-N 2.98Å; M124-A128 PolarHBondContact O-N 3.34Å
125	R	74.2	Confident	72.5	Confident	118 Å²	118	62.3 Å²	62.3	45%	0.445	35%	0.348	S	S	.	.	H	α-helix	trans	-63.6	-38.9	173.7	-82.2	177.8	-84.9	150.4	-6.8	112.1	F113 S120 S121 E123 A128 S129	F113-R125 HydrophobicContact CE1-CG 3.78Å; S120-R125 PolarHBondContact O-NE 3.36Å; S120-R125 PolarHBondContact O-NH2 3.43Å; S120-R125 WeakPolarHBondContact OG-CG 3.44Å; S121-R125 PolarHBondContact O-N 3.06Å; S121-R125 PolarHBondContact O-NE 3.23Å; E123-R125 PolarHBondContact O-N 2.81Å; R125-A128 PolarHBondContact O-N 3.5Å; R125-S129 VanDerWaalsContact O-CB 3.26Å; R125-S129 WeakPolarHBondContact O-CB 3.43Å; R125-S129 PolarHBondContact O-N 3.4Å
126	S	71.8	Confident	72.3	Confident	41 Å²	41	61.8 Å²	61.8	29%	0.287	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-43.2	172.9	-174.1	0	0	0	0	111.9	A122 E123 M124 S129 Q130	A122-S126 WeakPolarHBondContact O-CB 3.3Å; A122-S126 PolarHBondContact O-N 2.81Å; E123-S126 WeakPolarHBondContact O-CB 3.31Å; E123-S126 PolarHBondContact O-N 3.42Å; M124-S126 VanDerWaalsContact C-N 3.34Å; S126-S129 WeakPolarHBondContact O-CB 3.31Å; S126-S129 PolarHBondContact O-N 3.14Å; S126-Q130 VanDerWaalsContact O-CG 3.24Å; S126-Q130 WeakPolarHBondContact O-CG 3.16Å; S126-Q130 PolarHBondContact O-N 3.27Å; S126-Q130 PolarHBondContact O-NE2 3.42Å; S126-Q130 PolarHBondContact OG-NE2 3.18Å
127	Q	72.3	Confident	72.1	Confident	127 Å²	127	59.6 Å²	59.6	59%	0.593	33%	0.331	S	S	*	.	H	α-helix	trans	-63.5	-44.6	175.8	-73.2	173.7	-19.6	0	0	112.4	E123 M124 S129 Q130 L131	E123-Q127 WeakPolarHBondContact O-CG 3.28Å; E123-Q127 PolarHBondContact O-N 3.36Å; M124-Q127 PolarHBondContact O-N 2.98Å; Q127-S129 VanDerWaalsContact C-N 3.31Å; Q127-S129 PolarHBondContact O-N 3.26Å; Q127-Q130 PolarHBondContact O-N 3.03Å; Q127-L131 WeakPolarHBondContact O-CB 3.31Å; Q127-L131 PolarHBondContact O-N 3.48Å
128	A	68.9	Low	71.2	Confident	8 Å²	8	61.6 Å²	61.6	7%	0.066	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-40.2	174.6	0	0	0	0	0	111.7	L109 F113 M124 R125 L131 G132	L109-A128 WeakPolarHBondContact CD2-O 3.41Å; F113-A128 HydrophobicContact CB-CB 4.05Å; F113-A128 HydrophobicContact CD1-CB 3.5Å; F113-A128 HydrophobicContact CD2-CB 3.8Å; F113-A128 HydrophobicContact CE1-CB 3.91Å; F113-A128 HydrophobicContact CE2-CB 4.16Å; F113-A128 HydrophobicContact CG-CB 3.46Å; F113-A128 VanDerWaalsContact CG-CB 3.46Å; F113-A128 HydrophobicContact CZ-CB 4.22Å; M124-A128 PolarHBondContact O-N 3.34Å; R125-A128 PolarHBondContact O-N 3.5Å; A128-L131 PolarHBondContact O-N 2.98Å; A128-G132 PolarHBondContact O-N 3.44Å
129	S	69.1	Low	70.2	Confident	6 Å²	6	58.2 Å²	58.2	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-65.2	-40.7	176.2	-157.8	0	0	0	0	112.5	I63 S66 R125 S126 Q127 G132 W133	I63-S129 WeakPolarHBondContact CA-OG 3.47Å; S66-S129 WeakPolarHBondContact CB-OG 3.5Å; S66-S129 PolarHBondContact OG-OG 2.6Å; R125-S129 VanDerWaalsContact O-CB 3.26Å; R125-S129 WeakPolarHBondContact O-CB 3.43Å; R125-S129 PolarHBondContact O-N 3.4Å; S126-S129 WeakPolarHBondContact O-CB 3.31Å; S126-S129 PolarHBondContact O-N 3.14Å; Q127-S129 VanDerWaalsContact C-N 3.31Å; Q127-S129 PolarHBondContact O-N 3.26Å; S129-G132 PolarHBondContact O-N 2.95Å; S129-W133 PolarHBondContact O-N 3Å
130	Q	68.2	Low	68.7	Low	82 Å²	82	51.3 Å²	51.3	38%	0.383	28%	0.279	S	S	.	.	H	α-helix	trans	-65.9	-39.2	173.5	-70.4	167	50.2	0	0	112.2	V70 S126 Q127 W133 A134	V70-Q130 HydrophobicContact CG2-CB 4.37Å; V70-Q130 HydrophobicContact CG2-CG 3.94Å; S126-Q130 VanDerWaalsContact O-CG 3.24Å; S126-Q130 WeakPolarHBondContact O-CG 3.16Å; S126-Q130 PolarHBondContact O-N 3.27Å; S126-Q130 PolarHBondContact O-NE2 3.42Å; S126-Q130 PolarHBondContact OG-NE2 3.18Å; Q127-Q130 PolarHBondContact O-N 3.03Å; Q130-W133 PolarHBondContact O-N 3.01Å; Q130-A134 PolarHBondContact O-N 2.92Å
131	L	67.2	Low	66.9	Low	90 Å²	90	52.5 Å²	52.5	47%	0.471	29%	0.292	S	S	.	.	H	α-helix	trans	-68.1	-36.5	174.6	-173.3	64.9	0	0	0	111.6	L109 Q127 A128 A134 T135	L109-L131 HydrophobicContact CD1-CB 4.5Å; L109-L131 HydrophobicContact CD1-CD2 3.98Å; L109-L131 HydrophobicContact CD1-CG 3.81Å; L109-L131 HydrophobicContact CD2-CB 4.32Å; L109-L131 HydrophobicContact CD2-CD2 4.31Å; L109-L131 HydrophobicContact CD2-CG 4.38Å; Q127-L131 WeakPolarHBondContact O-CB 3.31Å; Q127-L131 PolarHBondContact O-N 3.48Å; A128-L131 PolarHBondContact O-N 2.98Å; L131-A134 HydrophobicContact CD1-CB 4.47Å; L131-A134 WeakPolarHBondContact O-CB 3.3Å; L131-A134 PolarHBondContact O-N 3.32Å; L131-A134 VanDerWaalsContact O-N 3.11Å; L131-T135 PolarHBondContact O-N 3.48Å
132	G	65	Low	64.6	Low	0 Å²	0	52 Å²	52	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-57.7	-47.7	169.8	0	0	0	0	0	111.5	A128 S129 A134 T135 E136	A128-G132 PolarHBondContact O-N 3.44Å; S129-G132 PolarHBondContact O-N 2.95Å; G132-A134 VanDerWaalsContact C-N 3.28Å; G132-A134 PolarHBondContact O-N 3.36Å; G132-T135 PolarHBondContact O-N 2.76Å; G132-T135 PolarHBondContact O-OG1 3.05Å; G132-E136 PolarHBondContact O-N 2.91Å
133	W	69.1	Low	62.8	Low	1 Å²	1	55.4 Å²	55.4	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-33	172.7	-83.1	112.2	0	0	0	113.6	I63 S66 F67 V70 L98 L103 S129 Q130 T135 E136 L137	I63-W133 HydrophobicContact CD1-CD2 4.33Å; I63-W133 HydrophobicContact CD1-CG 4.36Å; I63-W133 HydrophobicContact CG1-CD2 4.06Å; I63-W133 HydrophobicContact CG1-CG 4.09Å; I63-W133 HydrophobicContact CG1-CZ2 3.99Å; I63-W133 VanDerWaalsContact CG1-NE1 3.35Å; I63-W133 PolarHBondContact O-NE1 3.28Å; S66-W133 PolarHBondContact OG-NE1 2.91Å; F67-W133 HydrophobicContact CB-CH2 4.22Å; F67-W133 HydrophobicContact CB-CZ2 3.52Å; F67-W133 HydrophobicContact CD2-CD2 4.18Å; F67-W133 AromaticContact CD2-CE2 3.92Å; F67-W133 HydrophobicContact CD2-CE3 4.08Å; F67-W133 AromaticContact CD2-CH2 3.57Å; F67-W133 HydrophobicContact CD2-CH2 3.57Å; F67-W133 AromaticContact CD2-CZ2 3.66Å; F67-W133 HydrophobicContact CD2-CZ2 3.66Å; F67-W133 AromaticContact CD2-CZ3 3.79Å; F67-W133 HydrophobicContact CD2-CZ3 3.79Å; F67-W133 HydrophobicContact CE2-CH2 4.35Å; F67-W133 HydrophobicContact CE2-CZ3 4.27Å; F67-W133 HydrophobicContact CG-CH2 4.21Å; F67-W133 AromaticContact CG-CZ2 3.99Å; F67-W133 HydrophobicContact CG-CZ2 3.99Å; V70-W133 HydrophobicContact CB-CB 4.34Å; V70-W133 HydrophobicContact CB-CG 4.29Å; V70-W133 HydrophobicContact CG1-CB 3.98Å; V70-W133 HydrophobicContact CG1-CG 4.36Å; V70-W133 HydrophobicContact CG2-CB 3.95Å; V70-W133 HydrophobicContact CG2-CG 3.97Å; L98-W133 HydrophobicContact CB-CZ3 4Å; L98-W133 HydrophobicContact CD2-CE3 4.35Å; L98-W133 HydrophobicContact CD2-CZ3 4.26Å; L103-W133 HydrophobicContact CD1-CH2 3.88Å; L103-W133 HydrophobicContact CD1-CZ2 4.3Å; L103-W133 HydrophobicContact CD2-CH2 3.56Å; L103-W133 HydrophobicContact CD2-CZ3 3.7Å; L103-W133 HydrophobicContact CG-CH2 4.4Å; S129-W133 PolarHBondContact O-N 3Å; Q130-W133 PolarHBondContact O-N 3.01Å; W133-T135 PolarHBondContact O-N 3.34Å; W133-E136 HydrophobicContact CE3-CB 3.97Å; W133-E136 HydrophobicContact CE3-CG 4.41Å; W133-E136 HydrophobicContact CZ3-CB 4.15Å; W133-E136 HydrophobicContact CZ3-CG 4.48Å; W133-E136 PolarHBondContact O-N 3.47Å; W133-L137 VanDerWaalsContact O-CB 3.26Å; W133-L137 WeakPolarHBondContact O-CB 3.26Å; W133-L137 WeakPolarHBondContact O-CD1 3.33Å; W133-L137 VanDerWaalsContact O-CG 3.29Å; W133-L137 WeakPolarHBondContact O-CG 3.23Å; W133-L137 PolarHBondContact O-N 2.93Å
134	A	66	Low	60.8	Low	46 Å²	46	50.7 Å²	50.7	38%	0.38	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-35.2	173.4	0	0	0	0	0	111.8	Q130 L131 G132 D138	Q130-A134 PolarHBondContact O-N 2.92Å; L131-A134 HydrophobicContact CD1-CB 4.47Å; L131-A134 WeakPolarHBondContact O-CB 3.3Å; L131-A134 PolarHBondContact O-N 3.32Å; L131-A134 VanDerWaalsContact O-N 3.11Å; G132-A134 VanDerWaalsContact C-N 3.28Å; G132-A134 PolarHBondContact O-N 3.36Å; A134-D138 WeakPolarHBondContact O-CB 3.43Å; A134-D138 PolarHBondContact O-N 3.13Å
135	T	64	Low	58.9	Low	45 Å²	45	52.4 Å²	52.4	28%	0.276	29%	0.285	S	S	.	.	H	α-helix	trans	-72.5	-33.1	175	66.7	0	0	0	0	113.7	G106 L109 L131 G132 W133 D139	G106-T135 PolarHBondContact N-OG1 2.95Å; L109-T135 HydrophobicContact CD1-CG2 3.95Å; L131-T135 PolarHBondContact O-N 3.48Å; G132-T135 PolarHBondContact O-N 2.76Å; G132-T135 PolarHBondContact O-OG1 3.05Å; W133-T135 PolarHBondContact O-N 3.34Å; T135-D139 PolarHBondContact O-N 3.46Å
136	E	63.9	Low	57.1	Low	11 Å²	11	47.9 Å²	47.9	5%	0.051	27%	0.27	C	S	.	.	H	α-helix	trans	-75.8	-31.9	173.7	-59	-69.2	152	0	0	111.6	I63 L98 L103 I104 R105 G106 G132 W133 V140	I63-E136 HydrophobicContact CD1-CG 4.41Å; L98-E136 HydrophobicContact CD2-CB 4.27Å; L103-E136 WeakPolarHBondContact CA-OE1 3.24Å; L103-E136 HydrophobicContact CD2-CG 4.02Å; I104-E136 PolarHBondContact N-OE1 2.82Å; R105-E136 WeakPolarHBondContact CA-OE1 3.25Å; R105-E136 PolarHBondContact N-OE1 3.23Å; G106-E136 PolarHBondContact N-OE1 3.4Å; G132-E136 PolarHBondContact O-N 2.91Å; W133-E136 HydrophobicContact CE3-CB 3.97Å; W133-E136 HydrophobicContact CE3-CG 4.41Å; W133-E136 HydrophobicContact CZ3-CB 4.15Å; W133-E136 HydrophobicContact CZ3-CG 4.48Å; W133-E136 PolarHBondContact O-N 3.47Å; E136-V140 WeakPolarHBondContact O-CB 3.47Å; E136-V140 WeakPolarHBondContact O-CG2 3.42Å; E136-V140 PolarHBondContact O-N 2.68Å
137	L	65.5	Low	55.2	Low	48 Å²	48	48.6 Å²	48.6	25%	0.251	27%	0.27	S	S	.	.	H	α-helix	trans	-68.7	-35.6	170.8	-80.4	158.2	0	0	0	112.5	V70 I74 L94 L98 W133 G141	V70-L137 HydrophobicContact CG1-CD1 3.98Å; I74-L137 HydrophobicContact CD1-CD1 3.64Å; I74-L137 HydrophobicContact CD1-CD2 3.94Å; I74-L137 HydrophobicContact CD1-CG 4.47Å; L94-L137 HydrophobicContact CD2-CD2 4.06Å; L98-L137 HydrophobicContact CD1-CD2 3.61Å; L98-L137 HydrophobicContact CD1-CG 4.22Å; L98-L137 HydrophobicContact CD2-CD2 4.04Å; L98-L137 HydrophobicContact CD2-CG 4.02Å; L98-L137 HydrophobicContact CG-CD2 4.42Å; W133-L137 VanDerWaalsContact O-CB 3.26Å; W133-L137 WeakPolarHBondContact O-CB 3.26Å; W133-L137 WeakPolarHBondContact O-CD1 3.33Å; W133-L137 VanDerWaalsContact O-CG 3.29Å; W133-L137 WeakPolarHBondContact O-CG 3.23Å; W133-L137 PolarHBondContact O-N 2.93Å; L137-G141 PolarHBondContact O-N 3.24Å
138	D	59.1	Low	53.1	Low	90 Å²	90	44.7 Å²	44.7	48%	0.481	26%	0.264	S	S	.	.	H	α-helix	trans	-67.4	-48.5	172.6	-157.2	43.6	0	0	0	109.6	A134 V140 G141 L142	A134-D138 WeakPolarHBondContact O-CB 3.43Å; A134-D138 PolarHBondContact O-N 3.13Å; D138-V140 VanDerWaalsContact C-N 3.31Å; D138-V140 PolarHBondContact O-N 2.93Å; D138-G141 CarbonylContact O-C 2.91Å; D138-G141 WeakPolarHBondContact O-CA 2.97Å; D138-G141 PolarHBondContact O-N 2.68Å; D138-L142 HydrophobicContact CB-CD1 4.32Å; D138-L142 VanDerWaalsContact CG-CD1 3.49Å; D138-L142 WeakPolarHBondContact O-CD1 3.14Å; D138-L142 PolarHBondContact O-N 2.89Å
139	D	55.4	Low	51.2	Low	24 Å²	24	47.2 Å²	47.2	13%	0.128	28%	0.277	C	S	.	.	H	α-helix	trans	-54.7	-41.5	172.3	176.1	65.3	0	0	0	113.1	R105 T135 K143	R105-D139 IonicContact CZ-OD1 3.58Å; R105-D139 IonicContact NH1-OD1 2.67Å; R105-D139 PolarHBondContact NH1-OD1 3.1Å; R105-D139 IonicContact NH1-OD2 2.74Å; T135-D139 PolarHBondContact O-N 3.46Å; D139-K143 VanDerWaalsContact CG-NZ 3.27Å; D139-K143 VanDerWaalsContact O-CB 3.28Å; D139-K143 WeakPolarHBondContact O-CB 3.32Å; D139-K143 WeakPolarHBondContact O-CD 3.31Å; D139-K143 VanDerWaalsContact O-CG 3.24Å; D139-K143 WeakPolarHBondContact O-CG 3.32Å; D139-K143 PolarHBondContact O-N 3.11Å; D139-K143 WeakPolarHBondContact OD1-CE 3.3Å; D139-K143 IonicContact OD1-NZ 3.16Å; D139-K143 PolarHBondContact OD1-NZ 3.25Å; D139-K143 VanDerWaalsContact OD1-NZ 3.07Å; D139-K143 WeakPolarHBondContact OD2-CE 3.14Å; D139-K143 IonicContact OD2-NZ 2.77Å; D139-K143 PolarHBondContact OD2-NZ 3.16Å
140	V	51.3	Low	49.4	Very low	23 Å²	23	49.7 Å²	49.7	14%	0.139	29%	0.289	C	S	.	.	H	α-helix	trans	-66.9	-38.8	172.3	161.8	0	0	0	0	112.5	N97 L98 E136 D138 A144	N97-V140 HydrophobicContact CB-CB 4.44Å; N97-V140 HydrophobicContact CB-CG1 3.58Å; N97-V140 HydrophobicContact CB-CG2 3.93Å; N97-V140 WeakPolarHBondContact O-CG2 3.23Å; L98-V140 HydrophobicContact CD2-CB 4.08Å; L98-V140 HydrophobicContact CD2-CG2 3.56Å; L98-V140 HydrophobicContact CG-CG2 4.04Å; E136-V140 WeakPolarHBondContact O-CB 3.47Å; E136-V140 WeakPolarHBondContact O-CG2 3.42Å; E136-V140 PolarHBondContact O-N 2.68Å; D138-V140 VanDerWaalsContact C-N 3.31Å; D138-V140 PolarHBondContact O-N 2.93Å; V140-A144 WeakPolarHBondContact O-CB 3.24Å; V140-A144 PolarHBondContact O-N 2.9Å
141	G	42.7	Very low	47.8	Very low	31 Å²	31	47.5 Å²	47.5	32%	0.32	28%	0.28	S	S	.	.	H	α-helix	trans	-61.8	-48.8	174.6	0	0	0	0	0	111.8	L137 D138 A144 V145	L137-G141 PolarHBondContact O-N 3.24Å; D138-G141 CarbonylContact O-C 2.91Å; D138-G141 WeakPolarHBondContact O-CA 2.97Å; D138-G141 PolarHBondContact O-N 2.68Å; G141-A144 PolarHBondContact O-N 3.03Å; G141-V145 VanDerWaalsContact O-CB 3.29Å; G141-V145 WeakPolarHBondContact O-CB 3.28Å; G141-V145 VanDerWaalsContact O-CG2 3.25Å; G141-V145 WeakPolarHBondContact O-CG2 3.41Å; G141-V145 PolarHBondContact O-N 3.27Å
142	L	36.9	Very low	46.1	Very low	36 Å²	36	48 Å²	48	19%	0.188	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-47.5	175	-81.7	100.7	0	0	0	111.4	D138 A144 V145 N146 L149 A153	D138-L142 HydrophobicContact CB-CD1 4.32Å; D138-L142 VanDerWaalsContact CG-CD1 3.49Å; D138-L142 WeakPolarHBondContact O-CD1 3.14Å; D138-L142 PolarHBondContact O-N 2.89Å; L142-A144 VanDerWaalsContact C-N 3.26Å; L142-A144 PolarHBondContact O-N 2.78Å; L142-V145 PolarHBondContact O-N 3.46Å; L142-N146 CarbonylContact O-C 3.57Å; L142-N146 VanDerWaalsContact O-C 3.27Å; L142-N146 WeakPolarHBondContact O-CA 3.47Å; L142-N146 PolarHBondContact O-N 2.91Å; L142-L149 HydrophobicContact CD2-CB 3.84Å; L142-L149 WeakPolarHBondContact CD2-O 3.43Å; L142-A153 HydrophobicContact CD2-CB 4.14Å
143	K	39.5	Very low	44.4	Very low	134 Å²	134	49.5 Å²	49.5	58%	0.583	29%	0.292	S	S	*	.	H	α-helix	trans	-62.1	-29.5	175	-74.8	167.7	176.1	166.7	0	113.7	D139	D139-K143 VanDerWaalsContact CG-NZ 3.27Å; D139-K143 VanDerWaalsContact O-CB 3.28Å; D139-K143 WeakPolarHBondContact O-CB 3.32Å; D139-K143 WeakPolarHBondContact O-CD 3.31Å; D139-K143 VanDerWaalsContact O-CG 3.24Å; D139-K143 WeakPolarHBondContact O-CG 3.32Å; D139-K143 PolarHBondContact O-N 3.11Å; D139-K143 WeakPolarHBondContact OD1-CE 3.3Å; D139-K143 IonicContact OD1-NZ 3.16Å; D139-K143 PolarHBondContact OD1-NZ 3.25Å; D139-K143 VanDerWaalsContact OD1-NZ 3.07Å; D139-K143 WeakPolarHBondContact OD2-CE 3.14Å; D139-K143 IonicContact OD2-NZ 2.77Å; D139-K143 PolarHBondContact OD2-NZ 3.16Å
144	A	33.7	Very low	42.6	Very low	25 Å²	25	53.8 Å²	53.8	21%	0.207	32%	0.319	C	S	.	.	H	α-helix	trans	-83.7	-23	176.8	0	0	0	0	0	114.1	V140 G141 L142	V140-A144 WeakPolarHBondContact O-CB 3.24Å; V140-A144 PolarHBondContact O-N 2.9Å; G141-A144 PolarHBondContact O-N 3.03Å; L142-A144 VanDerWaalsContact C-N 3.26Å; L142-A144 PolarHBondContact O-N 2.78Å
145	V	33	Very low	41	Very low	114 Å²	114	52.5 Å²	52.5	69%	0.691	31%	0.308	S	S	*	.	H	α-helix	trans	-103	-48.8	-176.3	171.2	0	0	0	0	112.2	G141 L142	G141-V145 VanDerWaalsContact O-CB 3.29Å; G141-V145 WeakPolarHBondContact O-CB 3.28Å; G141-V145 VanDerWaalsContact O-CG2 3.25Å; G141-V145 WeakPolarHBondContact O-CG2 3.41Å; G141-V145 PolarHBondContact O-N 3.27Å; L142-V145 PolarHBondContact O-N 3.46Å
146	N	35.9	Very low	39.4	Very low	23 Å²	23	56.1 Å²	56.1	12%	0.123	33%	0.325	C	S	.	.			trans	-143.8	95	-176.4	-163.5	15.6	0	0	0	113	L142 G148 L149 Q388	L142-N146 CarbonylContact O-C 3.57Å; L142-N146 VanDerWaalsContact O-C 3.27Å; L142-N146 WeakPolarHBondContact O-CA 3.47Å; L142-N146 PolarHBondContact O-N 2.91Å; N146-G148 VanDerWaalsContact CG-C 3.4Å; N146-G148 PolarHBondContact ND2-O 3Å; N146-G148 PolarHBondContact O-N 3.26Å; N146-G148 WeakPolarHBondContact OD1-CA 3.45Å; N146-G148 PolarHBondContact OD1-N 3.18Å; N146-L149 HydrophobicContact CB-CB 4.16Å; N146-L149 HydrophobicContact CB-CD1 4.1Å; N146-L149 HydrophobicContact CB-CG 4.39Å; N146-L149 VanDerWaalsContact ND2-CG 3.35Å; N146-L149 WeakPolarHBondContact ND2-CG 3.28Å; N146-L149 PolarHBondContact ND2-N 3.16Å; N146-L149 PolarHBondContact O-N 3.16Å; N146-L149 VanDerWaalsContact O-N 3.14Å; N146-Q388 PolarHBondContact ND2-NE2 3.35Å; N146-Q388 PolarHBondContact OD1-NE2 2.89Å
147	D	33	Very low	37.8	Very low	56 Å²	56	63.5 Å²	63.5	30%	0.299	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	63	145.2	-125.7	1.1	0	0	0	110.3	N359 K363	D147-N359 VanDerWaalsContact CB-OD1 3.29Å; D147-N359 WeakPolarHBondContact CB-OD1 3.48Å; D147-N359 VanDerWaalsContact CG-ND2 3.33Å; D147-N359 PolarHBondContact O-OD1 3.29Å; D147-N359 VanDerWaalsContact O-OD1 3.13Å; D147-N359 PolarHBondContact OD1-ND2 3.19Å; D147-N359 PolarHBondContact OD2-N 3Å; D147-N359 PolarHBondContact OD2-OD1 3.29Å; D147-K363 IonicContact OD2-NZ 3.16Å; D147-K363 PolarHBondContact OD2-NZ 3.36Å
148	G	28.4	Very low	36.2	Very low	45 Å²	45	64.8 Å²	64.8	46%	0.464	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	149	20.5	-165.1	0	0	0	0	0	117.2	N146	N146-G148 VanDerWaalsContact CG-C 3.4Å; N146-G148 PolarHBondContact ND2-O 3Å; N146-G148 PolarHBondContact O-N 3.26Å; N146-G148 WeakPolarHBondContact OD1-CA 3.45Å; N146-G148 PolarHBondContact OD1-N 3.18Å
149	L	29.2	Very low	34.7	Very low	62 Å²	62	64.8 Å²	64.8	33%	0.325	37%	0.373	S	S	.	.			trans	-124.7	67.7	162.3	-97.6	161.4	0	0	0	108.8	L142 N146 L151	L142-L149 HydrophobicContact CD2-CB 3.84Å; L142-L149 WeakPolarHBondContact CD2-O 3.43Å; N146-L149 HydrophobicContact CB-CB 4.16Å; N146-L149 HydrophobicContact CB-CD1 4.1Å; N146-L149 HydrophobicContact CB-CG 4.39Å; N146-L149 VanDerWaalsContact ND2-CG 3.35Å; N146-L149 WeakPolarHBondContact ND2-CG 3.28Å; N146-L149 PolarHBondContact ND2-N 3.16Å; N146-L149 PolarHBondContact O-N 3.16Å; N146-L149 VanDerWaalsContact O-N 3.14Å; L149-L151 PolarHBondContact O-N 3.43Å
150	L	30.9	Very low	33.6	Very low	58 Å²	58	67.4 Å²	67.4	30%	0.304	39%	0.393	S	S	.	.			trans	-83.6	112.1	-173.9	-155.1	168.5	0	0	0	109.3	Q152 F176	L150-Q152 PolarHBondContact O-N 3.43Å; L150-F176 HydrophobicContact CB-CD1 4.42Å; L150-F176 HydrophobicContact CB-CE1 3.7Å; L150-F176 HydrophobicContact CB-CZ 3.87Å; L150-F176 HydrophobicContact CD1-CD1 3.82Å; L150-F176 HydrophobicContact CD1-CE1 3.95Å; L150-F176 HydrophobicContact CD1-CG 4.35Å; L150-F176 HydrophobicContact CD2-CD1 4.24Å; L150-F176 HydrophobicContact CD2-CD2 4.07Å; L150-F176 HydrophobicContact CD2-CE1 4.03Å; L150-F176 HydrophobicContact CD2-CE2 3.83Å; L150-F176 HydrophobicContact CD2-CG 4.27Å; L150-F176 HydrophobicContact CD2-CZ 3.82Å; L150-F176 HydrophobicContact CG-CD1 4.38Å; L150-F176 HydrophobicContact CG-CE1 4.09Å; L150-F176 HydrophobicContact CG-CZ 4.28Å; L150-F176 VanDerWaalsContact O-CZ 3.28Å; L150-F176 WeakPolarHBondContact O-CZ 3.48Å
151	L	35.1	Very low	32.8	Very low	36 Å²	36	75.4 Å²	75.4	19%	0.188	42%	0.422	C	S	.	.	S	Bend	trans	55.6	-20	-179.7	-106.6	70.7	0	0	0	118.7	L149 A153 T154 A155 V172 E175	L149-L151 PolarHBondContact O-N 3.43Å; L151-A153 PolarHBondContact O-N 3.44Å; L151-A153 VanDerWaalsContact O-N 3.16Å; L151-T154 WeakPolarHBondContact O-CB 3.39Å; L151-T154 PolarHBondContact O-N 3.27Å; L151-A155 PolarHBondContact O-N 2.8Å; L151-A155 VanDerWaalsContact O-N 3.08Å; L151-V172 HydrophobicContact CB-CG1 4.28Å; L151-V172 HydrophobicContact CD2-CB 4.42Å; L151-V172 HydrophobicContact CD2-CG1 3.87Å; L151-V172 HydrophobicContact CD2-CG2 4.09Å; L151-E175 WeakPolarHBondContact CD1-OE2 3.27Å; L151-E175 WeakPolarHBondContact CD2-OE2 3.18Å
152	Q	30.5	Very low	32.5	Very low	99 Å²	99	75.2 Å²	75.2	46%	0.463	41%	0.414	S	S	.	.	H	α-helix	trans	-58.5	-31.3	-176.3	-76.2	178.1	-23.3	0	0	113.2	L150 T154 A155 L156	L150-Q152 PolarHBondContact O-N 3.43Å; Q152-T154 VanDerWaalsContact C-N 3.34Å; Q152-T154 PolarHBondContact O-N 2.75Å; Q152-A155 CarbonylContact O-C 3.51Å; Q152-A155 PolarHBondContact O-N 2.99Å; Q152-L156 VanDerWaalsContact O-CB 3.29Å; Q152-L156 WeakPolarHBondContact O-CB 2.85Å; Q152-L156 WeakPolarHBondContact O-CD1 3.29Å; Q152-L156 WeakPolarHBondContact O-CG 3.41Å; Q152-L156 PolarHBondContact O-N 3.33Å
153	A	29.1	Very low	32.5	Very low	33 Å²	33	76.8 Å²	76.8	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-64.7	-36.2	174.1	0	0	0	0	0	112.9	L142 L151 M157	L142-A153 HydrophobicContact CD2-CB 4.14Å; L151-A153 PolarHBondContact O-N 3.44Å; L151-A153 VanDerWaalsContact O-N 3.16Å; A153-M157 VanDerWaalsContact O-CG 3.29Å; A153-M157 WeakPolarHBondContact O-CG 3.35Å; A153-M157 PolarHBondContact O-N 3.38Å
154	T	31.9	Very low	32.3	Very low	91 Å²	91	73.6 Å²	73.6	56%	0.558	43%	0.427	S	S	*	.	H	α-helix	trans	-72.7	-32.5	174.2	-43.6	0	0	0	0	111.3	L151 Q152	L151-T154 WeakPolarHBondContact O-CB 3.39Å; L151-T154 PolarHBondContact O-N 3.27Å; Q152-T154 VanDerWaalsContact C-N 3.34Å; Q152-T154 PolarHBondContact O-N 2.75Å
155	A	30.9	Very low	32.8	Very low	19 Å²	19	77.9 Å²	77.9	16%	0.157	45%	0.45	C	S	.	.	H	α-helix	trans	-76.2	-34.6	175.6	0	0	0	0	0	113.3	L151 Q152 M157 L158 L163	L151-A155 PolarHBondContact O-N 2.8Å; L151-A155 VanDerWaalsContact O-N 3.08Å; Q152-A155 CarbonylContact O-C 3.51Å; Q152-A155 PolarHBondContact O-N 2.99Å; A155-M157 PolarHBondContact O-N 3.02Å; A155-L158 WeakPolarHBondContact O-CA 3.4Å; A155-L158 VanDerWaalsContact O-CB 3.31Å; A155-L158 WeakPolarHBondContact O-CB 3.29Å; A155-L158 PolarHBondContact O-N 2.69Å; A155-L158 VanDerWaalsContact O-O 3.08Å; A155-L163 HydrophobicContact CB-CD1 4.19Å; A155-L163 HydrophobicContact CB-CD2 3.96Å; A155-L163 HydrophobicContact CB-CG 4.28Å
156	L	30.8	Very low	33.7	Very low	121 Å²	121	76 Å²	76	63%	0.634	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.7	173.2	-72.9	164.4	0	0	0	112.9	Q152 L158	Q152-L156 VanDerWaalsContact O-CB 3.29Å; Q152-L156 WeakPolarHBondContact O-CB 2.85Å; Q152-L156 WeakPolarHBondContact O-CD1 3.29Å; Q152-L156 WeakPolarHBondContact O-CG 3.41Å; Q152-L156 PolarHBondContact O-N 3.33Å; L156-L158 VanDerWaalsContact C-N 3.33Å
157	M	31.2	Very low	34.5	Very low	166 Å²	166	78.3 Å²	78.3	82%	0.818	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-4.6	167.9	-71.9	-89.4	-80	0	0	112.6	A153 A155	A153-M157 VanDerWaalsContact O-CG 3.29Å; A153-M157 WeakPolarHBondContact O-CG 3.35Å; A153-M157 PolarHBondContact O-N 3.38Å; A155-M157 PolarHBondContact O-N 3.02Å
158	L	30.9	Very low	35.4	Very low	74 Å²	74	77.6 Å²	77.6	39%	0.387	45%	0.452	S	S	.	.	S	Bend	trans	-95.9	130.6	165.2	-63.7	167.4	0	0	0	108.1	A155 L156 I162	A155-L158 WeakPolarHBondContact O-CA 3.4Å; A155-L158 VanDerWaalsContact O-CB 3.31Å; A155-L158 WeakPolarHBondContact O-CB 3.29Å; A155-L158 PolarHBondContact O-N 2.69Å; A155-L158 VanDerWaalsContact O-O 3.08Å; L156-L158 VanDerWaalsContact C-N 3.33Å; L158-I162 HydrophobicContact CB-CB 4.21Å; L158-I162 HydrophobicContact CB-CD1 4.03Å; L158-I162 HydrophobicContact CB-CG2 4.01Å; L158-I162 HydrophobicContact CD1-CG2 4.11Å; L158-I162 HydrophobicContact CD2-CD1 4.13Å
159	P	28.9	Very low	36.4	Very low	90 Å²	90	78 Å²	78	58%	0.584	44%	0.443	S	S	*	.			trans	-54.5	144.5	-178.4	-28.8	35.4	0	0	0	113.4	Y161 I162	P159-Y161 PolarHBondContact O-N 3.48Å; P159-I162 VanDerWaalsContact O-CB 3.28Å; P159-I162 WeakPolarHBondContact O-CB 3.49Å; P159-I162 PolarHBondContact O-N 2.75Å
160	S	31.7	Very low	37.7	Very low	79 Å²	79	77.7 Å²	77.7	55%	0.552	45%	0.445	S	S	*	.	H	α-helix	trans	-49.2	-31.7	-169.6	-35.1	0	0	0	0	115.2	I162 L163	S160-I162 PolarHBondContact O-N 3.45Å; S160-I162 VanDerWaalsContact O-N 3.15Å; S160-L163 PolarHBondContact O-N 3.26Å
161	Y	34.9	Very low	38.6	Very low	191 Å²	191	76.6 Å²	76.6	75%	0.749	44%	0.444	S	S	*	.	H	α-helix	trans	-53.6	-28.9	172.4	130.7	-99.7	0	0	0	113.9	P159	P159-Y161 PolarHBondContact O-N 3.48Å
162	I	35.3	Very low	39.4	Very low	28 Å²	28	77 Å²	77	14%	0.144	45%	0.449	C	S	.	.	H	α-helix	trans	-75.7	-47.9	-179.9	-68.9	-175.1	0	0	0	110.5	L158 P159 S160 G164 T165 H166	L158-I162 HydrophobicContact CB-CB 4.21Å; L158-I162 HydrophobicContact CB-CD1 4.03Å; L158-I162 HydrophobicContact CB-CG2 4.01Å; L158-I162 HydrophobicContact CD1-CG2 4.11Å; L158-I162 HydrophobicContact CD2-CD1 4.13Å; P159-I162 VanDerWaalsContact O-CB 3.28Å; P159-I162 WeakPolarHBondContact O-CB 3.49Å; P159-I162 PolarHBondContact O-N 2.75Å; S160-I162 PolarHBondContact O-N 3.45Å; S160-I162 VanDerWaalsContact O-N 3.15Å; I162-G164 VanDerWaalsContact C-N 3.26Å; I162-G164 PolarHBondContact O-N 3.14Å; I162-G164 VanDerWaalsContact O-N 3.09Å; I162-T165 PolarHBondContact O-N 2.92Å; I162-T165 VanDerWaalsContact O-N 3.13Å; I162-H166 HydrophobicContact CG2-CB 3.61Å; I162-H166 VanDerWaalsContact O-CB 3.27Å; I162-H166 WeakPolarHBondContact O-CB 3.26Å; I162-H166 PolarHBondContact O-N 3.42Å
163	L	38.1	Very low	40.7	Very low	69 Å²	69	76.6 Å²	76.6	36%	0.361	45%	0.447	S	S	.	.	H	α-helix	trans	-63.3	-23.5	-165.6	-103.1	166.1	0	0	0	115.3	A155 S160	A155-L163 HydrophobicContact CB-CD1 4.19Å; A155-L163 HydrophobicContact CB-CD2 3.96Å; A155-L163 HydrophobicContact CB-CG 4.28Å; S160-L163 PolarHBondContact O-N 3.26Å
164	G	34.9	Very low	42.4	Very low	66 Å²	66	76.6 Å²	76.6	68%	0.68	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-19.2	177.6	0	0	0	0	0	115.8	I162	I162-G164 VanDerWaalsContact C-N 3.26Å; I162-G164 PolarHBondContact O-N 3.14Å; I162-G164 VanDerWaalsContact O-N 3.09Å
165	T	45.1	Very low	43.7	Very low	115 Å²	115	75.8 Å²	75.8	71%	0.706	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147	14.3	-172.6	57.5	0	0	0	0	114.7	I162	I162-T165 PolarHBondContact O-N 2.92Å; I162-T165 VanDerWaalsContact O-N 3.13Å
166	H	50.8	Low	45.1	Very low	74 Å²	74	78.4 Å²	78.4	34%	0.343	44%	0.439	S	S	.	.			trans	-67.2	131.5	-174.8	-163.3	-128.2	0	0	0	112	I162 A168 L169	I162-H166 HydrophobicContact CG2-CB 3.61Å; I162-H166 VanDerWaalsContact O-CB 3.27Å; I162-H166 WeakPolarHBondContact O-CB 3.26Å; I162-H166 PolarHBondContact O-N 3.42Å; H166-A168 WeakPolarHBondContact ND1-CB 2.92Å; H166-A168 PolarHBondContact ND1-N 3.34Å; H166-A168 PolarHBondContact O-N 3.13Å; H166-L169 WeakPolarHBondContact O-CB 3.4Å; H166-L169 PolarHBondContact O-N 2.74Å
167	P	53.5	Low	46.9	Very low	73 Å²	73	74.3 Å²	74.3	47%	0.474	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23	175.9	18.2	-32.3	0	0	0	114.7	L267	P167-L267 HydrophobicContact CB-CD1 3.8Å; P167-L267 HydrophobicContact CB-CD2 3.48Å; P167-L267 VanDerWaalsContact CB-CD2 3.48Å; P167-L267 HydrophobicContact CB-CG 4.27Å; P167-L267 HydrophobicContact CG-CD2 4.44Å; P167-L267 WeakPolarHBondContact O-CD1 3.46Å
168	A	51.8	Low	48.6	Very low	40 Å²	40	70.4 Å²	70.4	33%	0.331	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-0.2	175.9	0	0	0	0	0	114.8	H166 A171 V172	H166-A168 WeakPolarHBondContact ND1-CB 2.92Å; H166-A168 PolarHBondContact ND1-N 3.34Å; H166-A168 PolarHBondContact O-N 3.13Å; A168-A171 WeakPolarHBondContact O-CB 3.27Å; A168-A171 PolarHBondContact O-N 2.98Å; A168-A171 VanDerWaalsContact O-N 3.14Å; A168-V172 PolarHBondContact O-N 2.78Å; A168-V172 VanDerWaalsContact O-N 3.12Å
169	L	49.5	Very low	50.5	Low	53 Å²	53	71.1 Å²	71.1	28%	0.277	40%	0.4	S	S	.	.	H	α-helix	trans	-58.3	-45.1	178.3	177.5	64.4	0	0	0	112.5	H166 A171 V172 E173	H166-L169 WeakPolarHBondContact O-CB 3.4Å; H166-L169 PolarHBondContact O-N 2.74Å; L169-A171 PolarHBondContact O-N 2.68Å; L169-V172 WeakPolarHBondContact O-CB 3.27Å; L169-V172 PolarHBondContact O-N 2.92Å; L169-E173 PolarHBondContact O-N 3.17Å
170	P	54.9	Low	52.9	Low	56 Å²	56	68.2 Å²	68.2	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-59.9	-32.1	175.1	-26.4	37.3	0	0	0	113.7	E173 Q174 L260	P170-E173 PolarHBondContact O-N 2.74Å; P170-Q174 PolarHBondContact O-N 2.99Å; P170-L260 HydrophobicContact CB-CD1 3.59Å; P170-L260 HydrophobicContact CB-CD2 4.41Å; P170-L260 VanDerWaalsContact O-CD2 3.27Å; P170-L260 WeakPolarHBondContact O-CD2 3.45Å
171	A	51.7	Low	55.1	Low	35 Å²	35	65.6 Å²	65.6	29%	0.289	36%	0.358	S	S	.	.	H	α-helix	trans	-72.6	-28.5	176.2	0	0	0	0	0	112.8	A168 L169 I264	A168-A171 WeakPolarHBondContact O-CB 3.27Å; A168-A171 PolarHBondContact O-N 2.98Å; A168-A171 VanDerWaalsContact O-N 3.14Å; L169-A171 PolarHBondContact O-N 2.68Å; A171-I264 HydrophobicContact CB-CD1 3.66Å; A171-I264 HydrophobicContact CB-CG1 4.09Å
172	V	51.3	Low	56.9	Low	46 Å²	46	59.9 Å²	59.9	28%	0.279	34%	0.34	S	S	.	.	H	α-helix	trans	-71.4	-47.1	170.5	172.2	0	0	0	0	110.1	L151 A168 L169 Q174 E175 F176	L151-V172 HydrophobicContact CB-CG1 4.28Å; L151-V172 HydrophobicContact CD2-CB 4.42Å; L151-V172 HydrophobicContact CD2-CG1 3.87Å; L151-V172 HydrophobicContact CD2-CG2 4.09Å; A168-V172 PolarHBondContact O-N 2.78Å; A168-V172 VanDerWaalsContact O-N 3.12Å; L169-V172 WeakPolarHBondContact O-CB 3.27Å; L169-V172 PolarHBondContact O-N 2.92Å; V172-Q174 PolarHBondContact O-N 2.62Å; V172-E175 PolarHBondContact O-N 2.88Å; V172-F176 HydrophobicContact CG1-CE2 4.1Å; V172-F176 WeakPolarHBondContact O-CD2 3.26Å
173	E	58.1	Low	58.8	Low	90 Å²	90	60.8 Å²	60.8	42%	0.421	35%	0.345	S	S	.	.	H	α-helix	trans	-56.4	-36.5	175.6	-68.2	174.8	178.7	0	0	111.9	L169 P170 E175 F176 Q177	L169-E173 PolarHBondContact O-N 3.17Å; P170-E173 PolarHBondContact O-N 2.74Å; E173-E175 VanDerWaalsContact C-N 3.32Å; E173-E175 PolarHBondContact O-N 2.92Å; E173-F176 WeakPolarHBondContact O-CB 3.43Å; E173-F176 PolarHBondContact O-N 2.76Å; E173-Q177 VanDerWaalsContact O-CG 3.26Å; E173-Q177 WeakPolarHBondContact O-CG 3.45Å; E173-Q177 PolarHBondContact O-N 3.5Å
174	Q	63.2	Low	60.7	Low	32 Å²	32	57.7 Å²	57.7	15%	0.15	33%	0.329	C	S	.	.	H	α-helix	trans	-61.1	-34	174.7	-167.1	178.5	14.6	0	0	113.9	P170 V172 F176 Q177 Q178 L260	P170-Q174 PolarHBondContact O-N 2.99Å; V172-Q174 PolarHBondContact O-N 2.62Å; Q174-F176 VanDerWaalsContact C-N 3.29Å; Q174-F176 PolarHBondContact O-N 3.49Å; Q174-Q177 PolarHBondContact O-N 2.95Å; Q174-Q178 WeakPolarHBondContact O-CB 3.28Å; Q174-Q178 PolarHBondContact O-N 2.78Å; Q174-L260 HydrophobicContact CB-CD2 3.57Å; Q174-L260 HydrophobicContact CG-CD2 3.93Å; Q174-L260 VanDerWaalsContact OE1-CD2 3.3Å
175	E	59.8	Low	62.8	Low	74 Å²	74	56.4 Å²	56.4	35%	0.346	31%	0.305	S	S	.	.	H	α-helix	trans	-63.4	-38.1	178.3	-166	173.3	163.3	0	0	110.6	R105 L151 V172 E173 D179	R105-E175 IonicContact CZ-OE1 3.67Å; R105-E175 IonicContact NH2-OE1 3.6Å; R105-E175 PolarHBondContact NH2-OE1 3.03Å; L151-E175 WeakPolarHBondContact CD1-OE2 3.27Å; L151-E175 WeakPolarHBondContact CD2-OE2 3.18Å; V172-E175 PolarHBondContact O-N 2.88Å; E173-E175 VanDerWaalsContact C-N 3.32Å; E173-E175 PolarHBondContact O-N 2.92Å; E175-D179 PolarHBondContact O-N 3.32Å
176	F	60.3	Low	63.7	Low	75 Å²	75	55.8 Å²	55.8	33%	0.329	30%	0.297	S	S	.	.	H	α-helix	trans	-67.1	-51.8	171.7	-65.9	-107.3	0	0	0	111.8	L150 V172 E173 Q174 Q178 D179 D180	L150-F176 HydrophobicContact CB-CD1 4.42Å; L150-F176 HydrophobicContact CB-CE1 3.7Å; L150-F176 HydrophobicContact CB-CZ 3.87Å; L150-F176 HydrophobicContact CD1-CD1 3.82Å; L150-F176 HydrophobicContact CD1-CE1 3.95Å; L150-F176 HydrophobicContact CD1-CG 4.35Å; L150-F176 HydrophobicContact CD2-CD1 4.24Å; L150-F176 HydrophobicContact CD2-CD2 4.07Å; L150-F176 HydrophobicContact CD2-CE1 4.03Å; L150-F176 HydrophobicContact CD2-CE2 3.83Å; L150-F176 HydrophobicContact CD2-CG 4.27Å; L150-F176 HydrophobicContact CD2-CZ 3.82Å; L150-F176 HydrophobicContact CG-CD1 4.38Å; L150-F176 HydrophobicContact CG-CE1 4.09Å; L150-F176 HydrophobicContact CG-CZ 4.28Å; L150-F176 VanDerWaalsContact O-CZ 3.28Å; L150-F176 WeakPolarHBondContact O-CZ 3.48Å; V172-F176 HydrophobicContact CG1-CE2 4.1Å; V172-F176 WeakPolarHBondContact O-CD2 3.26Å; E173-F176 WeakPolarHBondContact O-CB 3.43Å; E173-F176 PolarHBondContact O-N 2.76Å; Q174-F176 VanDerWaalsContact C-N 3.29Å; Q174-F176 PolarHBondContact O-N 3.49Å; F176-Q178 PolarHBondContact O-N 2.84Å; F176-D179 PolarHBondContact O-N 2.74Å; F176-D179 VanDerWaalsContact O-N 3.12Å; F176-D180 PolarHBondContact O-N 3.3Å
177	Q	69.4	Low	63.7	Low	34 Å²	34	56.5 Å²	56.5	16%	0.159	31%	0.311	C	S	.	.	H	α-helix	trans	-62.3	-32	-176.5	-64.3	168.4	10.8	0	0	112	E173 Q174 Y181 W206 L256	E173-Q177 VanDerWaalsContact O-CG 3.26Å; E173-Q177 WeakPolarHBondContact O-CG 3.45Å; E173-Q177 PolarHBondContact O-N 3.5Å; Q174-Q177 PolarHBondContact O-N 2.95Å; Q177-Y181 WeakPolarHBondContact O-CB 3.48Å; Q177-Y181 PolarHBondContact O-N 2.88Å; Q177-W206 HydrophobicContact CB-CB 4.34Å; Q177-W206 HydrophobicContact CB-CG 4.14Å; Q177-W206 HydrophobicContact CG-CB 4.09Å; Q177-W206 HydrophobicContact CG-CG 3.84Å; Q177-L256 VanDerWaalsContact OE1-CD2 3.24Å
178	Q	67.3	Low	63.2	Low	84 Å²	84	55.8 Å²	55.8	39%	0.393	32%	0.316	S	S	.	.	H	α-helix	trans	-72.3	-40.7	175.1	-176.4	164.5	36.1	0	0	112	Q174 F176 Y181 I182 Y253	Q174-Q178 WeakPolarHBondContact O-CB 3.28Å; Q174-Q178 PolarHBondContact O-N 2.78Å; F176-Q178 PolarHBondContact O-N 2.84Å; Q178-Y181 PolarHBondContact O-N 3.13Å; Q178-I182 HydrophobicContact CG-CD1 3.77Å; Q178-I182 HydrophobicContact CG-CG1 4.41Å; Q178-I182 WeakPolarHBondContact O-CB 3.2Å; Q178-I182 WeakPolarHBondContact O-CD1 3.49Å; Q178-I182 WeakPolarHBondContact O-CG1 3.31Å; Q178-I182 PolarHBondContact O-N 2.64Å; Q178-Y253 WeakPolarHBondContact CB-OH 3.46Å
179	D	69.6	Low	62.3	Low	89 Å²	89	60.1 Å²	60.1	48%	0.476	33%	0.334	S	S	.	.	H	α-helix	trans	-63.6	-48.3	175.7	-156.4	53	0	0	0	110.7	E175 F176 Y181 I182 D183	E175-D179 PolarHBondContact O-N 3.32Å; F176-D179 PolarHBondContact O-N 2.74Å; F176-D179 VanDerWaalsContact O-N 3.12Å; D179-Y181 VanDerWaalsContact C-N 3.32Å; D179-Y181 PolarHBondContact O-N 3.09Å; D179-I182 PolarHBondContact O-N 3.11Å; D179-D183 PolarHBondContact O-N 2.77Å
180	D	79	Confident	61.8	Low	29 Å²	29	61.3 Å²	61.3	16%	0.155	34%	0.337	C	S	.	.	H	α-helix	trans	-56.7	-41.9	173.6	-79.8	-14.4	0	0	0	112.7	F176 C184 T205 W206	F176-D180 PolarHBondContact O-N 3.3Å; D180-C184 VanDerWaalsContact O-CB 3.28Å; D180-C184 WeakPolarHBondContact O-CB 3.38Å; D180-C184 PolarHBondContact O-N 3.15Å; D180-T205 VanDerWaalsContact CG-CB 3.46Å; D180-T205 VanDerWaalsContact OD1-CG2 3.31Å; D180-T205 WeakPolarHBondContact OD1-CG2 3.47Å; D180-T205 VanDerWaalsContact OD2-CA 3.3Å; D180-T205 WeakPolarHBondContact OD2-CA 3.49Å; D180-T205 WeakPolarHBondContact OD2-CB 3.27Å; D180-W206 HydrophobicContact CB-CB 4.31Å; D180-W206 PolarHBondContact OD2-N 2.81Å
181	Y	79	Confident	61	Low	25 Å²	25	66.7 Å²	66.7	10%	0.098	36%	0.357	C	S	.	.	H	α-helix	trans	-67.7	-37.1	176.1	172.2	-87.7	0	0	0	111.5	Q177 Q178 D179 C184 F185 K250 Y253	Q177-Y181 WeakPolarHBondContact O-CB 3.48Å; Q177-Y181 PolarHBondContact O-N 2.88Å; Q178-Y181 PolarHBondContact O-N 3.13Å; D179-Y181 VanDerWaalsContact C-N 3.32Å; D179-Y181 PolarHBondContact O-N 3.09Å; Y181-C184 PolarHBondContact O-N 3.13Å; Y181-F185 AromaticContact CD2-CD2 3.36Å; Y181-F185 HydrophobicContact CD2-CD2 3.36Å; Y181-F185 AromaticContact CD2-CE2 3.87Å; Y181-F185 HydrophobicContact CD2-CE2 3.87Å; Y181-F185 HydrophobicContact CD2-CG 4.26Å; Y181-F185 HydrophobicContact CE1-CB 4.4Å; Y181-F185 HydrophobicContact CE2-CB 4.17Å; Y181-F185 AromaticContact CE2-CD2 3.51Å; Y181-F185 HydrophobicContact CE2-CD2 3.51Å; Y181-F185 HydrophobicContact CE2-CE2 4.13Å; Y181-F185 HydrophobicContact CE2-CG 4Å; Y181-F185 HydrophobicContact CG-CD2 4.01Å; Y181-F185 WeakPolarHBondContact O-CB 3.14Å; Y181-F185 WeakPolarHBondContact O-CD2 3.36Å; Y181-F185 PolarHBondContact O-N 3.19Å; Y181-K250 HydrophobicContact CE2-CG 4.11Å; Y181-K250 WeakPolarHBondContact OH-CE 3.15Å; Y181-Y253 HydrophobicContact CD1-CD1 4.16Å; Y181-Y253 AromaticContact CD1-CE1 3.98Å; Y181-Y253 HydrophobicContact CD1-CE1 3.98Å; Y181-Y253 AromaticContact CD2-CD1 3.58Å; Y181-Y253 HydrophobicContact CD2-CD1 3.58Å; Y181-Y253 AromaticContact CD2-CD2 3.71Å; Y181-Y253 HydrophobicContact CD2-CD2 3.71Å; Y181-Y253 HydrophobicContact CD2-CE1 4.2Å; Y181-Y253 HydrophobicContact CD2-CE2 4.28Å; Y181-Y253 AromaticContact CD2-CG 3.33Å; Y181-Y253 HydrophobicContact CD2-CG 3.33Å; Y181-Y253 HydrophobicContact CE1-CD1 4.19Å; Y181-Y253 HydrophobicContact CE1-CE1 4.19Å; Y181-Y253 AromaticContact CE2-CD1 3.62Å; Y181-Y253 HydrophobicContact CE2-CD1 3.62Å; Y181-Y253 HydrophobicContact CE2-CE1 4.39Å; Y181-Y253 AromaticContact CE2-CG 3.72Å; Y181-Y253 HydrophobicContact CE2-CG 3.72Å; Y181-Y253 AromaticContact CG-CD1 3.88Å; Y181-Y253 HydrophobicContact CG-CD1 3.88Å; Y181-Y253 AromaticContact CG-CD2 3.84Å; Y181-Y253 HydrophobicContact CG-CD2 3.84Å; Y181-Y253 HydrophobicContact CG-CE1 4.01Å; Y181-Y253 AromaticContact CG-CE2 3.94Å; Y181-Y253 HydrophobicContact CG-CE2 3.94Å; Y181-Y253 AromaticContact CG-CG 3.82Å; Y181-Y253 HydrophobicContact CG-CG 3.82Å; Y181-Y253 AromaticContact CZ-CD1 3.94Å
182	I	71.6	Confident	60.5	Low	71 Å²	71	73 Å²	73	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-69.3	-49.7	-179	-74.5	169.1	0	0	0	111.4	Q178 D179 C184 F185 N186	Q178-I182 HydrophobicContact CG-CD1 3.77Å; Q178-I182 HydrophobicContact CG-CG1 4.41Å; Q178-I182 WeakPolarHBondContact O-CB 3.2Å; Q178-I182 WeakPolarHBondContact O-CD1 3.49Å; Q178-I182 WeakPolarHBondContact O-CG1 3.31Å; Q178-I182 PolarHBondContact O-N 2.64Å; D179-I182 PolarHBondContact O-N 3.11Å; I182-C184 PolarHBondContact O-N 2.96Å; I182-F185 PolarHBondContact O-N 3.43Å; I182-N186 HydrophobicContact CG2-CB 4.19Å; I182-N186 WeakPolarHBondContact O-CB 3.18Å; I182-N186 PolarHBondContact O-N 3.39Å
183	D	75.7	Confident	60	Low	46 Å²	46	76 Å²	76	25%	0.246	40%	0.395	C	S	.	.	H	α-helix	trans	-57.5	-36.6	175.4	178.3	92	0	0	0	111.3	D179 C196 S197 D198	D179-D183 PolarHBondContact O-N 2.77Å; D183-C196 WeakPolarHBondContact O-CB 3.46Å; D183-C196 PolarHBondContact O-SG 3.24Å; D183-C196 VanDerWaalsContact O-SG 3.38Å; D183-C196 PolarHBondContact OD2-SG 3.35Å; D183-S197 WeakPolarHBondContact OD1-CB 3.42Å; D183-S197 PolarHBondContact OD1-N 2.99Å; D183-S197 PolarHBondContact OD1-OG 2.75Å; D183-S197 PolarHBondContact OD2-N 3.34Å; D183-D198 WeakPolarHBondContact OD2-CB 3.14Å; D183-D198 PolarHBondContact OD2-N 2.98Å; D183-D198 VanDerWaalsContact OD2-N 3.11Å
184	C	78.6	Confident	59.6	Low	4 Å²	4	78.7 Å²	78.7	3%	0.027	41%	0.407	C	S	.	.	H	α-helix	trans	-75.1	-47.8	179.7	-175.3	0	0	0	0	114.1	D180 Y181 I182 P207 K241 Y244	D180-C184 VanDerWaalsContact O-CB 3.28Å; D180-C184 WeakPolarHBondContact O-CB 3.38Å; D180-C184 PolarHBondContact O-N 3.15Å; Y181-C184 PolarHBondContact O-N 3.13Å; I182-C184 PolarHBondContact O-N 2.96Å; C184-P207 HydrophobicContact CB-CG 4.09Å; C184-K241 WeakPolarHBondContact O-CE 3.48Å; C184-K241 PolarHBondContact O-NZ 2.93Å; C184-Y244 VanDerWaalsContact SG-CD2 3.51Å
185	F	77.9	Confident	59.2	Low	39 Å²	39	81.1 Å²	81.1	17%	0.171	42%	0.422	C	S	.	.	H	α-helix	trans	-114.2	-17.9	-164.6	-63.7	-74.8	0	0	0	116	Y181 I182 S187 P207 Y244 V249 K250	Y181-F185 AromaticContact CD2-CD2 3.36Å; Y181-F185 HydrophobicContact CD2-CD2 3.36Å; Y181-F185 AromaticContact CD2-CE2 3.87Å; Y181-F185 HydrophobicContact CD2-CE2 3.87Å; Y181-F185 HydrophobicContact CD2-CG 4.26Å; Y181-F185 HydrophobicContact CE1-CB 4.4Å; Y181-F185 HydrophobicContact CE2-CB 4.17Å; Y181-F185 AromaticContact CE2-CD2 3.51Å; Y181-F185 HydrophobicContact CE2-CD2 3.51Å; Y181-F185 HydrophobicContact CE2-CE2 4.13Å; Y181-F185 HydrophobicContact CE2-CG 4Å; Y181-F185 HydrophobicContact CG-CD2 4.01Å; Y181-F185 WeakPolarHBondContact O-CB 3.14Å; Y181-F185 WeakPolarHBondContact O-CD2 3.36Å; Y181-F185 PolarHBondContact O-N 3.19Å; I182-F185 PolarHBondContact O-N 3.43Å; F185-S187 VanDerWaalsContact C-N 3.3Å; F185-S187 PolarHBondContact O-N 3.24Å; F185-P207 HydrophobicContact CE2-CB 4.34Å; F185-P207 HydrophobicContact CE2-CG 4.21Å; F185-Y244 HydrophobicContact CZ-CD2 4.1Å; F185-V249 HydrophobicContact CE2-CG1 4.12Å; F185-V249 HydrophobicContact CZ-CB 4.11Å; F185-V249 HydrophobicContact CZ-CG1 3.91Å; F185-K250 HydrophobicContact CE1-CB 4.41Å
186	N	65.4	Low	59.2	Low	102 Å²	102	77.8 Å²	77.8	55%	0.545	41%	0.407	S	S	.	.			trans	-91.3	45.6	-177.7	-81.1	0.4	0	0	0	113.6	I182 G188	I182-N186 HydrophobicContact CG2-CB 4.19Å; I182-N186 WeakPolarHBondContact O-CB 3.18Å; I182-N186 PolarHBondContact O-N 3.39Å; N186-G188 PolarHBondContact O-N 2.92Å
187	S	50.6	Low	59.6	Low	90 Å²	90	76.7 Å²	76.7	63%	0.629	41%	0.408	S	S	*	.			trans	-80.1	88.7	166.4	53.3	0	0	0	0	110.1	F185 N189	F185-S187 VanDerWaalsContact C-N 3.3Å; F185-S187 PolarHBondContact O-N 3.24Å; S187-N189 PolarHBondContact O-N 3.46Å
188	G	41.7	Very low	60.2	Low	57 Å²	57	75.2 Å²	75.2	59%	0.588	40%	0.401	S	S	*	.			trans	-87.2	99.1	-173.2	0	0	0	0	0	114.8	N186 K190	N186-G188 PolarHBondContact O-N 2.92Å; G188-K190 VanDerWaalsContact C-N 3.33Å; G188-K190 PolarHBondContact O-N 2.98Å
189	N	33.9	Very low	61	Low	131 Å²	131	71.3 Å²	71.3	70%	0.701	38%	0.383	S	S	*	.	S	Bend	trans	52.1	29.6	157.4	-65	8.7	0	0	0	118.5	S187	S187-N189 PolarHBondContact O-N 3.46Å
190	K	38.9	Very low	61.7	Low	78 Å²	78	67.6 Å²	67.6	34%	0.339	36%	0.364	S	S	.	.			trans	-133.8	143.4	169.4	-72.2	-177.2	171.8	-102.5	0	110.7	G188 D193 D304 V305	G188-K190 VanDerWaalsContact C-N 3.33Å; G188-K190 PolarHBondContact O-N 2.98Å; K190-D193 HydrophobicContact CB-CB 4.46Å; K190-D193 WeakPolarHBondContact CB-OD2 3.47Å; K190-D193 VanDerWaalsContact CD-OD2 3.27Å; K190-D193 WeakPolarHBondContact CD-OD2 3.29Å; K190-D304 VanDerWaalsContact CE-OD1 3.23Å; K190-D304 WeakPolarHBondContact CE-OD1 3.43Å; K190-D304 IonicContact NZ-OD1 2.7Å; K190-D304 PolarHBondContact NZ-OD1 3Å; K190-V305 PolarHBondContact NZ-O 3.01Å
191	E	38.4	Very low	61.7	Low	170 Å²	170	68.5 Å²	68.5	79%	0.794	37%	0.371	S	S	*	.	S	Bend	trans	-85.7	-11.9	-169.7	-61.8	-164.4	108.3	0	0	114.5	R234	E191-R234 PolarHBondContact O-NH1 2.94Å
192	E	40.6	Very low	61.8	Low	166 Å²	166	69 Å²	69	78%	0.776	38%	0.384	S	S	*	.	S	Bend	trans	-114.8	-4.4	-175.4	-54.5	-152.3	175.8	0	0	115.3
193	D	41.3	Very low	62.3	Low	111 Å²	111	68.7 Å²	68.7	59%	0.594	38%	0.38	S	S	*	.	S	Bend	trans	-74.2	152	-175.4	-91.9	-51	0	0	0	114.2	K190 D195	K190-D193 HydrophobicContact CB-CB 4.46Å; K190-D193 WeakPolarHBondContact CB-OD2 3.47Å; K190-D193 VanDerWaalsContact CD-OD2 3.27Å; K190-D193 WeakPolarHBondContact CD-OD2 3.29Å; D193-D195 PolarHBondContact O-N 3.26Å
194	E	50.1	Low	62.7	Low	145 Å²	145	72 Å²	72	68%	0.678	40%	0.402	S	S	*	.			trans	-43.1	117.3	-159.4	-58.3	-171.4	110.6	0	0	115.6	C196 R358	E194-C196 PolarHBondContact O-N 2.96Å; E194-C196 VanDerWaalsContact O-N 3.17Å; E194-R358 IonicContact OE1-CZ 3.07Å; E194-R358 VanDerWaalsContact OE1-CZ 3.31Å; E194-R358 IonicContact OE1-NE 2.69Å; E194-R358 IonicContact OE1-NH2 3.55Å; E194-R358 PolarHBondContact OE1-NH2 3.23Å
195	D	53.5	Low	63	Low	84 Å²	84	72 Å²	72	45%	0.449	40%	0.402	S	S	.	.			trans	-45.1	120	169.1	-97.3	-38.5	0	0	0	110.3	D193 S197	D193-D195 PolarHBondContact O-N 3.26Å; D195-S197 VanDerWaalsContact O-CA 3.29Å; D195-S197 WeakPolarHBondContact O-CA 3.29Å; D195-S197 PolarHBondContact O-N 3.34Å
196	C	60.5	Low	63.5	Low	4 Å²	4	71.8 Å²	71.8	3%	0.027	40%	0.4	C	S	.	.			trans	-39.7	104.3	179.1	163.9	0	0	0	0	110.9	D183 E194 D198 I199 A200 V237	D183-C196 WeakPolarHBondContact O-CB 3.46Å; D183-C196 PolarHBondContact O-SG 3.24Å; D183-C196 VanDerWaalsContact O-SG 3.38Å; D183-C196 PolarHBondContact OD2-SG 3.35Å; E194-C196 PolarHBondContact O-N 2.96Å; E194-C196 VanDerWaalsContact O-N 3.17Å; C196-D198 PolarHBondContact O-N 3.22Å; C196-I199 WeakPolarHBondContact SG-CD1 3.24Å; C196-I199 VanDerWaalsContact SG-CG1 3.51Å; C196-A200 WeakPolarHBondContact O-CB 3.28Å; C196-A200 PolarHBondContact O-N 3.02Å; C196-A200 VanDerWaalsContact O-N 3.16Å; C196-V237 HydrophobicContact CB-CG1 4.02Å
197	S	69.1	Low	64.6	Low	51 Å²	51	67 Å²	67	36%	0.357	37%	0.374	S	S	.	.	H	α-helix	trans	-75.6	-22.3	-154.9	69.8	0	0	0	0	111.2	D183 D195 T201	D183-S197 WeakPolarHBondContact OD1-CB 3.42Å; D183-S197 PolarHBondContact OD1-N 2.99Å; D183-S197 PolarHBondContact OD1-OG 2.75Å; D183-S197 PolarHBondContact OD2-N 3.34Å; D195-S197 VanDerWaalsContact O-CA 3.29Å; D195-S197 WeakPolarHBondContact O-CA 3.29Å; D195-S197 PolarHBondContact O-N 3.34Å; S197-T201 VanDerWaalsContact O-CB 3.26Å; S197-T201 WeakPolarHBondContact O-CB 3.37Å; S197-T201 VanDerWaalsContact O-CG2 3.23Å; S197-T201 WeakPolarHBondContact O-CG2 3.46Å; S197-T201 PolarHBondContact O-N 3.33Å; S197-T201 PolarHBondContact O-OG1 3.03Å
198	D	81.7	Confident	66.5	Low	4 Å²	4	63 Å²	63	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-89	-38.1	-173.3	-69.1	-10.1	0	0	0	112.8	D183 C196 A200 G202 K203 T205	D183-D198 WeakPolarHBondContact OD2-CB 3.14Å; D183-D198 PolarHBondContact OD2-N 2.98Å; D183-D198 VanDerWaalsContact OD2-N 3.11Å; C196-D198 PolarHBondContact O-N 3.22Å; D198-A200 VanDerWaalsContact C-N 3.31Å; D198-G202 WeakPolarHBondContact O-CA 3.23Å; D198-G202 PolarHBondContact O-N 2.98Å; D198-K203 HydrophobicContact CB-CB 4.04Å; D198-K203 HydrophobicContact CB-CD 4.17Å; D198-K203 HydrophobicContact CB-CG 4.2Å; D198-K203 VanDerWaalsContact CG-CD 3.41Å; D198-K203 VanDerWaalsContact CG-CE 3.43Å; D198-K203 PolarHBondContact O-N 3.12Å; D198-K203 VanDerWaalsContact OD1-CD 3.24Å; D198-K203 WeakPolarHBondContact OD1-CD 3.33Å; D198-K203 WeakPolarHBondContact OD1-CE 3.07Å; D198-K203 IonicContact OD1-NZ 2.83Å; D198-K203 PolarHBondContact OD1-NZ 3.26Å; D198-K203 WeakPolarHBondContact OD2-CD 3.25Å; D198-K203 WeakPolarHBondContact OD2-CE 3.29Å; D198-K203 IonicContact OD2-NZ 2.68Å; D198-K203 PolarHBondContact OD2-NZ 3.08Å; D198-T205 HydrophobicContact CB-CG2 3.78Å
199	I	84.1	Confident	68.8	Low	2 Å²	2	64.1 Å²	64.1	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-61.3	-44.5	165.5	-62.9	173.8	0	0	0	109.7	C196 Y229 G230 V237 V240 K241 Y244	C196-I199 WeakPolarHBondContact SG-CD1 3.24Å; C196-I199 VanDerWaalsContact SG-CG1 3.51Å; I199-Y229 HydrophobicContact CB-CE2 4.17Å; I199-Y229 HydrophobicContact CG1-CE2 3.85Å; I199-Y229 HydrophobicContact CG2-CD2 4.14Å; I199-Y229 HydrophobicContact CG2-CE2 4.11Å; I199-G230 VanDerWaalsContact O-CA 3.3Å; I199-G230 WeakPolarHBondContact O-CA 3.44Å; I199-G230 PolarHBondContact O-N 3Å; I199-V237 HydrophobicContact CB-CG1 4.19Å; I199-V237 HydrophobicContact CD1-CG1 4.35Å; I199-V237 HydrophobicContact CG2-CB 4.23Å; I199-V237 HydrophobicContact CG2-CG1 4.06Å; I199-V237 HydrophobicContact CG2-CG2 4.08Å; I199-V240 HydrophobicContact CD1-CB 4.17Å; I199-V240 HydrophobicContact CD1-CG1 3.62Å; I199-V240 HydrophobicContact CG1-CG1 3.99Å; I199-V240 HydrophobicContact CG2-CB 3.77Å; I199-V240 HydrophobicContact CG2-CG1 3.84Å; I199-V240 HydrophobicContact CG2-CG2 3.85Å; I199-K241 HydrophobicContact CD1-CG 3.87Å; I199-Y244 HydrophobicContact CD1-CE2 4Å; I199-Y244 HydrophobicContact CG1-CE2 4.47Å
200	A	83.3	Confident	71.5	Confident	10 Å²	10	58 Å²	58	8%	0.083	31%	0.305	C	S	.	.	H	α-helix	trans	-70.1	-32.4	-177	0	0	0	0	0	113.5	C196 D198 G230 Q232 V237	C196-A200 WeakPolarHBondContact O-CB 3.28Å; C196-A200 PolarHBondContact O-N 3.02Å; C196-A200 VanDerWaalsContact O-N 3.16Å; D198-A200 VanDerWaalsContact C-N 3.31Å; A200-G230 CarbonylContact O-C 3.27Å; A200-Q232 VanDerWaalsContact O-CG 3.25Å; A200-Q232 WeakPolarHBondContact O-CG 3.44Å; A200-V237 HydrophobicContact CB-CG2 4.01Å
201	T	79.2	Confident	74	Confident	49 Å²	49	54.3 Å²	54.3	30%	0.301	29%	0.289	S	S	.	.	H	α-helix	trans	-93.2	-14.8	177.6	58.4	0	0	0	0	114.3	S197	S197-T201 VanDerWaalsContact O-CB 3.26Å; S197-T201 WeakPolarHBondContact O-CB 3.37Å; S197-T201 VanDerWaalsContact O-CG2 3.23Å; S197-T201 WeakPolarHBondContact O-CG2 3.46Å; S197-T201 PolarHBondContact O-N 3.33Å; S197-T201 PolarHBondContact O-OG1 3.03Å
202	G	82	Confident	76.5	Confident	36 Å²	36	47.5 Å²	47.5	37%	0.371	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	33.3	178.4	0	0	0	0	0	113.7	D198	D198-G202 WeakPolarHBondContact O-CA 3.23Å; D198-G202 PolarHBondContact O-N 2.98Å
203	K	80.9	Confident	78.9	Confident	64 Å²	64	46.1 Å²	46.1	28%	0.278	25%	0.251	S	S	.	.			trans	-63.3	151.3	171.1	-73.6	-159.1	-160.8	147.6	0	110.3	D198 T205 Y229	D198-K203 HydrophobicContact CB-CB 4.04Å; D198-K203 HydrophobicContact CB-CD 4.17Å; D198-K203 HydrophobicContact CB-CG 4.2Å; D198-K203 VanDerWaalsContact CG-CD 3.41Å; D198-K203 VanDerWaalsContact CG-CE 3.43Å; D198-K203 PolarHBondContact O-N 3.12Å; D198-K203 VanDerWaalsContact OD1-CD 3.24Å; D198-K203 WeakPolarHBondContact OD1-CD 3.33Å; D198-K203 WeakPolarHBondContact OD1-CE 3.07Å; D198-K203 IonicContact OD1-NZ 2.83Å; D198-K203 PolarHBondContact OD1-NZ 3.26Å; D198-K203 WeakPolarHBondContact OD2-CD 3.25Å; D198-K203 WeakPolarHBondContact OD2-CE 3.29Å; D198-K203 IonicContact OD2-NZ 2.68Å; D198-K203 PolarHBondContact OD2-NZ 3.08Å; K203-T205 HydrophobicContact CB-CG2 3.75Å; K203-T205 HydrophobicContact CD-CG2 4.46Å; K203-T205 PolarHBondContact O-N 3.42Å; K203-Y229 VanDerWaalsContact O-CE1 3.25Å; K203-Y229 WeakPolarHBondContact O-CE1 3.19Å; K203-Y229 PolarHBondContact O-OH 2.94Å
204	V	84.3	Confident	81.3	Confident	115 Å²	115	44.3 Å²	44.3	70%	0.697	24%	0.24	S	C	*	.			trans	-80.5	116.1	162	179.2	0	0	0	0	107.3	I209	V204-I209 HydrophobicContact CG1-CD1 3.89Å; V204-I209 HydrophobicContact CG1-CG1 4.03Å
205	T	85.6	Confident	83.3	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.031	21%	0.21	C	C	.	.			trans	-128.9	159.2	-178.2	62.1	0	0	0	0	111.8	D180 D198 K203 L208 I209 Y229	D180-T205 VanDerWaalsContact CG-CB 3.46Å; D180-T205 VanDerWaalsContact OD1-CG2 3.31Å; D180-T205 WeakPolarHBondContact OD1-CG2 3.47Å; D180-T205 VanDerWaalsContact OD2-CA 3.3Å; D180-T205 WeakPolarHBondContact OD2-CA 3.49Å; D180-T205 WeakPolarHBondContact OD2-CB 3.27Å; D198-T205 HydrophobicContact CB-CG2 3.78Å; K203-T205 HydrophobicContact CB-CG2 3.75Å; K203-T205 HydrophobicContact CD-CG2 4.46Å; K203-T205 PolarHBondContact O-N 3.42Å; T205-L208 WeakPolarHBondContact O-CB 3.4Å; T205-L208 PolarHBondContact O-N 2.82Å; T205-I209 PolarHBondContact O-N 3.36Å; T205-Y229 PolarHBondContact OG1-OH 3.25Å
206	W	87.9	Confident	85	Confident	34 Å²	34	38.1 Å²	38.1	13%	0.129	22%	0.219	C	C	.	.	H	α-helix	trans	-53.9	-42.6	178.4	180	92.5	0	0	0	113.5	Q177 D180 L208 I209 T210 V249 K252 Y253 L256	Q177-W206 HydrophobicContact CB-CB 4.34Å; Q177-W206 HydrophobicContact CB-CG 4.14Å; Q177-W206 HydrophobicContact CG-CB 4.09Å; Q177-W206 HydrophobicContact CG-CG 3.84Å; D180-W206 HydrophobicContact CB-CB 4.31Å; D180-W206 PolarHBondContact OD2-N 2.81Å; W206-L208 VanDerWaalsContact C-N 3.31Å; W206-L208 PolarHBondContact O-N 3.23Å; W206-I209 PolarHBondContact O-N 2.91Å; W206-T210 HydrophobicContact CH2-CG2 3.88Å; W206-T210 HydrophobicContact CZ2-CG2 4.15Å; W206-T210 VanDerWaalsContact CZ2-OG1 3.3Å; W206-T210 WeakPolarHBondContact CZ2-OG1 3.34Å; W206-T210 HydrophobicContact CZ3-CG2 4.28Å; W206-T210 WeakPolarHBondContact O-CB 3.15Å; W206-T210 PolarHBondContact O-N 3.46Å; W206-T210 PolarHBondContact O-OG1 3.38Å; W206-V249 HydrophobicContact CH2-CG1 4.48Å; W206-V249 HydrophobicContact CZ3-CG1 3.89Å; W206-K252 HydrophobicContact CH2-CB 4.38Å; W206-Y253 HydrophobicContact CE3-CD2 4.25Å; W206-Y253 HydrophobicContact CH2-CD2 4.22Å; W206-Y253 HydrophobicContact CH2-CG 4.44Å; W206-Y253 AromaticContact CZ3-CD2 3.98Å; W206-Y253 HydrophobicContact CZ3-CD2 3.98Å; W206-Y253 HydrophobicContact CZ3-CG 4.33Å; W206-L256 HydrophobicContact CZ2-CD2 3.74Å
207	P	89.8	Confident	86.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.6	-35.2	172.8	-27.1	35.9	0	0	0	114.1	C184 F185 A211 Y244 V249	C184-P207 HydrophobicContact CB-CG 4.09Å; F185-P207 HydrophobicContact CE2-CB 4.34Å; F185-P207 HydrophobicContact CE2-CG 4.21Å; P207-A211 VanDerWaalsContact O-CB 3.23Å; P207-A211 WeakPolarHBondContact O-CB 3.37Å; P207-A211 PolarHBondContact O-N 2.95Å; P207-Y244 HydrophobicContact CB-CD2 4.06Å; P207-Y244 HydrophobicContact CB-CE2 3.57Å; P207-V249 HydrophobicContact CB-CG1 4.14Å
208	L	89.8	Confident	87	Confident	8 Å²	8	46 Å²	46	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-68.7	-52.6	177.1	175.8	66.9	0	0	0	111	T205 W206 T210 A211 L212 L225 Y229 Y244	T205-L208 WeakPolarHBondContact O-CB 3.4Å; T205-L208 PolarHBondContact O-N 2.82Å; W206-L208 VanDerWaalsContact C-N 3.31Å; W206-L208 PolarHBondContact O-N 3.23Å; L208-T210 VanDerWaalsContact C-N 3.3Å; L208-T210 PolarHBondContact O-N 2.73Å; L208-A211 PolarHBondContact O-N 3Å; L208-L212 HydrophobicContact CD1-CD1 4.04Å; L208-L212 HydrophobicContact CD1-CG 4.31Å; L208-L212 HydrophobicContact CG-CD1 3.97Å; L208-L212 VanDerWaalsContact O-CG 3.29Å; L208-L212 WeakPolarHBondContact O-CG 3.48Å; L208-L212 PolarHBondContact O-N 3.41Å; L208-L225 HydrophobicContact CD1-CD2 4.23Å; L208-L225 HydrophobicContact CD1-CG 4.43Å; L208-Y229 HydrophobicContact CB-CE2 4.29Å; L208-Y229 HydrophobicContact CD1-CD1 4.45Å; L208-Y229 HydrophobicContact CD1-CD2 3.91Å; L208-Y229 HydrophobicContact CD1-CE1 4.42Å; L208-Y229 HydrophobicContact CD1-CE2 3.87Å; L208-Y229 HydrophobicContact CD1-CG 4.2Å; L208-Y229 HydrophobicContact CD2-CD1 4.22Å; L208-Y229 HydrophobicContact CD2-CE1 3.74Å; L208-Y229 HydrophobicContact CD2-CE2 4.45Å; L208-Y229 HydrophobicContact CG-CE2 4.42Å; L208-Y244 WeakPolarHBondContact CA-OH 3.35Å; L208-Y244 PolarHBondContact N-OH 3.4Å
209	I	90	Very high	87.4	Confident	79 Å²	79	47.3 Å²	47.3	41%	0.405	27%	0.271	S	S	.	.	H	α-helix	trans	-57.2	-49.3	178.7	-62.3	170.3	0	0	0	109.3	V204 T205 W206 A211 L212 E213	V204-I209 HydrophobicContact CG1-CD1 3.89Å; V204-I209 HydrophobicContact CG1-CG1 4.03Å; T205-I209 PolarHBondContact O-N 3.36Å; W206-I209 PolarHBondContact O-N 2.91Å; I209-A211 VanDerWaalsContact C-N 3.33Å; I209-A211 PolarHBondContact O-N 3.16Å; I209-L212 PolarHBondContact O-N 3.06Å; I209-L212 VanDerWaalsContact O-N 3.13Å; I209-E213 WeakPolarHBondContact O-CG 3.03Å; I209-E213 PolarHBondContact O-N 3.03Å
210	T	90.6	Very high	87.8	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-57.6	-41.7	178.7	-68.5	0	0	0	0	113.1	W206 L208 M214 V249 K252	W206-T210 HydrophobicContact CH2-CG2 3.88Å; W206-T210 HydrophobicContact CZ2-CG2 4.15Å; W206-T210 VanDerWaalsContact CZ2-OG1 3.3Å; W206-T210 WeakPolarHBondContact CZ2-OG1 3.34Å; W206-T210 HydrophobicContact CZ3-CG2 4.28Å; W206-T210 WeakPolarHBondContact O-CB 3.15Å; W206-T210 PolarHBondContact O-N 3.46Å; W206-T210 PolarHBondContact O-OG1 3.38Å; L208-T210 VanDerWaalsContact C-N 3.3Å; L208-T210 PolarHBondContact O-N 2.73Å; T210-M214 HydrophobicContact CG2-SD 4.07Å; T210-M214 VanDerWaalsContact O-CG 3.22Å; T210-M214 WeakPolarHBondContact O-CG 3.46Å; T210-M214 PolarHBondContact O-N 2.99Å; T210-V249 HydrophobicContact CG2-CB 4.48Å; T210-V249 HydrophobicContact CG2-CG1 3.93Å; T210-V249 HydrophobicContact CG2-CG2 4.28Å; T210-K252 HydrophobicContact CG2-CB 4.43Å; T210-K252 HydrophobicContact CG2-CD 3.31Å; T210-K252 HydrophobicContact CG2-CG 4.5Å
211	A	91.7	Very high	88.1	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-69.8	-37.5	177.2	0	0	0	0	0	112.3	P207 L208 I209 M214 L215 L225 Y244 L247 V249	P207-A211 VanDerWaalsContact O-CB 3.23Å; P207-A211 WeakPolarHBondContact O-CB 3.37Å; P207-A211 PolarHBondContact O-N 2.95Å; L208-A211 PolarHBondContact O-N 3Å; I209-A211 VanDerWaalsContact C-N 3.33Å; I209-A211 PolarHBondContact O-N 3.16Å; A211-M214 PolarHBondContact O-N 3.43Å; A211-L215 WeakPolarHBondContact O-CB 3.41Å; A211-L215 WeakPolarHBondContact O-CD1 3.45Å; A211-L215 VanDerWaalsContact O-CG 3.23Å; A211-L215 WeakPolarHBondContact O-CG 3.46Å; A211-L215 PolarHBondContact O-N 3.21Å; A211-L225 HydrophobicContact CB-CD2 4.16Å; A211-Y244 HydrophobicContact CB-CD1 3.57Å; A211-Y244 HydrophobicContact CB-CE1 3.43Å; A211-Y244 VanDerWaalsContact CB-CE1 3.43Å; A211-L247 HydrophobicContact CB-CD1 3.78Å; A211-V249 HydrophobicContact CB-CG2 4.17Å
212	L	90.8	Very high	88.7	Confident	28 Å²	28	55.4 Å²	55.4	15%	0.147	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-45.5	176.2	-67.9	167.6	0	0	0	111.1	L208 I209 M214 L215 W222 L225 W226	L208-L212 HydrophobicContact CD1-CD1 4.04Å; L208-L212 HydrophobicContact CD1-CG 4.31Å; L208-L212 HydrophobicContact CG-CD1 3.97Å; L208-L212 VanDerWaalsContact O-CG 3.29Å; L208-L212 WeakPolarHBondContact O-CG 3.48Å; L208-L212 PolarHBondContact O-N 3.41Å; I209-L212 PolarHBondContact O-N 3.06Å; I209-L212 VanDerWaalsContact O-N 3.13Å; L212-M214 PolarHBondContact O-N 2.85Å; L212-L215 PolarHBondContact O-N 3.44Å; L212-W222 HydrophobicContact CB-CH2 4.14Å; L212-W222 HydrophobicContact CB-CZ3 3.82Å; L212-W222 HydrophobicContact CD2-CD2 4.08Å; L212-W222 HydrophobicContact CD2-CE3 3.79Å; L212-W222 HydrophobicContact CD2-CH2 3.71Å; L212-W222 HydrophobicContact CD2-CZ2 4Å; L212-W222 HydrophobicContact CD2-CZ3 3.61Å; L212-W222 HydrophobicContact CG-CH2 4.43Å; L212-W222 HydrophobicContact CG-CZ3 4.32Å; L212-W222 WeakPolarHBondContact O-CZ3 3.43Å; L212-L225 HydrophobicContact CD2-CD2 3.87Å; L212-L225 HydrophobicContact CG-CD2 4.25Å; L212-W226 HydrophobicContact CD1-CH2 4.43Å; L212-W226 HydrophobicContact CD1-CZ2 3.78Å; L212-W226 HydrophobicContact CD2-CZ2 3.98Å
213	E	91.1	Very high	89.1	Confident	136 Å²	136	57.3 Å²	57.3	64%	0.636	31%	0.313	S	S	*	.	H	α-helix	trans	-55.2	-32.7	174.7	-72	177.4	168.4	0	0	113.9	I209 K252	I209-E213 WeakPolarHBondContact O-CG 3.03Å; I209-E213 PolarHBondContact O-N 3.03Å; E213-K252 IonicContact OE2-NZ 3.47Å; E213-K252 PolarHBondContact OE2-NZ 3.38Å
214	M	91.5	Very high	89.6	Confident	74 Å²	74	58 Å²	58	37%	0.365	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-6.7	-177.8	-64.6	173.4	82.9	0	0	113.1	T210 A211 L212 L247 K252	T210-M214 HydrophobicContact CG2-SD 4.07Å; T210-M214 VanDerWaalsContact O-CG 3.22Å; T210-M214 WeakPolarHBondContact O-CG 3.46Å; T210-M214 PolarHBondContact O-N 2.99Å; A211-M214 PolarHBondContact O-N 3.43Å; L212-M214 PolarHBondContact O-N 2.85Å; M214-L247 HydrophobicContact CB-CD2 4.23Å; M214-L247 WeakPolarHBondContact CE-O 3.32Å; M214-K252 HydrophobicContact CE-CD 4.44Å; M214-K252 HydrophobicContact SD-CD 3.66Å; M214-K252 HydrophobicContact SD-CG 4.48Å
215	L	91.6	Very high	89.9	Confident	10 Å²	10	52.5 Å²	52.5	5%	0.052	29%	0.286	C	S	.	.	S	Bend	trans	-109.3	126.9	-176.8	-77.7	172.4	0	0	0	111	A211 L212 P217 Q221 W222 L225 I243 L247	A211-L215 WeakPolarHBondContact O-CB 3.41Å; A211-L215 WeakPolarHBondContact O-CD1 3.45Å; A211-L215 VanDerWaalsContact O-CG 3.23Å; A211-L215 WeakPolarHBondContact O-CG 3.46Å; A211-L215 PolarHBondContact O-N 3.21Å; L212-L215 PolarHBondContact O-N 3.44Å; L215-P217 WeakPolarHBondContact O-CD 3.49Å; L215-Q221 HydrophobicContact CD1-CB 4.45Å; L215-Q221 HydrophobicContact CD2-CB 3.44Å; L215-Q221 VanDerWaalsContact CD2-CB 3.44Å; L215-Q221 HydrophobicContact CD2-CG 4.46Å; L215-W222 HydrophobicContact CB-CB 4.46Å; L215-W222 HydrophobicContact CB-CE3 3.87Å; L215-L225 HydrophobicContact CD1-CD2 3.96Å; L215-I243 HydrophobicContact CD1-CG2 4.43Å; L215-L247 HydrophobicContact CD1-CD1 3.94Å; L215-L247 HydrophobicContact CD2-CD1 4.24Å; L215-L247 HydrophobicContact CD2-CD2 3.81Å; L215-L247 HydrophobicContact CG-CD1 3.83Å; L215-L247 HydrophobicContact CG-CD2 4.06Å
216	S	89	Confident	90.2	Very high	89 Å²	89	58.6 Å²	58.6	62%	0.622	31%	0.309	S	S	*	.			trans	-56.4	126.8	168.6	-53.5	0	0	0	0	109.9	S219	S216-S219 WeakPolarHBondContact O-CB 3.32Å; S216-S219 PolarHBondContact O-N 2.93Å; S216-S219 VanDerWaalsContact O-N 3.11Å; S216-S219 PolarHBondContact O-OG 3.17Å
217	P	87.8	Confident	90.4	Very high	95 Å²	95	59.8 Å²	59.8	62%	0.617	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	141.2	179.9	-29.9	36.4	0	0	0	112.6	L215 S219 W222	L215-P217 WeakPolarHBondContact O-CD 3.49Å; P217-S219 PolarHBondContact O-N 3.19Å; P217-S219 VanDerWaalsContact O-N 3.1Å; P217-W222 HydrophobicContact CG-CZ3 4.43Å
218	N	84.8	Confident	90.5	Very high	124 Å²	124	60.8 Å²	60.8	66%	0.663	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	8.4	-177	-50.9	-48.6	0	0	0	115.9	N223	N218-N223 WeakPolarHBondContact CA-OD1 3.17Å; N218-N223 PolarHBondContact O-ND2 2.71Å
219	S	90.9	Very high	90.6	Very high	33 Å²	33	61.6 Å²	61.6	23%	0.231	33%	0.334	C	S	.	.			trans	-61.7	162.3	170.5	64.3	0	0	0	0	112.2	S216 P217 Q221 W222 N223	S216-S219 WeakPolarHBondContact O-CB 3.32Å; S216-S219 PolarHBondContact O-N 2.93Å; S216-S219 VanDerWaalsContact O-N 3.11Å; S216-S219 PolarHBondContact O-OG 3.17Å; P217-S219 PolarHBondContact O-N 3.19Å; P217-S219 VanDerWaalsContact O-N 3.1Å; S219-Q221 VanDerWaalsContact C-N 3.26Å; S219-Q221 PolarHBondContact O-N 2.85Å; S219-W222 WeakPolarHBondContact O-CB 3.4Å; S219-W222 PolarHBondContact O-N 2.94Å; S219-W222 VanDerWaalsContact O-N 3.12Å; S219-W222 VanDerWaalsContact OG-CB 3.31Å; S219-W222 WeakPolarHBondContact OG-CB 3.42Å; S219-W222 PolarHBondContact OG-N 3.28Å; S219-N223 VanDerWaalsContact O-CG 3.27Å; S219-N223 PolarHBondContact O-N 3.45Å; S219-N223 PolarHBondContact O-ND2 3.04Å
220	C	91	Very high	90.5	Very high	95 Å²	95	59.5 Å²	59.5	64%	0.642	33%	0.332	S	S	*	.	H	α-helix	trans	-54.6	-42	176.9	-175.7	0	0	0	0	112.1	N224	C220-N224 VanDerWaalsContact O-CB 3.28Å; C220-N224 WeakPolarHBondContact O-CB 3.39Å; C220-N224 PolarHBondContact O-N 3.28Å; C220-N224 PolarHBondContact O-ND2 2.9Å; C220-N224 VanDerWaalsContact O-ND2 3.12Å
221	Q	89.6	Confident	90.4	Very high	82 Å²	82	62 Å²	62	38%	0.383	35%	0.345	S	S	.	.	H	α-helix	trans	-70.5	-38.4	176.5	-73.3	173.4	-80.9	0	0	113	L215 S219 N224 L225	L215-Q221 HydrophobicContact CD1-CB 4.45Å; L215-Q221 HydrophobicContact CD2-CB 3.44Å; L215-Q221 VanDerWaalsContact CD2-CB 3.44Å; L215-Q221 HydrophobicContact CD2-CG 4.46Å; S219-Q221 VanDerWaalsContact C-N 3.26Å; S219-Q221 PolarHBondContact O-N 2.85Å; Q221-N224 PolarHBondContact O-N 2.76Å; Q221-L225 WeakPolarHBondContact O-CB 3.06Å; Q221-L225 PolarHBondContact O-N 2.58Å
222	W	91.7	Very high	90	Very high	53 Å²	53	68.5 Å²	68.5	20%	0.201	38%	0.375	C	S	.	.	H	α-helix	trans	-58.5	-49.5	173	178.3	-78.6	0	0	0	111.4	L212 L215 P217 S219 N224 L225 W226	L212-W222 HydrophobicContact CB-CH2 4.14Å; L212-W222 HydrophobicContact CB-CZ3 3.82Å; L212-W222 HydrophobicContact CD2-CD2 4.08Å; L212-W222 HydrophobicContact CD2-CE3 3.79Å; L212-W222 HydrophobicContact CD2-CH2 3.71Å; L212-W222 HydrophobicContact CD2-CZ2 4Å; L212-W222 HydrophobicContact CD2-CZ3 3.61Å; L212-W222 HydrophobicContact CG-CH2 4.43Å; L212-W222 HydrophobicContact CG-CZ3 4.32Å; L212-W222 WeakPolarHBondContact O-CZ3 3.43Å; L215-W222 HydrophobicContact CB-CB 4.46Å; L215-W222 HydrophobicContact CB-CE3 3.87Å; P217-W222 HydrophobicContact CG-CZ3 4.43Å; S219-W222 WeakPolarHBondContact O-CB 3.4Å; S219-W222 PolarHBondContact O-N 2.94Å; S219-W222 VanDerWaalsContact O-N 3.12Å; S219-W222 VanDerWaalsContact OG-CB 3.31Å; S219-W222 WeakPolarHBondContact OG-CB 3.42Å; S219-W222 PolarHBondContact OG-N 3.28Å; W222-N224 PolarHBondContact O-N 3.38Å; W222-L225 WeakPolarHBondContact O-CB 3.06Å; W222-L225 PolarHBondContact O-N 3.26Å; W222-W226 AromaticContact CD1-CD1 3.63Å; W222-W226 AromaticContact CE2-CD1 3.88Å; W222-W226 AromaticContact CE2-NE1 3.42Å; W222-W226 AromaticContact CZ2-NE1 3.66Å; W222-W226 AromaticContact NE1-CD1 3.39Å; W222-W226 AromaticContact NE1-NE1 3.36Å; W222-W226 VanDerWaalsContact O-CD1 3.25Å; W222-W226 PolarHBondContact O-N 3.34Å
223	N	90.7	Very high	89.8	Confident	77 Å²	77	73.1 Å²	73.1	41%	0.412	39%	0.394	S	S	.	.	H	α-helix	trans	-66.2	-39.2	-180	-59	-25.1	0	0	0	111.3	N218 S219 W226 A227	N218-N223 WeakPolarHBondContact CA-OD1 3.17Å; N218-N223 PolarHBondContact O-ND2 2.71Å; S219-N223 VanDerWaalsContact O-CG 3.27Å; S219-N223 PolarHBondContact O-N 3.45Å; S219-N223 PolarHBondContact O-ND2 3.04Å; N223-W226 PolarHBondContact O-N 2.86Å; N223-A227 VanDerWaalsContact O-CB 3.3Å; N223-A227 WeakPolarHBondContact O-CB 3.37Å; N223-A227 PolarHBondContact O-N 3.07Å
224	N	91.9	Very high	89.6	Confident	77 Å²	77	72.6 Å²	72.6	41%	0.412	39%	0.386	S	S	.	.	H	α-helix	trans	-67.3	-32.3	175.8	-73	-23.2	0	0	0	112.9	C220 Q221 W222 N228 I243	C220-N224 VanDerWaalsContact O-CB 3.28Å; C220-N224 WeakPolarHBondContact O-CB 3.39Å; C220-N224 PolarHBondContact O-N 3.28Å; C220-N224 PolarHBondContact O-ND2 2.9Å; C220-N224 VanDerWaalsContact O-ND2 3.12Å; Q221-N224 PolarHBondContact O-N 2.76Å; W222-N224 PolarHBondContact O-N 3.38Å; N224-N228 PolarHBondContact O-N 3.09Å; N224-N228 PolarHBondContact O-ND2 3.44Å; N224-I243 HydrophobicContact CB-CD1 4.24Å
225	L	91.4	Very high	89.5	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-63.6	-53.8	173.7	-178.3	58.8	0	0	0	110	L208 A211 L212 L215 Q221 W222 A227 N228 Y229 V240 I243 Y244	L208-L225 HydrophobicContact CD1-CD2 4.23Å; L208-L225 HydrophobicContact CD1-CG 4.43Å; A211-L225 HydrophobicContact CB-CD2 4.16Å; L212-L225 HydrophobicContact CD2-CD2 3.87Å; L212-L225 HydrophobicContact CG-CD2 4.25Å; L215-L225 HydrophobicContact CD1-CD2 3.96Å; Q221-L225 WeakPolarHBondContact O-CB 3.06Å; Q221-L225 PolarHBondContact O-N 2.58Å; W222-L225 WeakPolarHBondContact O-CB 3.06Å; W222-L225 PolarHBondContact O-N 3.26Å; L225-A227 VanDerWaalsContact C-N 3.27Å; L225-A227 PolarHBondContact O-N 2.91Å; L225-N228 PolarHBondContact O-N 2.89Å; L225-N228 VanDerWaalsContact O-N 3.09Å; L225-Y229 HydrophobicContact CD1-CD2 4.41Å; L225-Y229 WeakPolarHBondContact O-CB 3.49Å; L225-Y229 PolarHBondContact O-N 3.26Å; L225-V240 HydrophobicContact CD1-CB 4.43Å; L225-V240 HydrophobicContact CD1-CG1 3.83Å; L225-V240 HydrophobicContact CD1-CG2 4.17Å; L225-I243 HydrophobicContact CB-CD1 4.08Å; L225-I243 HydrophobicContact CD1-CD1 4.4Å; L225-I243 HydrophobicContact CD1-CG2 4.47Å; L225-Y244 HydrophobicContact CD1-CE1 3.91Å
226	W	90.9	Very high	89.5	Confident	134 Å²	134	73.4 Å²	73.4	51%	0.508	40%	0.395	S	S	.	.	H	α-helix	trans	-62.8	-28.9	177.2	-73.7	110.2	0	0	0	114.1	L212 W222 N223 N228	L212-W226 HydrophobicContact CD1-CH2 4.43Å; L212-W226 HydrophobicContact CD1-CZ2 3.78Å; L212-W226 HydrophobicContact CD2-CZ2 3.98Å; W222-W226 AromaticContact CD1-CD1 3.63Å; W222-W226 AromaticContact CE2-CD1 3.88Å; W222-W226 AromaticContact CE2-NE1 3.42Å; W222-W226 AromaticContact CZ2-NE1 3.66Å; W222-W226 AromaticContact NE1-CD1 3.39Å; W222-W226 AromaticContact NE1-NE1 3.36Å; W222-W226 VanDerWaalsContact O-CD1 3.25Å; W222-W226 PolarHBondContact O-N 3.34Å; N223-W226 PolarHBondContact O-N 2.86Å; W226-N228 VanDerWaalsContact C-N 3.26Å; W226-N228 PolarHBondContact O-N 3.2Å
227	A	91.9	Very high	89.5	Confident	59 Å²	59	69.3 Å²	69.3	49%	0.488	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-9.5	176.4	0	0	0	0	0	114.4	N223 L225 I231	N223-A227 VanDerWaalsContact O-CB 3.3Å; N223-A227 WeakPolarHBondContact O-CB 3.37Å; N223-A227 PolarHBondContact O-N 3.07Å; L225-A227 VanDerWaalsContact C-N 3.27Å; L225-A227 PolarHBondContact O-N 2.91Å; A227-I231 WeakPolarHBondContact O-CD1 3.5Å
228	N	92.4	Very high	89.6	Confident	21 Å²	21	69.2 Å²	69.2	11%	0.112	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.9	-23.3	-178.1	-72.2	-76.7	0	0	0	114.1	N224 L225 W226 H236 H239 V240	N224-N228 PolarHBondContact O-N 3.09Å; N224-N228 PolarHBondContact O-ND2 3.44Å; L225-N228 PolarHBondContact O-N 2.89Å; L225-N228 VanDerWaalsContact O-N 3.09Å; W226-N228 VanDerWaalsContact C-N 3.26Å; W226-N228 PolarHBondContact O-N 3.2Å; N228-H236 HydrophobicContact CB-CB 4.13Å; N228-H236 PolarHBondContact OD1-ND1 3.04Å; N228-H239 HydrophobicContact CB-CB 4.36Å; N228-V240 HydrophobicContact CB-CG2 3.81Å
229	Y	91	Very high	89.9	Confident	24 Å²	24	68.8 Å²	68.8	9%	0.094	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	143.9	-179	-151.6	-93.8	0	0	0	112.9	I199 K203 T205 L208 L225 I231 V240 Y244	I199-Y229 HydrophobicContact CB-CE2 4.17Å; I199-Y229 HydrophobicContact CG1-CE2 3.85Å; I199-Y229 HydrophobicContact CG2-CD2 4.14Å; I199-Y229 HydrophobicContact CG2-CE2 4.11Å; K203-Y229 VanDerWaalsContact O-CE1 3.25Å; K203-Y229 WeakPolarHBondContact O-CE1 3.19Å; K203-Y229 PolarHBondContact O-OH 2.94Å; T205-Y229 PolarHBondContact OG1-OH 3.25Å; L208-Y229 HydrophobicContact CB-CE2 4.29Å; L208-Y229 HydrophobicContact CD1-CD1 4.45Å; L208-Y229 HydrophobicContact CD1-CD2 3.91Å; L208-Y229 HydrophobicContact CD1-CE1 4.42Å; L208-Y229 HydrophobicContact CD1-CE2 3.87Å; L208-Y229 HydrophobicContact CD1-CG 4.2Å; L208-Y229 HydrophobicContact CD2-CD1 4.22Å; L208-Y229 HydrophobicContact CD2-CE1 3.74Å; L208-Y229 HydrophobicContact CD2-CE2 4.45Å; L208-Y229 HydrophobicContact CG-CE2 4.42Å; L225-Y229 HydrophobicContact CD1-CD2 4.41Å; L225-Y229 WeakPolarHBondContact O-CB 3.49Å; L225-Y229 PolarHBondContact O-N 3.26Å; Y229-I231 VanDerWaalsContact C-N 3.29Å; Y229-I231 PolarHBondContact O-N 3.43Å; Y229-V240 HydrophobicContact CD2-CG1 3.85Å; Y229-V240 HydrophobicContact CD2-CG2 4.09Å; Y229-V240 HydrophobicContact CE2-CG1 4.07Å; Y229-Y244 VanDerWaalsContact CE2-OH 3.31Å; Y229-Y244 WeakPolarHBondContact CE2-OH 3.28Å
230	G	87.9	Confident	90	Very high	35 Å²	35	67.2 Å²	67.2	36%	0.361	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	15.3	179.6	0	0	0	0	0	115.3	I199 A200	I199-G230 VanDerWaalsContact O-CA 3.3Å; I199-G230 WeakPolarHBondContact O-CA 3.44Å; I199-G230 PolarHBondContact O-N 3Å; A200-G230 CarbonylContact O-C 3.27Å
231	I	88.4	Confident	90	Very high	57 Å²	57	65 Å²	65	29%	0.292	32%	0.32	S	S	.	.			trans	-108.9	117.7	-179.6	-59.9	177.8	0	0	0	109.4	A227 Y229 K233 H236	A227-I231 WeakPolarHBondContact O-CD1 3.5Å; Y229-I231 VanDerWaalsContact C-N 3.29Å; Y229-I231 PolarHBondContact O-N 3.43Å; I231-K233 HydrophobicContact CG2-CB 4.09Å; I231-K233 HydrophobicContact CG2-CD 4.2Å; I231-K233 HydrophobicContact CG2-CG 4.13Å; I231-K233 PolarHBondContact O-N 3.3Å; I231-H236 HydrophobicContact CB-CB 4.02Å; I231-H236 HydrophobicContact CG2-CB 4.1Å
232	Q	84.8	Confident	90.1	Very high	136 Å²	136	63.4 Å²	63.4	64%	0.636	32%	0.32	S	S	*	.			trans	-69.2	26.8	-178.1	-58.7	-170.7	-61.6	0	0	115.2	A200	A200-Q232 VanDerWaalsContact O-CG 3.25Å; A200-Q232 WeakPolarHBondContact O-CG 3.44Å
233	K	86.7	Confident	90.2	Very high	124 Å²	124	61.7 Å²	61.7	54%	0.539	32%	0.315	S	S	.	.			trans	-106.4	121.9	175.5	-72.9	177.4	175.8	-178.9	0	108.2	I231 S235 H236 V237	I231-K233 HydrophobicContact CG2-CB 4.09Å; I231-K233 HydrophobicContact CG2-CD 4.2Å; I231-K233 HydrophobicContact CG2-CG 4.13Å; I231-K233 PolarHBondContact O-N 3.3Å; K233-S235 PolarHBondContact O-N 2.86Å; K233-S235 VanDerWaalsContact O-N 3.08Å; K233-H236 HydrophobicContact CB-CB 4.48Å; K233-H236 WeakPolarHBondContact O-CA 3.42Å; K233-H236 WeakPolarHBondContact O-CB 3.38Å; K233-H236 PolarHBondContact O-N 3.21Å; K233-V237 PolarHBondContact O-N 3.37Å
234	R	86	Confident	90.3	Very high	126 Å²	126	58 Å²	58	48%	0.475	30%	0.295	S	S	.	.	H	α-helix	trans	-42.9	-44.9	175.9	176.3	164.9	169.5	164.3	-2.9	113.5	E191 H236 V237 E238	E191-R234 PolarHBondContact O-NH1 2.94Å; R234-H236 VanDerWaalsContact C-N 3.32Å; R234-H236 PolarHBondContact O-N 2.95Å; R234-V237 WeakPolarHBondContact O-CB 3.07Å; R234-V237 PolarHBondContact O-N 2.88Å; R234-V237 VanDerWaalsContact O-N 3.11Å; R234-E238 HydrophobicContact CG-CG 4.24Å; R234-E238 VanDerWaalsContact CG-OE1 3.24Å; R234-E238 WeakPolarHBondContact CG-OE1 3.45Å; R234-E238 IonicContact CZ-OE1 3.79Å; R234-E238 IonicContact NE-OE1 3.75Å; R234-E238 PolarHBondContact NE-OE1 3.12Å; R234-E238 IonicContact NH2-OE1 2.72Å; R234-E238 WeakPolarHBondContact O-CB 3.27Å; R234-E238 VanDerWaalsContact O-CG 3.31Å; R234-E238 WeakPolarHBondContact O-CG 3.35Å; R234-E238 PolarHBondContact O-N 2.74Å
235	S	89.9	Confident	90.3	Very high	59 Å²	59	57.6 Å²	57.6	41%	0.413	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-31.2	177.4	61	0	0	0	0	115	K233 E238 H239	K233-S235 PolarHBondContact O-N 2.86Å; K233-S235 VanDerWaalsContact O-N 3.08Å; S235-E238 WeakPolarHBondContact CA-OE2 3.23Å; S235-H239 PolarHBondContact O-N 3.14Å; S235-H239 PolarHBondContact O-ND1 3.07Å
236	H	91.6	Very high	90.3	Very high	41 Å²	41	65.5 Å²	65.5	19%	0.19	34%	0.337	C	S	.	.	H	α-helix	trans	-76.6	-38.8	174.2	-69.1	-108.6	0	0	0	110.7	N228 I231 K233 R234 E238 H239 V240	N228-H236 HydrophobicContact CB-CB 4.13Å; N228-H236 PolarHBondContact OD1-ND1 3.04Å; I231-H236 HydrophobicContact CB-CB 4.02Å; I231-H236 HydrophobicContact CG2-CB 4.1Å; K233-H236 HydrophobicContact CB-CB 4.48Å; K233-H236 WeakPolarHBondContact O-CA 3.42Å; K233-H236 WeakPolarHBondContact O-CB 3.38Å; K233-H236 PolarHBondContact O-N 3.21Å; R234-H236 VanDerWaalsContact C-N 3.32Å; R234-H236 PolarHBondContact O-N 2.95Å; H236-E238 VanDerWaalsContact C-N 3.34Å; H236-E238 PolarHBondContact O-N 3.37Å; H236-H239 PolarHBondContact O-N 2.99Å; H236-V240 WeakPolarHBondContact O-CG2 3.47Å; H236-V240 PolarHBondContact O-N 2.69Å; H236-V240 VanDerWaalsContact O-N 3.07Å
237	V	89.2	Confident	90.5	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.024	32%	0.32	C	S	.	.	H	α-helix	trans	-59.7	-44.1	172.7	180	0	0	0	0	111	C196 I199 A200 K233 R234 H239 V240 K241	C196-V237 HydrophobicContact CB-CG1 4.02Å; I199-V237 HydrophobicContact CB-CG1 4.19Å; I199-V237 HydrophobicContact CD1-CG1 4.35Å; I199-V237 HydrophobicContact CG2-CB 4.23Å; I199-V237 HydrophobicContact CG2-CG1 4.06Å; I199-V237 HydrophobicContact CG2-CG2 4.08Å; A200-V237 HydrophobicContact CB-CG2 4.01Å; K233-V237 PolarHBondContact O-N 3.37Å; R234-V237 WeakPolarHBondContact O-CB 3.07Å; R234-V237 PolarHBondContact O-N 2.88Å; R234-V237 VanDerWaalsContact O-N 3.11Å; V237-H239 PolarHBondContact O-N 2.72Å; V237-V240 PolarHBondContact O-N 3.06Å; V237-V240 VanDerWaalsContact O-N 3.17Å; V237-K241 PolarHBondContact O-N 2.83Å
238	E	89.3	Confident	90.5	Very high	93 Å²	93	58.7 Å²	58.7	44%	0.435	31%	0.306	S	S	.	.	H	α-helix	trans	-60.9	-40.3	175.7	-72.9	165.4	169.1	0	0	112	R234 S235 H236 K241 A242	R234-E238 HydrophobicContact CG-CG 4.24Å; R234-E238 VanDerWaalsContact CG-OE1 3.24Å; R234-E238 WeakPolarHBondContact CG-OE1 3.45Å; R234-E238 IonicContact CZ-OE1 3.79Å; R234-E238 IonicContact NE-OE1 3.75Å; R234-E238 PolarHBondContact NE-OE1 3.12Å; R234-E238 IonicContact NH2-OE1 2.72Å; R234-E238 WeakPolarHBondContact O-CB 3.27Å; R234-E238 VanDerWaalsContact O-CG 3.31Å; R234-E238 WeakPolarHBondContact O-CG 3.35Å; R234-E238 PolarHBondContact O-N 2.74Å; S235-E238 WeakPolarHBondContact CA-OE2 3.23Å; H236-E238 VanDerWaalsContact C-N 3.34Å; H236-E238 PolarHBondContact O-N 3.37Å; E238-K241 PolarHBondContact O-N 3.27Å; E238-A242 VanDerWaalsContact O-CB 3.28Å; E238-A242 WeakPolarHBondContact O-CB 3.21Å; E238-A242 PolarHBondContact O-N 2.68Å
239	H	91.4	Very high	90.5	Very high	114 Å²	114	57.7 Å²	57.7	53%	0.528	30%	0.301	S	S	.	.	H	α-helix	trans	-63	-40.4	172.7	-79	98.2	0	0	0	112.6	N228 S235 H236 V237 A242 I243	N228-H239 HydrophobicContact CB-CB 4.36Å; S235-H239 PolarHBondContact O-N 3.14Å; S235-H239 PolarHBondContact O-ND1 3.07Å; H236-H239 PolarHBondContact O-N 2.99Å; V237-H239 PolarHBondContact O-N 2.72Å; H239-A242 PolarHBondContact O-N 3.04Å; H239-I243 WeakPolarHBondContact O-CG1 3.28Å; H239-I243 PolarHBondContact O-N 2.68Å
240	V	92.4	Very high	90.4	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.3	-49.1	175.9	174.5	0	0	0	0	110.8	I199 L225 N228 Y229 H236 V237 A242 I243 Y244	I199-V240 HydrophobicContact CD1-CB 4.17Å; I199-V240 HydrophobicContact CD1-CG1 3.62Å; I199-V240 HydrophobicContact CG1-CG1 3.99Å; I199-V240 HydrophobicContact CG2-CB 3.77Å; I199-V240 HydrophobicContact CG2-CG1 3.84Å; I199-V240 HydrophobicContact CG2-CG2 3.85Å; L225-V240 HydrophobicContact CD1-CB 4.43Å; L225-V240 HydrophobicContact CD1-CG1 3.83Å; L225-V240 HydrophobicContact CD1-CG2 4.17Å; N228-V240 HydrophobicContact CB-CG2 3.81Å; Y229-V240 HydrophobicContact CD2-CG1 3.85Å; Y229-V240 HydrophobicContact CD2-CG2 4.09Å; Y229-V240 HydrophobicContact CE2-CG1 4.07Å; H236-V240 WeakPolarHBondContact O-CG2 3.47Å; H236-V240 PolarHBondContact O-N 2.69Å; H236-V240 VanDerWaalsContact O-N 3.07Å; V237-V240 PolarHBondContact O-N 3.06Å; V237-V240 VanDerWaalsContact O-N 3.17Å; V240-A242 PolarHBondContact O-N 2.95Å; V240-I243 WeakPolarHBondContact O-CB 3.28Å; V240-I243 PolarHBondContact O-N 2.84Å; V240-Y244 HydrophobicContact CG1-CD1 4.35Å; V240-Y244 HydrophobicContact CG1-CD2 4.34Å; V240-Y244 HydrophobicContact CG1-CE1 3.82Å; V240-Y244 HydrophobicContact CG1-CE2 3.84Å; V240-Y244 PolarHBondContact O-N 2.78Å
241	K	91.4	Very high	90.5	Very high	50 Å²	50	65 Å²	65	22%	0.217	33%	0.325	C	S	.	.	H	α-helix	trans	-57.9	-37.8	175.9	-68.2	-163.3	-176.4	-155.8	0	111.7	C184 I199 V237 E238 Y244 A245	C184-K241 WeakPolarHBondContact O-CE 3.48Å; C184-K241 PolarHBondContact O-NZ 2.93Å; I199-K241 HydrophobicContact CD1-CG 3.87Å; V237-K241 PolarHBondContact O-N 2.83Å; E238-K241 PolarHBondContact O-N 3.27Å; K241-Y244 PolarHBondContact O-N 2.87Å; K241-A245 WeakPolarHBondContact O-CB 2.74Å; K241-A245 PolarHBondContact O-N 3.49Å
242	A	91.8	Very high	90.6	Very high	47 Å²	47	65.4 Å²	65.4	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-69	-28.3	175.2	0	0	0	0	0	114	E238 H239 V240 K246	E238-A242 VanDerWaalsContact O-CB 3.28Å; E238-A242 WeakPolarHBondContact O-CB 3.21Å; E238-A242 PolarHBondContact O-N 2.68Å; H239-A242 PolarHBondContact O-N 3.04Å; V240-A242 PolarHBondContact O-N 2.95Å; A242-K246 WeakPolarHBondContact O-CB 3.48Å; A242-K246 VanDerWaalsContact O-CG 3.28Å; A242-K246 WeakPolarHBondContact O-CG 3.38Å; A242-K246 PolarHBondContact O-N 3.16Å
243	I	92.5	Very high	90.7	Very high	17 Å²	17	59.2 Å²	59.2	9%	0.087	30%	0.295	C	S	.	.	H	α-helix	trans	-70.7	-47.1	170.4	-70.2	166.7	0	0	0	109.8	L215 N224 L225 H239 V240 A245 K246 L247	L215-I243 HydrophobicContact CD1-CG2 4.43Å; N224-I243 HydrophobicContact CB-CD1 4.24Å; L225-I243 HydrophobicContact CB-CD1 4.08Å; L225-I243 HydrophobicContact CD1-CD1 4.4Å; L225-I243 HydrophobicContact CD1-CG2 4.47Å; H239-I243 WeakPolarHBondContact O-CG1 3.28Å; H239-I243 PolarHBondContact O-N 2.68Å; V240-I243 WeakPolarHBondContact O-CB 3.28Å; V240-I243 PolarHBondContact O-N 2.84Å; I243-A245 VanDerWaalsContact C-N 3.34Å; I243-A245 PolarHBondContact O-N 2.87Å; I243-K246 PolarHBondContact O-N 3.07Å; I243-K246 VanDerWaalsContact O-N 3.14Å; I243-L247 HydrophobicContact CG2-CD1 3.81Å; I243-L247 HydrophobicContact CG2-CG 4.45Å; I243-L247 WeakPolarHBondContact O-CG 3.44Å; I243-L247 PolarHBondContact O-N 2.83Å
244	Y	93.9	Very high	90.6	Very high	1 Å²	1	55.4 Å²	55.4	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-41.6	178.7	-66	-7.3	0	0	0	112.8	C184 F185 I199 P207 L208 A211 L225 Y229 V240 K241 L247 G248 V249	C184-Y244 VanDerWaalsContact SG-CD2 3.51Å; F185-Y244 HydrophobicContact CZ-CD2 4.1Å; I199-Y244 HydrophobicContact CD1-CE2 4Å; I199-Y244 HydrophobicContact CG1-CE2 4.47Å; P207-Y244 HydrophobicContact CB-CD2 4.06Å; P207-Y244 HydrophobicContact CB-CE2 3.57Å; L208-Y244 WeakPolarHBondContact CA-OH 3.35Å; L208-Y244 PolarHBondContact N-OH 3.4Å; A211-Y244 HydrophobicContact CB-CD1 3.57Å; A211-Y244 HydrophobicContact CB-CE1 3.43Å; A211-Y244 VanDerWaalsContact CB-CE1 3.43Å; L225-Y244 HydrophobicContact CD1-CE1 3.91Å; Y229-Y244 VanDerWaalsContact CE2-OH 3.31Å; Y229-Y244 WeakPolarHBondContact CE2-OH 3.28Å; V240-Y244 HydrophobicContact CG1-CD1 4.35Å; V240-Y244 HydrophobicContact CG1-CD2 4.34Å; V240-Y244 HydrophobicContact CG1-CE1 3.82Å; V240-Y244 HydrophobicContact CG1-CE2 3.84Å; V240-Y244 PolarHBondContact O-N 2.78Å; K241-Y244 PolarHBondContact O-N 2.87Å; Y244-L247 PolarHBondContact O-N 3.36Å; Y244-G248 PolarHBondContact O-N 3.06Å; Y244-G248 VanDerWaalsContact O-N 3.16Å; Y244-V249 HydrophobicContact CD1-CG2 4.34Å; Y244-V249 HydrophobicContact CG-CG2 4.3Å; Y244-V249 PolarHBondContact O-N 3.17Å; Y244-V249 VanDerWaalsContact O-N 3.16Å
245	A	91.4	Very high	90.6	Very high	68 Å²	68	53.8 Å²	53.8	56%	0.562	28%	0.282	S	S	*	.	H	α-helix	trans	-63.5	-39	174.8	0	0	0	0	0	112.6	K241 I243 L247 G248	K241-A245 WeakPolarHBondContact O-CB 2.74Å; K241-A245 PolarHBondContact O-N 3.49Å; I243-A245 VanDerWaalsContact C-N 3.34Å; I243-A245 PolarHBondContact O-N 2.87Å; A245-L247 VanDerWaalsContact C-N 3.33Å; A245-L247 PolarHBondContact O-N 3.17Å; A245-G248 PolarHBondContact O-N 2.86Å
246	K	92.7	Very high	90.2	Very high	166 Å²	166	53.6 Å²	53.6	72%	0.722	28%	0.276	S	S	*	.	H	α-helix	trans	-71.2	-25.4	176.8	-77.1	174.3	-179.4	177.2	0	113.9	A242 I243	A242-K246 WeakPolarHBondContact O-CB 3.48Å; A242-K246 VanDerWaalsContact O-CG 3.28Å; A242-K246 WeakPolarHBondContact O-CG 3.38Å; A242-K246 PolarHBondContact O-N 3.16Å; I243-K246 PolarHBondContact O-N 3.07Å; I243-K246 VanDerWaalsContact O-N 3.14Å
247	L	93.5	Very high	89.4	Confident	31 Å²	31	55.2 Å²	55.2	16%	0.162	28%	0.284	C	S	.	.	H	α-helix	trans	-84.9	-18.7	176.5	-70.3	169.8	0	0	0	113	A211 M214 L215 I243 Y244 A245 V249	A211-L247 HydrophobicContact CB-CD1 3.78Å; M214-L247 HydrophobicContact CB-CD2 4.23Å; M214-L247 WeakPolarHBondContact CE-O 3.32Å; L215-L247 HydrophobicContact CD1-CD1 3.94Å; L215-L247 HydrophobicContact CD2-CD1 4.24Å; L215-L247 HydrophobicContact CD2-CD2 3.81Å; L215-L247 HydrophobicContact CG-CD1 3.83Å; L215-L247 HydrophobicContact CG-CD2 4.06Å; I243-L247 HydrophobicContact CG2-CD1 3.81Å; I243-L247 HydrophobicContact CG2-CG 4.45Å; I243-L247 WeakPolarHBondContact O-CG 3.44Å; I243-L247 PolarHBondContact O-N 2.83Å; Y244-L247 PolarHBondContact O-N 3.36Å; A245-L247 VanDerWaalsContact C-N 3.33Å; A245-L247 PolarHBondContact O-N 3.17Å; L247-V249 HydrophobicContact CB-CG2 4.07Å
248	G	93.1	Very high	88.8	Confident	18 Å²	18	62.4 Å²	62.4	19%	0.186	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	32.2	-174.2	0	0	0	0	0	113.6	Y244 A245 K250 E251 K252	Y244-G248 PolarHBondContact O-N 3.06Å; Y244-G248 VanDerWaalsContact O-N 3.16Å; A245-G248 PolarHBondContact O-N 2.86Å; G248-K250 PolarHBondContact O-N 3.12Å; G248-E251 VanDerWaalsContact C-OE2 3.3Å; G248-E251 WeakPolarHBondContact CA-OE2 3.21Å; G248-E251 PolarHBondContact O-N 2.64Å; G248-K252 PolarHBondContact O-N 2.91Å
249	V	91.8	Very high	88.2	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-34.6	179.8	175.2	0	0	0	0	111.4	F185 W206 P207 T210 A211 Y244 L247 K252 Y253	F185-V249 HydrophobicContact CE2-CG1 4.12Å; F185-V249 HydrophobicContact CZ-CB 4.11Å; F185-V249 HydrophobicContact CZ-CG1 3.91Å; W206-V249 HydrophobicContact CH2-CG1 4.48Å; W206-V249 HydrophobicContact CZ3-CG1 3.89Å; P207-V249 HydrophobicContact CB-CG1 4.14Å; T210-V249 HydrophobicContact CG2-CB 4.48Å; T210-V249 HydrophobicContact CG2-CG1 3.93Å; T210-V249 HydrophobicContact CG2-CG2 4.28Å; A211-V249 HydrophobicContact CB-CG2 4.17Å; Y244-V249 HydrophobicContact CD1-CG2 4.34Å; Y244-V249 HydrophobicContact CG-CG2 4.3Å; Y244-V249 PolarHBondContact O-N 3.17Å; Y244-V249 VanDerWaalsContact O-N 3.16Å; L247-V249 HydrophobicContact CB-CG2 4.07Å; V249-K252 PolarHBondContact O-N 3.06Å; V249-Y253 PolarHBondContact O-N 3.26Å
250	K	88.7	Confident	87.1	Confident	99 Å²	99	57.1 Å²	57.1	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-65	-44	177.2	-179.1	176.5	-175.8	176.8	0	111.7	Y181 F185 G248 K252 Y253 S254	Y181-K250 HydrophobicContact CE2-CG 4.11Å; Y181-K250 WeakPolarHBondContact OH-CE 3.15Å; F185-K250 HydrophobicContact CE1-CB 4.41Å; G248-K250 PolarHBondContact O-N 3.12Å; K250-K252 VanDerWaalsContact C-N 3.34Å; K250-Y253 WeakPolarHBondContact O-CB 3.35Å; K250-Y253 PolarHBondContact O-N 2.9Å; K250-S254 PolarHBondContact O-N 3.24Å; K250-S254 PolarHBondContact O-OG 3.41Å
251	E	90.6	Very high	85.8	Confident	114 Å²	114	65.3 Å²	65.3	53%	0.533	32%	0.317	S	S	.	.	H	α-helix	trans	-68.3	-36.1	179.1	-66.5	62.5	-142.8	0	0	110.9	G248 S254 Q255	G248-E251 VanDerWaalsContact C-OE2 3.3Å; G248-E251 WeakPolarHBondContact CA-OE2 3.21Å; G248-E251 PolarHBondContact O-N 2.64Å; E251-S254 PolarHBondContact O-N 3.17Å; E251-Q255 PolarHBondContact O-N 3.25Å
252	K	89.5	Confident	84.9	Confident	65 Å²	65	69.2 Å²	69.2	28%	0.283	33%	0.334	S	S	.	.	H	α-helix	trans	-61.6	-44.4	170.7	-136.9	-160.4	-169.8	-171.6	0	111.1	W206 T210 E213 M214 G248 V249 K250 Q255 L256	W206-K252 HydrophobicContact CH2-CB 4.38Å; T210-K252 HydrophobicContact CG2-CB 4.43Å; T210-K252 HydrophobicContact CG2-CD 3.31Å; T210-K252 HydrophobicContact CG2-CG 4.5Å; E213-K252 IonicContact OE2-NZ 3.47Å; E213-K252 PolarHBondContact OE2-NZ 3.38Å; M214-K252 HydrophobicContact CE-CD 4.44Å; M214-K252 HydrophobicContact SD-CD 3.66Å; M214-K252 HydrophobicContact SD-CG 4.48Å; G248-K252 PolarHBondContact O-N 2.91Å; V249-K252 PolarHBondContact O-N 3.06Å; K250-K252 VanDerWaalsContact C-N 3.34Å; K252-Q255 WeakPolarHBondContact O-CB 3.33Å; K252-Q255 PolarHBondContact O-N 2.69Å; K252-Q255 VanDerWaalsContact O-N 3.13Å; K252-L256 PolarHBondContact O-N 3.44Å
253	Y	86.8	Confident	83.8	Confident	7 Å²	7	71.4 Å²	71.4	3%	0.027	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-47.7	174.9	179.9	-89.1	0	0	0	111.1	Q178 Y181 W206 V249 K250 Q255 L256 E257	Q178-Y253 WeakPolarHBondContact CB-OH 3.46Å; Y181-Y253 HydrophobicContact CD1-CD1 4.16Å; Y181-Y253 AromaticContact CD1-CE1 3.98Å; Y181-Y253 HydrophobicContact CD1-CE1 3.98Å; Y181-Y253 AromaticContact CD2-CD1 3.58Å; Y181-Y253 HydrophobicContact CD2-CD1 3.58Å; Y181-Y253 AromaticContact CD2-CD2 3.71Å; Y181-Y253 HydrophobicContact CD2-CD2 3.71Å; Y181-Y253 HydrophobicContact CD2-CE1 4.2Å; Y181-Y253 HydrophobicContact CD2-CE2 4.28Å; Y181-Y253 AromaticContact CD2-CG 3.33Å; Y181-Y253 HydrophobicContact CD2-CG 3.33Å; Y181-Y253 HydrophobicContact CE1-CD1 4.19Å; Y181-Y253 HydrophobicContact CE1-CE1 4.19Å; Y181-Y253 AromaticContact CE2-CD1 3.62Å; Y181-Y253 HydrophobicContact CE2-CD1 3.62Å; Y181-Y253 HydrophobicContact CE2-CE1 4.39Å; Y181-Y253 AromaticContact CE2-CG 3.72Å; Y181-Y253 HydrophobicContact CE2-CG 3.72Å; Y181-Y253 AromaticContact CG-CD1 3.88Å; Y181-Y253 HydrophobicContact CG-CD1 3.88Å; Y181-Y253 AromaticContact CG-CD2 3.84Å; Y181-Y253 HydrophobicContact CG-CD2 3.84Å; Y181-Y253 HydrophobicContact CG-CE1 4.01Å; Y181-Y253 AromaticContact CG-CE2 3.94Å; Y181-Y253 HydrophobicContact CG-CE2 3.94Å; Y181-Y253 AromaticContact CG-CG 3.82Å; Y181-Y253 HydrophobicContact CG-CG 3.82Å; Y181-Y253 AromaticContact CZ-CD1 3.94Å; W206-Y253 HydrophobicContact CE3-CD2 4.25Å; W206-Y253 HydrophobicContact CH2-CD2 4.22Å; W206-Y253 HydrophobicContact CH2-CG 4.44Å; W206-Y253 AromaticContact CZ3-CD2 3.98Å; W206-Y253 HydrophobicContact CZ3-CD2 3.98Å; W206-Y253 HydrophobicContact CZ3-CG 4.33Å; V249-Y253 PolarHBondContact O-N 3.26Å; K250-Y253 WeakPolarHBondContact O-CB 3.35Å; K250-Y253 PolarHBondContact O-N 2.9Å; Y253-Q255 PolarHBondContact O-N 3.32Å; Y253-L256 PolarHBondContact O-N 2.79Å; Y253-L256 VanDerWaalsContact O-N 3.11Å; Y253-E257 HydrophobicContact CE1-CB 4.31Å; Y253-E257 WeakPolarHBondContact O-CB 3.26Å; Y253-E257 PolarHBondContact O-N 2.99Å
254	S	84.3	Confident	82.3	Confident	44 Å²	44	72.7 Å²	72.7	31%	0.308	35%	0.346	S	S	.	.	H	α-helix	trans	-65.1	-17.7	175.9	-62.3	0	0	0	0	113.7	K250 E251 R258	K250-S254 PolarHBondContact O-N 3.24Å; K250-S254 PolarHBondContact O-OG 3.41Å; E251-S254 PolarHBondContact O-N 3.17Å; S254-R258 VanDerWaalsContact O-CG 3.32Å; S254-R258 WeakPolarHBondContact O-CG 3.3Å; S254-R258 PolarHBondContact O-NE 3.4Å
255	Q	87.2	Confident	81	Confident	92 Å²	92	75.4 Å²	75.4	43%	0.43	37%	0.365	S	S	.	.	H	α-helix	trans	-76.9	-51.1	166.2	179.3	172.2	-13.6	0	0	111.3	E251 K252 Y253 E257 R258 E259	E251-Q255 PolarHBondContact O-N 3.25Å; K252-Q255 WeakPolarHBondContact O-CB 3.33Å; K252-Q255 PolarHBondContact O-N 2.69Å; K252-Q255 VanDerWaalsContact O-N 3.13Å; Y253-Q255 PolarHBondContact O-N 3.32Å; Q255-E257 VanDerWaalsContact C-N 3.33Å; Q255-E257 PolarHBondContact O-N 2.8Å; Q255-R258 CarbonylContact O-C 3.52Å; Q255-R258 WeakPolarHBondContact O-CA 3.26Å; Q255-R258 WeakPolarHBondContact O-CB 3.39Å; Q255-R258 PolarHBondContact O-N 3.22Å; Q255-E259 HydrophobicContact CG-CG 4.46Å; Q255-E259 VanDerWaalsContact CG-OE1 3.27Å; Q255-E259 WeakPolarHBondContact CG-OE1 3.21Å; Q255-E259 PolarHBondContact NE2-OE1 3.28Å; Q255-E259 PolarHBondContact O-N 3.46Å
256	L	80.5	Confident	80	Confident	54 Å²	54	74.6 Å²	74.6	28%	0.283	36%	0.358	S	S	.	.	H	α-helix	trans	-56.7	-44.7	180	-175.6	55.2	0	0	0	112	Q177 W206 K252 Y253 R258 E259 L260	Q177-L256 VanDerWaalsContact OE1-CD2 3.24Å; W206-L256 HydrophobicContact CZ2-CD2 3.74Å; K252-L256 PolarHBondContact O-N 3.44Å; Y253-L256 PolarHBondContact O-N 2.79Å; Y253-L256 VanDerWaalsContact O-N 3.11Å; L256-R258 VanDerWaalsContact C-N 3.32Å; L256-R258 PolarHBondContact O-N 2.97Å; L256-E259 PolarHBondContact O-N 3.23Å; L256-L260 WeakPolarHBondContact O-CB 3.47Å; L256-L260 PolarHBondContact O-N 3.48Å
257	E	74.7	Confident	78.7	Confident	75 Å²	75	69.9 Å²	69.9	35%	0.35	34%	0.341	S	S	.	.	H	α-helix	trans	-58.9	-40	173.9	-168.3	-164.3	155.2	0	0	112.3	Y253 Q255 R261	Y253-E257 HydrophobicContact CE1-CB 4.31Å; Y253-E257 WeakPolarHBondContact O-CB 3.26Å; Y253-E257 PolarHBondContact O-N 2.99Å; Q255-E257 VanDerWaalsContact C-N 3.33Å; Q255-E257 PolarHBondContact O-N 2.8Å; E257-R261 WeakPolarHBondContact O-CB 3.36Å; E257-R261 PolarHBondContact O-N 3.4Å
258	R	77.6	Confident	77.1	Confident	156 Å²	156	71.9 Å²	71.9	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-74.5	-25.9	178.6	-79.4	-178.7	-65.5	150.8	3.6	113.5	S254 Q255 L256 K262	S254-R258 VanDerWaalsContact O-CG 3.32Å; S254-R258 WeakPolarHBondContact O-CG 3.3Å; S254-R258 PolarHBondContact O-NE 3.4Å; Q255-R258 CarbonylContact O-C 3.52Å; Q255-R258 WeakPolarHBondContact O-CA 3.26Å; Q255-R258 WeakPolarHBondContact O-CB 3.39Å; Q255-R258 PolarHBondContact O-N 3.22Å; L256-R258 VanDerWaalsContact C-N 3.32Å; L256-R258 PolarHBondContact O-N 2.97Å; R258-K262 WeakPolarHBondContact O-CE 3.24Å; R258-K262 WeakPolarHBondContact O-CG 3.29Å
259	E	77.3	Confident	76	Confident	81 Å²	81	74.4 Å²	74.4	38%	0.379	37%	0.366	S	S	.	.	H	α-helix	trans	-79	-57.8	176.6	-75.4	167.8	-177.3	0	0	109.4	Q255 L256 R261 K262 D263	Q255-E259 HydrophobicContact CG-CG 4.46Å; Q255-E259 VanDerWaalsContact CG-OE1 3.27Å; Q255-E259 WeakPolarHBondContact CG-OE1 3.21Å; Q255-E259 PolarHBondContact NE2-OE1 3.28Å; Q255-E259 PolarHBondContact O-N 3.46Å; L256-E259 PolarHBondContact O-N 3.23Å; E259-R261 VanDerWaalsContact C-N 3.26Å; E259-R261 PolarHBondContact O-N 3.48Å; E259-K262 WeakPolarHBondContact O-CA 3.29Å; E259-K262 VanDerWaalsContact O-CB 3.27Å; E259-K262 WeakPolarHBondContact O-CB 3.27Å; E259-K262 PolarHBondContact O-N 3.1Å; E259-D263 PolarHBondContact O-N 3.25Å
260	L	67.3	Low	75	Confident	14 Å²	14	80.8 Å²	80.8	7%	0.073	40%	0.4	C	S	.	.	H	α-helix	trans	-60.5	-32.3	178.6	178.9	55.4	0	0	0	113.3	P170 Q174 L256 K262 D263 I264	P170-L260 HydrophobicContact CB-CD1 3.59Å; P170-L260 HydrophobicContact CB-CD2 4.41Å; P170-L260 VanDerWaalsContact O-CD2 3.27Å; P170-L260 WeakPolarHBondContact O-CD2 3.45Å; Q174-L260 HydrophobicContact CB-CD2 3.57Å; Q174-L260 HydrophobicContact CG-CD2 3.93Å; Q174-L260 VanDerWaalsContact OE1-CD2 3.3Å; L256-L260 WeakPolarHBondContact O-CB 3.47Å; L256-L260 PolarHBondContact O-N 3.48Å; L260-K262 PolarHBondContact O-N 3.03Å; L260-D263 HydrophobicContact CD1-CB 4.44Å; L260-D263 PolarHBondContact O-N 2.88Å; L260-I264 HydrophobicContact CD1-CD1 3.91Å; L260-I264 HydrophobicContact CD1-CG1 3.85Å; L260-I264 HydrophobicContact CD2-CD1 4.39Å; L260-I264 HydrophobicContact CG-CD1 3.76Å; L260-I264 HydrophobicContact CG-CG1 4.19Å; L260-I264 WeakPolarHBondContact O-CB 3.32Å; L260-I264 WeakPolarHBondContact O-CG1 3.46Å; L260-I264 PolarHBondContact O-N 3.08Å
261	R	66.3	Low	73.9	Confident	172 Å²	172	79.6 Å²	79.6	65%	0.649	40%	0.398	S	S	*	.	H	α-helix	trans	-61.4	-29.6	172.1	179.2	172.3	175.2	172	-0.5	113.1	E257 E259 S265	E257-R261 WeakPolarHBondContact O-CB 3.36Å; E257-R261 PolarHBondContact O-N 3.4Å; E259-R261 VanDerWaalsContact C-N 3.26Å; E259-R261 PolarHBondContact O-N 3.48Å; R261-S265 VanDerWaalsContact O-CB 3.26Å; R261-S265 WeakPolarHBondContact O-CB 3.46Å; R261-S265 PolarHBondContact O-N 3.31Å; R261-S265 VanDerWaalsContact O-N 3.12Å; R261-S265 PolarHBondContact O-OG 3.48Å
262	K	72.2	Confident	72.4	Confident	132 Å²	132	78.9 Å²	78.9	57%	0.574	41%	0.412	S	S	*	.	H	α-helix	trans	-70.6	-46.2	172.9	-61.9	161.9	-171.2	166.3	0	110.1	R258 E259 L260 S265 A266	R258-K262 WeakPolarHBondContact O-CE 3.24Å; R258-K262 WeakPolarHBondContact O-CG 3.29Å; E259-K262 WeakPolarHBondContact O-CA 3.29Å; E259-K262 VanDerWaalsContact O-CB 3.27Å; E259-K262 WeakPolarHBondContact O-CB 3.27Å; E259-K262 PolarHBondContact O-N 3.1Å; L260-K262 PolarHBondContact O-N 3.03Å; K262-S265 CarbonylContact O-C 3.5Å; K262-S265 WeakPolarHBondContact O-CA 3.17Å; K262-S265 WeakPolarHBondContact O-CB 3.32Å; K262-S265 PolarHBondContact O-N 2.98Å; K262-A266 PolarHBondContact O-N 2.78Å
263	D	68.2	Low	71.2	Confident	93 Å²	93	78.1 Å²	78.1	50%	0.497	41%	0.414	S	S	.	.	H	α-helix	trans	-65.1	-45.6	-176.8	-55.9	-27.1	0	0	0	110.9	E259 L260 S265 A266 L267	E259-D263 PolarHBondContact O-N 3.25Å; L260-D263 HydrophobicContact CD1-CB 4.44Å; L260-D263 PolarHBondContact O-N 2.88Å; D263-S265 VanDerWaalsContact C-N 3.28Å; D263-S265 PolarHBondContact O-N 3.27Å; D263-A266 PolarHBondContact O-N 3.27Å; D263-A266 VanDerWaalsContact O-N 3.16Å; D263-L267 WeakPolarHBondContact O-CB 3.38Å; D263-L267 VanDerWaalsContact O-CG 3.28Å; D263-L267 WeakPolarHBondContact O-CG 3.36Å; D263-L267 PolarHBondContact O-N 3.3Å
264	I	61.4	Low	70.4	Confident	44 Å²	44	81.9 Å²	81.9	23%	0.226	44%	0.441	C	S	.	.	H	α-helix	trans	-59.4	-39	171	-66.7	171.8	0	0	0	110.9	A171 L260 L267 I268	A171-I264 HydrophobicContact CB-CD1 3.66Å; A171-I264 HydrophobicContact CB-CG1 4.09Å; L260-I264 HydrophobicContact CD1-CD1 3.91Å; L260-I264 HydrophobicContact CD1-CG1 3.85Å; L260-I264 HydrophobicContact CD2-CD1 4.39Å; L260-I264 HydrophobicContact CG-CD1 3.76Å; L260-I264 HydrophobicContact CG-CG1 4.19Å; L260-I264 WeakPolarHBondContact O-CB 3.32Å; L260-I264 WeakPolarHBondContact O-CG1 3.46Å; L260-I264 PolarHBondContact O-N 3.08Å; I264-L267 PolarHBondContact O-N 3.44Å; I264-I268 HydrophobicContact CG2-CD1 3.74Å; I264-I268 HydrophobicContact CG2-CG1 4.34Å; I264-I268 WeakPolarHBondContact O-CB 3.5Å; I264-I268 WeakPolarHBondContact O-CG1 3.38Å; I264-I268 PolarHBondContact O-N 2.94Å
265	S	65.7	Low	69	Low	59 Å²	59	81.1 Å²	81.1	41%	0.413	44%	0.437	S	S	.	.	H	α-helix	trans	-68.5	-33.5	177	-61.6	0	0	0	0	113	R261 K262 D263 S269	R261-S265 VanDerWaalsContact O-CB 3.26Å; R261-S265 WeakPolarHBondContact O-CB 3.46Å; R261-S265 PolarHBondContact O-N 3.31Å; R261-S265 VanDerWaalsContact O-N 3.12Å; R261-S265 PolarHBondContact O-OG 3.48Å; K262-S265 CarbonylContact O-C 3.5Å; K262-S265 WeakPolarHBondContact O-CA 3.17Å; K262-S265 WeakPolarHBondContact O-CB 3.32Å; K262-S265 PolarHBondContact O-N 2.98Å; D263-S265 VanDerWaalsContact C-N 3.28Å; D263-S265 PolarHBondContact O-N 3.27Å; S265-S269 WeakPolarHBondContact O-CB 3.36Å; S265-S269 PolarHBondContact O-N 3.35Å; S265-S269 PolarHBondContact O-OG 3.05Å
266	A	70.1	Confident	67.5	Low	50 Å²	50	78.5 Å²	78.5	41%	0.413	43%	0.428	S	S	.	.	H	α-helix	trans	-69.2	-49.5	173.1	0	0	0	0	0	110.7	K262 D263 I268 S269 D270	K262-A266 PolarHBondContact O-N 2.78Å; D263-A266 PolarHBondContact O-N 3.27Å; D263-A266 VanDerWaalsContact O-N 3.16Å; A266-I268 VanDerWaalsContact C-N 3.32Å; A266-I268 PolarHBondContact O-N 2.88Å; A266-S269 CarbonylContact O-C 3.56Å; A266-S269 WeakPolarHBondContact O-CA 3.35Å; A266-S269 VanDerWaalsContact O-CB 3.29Å; A266-S269 WeakPolarHBondContact O-CB 3.35Å; A266-S269 PolarHBondContact O-N 3.2Å; A266-D270 PolarHBondContact O-N 3.3Å
267	L	65.4	Low	66.4	Low	68 Å²	68	81.3 Å²	81.3	36%	0.356	43%	0.434	S	S	.	.	H	α-helix	trans	-59	-40.8	176.5	-68.3	171.9	0	0	0	112.7	P167 D263 I264 D270 L271	P167-L267 HydrophobicContact CB-CD1 3.8Å; P167-L267 HydrophobicContact CB-CD2 3.48Å; P167-L267 VanDerWaalsContact CB-CD2 3.48Å; P167-L267 HydrophobicContact CB-CG 4.27Å; P167-L267 HydrophobicContact CG-CD2 4.44Å; P167-L267 WeakPolarHBondContact O-CD1 3.46Å; D263-L267 WeakPolarHBondContact O-CB 3.38Å; D263-L267 VanDerWaalsContact O-CG 3.28Å; D263-L267 WeakPolarHBondContact O-CG 3.36Å; D263-L267 PolarHBondContact O-N 3.3Å; I264-L267 PolarHBondContact O-N 3.44Å; L267-D270 PolarHBondContact O-N 3.13Å; L267-L271 PolarHBondContact O-N 3.04Å
268	I	61.2	Low	65.3	Low	72 Å²	72	81.6 Å²	81.6	37%	0.369	45%	0.445	S	S	.	.	H	α-helix	trans	-62.6	-45	170.7	-71.6	168.6	0	0	0	109.9	I264 A266 D270 L271 R277	I264-I268 HydrophobicContact CG2-CD1 3.74Å; I264-I268 HydrophobicContact CG2-CG1 4.34Å; I264-I268 WeakPolarHBondContact O-CB 3.5Å; I264-I268 WeakPolarHBondContact O-CG1 3.38Å; I264-I268 PolarHBondContact O-N 2.94Å; A266-I268 VanDerWaalsContact C-N 3.32Å; A266-I268 PolarHBondContact O-N 2.88Å; I268-D270 VanDerWaalsContact C-N 3.25Å; I268-D270 PolarHBondContact O-N 2.97Å; I268-L271 WeakPolarHBondContact O-CB 3.11Å; I268-L271 PolarHBondContact O-N 3.38Å; I268-L271 VanDerWaalsContact O-N 3.13Å; I268-R277 HydrophobicContact CG2-CG 4.27Å; I268-R277 WeakPolarHBondContact O-CD 3.29Å; I268-R277 WeakPolarHBondContact O-CG 2.74Å
269	S	68.8	Low	63.7	Low	71 Å²	71	75.2 Å²	75.2	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-59.4	-35	179.6	-62.1	0	0	0	0	112.9	S265 A266 L271 R277	S265-S269 WeakPolarHBondContact O-CB 3.36Å; S265-S269 PolarHBondContact O-N 3.35Å; S265-S269 PolarHBondContact O-OG 3.05Å; A266-S269 CarbonylContact O-C 3.56Å; A266-S269 WeakPolarHBondContact O-CA 3.35Å; A266-S269 VanDerWaalsContact O-CB 3.29Å; A266-S269 WeakPolarHBondContact O-CB 3.35Å; A266-S269 PolarHBondContact O-N 3.2Å; S269-L271 VanDerWaalsContact C-N 3.35Å; S269-R277 WeakPolarHBondContact O-CD 3.05Å; S269-R277 PolarHBondContact O-NH1 2.92Å
270	D	71.1	Confident	61.8	Low	134 Å²	134	80.5 Å²	80.5	72%	0.717	45%	0.445	S	S	*	.	H	α-helix	trans	-78.4	-10.5	178.9	-70.2	-21	0	0	0	114.4	A266 L267 I268 A272	A266-D270 PolarHBondContact O-N 3.3Å; L267-D270 PolarHBondContact O-N 3.13Å; I268-D270 VanDerWaalsContact C-N 3.25Å; I268-D270 PolarHBondContact O-N 2.97Å; D270-A272 PolarHBondContact O-N 2.7Å; D270-A272 VanDerWaalsContact O-N 3.12Å
271	L	64.9	Low	60.2	Low	75 Å²	75	86.4 Å²	86.4	39%	0.393	47%	0.471	S	S	.	.			trans	-60.9	116.7	176	-68.9	174.3	0	0	0	111.2	L267 I268 S269 C273 V276 R277	L267-L271 PolarHBondContact O-N 3.04Å; I268-L271 WeakPolarHBondContact O-CB 3.11Å; I268-L271 PolarHBondContact O-N 3.38Å; I268-L271 VanDerWaalsContact O-N 3.13Å; S269-L271 VanDerWaalsContact C-N 3.35Å; L271-C273 PolarHBondContact O-N 3.04Å; L271-V276 HydrophobicContact CD1-CG1 4.09Å; L271-R277 HydrophobicContact CB-CG 3.8Å; L271-R277 HydrophobicContact CD1-CG 4.45Å; L271-R277 VanDerWaalsContact O-CD 3.24Å; L271-R277 WeakPolarHBondContact O-CD 3.17Å; L271-R277 PolarHBondContact O-NE 2.69Å; L271-R277 PolarHBondContact O-NH2 2.98Å
272	A	60.1	Low	58.3	Low	99 Å²	99	84 Å²	84	82%	0.818	48%	0.475	S	S	*	.	S	Bend	trans	-53.2	-35.4	-178.8	0	0	0	0	0	113.7	D270 S274	D270-A272 PolarHBondContact O-N 2.7Å; D270-A272 VanDerWaalsContact O-N 3.12Å; A272-S274 PolarHBondContact O-N 2.92Å
273	C	64.6	Low	56	Low	49 Å²	49	84.7 Å²	84.7	33%	0.331	48%	0.48	S	S	.	.			trans	-78.8	107.1	178.7	-168.9	0	0	0	0	112.1	L271 A275 V276 R277	L271-C273 PolarHBondContact O-N 3.04Å; C273-A275 PolarHBondContact O-N 3.43Å; C273-V276 HydrophobicContact CB-CB 4.22Å; C273-V276 HydrophobicContact CB-CG2 4.04Å; C273-V276 PolarHBondContact O-N 3.29Å; C273-R277 PolarHBondContact O-N 3.2Å
274	S	68.9	Low	54	Low	85 Å²	85	83.6 Å²	83.6	59%	0.594	47%	0.473	S	S	*	.	H	α-helix	trans	-58.9	-31.8	173	50.7	0	0	0	0	113.6	A272 R277 S278	A272-S274 PolarHBondContact O-N 2.92Å; S274-R277 PolarHBondContact O-N 3.13Å; S274-S278 PolarHBondContact O-N 3.42Å; S274-S278 VanDerWaalsContact O-N 3.14Å
275	A	55	Low	52.2	Low	28 Å²	28	84 Å²	84	23%	0.231	48%	0.48	C	S	.	.	H	α-helix	trans	-66	-46.5	178.5	0	0	0	0	0	111.6	A115 C273 R277 S278 C279	A115-A275 HydrophobicContact CB-CB 4.05Å; A115-A275 VanDerWaalsContact O-CB 3.25Å; A115-A275 WeakPolarHBondContact O-CB 3.49Å; C273-A275 PolarHBondContact O-N 3.43Å; A275-R277 VanDerWaalsContact C-N 3.33Å; A275-R277 PolarHBondContact O-N 2.94Å; A275-S278 WeakPolarHBondContact O-CB 3.39Å; A275-S278 PolarHBondContact O-N 3.35Å; A275-S278 PolarHBondContact O-OG 3.12Å; A275-C279 PolarHBondContact O-N 3.16Å
276	V	55.5	Low	50.2	Low	38 Å²	38	85 Å²	85	23%	0.23	48%	0.484	C	S	.	.	H	α-helix	trans	-63.6	-38.1	175.6	179.1	0	0	0	0	111.5	L116 L271 C273 S278 C279	L116-V276 HydrophobicContact CD2-CG2 3.8Å; L116-V276 HydrophobicContact CG-CG2 4.09Å; L271-V276 HydrophobicContact CD1-CG1 4.09Å; C273-V276 HydrophobicContact CB-CB 4.22Å; C273-V276 HydrophobicContact CB-CG2 4.04Å; C273-V276 PolarHBondContact O-N 3.29Å; V276-S278 PolarHBondContact O-N 3.29Å; V276-C279 WeakPolarHBondContact O-CB 3.42Å; V276-C279 PolarHBondContact O-N 3.44Å
277	R	58.6	Low	47.9	Very low	112 Å²	112	86.1 Å²	86.1	42%	0.423	49%	0.488	S	S	.	.	H	α-helix	trans	-60.9	-22.3	171.6	-69.9	-171.5	-77.2	-175.2	-10.7	114.1	I268 S269 L271 C273 S274 A275	I268-R277 HydrophobicContact CG2-CG 4.27Å; I268-R277 WeakPolarHBondContact O-CD 3.29Å; I268-R277 WeakPolarHBondContact O-CG 2.74Å; S269-R277 WeakPolarHBondContact O-CD 3.05Å; S269-R277 PolarHBondContact O-NH1 2.92Å; L271-R277 HydrophobicContact CB-CG 3.8Å; L271-R277 HydrophobicContact CD1-CG 4.45Å; L271-R277 VanDerWaalsContact O-CD 3.24Å; L271-R277 WeakPolarHBondContact O-CD 3.17Å; L271-R277 PolarHBondContact O-NE 2.69Å; L271-R277 PolarHBondContact O-NH2 2.98Å; C273-R277 PolarHBondContact O-N 3.2Å; S274-R277 PolarHBondContact O-N 3.13Å; A275-R277 VanDerWaalsContact C-N 3.33Å; A275-R277 PolarHBondContact O-N 2.94Å
278	S	50.5	Low	45.9	Very low	81 Å²	81	94 Å²	94	57%	0.566	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-5.1	-177.7	76.7	0	0	0	0	114.6	S274 A275 V276 K280	S274-S278 PolarHBondContact O-N 3.42Å; S274-S278 VanDerWaalsContact O-N 3.14Å; A275-S278 WeakPolarHBondContact O-CB 3.39Å; A275-S278 PolarHBondContact O-N 3.35Å; A275-S278 PolarHBondContact O-OG 3.12Å; V276-S278 PolarHBondContact O-N 3.29Å; S278-K280 PolarHBondContact O-N 3.1Å
279	C	44.3	Very low	44	Very low	22 Å²	22	94.7 Å²	94.7	15%	0.149	54%	0.538	C	S	.	.			trans	-60.5	107.3	178.8	-68.6	0	0	0	0	111.4	A275 V276 F281	A275-C279 PolarHBondContact O-N 3.16Å; V276-C279 WeakPolarHBondContact O-CB 3.42Å; V276-C279 PolarHBondContact O-N 3.44Å; C279-F281 HydrophobicContact CB-CE1 4.08Å; C279-F281 HydrophobicContact CB-CE2 4.41Å; C279-F281 HydrophobicContact CB-CZ 3.77Å; C279-F281 WeakPolarHBondContact O-CE2 3.1Å
280	K	37.4	Very low	41.7	Very low	192 Å²	192	94.5 Å²	94.5	84%	0.835	54%	0.537	S	S	*	.			trans	-85.6	115.4	174.4	-69.3	-174.1	178.6	-177.4	0	110.5	S278	S278-K280 PolarHBondContact O-N 3.1Å
281	F	33.7	Very low	39.4	Very low	138 Å²	138	94.9 Å²	94.9	61%	0.605	54%	0.543	S	S	*	.			trans	-85.1	121.8	176.5	-54	-65.3	0	0	0	110.8	L108 C279	L108-F281 HydrophobicContact CD1-CD1 4.39Å; L108-F281 HydrophobicContact CD1-CE1 3.43Å; L108-F281 VanDerWaalsContact CD1-CE1 3.43Å; L108-F281 HydrophobicContact CD1-CZ 3.78Å; C279-F281 HydrophobicContact CB-CE1 4.08Å; C279-F281 HydrophobicContact CB-CE2 4.41Å; C279-F281 HydrophobicContact CB-CZ 3.77Å; C279-F281 WeakPolarHBondContact O-CE2 3.1Å
282	V	26.5	Very low	37.4	Very low	123 Å²	123	97 Å²	97	75%	0.745	55%	0.554	S	S	*	*			trans	-99	118.7	172.1	-178.7	0	0	0	0	107.8	I284	V282-I284 HydrophobicContact CG1-CG1 4.1Å; V282-I284 PolarHBondContact O-N 3.47Å; V282-I284 VanDerWaalsContact O-N 3.15Å
283	H	25.1	Very low	35.6	Very low	145 Å²	145	97.2 Å²	97.2	67%	0.671	55%	0.546	S	S	*	.			trans	-80.6	94.6	178.7	-174.7	-81.5	0	0	0	109.8	K102 S285	K102-H283 PolarHBondContact NZ-CE1 3.5Å; K102-H283 VanDerWaalsContact NZ-CE1 3.26Å; K102-H283 PolarHBondContact NZ-NE2 2.85Å; K102-H283 VanDerWaalsContact NZ-NE2 3.17Å; H283-S285 PolarHBondContact O-N 3.4Å
284	I	25	Very low	33.7	Very low	70 Å²	70	102.5 Å²	102.5	36%	0.359	57%	0.566	S	S	.	*			trans	-85.1	108.8	177.9	-56.3	177	0	0	0	108.5	P61 V282 V286	P61-I284 HydrophobicContact CG-CD1 4.17Å; V282-I284 HydrophobicContact CG1-CG1 4.1Å; V282-I284 PolarHBondContact O-N 3.47Å; V282-I284 VanDerWaalsContact O-N 3.15Å; I284-V286 HydrophobicContact CG2-CG2 3.95Å
285	S	23.2	Very low	31.6	Very low	52 Å²	52	106 Å²	106	36%	0.364	58%	0.577	S	S	.	*			trans	-94.2	103.1	173.6	-156.5	0	0	0	0	110.4	H283 C287	H283-S285 PolarHBondContact O-N 3.4Å; S285-C287 PolarHBondContact O-N 3.15Å
286	V	24	Very low	30.1	Very low	81 Å²	81	110.3 Å²	110.3	49%	0.491	61%	0.613	S	S	.	*			trans	-87.1	81.2	177	-173.3	0	0	0	0	109.7	I284	I284-V286 HydrophobicContact CG2-CG2 3.95Å
287	C	21.6	Very low	28.5	Very low	73 Å²	73	111.6 Å²	111.6	49%	0.493	63%	0.634	S	S	.	*	B	Isolated β-bridge	trans	-69	141.4	169.6	-67.6	0	0	0	0	110.3	S285 G289 S290	S285-C287 PolarHBondContact O-N 3.15Å; C287-G289 PolarHBondContact O-N 3.44Å; C287-G289 VanDerWaalsContact O-N 3.09Å; C287-S290 PolarHBondContact O-N 3.36Å
288	R	23	Very low	26.7	Very low	233 Å²	233	115.5 Å²	115.5	88%	0.879	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	114.9	176.9	-75.8	-179.7	173.1	160.6	0.1	110
289	G	21.5	Very low	25.4	Very low	88 Å²	88	121.3 Å²	121.3	91%	0.907	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	101.3	-18	172.3	0	0	0	0	0	116.1	C287	C287-G289 PolarHBondContact O-N 3.44Å; C287-G289 VanDerWaalsContact O-N 3.09Å
290	S	21.5	Very low	24.3	Very low	67 Å²	67	129.1 Å²	129.1	47%	0.469	71%	0.709	S	S	.	*	B	Isolated β-bridge	trans	-136.6	118.5	-173.2	-60.6	0	0	0	0	112.5	C287 L292	C287-S290 PolarHBondContact O-N 3.36Å; S290-L292 PolarHBondContact O-N 2.85Å
291	V	22.6	Very low	23.5	Very low	141 Å²	141	125 Å²	125	86%	0.855	71%	0.705	S	S	*	*			trans	-84.9	86.2	168.8	-178.4	0	0	0	0	108.6	T293	V291-T293 HydrophobicContact CG1-CG2 4.2Å
292	L	22.2	Very low	23	Very low	119 Å²	119	121.3 Å²	121.3	62%	0.623	70%	0.7	S	S	*	*			trans	-89.8	105.4	170.8	-68	177	0	0	0	109.6	S290 E294	S290-L292 PolarHBondContact O-N 2.85Å; L292-E294 PolarHBondContact O-N 3.11Å
293	T	23.7	Very low	22.8	Very low	105 Å²	105	122.8 Å²	122.8	64%	0.644	70%	0.703	S	S	*	*			trans	-85.2	76.8	174.1	51.8	0	0	0	0	110.5	V291	V291-T293 HydrophobicContact CG1-CG2 4.2Å
294	E	24.1	Very low	22.7	Very low	160 Å²	160	120.6 Å²	120.6	75%	0.748	70%	0.696	S	S	*	*			trans	-84.1	115.4	176.3	-69.4	-176.9	169.5	0	0	111	L292	L292-E294 PolarHBondContact O-N 3.11Å
295	N	24.2	Very low	22.6	Very low	157 Å²	157	123 Å²	123	84%	0.84	71%	0.714	S	S	*	*			trans	-67.9	136	163.1	-74.6	-58.9	0	0	0	108.6	G297	N295-G297 PolarHBondContact O-N 3.34Å
296	A	24.8	Very low	22.6	Very low	119 Å²	119	127.2 Å²	127.2	98%	0.983	73%	0.728	S	S	*	*	S	Bend	trans	-67.5	90.6	-178.5	0	0	0	0	0	112.1
297	G	21.1	Very low	22.6	Very low	65 Å²	65	132.4 Å²	132.4	67%	0.67	75%	0.746	S	S	*	*			trans	-169	101.8	-179.4	0	0	0	0	0	114.4	N295	N295-G297 PolarHBondContact O-N 3.34Å
298	M	21	Very low	22.6	Very low	194 Å²	194	132.5 Å²	132.5	96%	0.956	75%	0.753	S	S	*	*			trans	69	157.3	170.6	-66.2	168.5	56.9	0	0	116.9
299	F	22	Very low	22.6	Very low	204 Å²	204	127.7 Å²	127.7	90%	0.895	75%	0.749	S	S	*	*			trans	-91.9	154.6	-172.2	-63.4	-103.3	0	0	0	111.8
300	E	21.3	Very low	22.7	Very low	185 Å²	185	125.5 Å²	125.5	86%	0.864	73%	0.726	S	S	*	*				173.6	129.1	110.4	-91.9	175.3	174.2	0	0	114.9
301	S	21.8	Very low	23.1	Very low	107 Å²	107	123.7 Å²	123.7	75%	0.748	71%	0.713	S	S	*	*			trans	47.1	108.4	153.8	62.4	0	0	0	0	124.7
302	A	22.3	Very low	23.1	Very low	60 Å²	60	122.7 Å²	122.7	50%	0.496	70%	0.702	S	S	.	*				80.4	147.4	111.8	0	0	0	0	0	124.4
303	L	22.5	Very low	23.1	Very low	154 Å²	154	122.1 Å²	122.1	81%	0.806	70%	0.699	S	S	*	*			trans	70.2	138.5	161.4	-63	151.5	0	0	0	117.1
304	D	23.1	Very low	23	Very low	99 Å²	99	124.7 Å²	124.7	53%	0.529	71%	0.708	S	S	.	*			cis	-151.8	-152.4	-14.5	-157.9	13.1	0	0	0	109.2	K190	K190-D304 VanDerWaalsContact CE-OD1 3.23Å; K190-D304 WeakPolarHBondContact CE-OD1 3.43Å; K190-D304 IonicContact NZ-OD1 2.7Å; K190-D304 PolarHBondContact NZ-OD1 3Å
305	V	24.1	Very low	22.9	Very low	120 Å²	120	122 Å²	122	73%	0.727	71%	0.707	S	S	*	*			cis	-145.8	-151.5	15.7	-144.9	0	0	0	0	110.6	K190	K190-V305 PolarHBondContact NZ-O 3.01Å
306	E	22.1	Very low	22.9	Very low	141 Å²	141	119.7 Å²	119.7	66%	0.659	70%	0.702	S	S	*	*			trans	-145	-173.9	-173.3	-80	-149.1	93.8	0	0	116.4
307	E	23.8	Very low	22.7	Very low	189 Å²	189	120.7 Å²	120.7	88%	0.883	69%	0.691	S	S	*	*			trans	77.7	142.6	170.2	-67.6	-154.9	117.6	0	0	119.7
308	A	22.6	Very low	22.8	Very low	76 Å²	76	123.7 Å²	123.7	63%	0.628	70%	0.696	S	S	*	*			cis	-160.4	150.6	-12.5	0	0	0	0	0	114.1
309	V	22.1	Very low	22.7	Very low	132 Å²	132	120.5 Å²	120.5	80%	0.8	68%	0.682	S	S	*	*			trans	38.3	135.6	140.5	-173.6	0	0	0	0	122.7
310	G	24	Very low	22.7	Very low	41 Å²	41	117.3 Å²	117.3	42%	0.423	67%	0.672	S	S	.	*			trans	-118.2	-159.3	163.3	0	0	0	0	0	112	C23 G25	C23-G310 VanDerWaalsContact O-O 3.14Å; G25-G310 WeakPolarHBondContact CA-O 3.47Å; G25-G310 PolarHBondContact N-O 2.91Å; G25-G310 CarbonylContact O-C 3.6Å
311	P	30.2	Very low	22.9	Very low	29 Å²	29	115.2 Å²	115.2	19%	0.188	67%	0.667	C	S	.	*			cis	-147.8	-146.7	8.6	44.8	-19.8	0	0	0	113.5	F22 C23 G25	F22-P311 HydrophobicContact CB-CB 3.85Å; F22-P311 HydrophobicContact CB-CG 3.64Å; F22-P311 HydrophobicContact CD1-CB 3.3Å; F22-P311 HydrophobicContact CD1-CG 4.08Å; F22-P311 HydrophobicContact CE1-CB 4Å; F22-P311 HydrophobicContact CG-CB 3.83Å; F22-P311 HydrophobicContact CG-CG 4.22Å; C23-P311 WeakPolarHBondContact O-CD 3.32Å; C23-P311 VanDerWaalsContact O-CG 3.23Å; C23-P311 WeakPolarHBondContact O-CG 3.31Å; G25-P311 WeakPolarHBondContact O-CD 3.42Å
312	L	22.2	Very low	23	Very low	120 Å²	120	117.4 Å²	117.4	63%	0.628	66%	0.663	S	S	*	*				-164.3	-159.1	123.5	-140.2	80.2	0	0	0	114
313	L	21.6	Very low	23.2	Very low	107 Å²	107	117.2 Å²	117.2	56%	0.56	66%	0.658	S	S	*	*			trans	-133.8	154.4	-148.5	-79.9	163.6	0	0	0	116.1	F22	F22-L313 HydrophobicContact CB-CD2 4.35Å
314	L	22.5	Very low	23.3	Very low	160 Å²	160	113.4 Å²	113.4	84%	0.838	64%	0.637	S	S	*	*			trans	65.3	158.2	150.5	-70.9	164.4	0	0	0	117.6
315	S	22.5	Very low	23.6	Very low	103 Å²	103	109.3 Å²	109.3	72%	0.72	62%	0.615	S	S	*	*			cis	-132.3	-165.6	17.5	59.9	0	0	0	0	110.9
316	C	22.5	Very low	23.7	Very low	108 Å²	108	108.4 Å²	108.4	73%	0.73	60%	0.602	S	S	*	*			cis	-155.3	-159	10.5	-153.4	0	0	0	0	112.3
317	N	21.2	Very low	24.2	Very low	141 Å²	141	102.5 Å²	102.5	75%	0.754	57%	0.574	S	S	*	*			trans	-87.1	176.8	168.7	-60	-66	0	0	0	110.5
318	V	22.5	Very low	24.4	Very low	128 Å²	128	96.7 Å²	96.7	78%	0.776	55%	0.553	S	S	*	*			cis	-130.3	-140.6	8.2	-140.9	0	0	0	0	107.9
319	N	20.9	Very low	24.6	Very low	126 Å²	126	101.3 Å²	101.3	67%	0.674	56%	0.562	S	S	*	*			cis	-160.6	167.9	-11.8	-127	-1.6	0	0	0	106
320	M	21.8	Very low	25	Very low	138 Å²	138	98.6 Å²	98.6	68%	0.68	54%	0.54	S	S	*	.			cis	-161.3	130.8	-19.9	-153.6	169	179.3	0	0	107.3	F322	M320-F322 HydrophobicContact CE-CE2 4.07Å
321	D	24.4	Very low	25.3	Very low	141 Å²	141	101.2 Å²	101.2	75%	0.754	54%	0.544	S	S	*	.			trans	177.8	158.1	137.4	-132.9	-28.1	0	0	0	111.3
322	F	23.6	Very low	25.6	Very low	153 Å²	153	100.3 Å²	100.3	67%	0.671	54%	0.537	S	S	*	.			trans	-104.9	128.6	-159.4	-76	-94.6	0	0	0	117.4	M320	M320-F322 HydrophobicContact CE-CE2 4.07Å
323	S	26.2	Very low	26.1	Very low	55 Å²	55	99.9 Å²	99.9	39%	0.385	53%	0.532	S	S	.	.			trans	-164.8	75.7	151.2	-72.7	0	0	0	0	106.8
324	M	25	Very low	26.6	Very low	74 Å²	74	98.3 Å²	98.3	37%	0.365	52%	0.524	S	S	.	.			trans	-92.8	108.2	-167.6	-145.9	-173.1	84.3	0	0	111.4	K326 R346 Y348	M324-K326 HydrophobicContact CE-CB 3.83Å; M324-K326 HydrophobicContact CE-CG 4.17Å; M324-R346 HydrophobicContact CE-CG 4.25Å; M324-Y348 HydrophobicContact CG-CE1 4.18Å
325	V	29.3	Very low	27	Very low	13 Å²	13	98.8 Å²	98.8	8%	0.079	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.9	158.8	178.8	0	0	0	0	107.6	F327 R346 M347 L377 L381	V325-F327 HydrophobicContact CG1-CD1 4.31Å; V325-F327 HydrophobicContact CG1-CD2 4.26Å; V325-F327 HydrophobicContact CG1-CE1 3.86Å; V325-F327 HydrophobicContact CG1-CE2 3.78Å; V325-F327 HydrophobicContact CG1-CZ 3.6Å; V325-R346 WeakPolarHBondContact O-CA 3.43Å; V325-M347 HydrophobicContact CB-CB 4.34Å; V325-M347 HydrophobicContact CG2-CB 4.48Å; V325-M347 PolarHBondContact N-O 3.41Å; V325-L377 HydrophobicContact CG1-CD2 3.66Å; V325-L377 HydrophobicContact CG2-CD2 4.2Å; V325-L381 HydrophobicContact CG2-CD1 3.62Å
326	K	27.1	Very low	27.8	Very low	101 Å²	101	103.6 Å²	103.6	44%	0.439	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	114.3	169.9	-167.6	-159.1	172.9	-153.7	0	109.3	M324 C328 D344	M324-K326 HydrophobicContact CE-CB 3.83Å; M324-K326 HydrophobicContact CE-CG 4.17Å; K326-C328 VanDerWaalsContact CE-SG 3.56Å; K326-C328 PolarHBondContact NZ-SG 3.32Å; K326-D344 VanDerWaalsContact CE-CG 3.41Å; K326-D344 WeakPolarHBondContact CE-OD1 3.4Å; K326-D344 WeakPolarHBondContact CE-OD2 3.46Å; K326-D344 IonicContact NZ-OD1 2.58Å
327	F	32.1	Very low	28.9	Very low	18 Å²	18	102.3 Å²	102.3	8%	0.079	52%	0.517	C	S	.	.			trans	-81.8	138.2	167.6	-53	-69.9	0	0	0	109.6	V325 L345 M347 I375 L377	V325-F327 HydrophobicContact CG1-CD1 4.31Å; V325-F327 HydrophobicContact CG1-CD2 4.26Å; V325-F327 HydrophobicContact CG1-CE1 3.86Å; V325-F327 HydrophobicContact CG1-CE2 3.78Å; V325-F327 HydrophobicContact CG1-CZ 3.6Å; F327-L345 HydrophobicContact CD2-CB 3.75Å; F327-L345 HydrophobicContact CD2-CD2 4.23Å; F327-L345 HydrophobicContact CD2-CG 4.02Å; F327-L345 WeakPolarHBondContact CD2-O 3.25Å; F327-L345 HydrophobicContact CE2-CB 4.1Å; F327-L345 HydrophobicContact CE2-CD2 3.77Å; F327-L345 HydrophobicContact CE2-CG 3.83Å; F327-M347 HydrophobicContact CE2-CE 4.35Å; F327-M347 HydrophobicContact CZ-CE 4.22Å; F327-I375 HydrophobicContact CB-CG2 4.48Å; F327-I375 HydrophobicContact CD1-CB 4.45Å; F327-I375 HydrophobicContact CD1-CG2 3.22Å; F327-I375 HydrophobicContact CE1-CB 4.22Å; F327-I375 HydrophobicContact CE1-CG2 3.39Å; F327-I375 HydrophobicContact CG-CG2 3.92Å; F327-I375 HydrophobicContact CZ-CG2 4.23Å; F327-L377 HydrophobicContact CE1-CD2 3.67Å; F327-L377 HydrophobicContact CE1-CG 3.94Å; F327-L377 HydrophobicContact CZ-CD2 3.62Å; F327-L377 HydrophobicContact CZ-CG 4.19Å
328	C	27.2	Very low	30.1	Very low	66 Å²	66	101.1 Å²	101.1	45%	0.446	51%	0.505	S	S	.	.			trans	-126.3	120.2	-176.4	-73.3	0	0	0	0	110.3	K326 E330	K326-C328 VanDerWaalsContact CE-SG 3.56Å; K326-C328 PolarHBondContact NZ-SG 3.32Å; C328-E330 VanDerWaalsContact C-N 3.32Å; C328-E330 PolarHBondContact O-N 3.03Å; C328-E330 VanDerWaalsContact O-N 3.1Å
329	Q	28.3	Very low	31.3	Very low	174 Å²	174	96.9 Å²	96.9	81%	0.813	48%	0.477	S	S	*	.	S	Bend	trans	60.5	19.9	157	-59.6	-179.1	-55.2	0	0	118.5
330	E	31	Very low	32.7	Very low	74 Å²	74	93.7 Å²	93.7	35%	0.346	46%	0.46	S	S	.	.			trans	-83.9	123.4	172.1	-72.5	171.8	165	0	0	111.2	C328 V332 I375 Q376	C328-E330 VanDerWaalsContact C-N 3.32Å; C328-E330 PolarHBondContact O-N 3.03Å; C328-E330 VanDerWaalsContact O-N 3.1Å; E330-V332 PolarHBondContact O-N 3Å; E330-I375 WeakPolarHBondContact OE2-CG2 3.37Å; E330-Q376 PolarHBondContact OE1-NE2 3.35Å
331	I	28.5	Very low	33.8	Very low	97 Å²	97	90.9 Å²	90.9	50%	0.497	45%	0.45	S	S	.	.			trans	-78.7	111.1	169	-67.7	178.4	0	0	0	107.5	E333 K338	I331-E333 HydrophobicContact CG2-CB 4.49Å; I331-E333 HydrophobicContact CG2-CG 3.81Å; I331-E333 PolarHBondContact O-N 2.66Å; I331-E333 VanDerWaalsContact O-N 3.16Å; I331-K338 HydrophobicContact CG2-CG 4.44Å
332	V	37.6	Very low	34.6	Very low	9 Å²	9	90.2 Å²	90.2	6%	0.055	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	90.8	175.1	177.9	0	0	0	0	109.2	E330 K338 L339 L340 M369	E330-V332 PolarHBondContact O-N 3Å; V332-K338 WeakPolarHBondContact O-CA 2.95Å; V332-L339 HydrophobicContact CB-CB 4.36Å; V332-L339 HydrophobicContact CG1-CB 3.83Å; V332-L339 HydrophobicContact CG1-CD1 3.99Å; V332-L339 HydrophobicContact CG1-CG 4.15Å; V332-L339 PolarHBondContact O-N 3.09Å; V332-L340 HydrophobicContact CB-CB 4.31Å; V332-L340 HydrophobicContact CG2-CB 4.25Å; V332-L340 PolarHBondContact N-O 3.17Å; V332-M369 HydrophobicContact CB-CE 4.36Å; V332-M369 HydrophobicContact CG1-CE 3.71Å; V332-M369 HydrophobicContact CG1-SD 3.37Å; V332-M369 WeakPolarHBondContact CG1-SD 3.46Å; V332-M369 HydrophobicContact CG2-CE 3.95Å
333	E	32	Very low	35.4	Very low	111 Å²	111	85 Å²	85	52%	0.519	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.1	168.6	-85.9	177.5	-147.7	0	0	111	I331 K338	I331-E333 HydrophobicContact CG2-CB 4.49Å; I331-E333 HydrophobicContact CG2-CG 3.81Å; I331-E333 PolarHBondContact O-N 2.66Å; I331-E333 VanDerWaalsContact O-N 3.16Å; E333-K338 HydrophobicContact CG-CG 3.64Å; E333-K338 WeakPolarHBondContact OE1-CE 3.4Å; E333-K338 IonicContact OE1-NZ 2.62Å; E333-K338 PolarHBondContact OE1-NZ 3.29Å
334	L	32.4	Very low	36.2	Very low	75 Å²	75	85.9 Å²	85.9	39%	0.393	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	129.6	167.8	-111.9	161.8	0	0	0	107.7	K336 K337 T365 M369	L334-K336 PolarHBondContact O-N 3.45Å; L334-K337 PolarHBondContact N-O 3.19Å; L334-K337 PolarHBondContact O-N 2.95Å; L334-T365 HydrophobicContact CB-CG2 4.49Å; L334-T365 HydrophobicContact CD1-CG2 3.52Å; L334-M369 HydrophobicContact CD1-CG 4.27Å; L334-M369 HydrophobicContact CD1-SD 3.82Å
335	L	31.7	Very low	37.4	Very low	170 Å²	170	84.9 Å²	84.9	89%	0.89	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	41.2	-176.6	-56.5	174.1	0	0	0	113.4	K337	L335-K337 PolarHBondContact O-N 3.22Å; L335-K337 VanDerWaalsContact O-N 3.11Å
336	K	39.6	Very low	38.4	Very low	203 Å²	203	89.6 Å²	89.6	88%	0.883	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	0.4	-175.8	-52.2	176.8	-178	174.7	0	115.9	L334	L334-K336 PolarHBondContact O-N 3.45Å
337	K	44.1	Very low	39.5	Very low	82 Å²	82	87 Å²	87	36%	0.357	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	120.4	175	-166.4	175.2	-174	177.5	0	109.5	L334 L335 L339 G360	L334-K337 PolarHBondContact N-O 3.19Å; L334-K337 PolarHBondContact O-N 2.95Å; L335-K337 PolarHBondContact O-N 3.22Å; L335-K337 VanDerWaalsContact O-N 3.11Å; K337-L339 HydrophobicContact CD-CD2 4.21Å; K337-L339 HydrophobicContact CG-CD2 4.14Å; K337-L339 PolarHBondContact O-N 2.79Å; K337-G360 PolarHBondContact NZ-O 3.25Å
338	K	47.2	Very low	40.3	Very low	116 Å²	116	91.4 Å²	91.4	50%	0.504	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	113	171.2	-75.1	177.5	176.5	179.5	0	109.2	I331 V332 E333 V341	I331-K338 HydrophobicContact CG2-CG 4.44Å; V332-K338 WeakPolarHBondContact O-CA 2.95Å; E333-K338 HydrophobicContact CG-CG 3.64Å; E333-K338 WeakPolarHBondContact OE1-CE 3.4Å; E333-K338 IonicContact OE1-NZ 2.62Å; E333-K338 PolarHBondContact OE1-NZ 3.29Å; K338-V341 HydrophobicContact CB-CG2 3.89Å; K338-V341 HydrophobicContact CD-CG2 3.93Å; K338-V341 HydrophobicContact CG-CG2 4.27Å
339	L	48.3	Very low	41.3	Very low	38 Å²	38	96.5 Å²	96.5	20%	0.199	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-37.3	-179.6	-56.1	-178.4	0	0	0	112.2	V332 K337 T365	V332-L339 HydrophobicContact CB-CB 4.36Å; V332-L339 HydrophobicContact CG1-CB 3.83Å; V332-L339 HydrophobicContact CG1-CD1 3.99Å; V332-L339 HydrophobicContact CG1-CG 4.15Å; V332-L339 PolarHBondContact O-N 3.09Å; K337-L339 HydrophobicContact CD-CD2 4.21Å; K337-L339 HydrophobicContact CG-CD2 4.14Å; K337-L339 PolarHBondContact O-N 2.79Å; L339-T365 HydrophobicContact CD1-CG2 3.55Å
340	L	49.2	Very low	42.1	Very low	59 Å²	59	92.1 Å²	92.1	31%	0.309	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	138.3	174.3	-67.2	177.1	0	0	0	109	V332 A343 L366	V332-L340 HydrophobicContact CB-CB 4.31Å; V332-L340 HydrophobicContact CG2-CB 4.25Å; V332-L340 PolarHBondContact N-O 3.17Å; L340-A343 HydrophobicContact CB-CB 4.04Å; L340-A343 HydrophobicContact CD1-CB 4.4Å; L340-A343 HydrophobicContact CD2-CB 3.89Å; L340-A343 HydrophobicContact CG-CB 4.34Å; L340-L366 HydrophobicContact CD1-CD1 3.79Å; L340-L366 HydrophobicContact CD1-CD2 4.38Å
341	V	46	Very low	42.8	Very low	79 Å²	79	92.4 Å²	92.4	48%	0.479	47%	0.468	S	S	.	.	S	Bend	trans	-134.4	122.3	175.2	-176.5	0	0	0	0	107.2	K338 A343	K338-V341 HydrophobicContact CB-CG2 3.89Å; K338-V341 HydrophobicContact CD-CG2 3.93Å; K338-V341 HydrophobicContact CG-CG2 4.27Å; V341-A343 PolarHBondContact O-N 3.18Å
342	N	40.4	Very low	43.6	Very low	127 Å²	127	95.5 Å²	95.5	68%	0.679	47%	0.474	S	S	*	.	S	Bend	trans	52.1	35.6	179.5	-60	-23	0	0	0	114.5
343	A	40.9	Very low	44	Very low	44 Å²	44	99.9 Å²	99.9	36%	0.364	49%	0.49	S	S	.	.			trans	-96.7	113.4	-172.2	0	0	0	0	0	113.5	L340 V341 L345	L340-A343 HydrophobicContact CB-CB 4.04Å; L340-A343 HydrophobicContact CD1-CB 4.4Å; L340-A343 HydrophobicContact CD2-CB 3.89Å; L340-A343 HydrophobicContact CG-CB 4.34Å; V341-A343 PolarHBondContact O-N 3.18Å; A343-L345 PolarHBondContact O-N 2.88Å; A343-L345 VanDerWaalsContact O-N 3.16Å
344	D	43.1	Very low	44.5	Very low	73 Å²	73	96 Å²	96	39%	0.39	48%	0.479	S	S	.	.			trans	-82.9	78.4	178.1	-128.6	70.1	0	0	0	110.5	K326 R346	K326-D344 VanDerWaalsContact CE-CG 3.41Å; K326-D344 WeakPolarHBondContact CE-OD1 3.4Å; K326-D344 WeakPolarHBondContact CE-OD2 3.46Å; K326-D344 IonicContact NZ-OD1 2.58Å; D344-R346 PolarHBondContact O-N 2.81Å; D344-R346 IonicContact OD2-CZ 3.86Å; D344-R346 IonicContact OD2-NE 3.86Å; D344-R346 PolarHBondContact OD2-NE 3.06Å; D344-R346 IonicContact OD2-NH2 2.71Å; D344-R346 PolarHBondContact OD2-NH2 3.41Å
345	L	49.5	Very low	45.3	Very low	54 Å²	54	94.7 Å²	94.7	28%	0.283	47%	0.472	S	S	.	.			trans	-75	121.3	172.6	167.7	64.5	0	0	0	109.9	F327 A343 M347	F327-L345 HydrophobicContact CD2-CB 3.75Å; F327-L345 HydrophobicContact CD2-CD2 4.23Å; F327-L345 HydrophobicContact CD2-CG 4.02Å; F327-L345 WeakPolarHBondContact CD2-O 3.25Å; F327-L345 HydrophobicContact CE2-CB 4.1Å; F327-L345 HydrophobicContact CE2-CD2 3.77Å; F327-L345 HydrophobicContact CE2-CG 3.83Å; A343-L345 PolarHBondContact O-N 2.88Å; A343-L345 VanDerWaalsContact O-N 3.16Å; L345-M347 HydrophobicContact CD1-CG 4.41Å; L345-M347 HydrophobicContact CG-CG 4.49Å
346	R	50.5	Low	46	Very low	111 Å²	111	88.5 Å²	88.5	42%	0.419	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	116.3	-177.8	-62.9	-177.2	-175.5	-168.3	8.9	112.2	M324 V325 D344 Y353	M324-R346 HydrophobicContact CE-CG 4.25Å; V325-R346 WeakPolarHBondContact O-CA 3.43Å; D344-R346 PolarHBondContact O-N 2.81Å; D344-R346 IonicContact OD2-CZ 3.86Å; D344-R346 IonicContact OD2-NE 3.86Å; D344-R346 PolarHBondContact OD2-NE 3.06Å; D344-R346 IonicContact OD2-NH2 2.71Å; D344-R346 PolarHBondContact OD2-NH2 3.41Å; R346-Y353 PolarHBondContact O-OH 2.74Å
347	M	49.4	Very low	46.2	Very low	48 Å²	48	80.4 Å²	80.4	24%	0.236	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	141.4	178.9	-63.8	-165.8	-68.5	0	0	111.8	V325 F327 L345 Y353 L377	V325-M347 HydrophobicContact CB-CB 4.34Å; V325-M347 HydrophobicContact CG2-CB 4.48Å; V325-M347 PolarHBondContact N-O 3.41Å; F327-M347 HydrophobicContact CE2-CE 4.35Å; F327-M347 HydrophobicContact CZ-CE 4.22Å; L345-M347 HydrophobicContact CD1-CG 4.41Å; L345-M347 HydrophobicContact CG-CG 4.49Å; M347-Y353 VanDerWaalsContact CA-OH 3.32Å; M347-Y353 WeakPolarHBondContact CA-OH 3.33Å; M347-Y353 HydrophobicContact CB-CE2 3.93Å; M347-Y353 HydrophobicContact CG-CD2 4.34Å; M347-Y353 HydrophobicContact CG-CE2 3.99Å; M347-Y353 HydrophobicContact SD-CD2 4.47Å; M347-L377 HydrophobicContact CE-CD2 4.37Å
348	Y	50	Low	46.2	Very low	109 Å²	109	85 Å²	85	43%	0.427	43%	0.43	S	S	.	.			trans	-117.9	135	176.9	-61	-70.2	0	0	0	110.7	M324 K351 Y353	M324-Y348 HydrophobicContact CG-CE1 4.18Å; Y348-K351 PolarHBondContact O-N 3.21Å; Y348-Y353 VanDerWaalsContact CD2-OH 3.32Å; Y348-Y353 WeakPolarHBondContact CD2-OH 3.27Å; Y348-Y353 PolarHBondContact N-OH 2.85Å
349	K	47	Very low	46.3	Very low	174 Å²	174	82.3 Å²	82.3	76%	0.757	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	141.4	177.9	-173.4	174.7	-179.4	178.1	0	111.9	K351	K349-K351 VanDerWaalsContact C-N 3.26Å; K349-K351 PolarHBondContact O-N 2.97Å
350	G	46.6	Very low	46.4	Very low	82 Å²	82	82.5 Å²	82.5	85%	0.845	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	-2.7	176.7	0	0	0	0	0	116.2
351	K	44.7	Very low	46.7	Very low	79 Å²	79	83.1 Å²	83.1	34%	0.343	44%	0.439	S	S	.	.			trans	-111.1	111.8	-177.7	-47.2	-70.7	176.8	177.7	0	110.3	E11 K15 Y348 K349 Y353	E11-K351 IonicContact OE1-NZ 2.67Å; E11-K351 PolarHBondContact OE1-NZ 3.41Å; E11-K351 WeakPolarHBondContact OE2-CD 3.31Å; E11-K351 IonicContact OE2-NZ 2.68Å; E11-K351 PolarHBondContact OE2-NZ 3.31Å; K15-K351 VanDerWaalsContact NZ-C 3.3Å; K15-K351 PolarHBondContact NZ-O 3.37Å; Y348-K351 PolarHBondContact O-N 3.21Å; K349-K351 VanDerWaalsContact C-N 3.26Å; K349-K351 PolarHBondContact O-N 2.97Å; K351-Y353 WeakPolarHBondContact O-CD2 3.41Å; K351-Y353 VanDerWaalsContact O-CE2 3.26Å; K351-Y353 WeakPolarHBondContact O-CE2 3.24Å
352	R	46	Very low	47.1	Very low	163 Å²	163	79.9 Å²	79.9	62%	0.615	42%	0.422	S	S	*	.			trans	-57.1	148.2	174.8	-58.5	-179.4	179.9	156.8	-9.1	111.9	Q12 K15	Q12-R352 HydrophobicContact CG-CB 4.34Å; K15-R352 WeakPolarHBondContact CD-O 3.49Å; K15-R352 WeakPolarHBondContact CE-O 3.43Å; K15-R352 PolarHBondContact NZ-O 3.04Å
353	Y	44.6	Very low	47.9	Very low	101 Å²	101	75.3 Å²	75.3	40%	0.396	40%	0.396	S	S	.	.			trans	-126.7	149.5	178.7	-75.2	-90.2	0	0	0	110.8	K15 R346 M347 Y348 K351	K15-Y353 HydrophobicContact CD-CD1 4.05Å; K15-Y353 HydrophobicContact CD-CE1 4.2Å; K15-Y353 HydrophobicContact CD-CG 4.42Å; K15-Y353 VanDerWaalsContact NZ-CD1 3.35Å; K15-Y353 VanDerWaalsContact NZ-CG 3.32Å; R346-Y353 PolarHBondContact O-OH 2.74Å; M347-Y353 VanDerWaalsContact CA-OH 3.32Å; M347-Y353 WeakPolarHBondContact CA-OH 3.33Å; M347-Y353 HydrophobicContact CB-CE2 3.93Å; M347-Y353 HydrophobicContact CG-CD2 4.34Å; M347-Y353 HydrophobicContact CG-CE2 3.99Å; M347-Y353 HydrophobicContact SD-CD2 4.47Å; Y348-Y353 VanDerWaalsContact CD2-OH 3.32Å; Y348-Y353 WeakPolarHBondContact CD2-OH 3.27Å; Y348-Y353 PolarHBondContact N-OH 2.85Å; K351-Y353 WeakPolarHBondContact O-CD2 3.41Å; K351-Y353 VanDerWaalsContact O-CE2 3.26Å; K351-Y353 WeakPolarHBondContact O-CE2 3.24Å
354	G	44.3	Very low	48.7	Very low	28 Å²	28	74.6 Å²	74.6	29%	0.289	39%	0.387	S	S	.	.			trans	-125.8	141.1	175.2	0	0	0	0	0	112.1	V356	G354-V356 PolarHBondContact O-N 3.03Å
355	L	49.1	Very low	49.6	Very low	48 Å²	48	72.9 Å²	72.9	25%	0.251	38%	0.38	S	S	.	.			trans	-98.8	71.6	179.7	-70.7	-177.3	0	0	0	111.9	K363 L366 L367	L355-K363 WeakPolarHBondContact O-CD 3.34Å; L355-L366 HydrophobicContact CD1-CD2 4.24Å; L355-L366 HydrophobicContact CD2-CD2 4.08Å; L355-L367 HydrophobicContact CD1-CD1 4.21Å; L355-L367 HydrophobicContact CD1-CD2 3.63Å; L355-L367 HydrophobicContact CD1-CG 3.66Å
356	V	45.8	Very low	50.3	Low	40 Å²	40	71.5 Å²	71.5	24%	0.242	37%	0.372	C	S	.	.			trans	-69	144.3	172.4	-165	0	0	0	0	111.5	K19 G354	K19-V356 HydrophobicContact CB-CB 4.07Å; K19-V356 HydrophobicContact CD-CB 3.91Å; K19-V356 HydrophobicContact CD-CG2 4.26Å; K19-V356 PolarHBondContact NZ-O 2.67Å; G354-V356 PolarHBondContact O-N 3.03Å
357	G	44	Very low	51	Low	33 Å²	33	69.8 Å²	69.8	34%	0.34	37%	0.371	S	S	.	.			trans	159.9	160.8	177.6	0	0	0	0	0	110.1	K363	G357-K363 PolarHBondContact O-NZ 2.74Å
358	R	42.9	Very low	52	Low	178 Å²	178	74.2 Å²	74.2	67%	0.672	39%	0.385	S	S	*	.			trans	-57	167	178.4	-84.6	-170.4	-179.2	150.9	4.7	112.9	E194 V361 K363	E194-R358 IonicContact OE1-CZ 3.07Å; E194-R358 VanDerWaalsContact OE1-CZ 3.31Å; E194-R358 IonicContact OE1-NE 2.69Å; E194-R358 IonicContact OE1-NH2 3.55Å; E194-R358 PolarHBondContact OE1-NH2 3.23Å; R358-V361 HydrophobicContact CB-CG1 3.88Å; R358-V361 WeakPolarHBondContact O-CG1 3.49Å; R358-V361 VanDerWaalsContact O-CG2 3.23Å; R358-V361 WeakPolarHBondContact O-CG2 3.39Å; R358-K363 VanDerWaalsContact C-NZ 3.3Å; R358-K363 PolarHBondContact O-NZ 2.95Å
359	N	50.7	Low	52.6	Low	60 Å²	60	70 Å²	70	32%	0.321	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	151.6	165.8	-87.3	-44.8	0	0	0	111.6	D147 V361	D147-N359 VanDerWaalsContact CB-OD1 3.29Å; D147-N359 WeakPolarHBondContact CB-OD1 3.48Å; D147-N359 VanDerWaalsContact CG-ND2 3.33Å; D147-N359 PolarHBondContact O-OD1 3.29Å; D147-N359 VanDerWaalsContact O-OD1 3.13Å; D147-N359 PolarHBondContact OD1-ND2 3.19Å; D147-N359 PolarHBondContact OD2-N 3Å; D147-N359 PolarHBondContact OD2-OD1 3.29Å; N359-V361 PolarHBondContact O-N 3Å
360	G	49.4	Very low	53.5	Low	42 Å²	42	63 Å²	63	43%	0.433	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	1.4	177.8	0	0	0	0	0	117.5	K337 G362	K337-G360 PolarHBondContact NZ-O 3.25Å; G360-G362 PolarHBondContact O-N 3.29Å
361	V	55.4	Low	54.5	Low	72 Å²	72	61.2 Å²	61.2	44%	0.436	32%	0.315	S	S	.	.	S	Bend	trans	-77.8	0.9	178.6	-51.9	0	0	0	0	114.5	R358 N359 K363	R358-V361 HydrophobicContact CB-CG1 3.88Å; R358-V361 WeakPolarHBondContact O-CG1 3.49Å; R358-V361 VanDerWaalsContact O-CG2 3.23Å; R358-V361 WeakPolarHBondContact O-CG2 3.39Å; N359-V361 PolarHBondContact O-N 3Å; V361-K363 HydrophobicContact CG2-CG 3.82Å
362	G	54.5	Low	55.7	Low	12 Å²	12	60.6 Å²	60.6	12%	0.124	32%	0.321	C	S	.	.	S	Bend	trans	88.4	22.2	178.3	0	0	0	0	0	115.8	G360 T365 L366	G360-G362 PolarHBondContact O-N 3.29Å; G362-T365 PolarHBondContact O-N 3.32Å; G362-L366 PolarHBondContact O-N 3.44Å
363	K	56.7	Low	56.7	Low	30 Å²	30	55.2 Å²	55.2	13%	0.13	32%	0.315	C	S	.	.	H	α-helix	trans	-51.3	-58	175.5	-63.4	-173.2	-71.6	-88.3	0	112	D147 L355 G357 R358 V361 T365 L366 L367	D147-K363 IonicContact OD2-NZ 3.16Å; D147-K363 PolarHBondContact OD2-NZ 3.36Å; L355-K363 WeakPolarHBondContact O-CD 3.34Å; G357-K363 PolarHBondContact O-NZ 2.74Å; R358-K363 VanDerWaalsContact C-NZ 3.3Å; R358-K363 PolarHBondContact O-NZ 2.95Å; V361-K363 HydrophobicContact CG2-CG 3.82Å; K363-T365 VanDerWaalsContact C-N 3.31Å; K363-T365 PolarHBondContact O-N 3.19Å; K363-L366 PolarHBondContact O-N 3.3Å; K363-L367 PolarHBondContact O-N 3.2Å
364	T	59	Low	57.6	Low	29 Å²	29	55.1 Å²	55.1	18%	0.178	32%	0.322	C	S	.	.	H	α-helix	trans	-61.9	-39.5	177.2	-46.8	0	0	0	0	111.5	L366 L367 R368 Q388	T364-L366 VanDerWaalsContact C-N 3.3Å; T364-L366 PolarHBondContact O-N 3.06Å; T364-L367 WeakPolarHBondContact O-CB 3.47Å; T364-L367 PolarHBondContact O-N 2.82Å; T364-L367 VanDerWaalsContact O-N 3.09Å; T364-R368 HydrophobicContact CG2-CG 4.31Å; T364-R368 WeakPolarHBondContact O-CG 3.15Å; T364-R368 PolarHBondContact O-N 3.49Å; T364-Q388 HydrophobicContact CG2-CG 4.2Å; T364-Q388 PolarHBondContact OG1-OE1 3.06Å
365	T	61.4	Low	58.4	Low	38 Å²	38	54.3 Å²	54.3	23%	0.233	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-37.8	179.5	-36.1	0	0	0	0	111.9	L334 L339 G362 K363 M369	L334-T365 HydrophobicContact CB-CG2 4.49Å; L334-T365 HydrophobicContact CD1-CG2 3.52Å; L339-T365 HydrophobicContact CD1-CG2 3.55Å; G362-T365 PolarHBondContact O-N 3.32Å; K363-T365 VanDerWaalsContact C-N 3.31Å; K363-T365 PolarHBondContact O-N 3.19Å; T365-M369 WeakPolarHBondContact O-CB 3.38Å; T365-M369 WeakPolarHBondContact O-CG 3.26Å; T365-M369 PolarHBondContact O-N 3.36Å
366	L	63.8	Low	58.9	Low	25 Å²	25	59.3 Å²	59.3	13%	0.131	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-41	171.9	179.6	60.5	0	0	0	112	L340 L355 G362 K363 T364 M369 I370 I375	L340-L366 HydrophobicContact CD1-CD1 3.79Å; L340-L366 HydrophobicContact CD1-CD2 4.38Å; L355-L366 HydrophobicContact CD1-CD2 4.24Å; L355-L366 HydrophobicContact CD2-CD2 4.08Å; G362-L366 PolarHBondContact O-N 3.44Å; K363-L366 PolarHBondContact O-N 3.3Å; T364-L366 VanDerWaalsContact C-N 3.3Å; T364-L366 PolarHBondContact O-N 3.06Å; L366-M369 PolarHBondContact O-N 3.24Å; L366-I370 HydrophobicContact CD1-CD1 4.38Å; L366-I370 HydrophobicContact CG-CD1 4.24Å; L366-I370 VanDerWaalsContact O-CG1 3.32Å; L366-I370 WeakPolarHBondContact O-CG1 3.24Å; L366-I370 PolarHBondContact O-N 3.37Å; L366-I375 HydrophobicContact CD1-CD1 3.9Å
367	L	66.6	Low	59.7	Low	75 Å²	75	59.5 Å²	59.5	39%	0.393	33%	0.332	S	S	.	.	H	α-helix	trans	-63.5	-46	174.9	-66.4	174.7	0	0	0	112	L355 K363 T364 M369 I370 S371	L355-L367 HydrophobicContact CD1-CD1 4.21Å; L355-L367 HydrophobicContact CD1-CD2 3.63Å; L355-L367 HydrophobicContact CD1-CG 3.66Å; K363-L367 PolarHBondContact O-N 3.2Å; T364-L367 WeakPolarHBondContact O-CB 3.47Å; T364-L367 PolarHBondContact O-N 2.82Å; T364-L367 VanDerWaalsContact O-N 3.09Å; L367-M369 VanDerWaalsContact C-N 3.3Å; L367-M369 PolarHBondContact O-N 2.94Å; L367-I370 WeakPolarHBondContact O-CB 3.39Å; L367-I370 PolarHBondContact O-N 3.48Å; L367-S371 PolarHBondContact O-N 2.93Å; L367-S371 PolarHBondContact O-OG 2.83Å
368	R	68.7	Low	60.6	Low	141 Å²	141	60.5 Å²	60.5	53%	0.532	33%	0.333	S	S	.	.	H	α-helix	trans	-59.4	-37.7	175.3	-70	178.9	-167.5	166.2	4.5	112.4	T364 S371 S372	T364-R368 HydrophobicContact CG2-CG 4.31Å; T364-R368 WeakPolarHBondContact O-CG 3.15Å; T364-R368 PolarHBondContact O-N 3.49Å; R368-S371 WeakPolarHBondContact CA-OG 3.32Å; R368-S371 PolarHBondContact O-N 3Å; R368-S371 PolarHBondContact O-OG 2.91Å; R368-S372 VanDerWaalsContact O-CB 3.27Å; R368-S372 WeakPolarHBondContact O-CB 3.45Å; R368-S372 PolarHBondContact O-N 3.06Å; R368-S372 PolarHBondContact O-OG 2.74Å
369	M	64	Low	61.3	Low	21 Å²	21	58.3 Å²	58.3	10%	0.103	35%	0.345	C	S	.	.	H	α-helix	trans	-75.2	-30.9	177.6	-75.5	-174.9	64.2	0	0	113.6	V332 L334 T365 L366 L367 S372 N374 I375	V332-M369 HydrophobicContact CB-CE 4.36Å; V332-M369 HydrophobicContact CG1-CE 3.71Å; V332-M369 HydrophobicContact CG1-SD 3.37Å; V332-M369 WeakPolarHBondContact CG1-SD 3.46Å; V332-M369 HydrophobicContact CG2-CE 3.95Å; L334-M369 HydrophobicContact CD1-CG 4.27Å; L334-M369 HydrophobicContact CD1-SD 3.82Å; T365-M369 WeakPolarHBondContact O-CB 3.38Å; T365-M369 WeakPolarHBondContact O-CG 3.26Å; T365-M369 PolarHBondContact O-N 3.36Å; L366-M369 PolarHBondContact O-N 3.24Å; L367-M369 VanDerWaalsContact C-N 3.3Å; L367-M369 PolarHBondContact O-N 2.94Å; M369-S372 PolarHBondContact O-OG 3.19Å; M369-N374 HydrophobicContact CB-CB 4.29Å; M369-N374 HydrophobicContact CE-CB 4.01Å; M369-N374 HydrophobicContact CG-CB 4.38Å; M369-N374 PolarHBondContact O-N 3.46Å; M369-I375 HydrophobicContact CB-CD1 3.96Å; M369-I375 HydrophobicContact CB-CG1 3.99Å; M369-I375 HydrophobicContact CE-CG1 4.28Å; M369-I375 PolarHBondContact O-N 2.91Å
370	I	65.4	Low	62.1	Low	25 Å²	25	62.2 Å²	62.2	13%	0.128	36%	0.361	C	S	.	.	H	α-helix	trans	-64.3	-45.4	167.8	-71.7	167	0	0	0	109.5	L366 L367 I375 L377 I383	L366-I370 HydrophobicContact CD1-CD1 4.38Å; L366-I370 HydrophobicContact CG-CD1 4.24Å; L366-I370 VanDerWaalsContact O-CG1 3.32Å; L366-I370 WeakPolarHBondContact O-CG1 3.24Å; L366-I370 PolarHBondContact O-N 3.37Å; L367-I370 WeakPolarHBondContact O-CB 3.39Å; L367-I370 PolarHBondContact O-N 3.48Å; I370-I375 HydrophobicContact CG1-CD1 4.03Å; I370-L377 HydrophobicContact CG2-CD1 4.04Å; I370-I383 HydrophobicContact CG2-CD1 4.44Å; I370-I383 HydrophobicContact CG2-CG2 4.3Å; I370-I383 VanDerWaalsContact O-CD1 3.28Å; I370-I383 WeakPolarHBondContact O-CD1 3.44Å
371	S	67.9	Low	62.7	Low	45 Å²	45	63.5 Å²	63.5	32%	0.315	36%	0.357	S	S	.	.	H	α-helix	trans	-73.5	-33	-176.8	70.7	0	0	0	0	114.4	L367 R368 G373 H385	L367-S371 PolarHBondContact O-N 2.93Å; L367-S371 PolarHBondContact O-OG 2.83Å; R368-S371 WeakPolarHBondContact CA-OG 3.32Å; R368-S371 PolarHBondContact O-N 3Å; R368-S371 PolarHBondContact O-OG 2.91Å; S371-G373 PolarHBondContact O-N 3.07Å; S371-H385 VanDerWaalsContact CB-CG 3.45Å
372	S	69.6	Low	62.9	Low	67 Å²	67	66.2 Å²	66.2	47%	0.469	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-4.9	178.7	73.7	0	0	0	0	113.9	R368 M369 N374	R368-S372 VanDerWaalsContact O-CB 3.27Å; R368-S372 WeakPolarHBondContact O-CB 3.45Å; R368-S372 PolarHBondContact O-N 3.06Å; R368-S372 PolarHBondContact O-OG 2.74Å; M369-S372 PolarHBondContact O-OG 3.19Å; S372-N374 PolarHBondContact O-N 2.9Å; S372-N374 WeakPolarHBondContact OG-CB 3.35Å; S372-N374 PolarHBondContact OG-N 3.45Å; S372-N374 PolarHBondContact OG-OD1 2.93Å
373	G	67.7	Low	63.4	Low	49 Å²	49	69.4 Å²	69.4	51%	0.505	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	8.9	-173.5	0	0	0	0	0	114.3	S371 I375	S371-G373 PolarHBondContact O-N 3.07Å; G373-I375 PolarHBondContact O-N 3.31Å
374	N	62	Low	63.8	Low	99 Å²	99	73.6 Å²	73.6	53%	0.529	42%	0.416	S	S	.	.			trans	-63.6	-19.4	176.4	-75.2	30.1	0	0	0	112.7	M369 S372	M369-N374 HydrophobicContact CB-CB 4.29Å; M369-N374 HydrophobicContact CE-CB 4.01Å; M369-N374 HydrophobicContact CG-CB 4.38Å; M369-N374 PolarHBondContact O-N 3.46Å; S372-N374 PolarHBondContact O-N 2.9Å; S372-N374 WeakPolarHBondContact OG-CB 3.35Å; S372-N374 PolarHBondContact OG-N 3.45Å; S372-N374 PolarHBondContact OG-OD1 2.93Å
375	I	61.8	Low	64.1	Low	12 Å²	12	74.7 Å²	74.7	6%	0.062	42%	0.419	C	S	.	.	S	Bend	trans	-113.3	120.7	174.4	-41.4	-178.1	0	0	0	108	F327 E330 L366 M369 I370 G373 L377	F327-I375 HydrophobicContact CB-CG2 4.48Å; F327-I375 HydrophobicContact CD1-CB 4.45Å; F327-I375 HydrophobicContact CD1-CG2 3.22Å; F327-I375 HydrophobicContact CE1-CB 4.22Å; F327-I375 HydrophobicContact CE1-CG2 3.39Å; F327-I375 HydrophobicContact CG-CG2 3.92Å; F327-I375 HydrophobicContact CZ-CG2 4.23Å; E330-I375 WeakPolarHBondContact OE2-CG2 3.37Å; L366-I375 HydrophobicContact CD1-CD1 3.9Å; M369-I375 HydrophobicContact CB-CD1 3.96Å; M369-I375 HydrophobicContact CB-CG1 3.99Å; M369-I375 HydrophobicContact CE-CG1 4.28Å; M369-I375 PolarHBondContact O-N 2.91Å; I370-I375 HydrophobicContact CG1-CD1 4.03Å; G373-I375 PolarHBondContact O-N 3.31Å; I375-L377 PolarHBondContact O-N 3.31Å
376	Q	59	Low	64.1	Low	153 Å²	153	78 Å²	78	72%	0.715	44%	0.439	S	S	*	.			trans	-65.3	119.8	-170.3	-62.7	179	48.5	0	0	112.1	E330	E330-Q376 PolarHBondContact OE1-NE2 3.35Å
377	L	62.6	Low	63.9	Low	44 Å²	44	83.1 Å²	83.1	23%	0.23	46%	0.462	C	S	.	.			trans	-118	143.6	-179.9	-84.3	170.4	0	0	0	111.9	V325 F327 M347 I370 I375 S379 L381 I383	V325-L377 HydrophobicContact CG1-CD2 3.66Å; V325-L377 HydrophobicContact CG2-CD2 4.2Å; F327-L377 HydrophobicContact CE1-CD2 3.67Å; F327-L377 HydrophobicContact CE1-CG 3.94Å; F327-L377 HydrophobicContact CZ-CD2 3.62Å; F327-L377 HydrophobicContact CZ-CG 4.19Å; M347-L377 HydrophobicContact CE-CD2 4.37Å; I370-L377 HydrophobicContact CG2-CD1 4.04Å; I375-L377 PolarHBondContact O-N 3.31Å; L377-S379 PolarHBondContact O-N 2.92Å; L377-L381 HydrophobicContact CD2-CD1 3.95Å; L377-I383 HydrophobicContact CD1-CD1 3.45Å; L377-I383 VanDerWaalsContact CD1-CD1 3.45Å; L377-I383 HydrophobicContact CD1-CG1 4.22Å
378	P	63.2	Low	63.1	Low	53 Å²	53	83.2 Å²	83.2	34%	0.344	46%	0.461	S	S	.	.			trans	-54.2	130	172.5	-28.3	34.7	0	0	0	112.9	H380 L381	P378-H380 VanDerWaalsContact CB-CE1 3.4Å; P378-H380 WeakPolarHBondContact CB-CE1 3.38Å; P378-H380 PolarHBondContact O-N 2.82Å; P378-L381 HydrophobicContact CB-CD1 4.32Å; P378-L381 HydrophobicContact CG-CD1 4.32Å; P378-L381 WeakPolarHBondContact O-CB 3.17Å; P378-L381 PolarHBondContact O-N 3.01Å
379	S	58.9	Low	62	Low	133 Å²	133	84.3 Å²	84.3	93%	0.93	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-6.6	-172.2	54.9	0	0	0	0	116.5	L377	L377-S379 PolarHBondContact O-N 2.92Å
380	H	66.5	Low	61.5	Low	141 Å²	141	88.5 Å²	88.5	65%	0.653	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	1.7	174	65.3	-102.3	0	0	0	113.6	P378	P378-H380 VanDerWaalsContact CB-CE1 3.4Å; P378-H380 WeakPolarHBondContact CB-CE1 3.38Å; P378-H380 PolarHBondContact O-N 2.82Å
381	L	62.3	Low	60.9	Low	70 Å²	70	96.3 Å²	96.3	37%	0.366	53%	0.534	S	S	.	.			trans	-100.4	106.8	178.8	-62.6	175.2	0	0	0	110.6	V325 L377 P378	V325-L381 HydrophobicContact CG2-CD1 3.62Å; L377-L381 HydrophobicContact CD2-CD1 3.95Å; P378-L381 HydrophobicContact CB-CD1 4.32Å; P378-L381 HydrophobicContact CG-CD1 4.32Å; P378-L381 WeakPolarHBondContact O-CB 3.17Å; P378-L381 PolarHBondContact O-N 3.01Å
382	S	60.5	Low	60.3	Low	129 Å²	129	97.3 Å²	97.3	90%	0.902	55%	0.552	S	S	*	*			trans	-67.8	129.6	165.9	-52.8	0	0	0	0	109.9
383	I	64	Low	60.2	Low	79 Å²	79	98.9 Å²	98.9	41%	0.405	56%	0.555	S	S	.	*			trans	-107.9	120.7	174.5	-46.3	175.9	0	0	0	107.6	I370 L377	I370-I383 HydrophobicContact CG2-CD1 4.44Å; I370-I383 HydrophobicContact CG2-CG2 4.3Å; I370-I383 VanDerWaalsContact O-CD1 3.28Å; I370-I383 WeakPolarHBondContact O-CD1 3.44Å; L377-I383 HydrophobicContact CD1-CD1 3.45Å; L377-I383 VanDerWaalsContact CD1-CD1 3.45Å; L377-I383 HydrophobicContact CD1-CG1 4.22Å
384	L	65.6	Low	60.6	Low	117 Å²	117	103.8 Å²	103.8	61%	0.613	57%	0.57	S	S	*	*			trans	-110.4	118.1	165.7	-179.3	63.6	0	0	0	107.3	A404	L384-A404 HydrophobicContact CD1-CB 4.01Å
385	H	64	Low	61.1	Low	52 Å²	52	101.1 Å²	101.1	24%	0.241	56%	0.557	C	S	.	*			trans	-114.6	117.4	176.6	-179.9	-100.1	0	0	0	108	S371	S371-H385 VanDerWaalsContact CB-CG 3.45Å
386	V	62.7	Low	61.4	Low	108 Å²	108	106 Å²	106	66%	0.655	58%	0.582	S	S	*	*			trans	-89.5	128	171.8	-174	0	0	0	0	106.5	V390	V386-V390 HydrophobicContact CG1-CG2 4.32Å
387	E	59.4	Low	61.5	Low	133 Å²	133	105.8 Å²	105.8	62%	0.621	59%	0.585	S	S	*	*			trans	-70.2	154.7	176.5	-53.4	-149.6	121.6	0	0	110	E389	E387-E389 PolarHBondContact O-N 2.76Å
388	Q	49.7	Very low	61.7	Low	76 Å²	76	109 Å²	109	36%	0.355	60%	0.601	S	S	.	*	S	Bend	trans	-72.6	-19.2	-174.2	-62.6	-162.6	-92.5	0	0	112.9	N146 T364	N146-Q388 PolarHBondContact ND2-NE2 3.35Å; N146-Q388 PolarHBondContact OD1-NE2 2.89Å; T364-Q388 HydrophobicContact CG2-CG 4.2Å; T364-Q388 PolarHBondContact OG1-OE1 3.06Å
389	E	46.5	Very low	62.1	Low	165 Å²	165	109.7 Å²	109.7	77%	0.771	60%	0.602	S	S	*	*			trans	-123.3	124.6	173.7	-71.1	153.5	-142.7	0	0	106.5	E387	E387-E389 PolarHBondContact O-N 2.76Å
390	V	52.8	Low	62.4	Low	108 Å²	108	106.1 Å²	106.1	66%	0.655	58%	0.577	S	S	*	*			trans	-136	127.3	171.2	-179	0	0	0	0	105.7	V386 G392	V386-V390 HydrophobicContact CG1-CG2 4.32Å; V390-G392 PolarHBondContact O-N 2.68Å
391	E	52.7	Low	62.4	Low	190 Å²	190	103.6 Å²	103.6	89%	0.888	57%	0.571	S	S	*	*			trans	-64.1	117.1	174	-66.2	-173.4	158.5	0	0	108.8	D393	E391-D393 PolarHBondContact O-N 2.95Å
392	G	54.7	Low	62.9	Low	66 Å²	66	103.1 Å²	103.1	68%	0.68	57%	0.568	S	S	*	*			trans	-77.2	117.3	-178.4	0	0	0	0	0	111.3	V390	V390-G392 PolarHBondContact O-N 2.68Å
393	D	67.8	Low	63.4	Low	100 Å²	100	101.1 Å²	101.1	54%	0.535	55%	0.545	S	S	.	.			trans	-100.7	-177	171.6	71.4	-22.5	0	0	0	111.3	E391 T395	E391-D393 PolarHBondContact O-N 2.95Å; D393-T395 PolarHBondContact O-N 3.45Å; D393-T395 VanDerWaalsContact OD1-CB 3.24Å; D393-T395 WeakPolarHBondContact OD1-CB 3.46Å; D393-T395 PolarHBondContact OD1-N 3.02Å; D393-T395 VanDerWaalsContact OD2-CB 3.26Å; D393-T395 WeakPolarHBondContact OD2-CB 2.79Å; D393-T395 PolarHBondContact OD2-OG1 3.16Å
394	D	75.1	Confident	63.5	Low	152 Å²	152	99.6 Å²	99.6	81%	0.813	54%	0.544	S	S	*	.	S	Bend	trans	-77.5	6.6	175.9	-68.1	-42.3	0	0	0	113.1	L396	D394-L396 PolarHBondContact O-N 3.43Å
395	T	73.2	Confident	63.9	Low	42 Å²	42	97.8 Å²	97.8	26%	0.258	54%	0.535	S	S	.	.			trans	-70	127.8	179	-65.6	0	0	0	0	110.3	D393 I397 D399	D393-T395 PolarHBondContact O-N 3.45Å; D393-T395 VanDerWaalsContact OD1-CB 3.24Å; D393-T395 WeakPolarHBondContact OD1-CB 3.46Å; D393-T395 PolarHBondContact OD1-N 3.02Å; D393-T395 VanDerWaalsContact OD2-CB 3.26Å; D393-T395 WeakPolarHBondContact OD2-CB 2.79Å; D393-T395 PolarHBondContact OD2-OG1 3.16Å; T395-I397 PolarHBondContact O-N 3.06Å; T395-D399 HydrophobicContact CG2-CB 3.81Å
396	L	68.5	Low	64.5	Low	115 Å²	115	99.9 Å²	99.9	60%	0.602	55%	0.552	S	S	*	*			trans	-59.4	139.8	177.2	-59.1	177.8	0	0	0	110.3	D394 I398 D399 S400	D394-L396 PolarHBondContact O-N 3.43Å; L396-I398 HydrophobicContact CB-CG2 4.09Å; L396-I398 PolarHBondContact O-N 3.42Å; L396-D399 HydrophobicContact CB-CB 4.45Å; L396-D399 WeakPolarHBondContact O-CA 3.18Å; L396-D399 PolarHBondContact O-N 3.17Å; L396-S400 PolarHBondContact O-N 3Å
397	I	60.7	Low	65.2	Low	148 Å²	148	104 Å²	104	76%	0.759	56%	0.556	S	S	*	*	H	α-helix	trans	-50.3	-35.8	-179.9	-60.5	171.6	0	0	0	112.1	T395 V401	T395-I397 PolarHBondContact O-N 3.06Å; I397-V401 VanDerWaalsContact O-CG2 3.3Å; I397-V401 WeakPolarHBondContact O-CG2 3.46Å; I397-V401 PolarHBondContact O-N 3.28Å; I397-V401 VanDerWaalsContact O-N 3.1Å
398	I	67.4	Low	66.1	Low	111 Å²	111	102 Å²	102	57%	0.569	54%	0.542	S	S	*	.	H	α-helix	trans	-67.5	-41.8	176	-169.1	166.4	0	0	0	112.3	L396 V401 L402	L396-I398 HydrophobicContact CB-CG2 4.09Å; L396-I398 PolarHBondContact O-N 3.42Å; I398-V401 PolarHBondContact O-N 3.41Å; I398-L402 HydrophobicContact CG1-CD1 4.04Å; I398-L402 HydrophobicContact CG1-CG 4.46Å; I398-L402 VanDerWaalsContact O-CB 3.31Å; I398-L402 WeakPolarHBondContact O-CB 3.47Å; I398-L402 WeakPolarHBondContact O-CG 3.25Å; I398-L402 PolarHBondContact O-N 3.45Å
399	D	71.3	Confident	67.5	Low	68 Å²	68	101.6 Å²	101.6	36%	0.364	54%	0.541	S	S	.	.	H	α-helix	trans	-71.8	-38.7	179.4	-64.9	-44.5	0	0	0	111.1	T395 L396 V401 L402 Q403	T395-D399 HydrophobicContact CG2-CB 3.81Å; L396-D399 HydrophobicContact CB-CB 4.45Å; L396-D399 WeakPolarHBondContact O-CA 3.18Å; L396-D399 PolarHBondContact O-N 3.17Å; D399-V401 PolarHBondContact O-N 2.95Å; D399-L402 CarbonylContact O-C 3.58Å; D399-L402 PolarHBondContact O-N 3.35Å; D399-L402 VanDerWaalsContact O-N 3.13Å; D399-Q403 WeakPolarHBondContact O-CB 3.48Å; D399-Q403 WeakPolarHBondContact O-CG 3.46Å; D399-Q403 PolarHBondContact O-N 3.25Å
400	S	65.4	Low	69.4	Low	58 Å²	58	100.3 Å²	100.3	41%	0.406	53%	0.532	S	S	.	.	H	α-helix	trans	-58	-47.5	171.5	178.7	0	0	0	0	111.8	L396 L402 Q403 A404	L396-S400 PolarHBondContact O-N 3Å; S400-L402 VanDerWaalsContact C-N 3.31Å; S400-L402 PolarHBondContact O-N 3.34Å; S400-Q403 PolarHBondContact O-N 2.94Å; S400-A404 PolarHBondContact O-N 3.29Å
401	V	67.3	Low	71.1	Confident	88 Å²	88	99.7 Å²	99.7	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-35.1	174.7	169.8	0	0	0	0	112.2	I397 I398 D399	I397-V401 VanDerWaalsContact O-CG2 3.3Å; I397-V401 WeakPolarHBondContact O-CG2 3.46Å; I397-V401 PolarHBondContact O-N 3.28Å; I397-V401 VanDerWaalsContact O-N 3.1Å; I398-V401 PolarHBondContact O-N 3.41Å; D399-V401 PolarHBondContact O-N 2.95Å
402	L	71.3	Confident	72.7	Confident	60 Å²	60	94.3 Å²	94.3	31%	0.314	50%	0.502	S	S	.	.	H	α-helix	trans	-75	-27.3	177	-75.9	174.4	0	0	0	113.4	I398 D399 S400 R408	I398-L402 HydrophobicContact CG1-CD1 4.04Å; I398-L402 HydrophobicContact CG1-CG 4.46Å; I398-L402 VanDerWaalsContact O-CB 3.31Å; I398-L402 WeakPolarHBondContact O-CB 3.47Å; I398-L402 WeakPolarHBondContact O-CG 3.25Å; I398-L402 PolarHBondContact O-N 3.45Å; D399-L402 CarbonylContact O-C 3.58Å; D399-L402 PolarHBondContact O-N 3.35Å; D399-L402 VanDerWaalsContact O-N 3.13Å; S400-L402 VanDerWaalsContact C-N 3.31Å; S400-L402 PolarHBondContact O-N 3.34Å; L402-R408 PolarHBondContact O-NH1 3.39Å
403	Q	71	Confident	74.3	Confident	88 Å²	88	97.1 Å²	97.1	41%	0.411	50%	0.497	S	S	.	.	H	α-helix	trans	-78	-32.2	174.1	-75	168.9	14	0	0	112	D399 S400 D405 Q409	D399-Q403 WeakPolarHBondContact O-CB 3.48Å; D399-Q403 WeakPolarHBondContact O-CG 3.46Å; D399-Q403 PolarHBondContact O-N 3.25Å; S400-Q403 PolarHBondContact O-N 2.94Å; Q403-D405 PolarHBondContact O-N 3.41Å; Q403-Q409 VanDerWaalsContact CA-NE2 3.34Å; Q403-Q409 VanDerWaalsContact O-CG 3.28Å; Q403-Q409 WeakPolarHBondContact O-CG 3.43Å; Q403-Q409 PolarHBondContact O-NE2 3.27Å
404	A	65.9	Low	75.4	Confident	47 Å²	47	96.8 Å²	96.8	39%	0.388	49%	0.492	S	S	.	.	S	Bend	trans	-65.3	-20.5	177.2	0	0	0	0	0	113.4	L384 S400 T406	L384-A404 HydrophobicContact CD1-CB 4.01Å; S400-A404 PolarHBondContact O-N 3.29Å; A404-T406 VanDerWaalsContact C-N 3.28Å; A404-T406 PolarHBondContact O-N 3.03Å
405	D	75.3	Confident	76.2	Confident	78 Å²	78	93.5 Å²	93.5	42%	0.417	47%	0.472	S	S	.	.			trans	-75.1	82.1	167.5	-172.3	-14.7	0	0	0	110.6	Q403 R407 R408 Q409	Q403-D405 PolarHBondContact O-N 3.41Å; D405-R407 PolarHBondContact O-N 3.14Å; D405-R407 VanDerWaalsContact O-N 3.09Å; D405-R407 WeakPolarHBondContact OD1-CB 3.5Å; D405-R407 PolarHBondContact OD1-N 2.83Å; D405-R408 HydrophobicContact CB-CB 3.82Å; D405-R408 PolarHBondContact O-N 2.67Å; D405-R408 PolarHBondContact OD1-N 3.35Å; D405-R408 WeakPolarHBondContact OD2-CB 3.39Å; D405-Q409 WeakPolarHBondContact O-CG 3.46Å; D405-Q409 PolarHBondContact O-N 2.83Å
406	T	76.2	Confident	76.9	Confident	97 Å²	97	92.8 Å²	92.8	60%	0.595	47%	0.473	S	S	*	.	H	α-helix	trans	-58.6	-17.7	176.9	59.3	0	0	0	0	114.3	A404 K410	A404-T406 VanDerWaalsContact C-N 3.28Å; A404-T406 PolarHBondContact O-N 3.03Å; T406-K410 WeakPolarHBondContact O-CG 3.33Å; T406-K410 PolarHBondContact O-N 2.87Å
407	R	76.4	Confident	78	Confident	194 Å²	194	93.3 Å²	93.3	73%	0.732	47%	0.467	S	S	*	.	H	α-helix	trans	-82	-43.4	173.3	-177.2	179.5	179.8	171.4	1.3	110.5	D405 L411	D405-R407 PolarHBondContact O-N 3.14Å; D405-R407 VanDerWaalsContact O-N 3.09Å; D405-R407 WeakPolarHBondContact OD1-CB 3.5Å; D405-R407 PolarHBondContact OD1-N 2.83Å; R407-L411 HydrophobicContact CG-CD1 4.15Å; R407-L411 WeakPolarHBondContact O-CG 3.45Å; R407-L411 PolarHBondContact O-N 3.22Å; R407-L411 VanDerWaalsContact O-N 3.1Å
408	R	79	Confident	79.4	Confident	91 Å²	91	89.7 Å²	89.7	34%	0.343	45%	0.449	S	S	.	.	H	α-helix	trans	-62.5	-42.6	173.6	177.1	-179.8	167.6	-80.4	-5.3	111.6	L402 D405 L411 L412	L402-R408 PolarHBondContact O-NH1 3.39Å; D405-R408 HydrophobicContact CB-CB 3.82Å; D405-R408 PolarHBondContact O-N 2.67Å; D405-R408 PolarHBondContact OD1-N 3.35Å; D405-R408 WeakPolarHBondContact OD2-CB 3.39Å; R408-L411 PolarHBondContact O-N 3.4Å; R408-L412 HydrophobicContact CG-CD1 3.88Å; R408-L412 HydrophobicContact CG-CG 4.44Å; R408-L412 WeakPolarHBondContact O-CG 3.45Å; R408-L412 PolarHBondContact O-N 3.5Å
409	Q	79	Confident	80.4	Confident	68 Å²	68	92 Å²	92	32%	0.318	45%	0.45	S	S	.	.	H	α-helix	trans	-51	-59.3	173.4	-68	-95	45.9	0	0	110.8	Q403 D405 L411 L412 E413	Q403-Q409 VanDerWaalsContact CA-NE2 3.34Å; Q403-Q409 VanDerWaalsContact O-CG 3.28Å; Q403-Q409 WeakPolarHBondContact O-CG 3.43Å; Q403-Q409 PolarHBondContact O-NE2 3.27Å; D405-Q409 WeakPolarHBondContact O-CG 3.46Å; D405-Q409 PolarHBondContact O-N 2.83Å; Q409-L411 VanDerWaalsContact C-N 3.3Å; Q409-L411 PolarHBondContact O-N 3.22Å; Q409-L412 PolarHBondContact O-N 2.9Å; Q409-E413 WeakPolarHBondContact O-CG 3.29Å; Q409-E413 PolarHBondContact O-N 3.05Å
410	K	86.5	Confident	81.2	Confident	138 Å²	138	95.6 Å²	95.6	60%	0.6	47%	0.465	S	S	*	.	H	α-helix	trans	-58.9	-36.5	-179.3	-71.6	174.7	-179.8	-179.7	0	114.1	T406 E413 E414	T406-K410 WeakPolarHBondContact O-CG 3.33Å; T406-K410 PolarHBondContact O-N 2.87Å; K410-E413 WeakPolarHBondContact CA-OE2 3.48Å; K410-E414 VanDerWaalsContact O-CB 3.28Å; K410-E414 WeakPolarHBondContact O-CB 3.12Å; K410-E414 PolarHBondContact O-N 2.95Å
411	L	88.5	Confident	82.3	Confident	95 Å²	95	97.4 Å²	97.4	50%	0.497	47%	0.467	S	S	.	.	H	α-helix	trans	-71.3	-31.9	176.8	-73	171.4	0	0	0	112.6	R407 R408 Q409 E415	R407-L411 HydrophobicContact CG-CD1 4.15Å; R407-L411 WeakPolarHBondContact O-CG 3.45Å; R407-L411 PolarHBondContact O-N 3.22Å; R407-L411 VanDerWaalsContact O-N 3.1Å; R408-L411 PolarHBondContact O-N 3.4Å; Q409-L411 VanDerWaalsContact C-N 3.3Å; Q409-L411 PolarHBondContact O-N 3.22Å; L411-E415 VanDerWaalsContact O-CB 3.31Å; L411-E415 WeakPolarHBondContact O-CB 3.28Å; L411-E415 PolarHBondContact O-N 3.22Å
412	L	86.6	Confident	83.1	Confident	76 Å²	76	99.2 Å²	99.2	40%	0.398	47%	0.471	S	S	.	.	H	α-helix	trans	-76	-36.9	174.1	-69.2	168.8	0	0	0	111.9	R408 Q409 G416	R408-L412 HydrophobicContact CG-CD1 3.88Å; R408-L412 HydrophobicContact CG-CG 4.44Å; R408-L412 WeakPolarHBondContact O-CG 3.45Å; R408-L412 PolarHBondContact O-N 3.5Å; Q409-L412 PolarHBondContact O-N 2.9Å; L412-G416 PolarHBondContact O-N 3.48Å
413	E	89	Confident	83.4	Confident	126 Å²	126	97.9 Å²	97.9	59%	0.589	47%	0.472	S	S	*	.	H	α-helix	trans	-60.1	-46.2	170.1	-68.9	167.1	172.4	0	0	111	Q409 K410 G416 R417	Q409-E413 WeakPolarHBondContact O-CG 3.29Å; Q409-E413 PolarHBondContact O-N 3.05Å; K410-E413 WeakPolarHBondContact CA-OE2 3.48Å; E413-G416 PolarHBondContact O-N 3.25Å; E413-R417 PolarHBondContact O-N 2.86Å
414	E	90.1	Very high	83.3	Confident	92 Å²	92	97 Å²	97	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-67.9	-41.1	177.6	-176.2	160.6	-130.6	0	0	112.3	K410 G416 R417 I418	K410-E414 VanDerWaalsContact O-CB 3.28Å; K410-E414 WeakPolarHBondContact O-CB 3.12Å; K410-E414 PolarHBondContact O-N 2.95Å; E414-G416 VanDerWaalsContact C-N 3.34Å; E414-G416 PolarHBondContact O-N 3.07Å; E414-R417 PolarHBondContact O-N 3.05Å; E414-I418 HydrophobicContact CG-CD1 3.86Å; E414-I418 WeakPolarHBondContact O-CB 3.06Å; E414-I418 WeakPolarHBondContact O-CD1 3.41Å; E414-I418 VanDerWaalsContact O-CG1 3.24Å; E414-I418 WeakPolarHBondContact O-CG1 3.12Å; E414-I418 PolarHBondContact O-N 3.46Å
415	E	91	Very high	83.1	Confident	84 Å²	84	99.6 Å²	99.6	39%	0.393	49%	0.487	S	S	.	.	H	α-helix	trans	-60.7	-42.9	172.2	-169.1	-169.3	167.9	0	0	111.6	L411 I418 R419	L411-E415 VanDerWaalsContact O-CB 3.31Å; L411-E415 WeakPolarHBondContact O-CB 3.28Å; L411-E415 PolarHBondContact O-N 3.22Å; E415-I418 PolarHBondContact O-N 2.79Å; E415-R419 WeakPolarHBondContact O-CB 3.08Å; E415-R419 VanDerWaalsContact O-CG 3.27Å; E415-R419 WeakPolarHBondContact O-CG 3.36Å; E415-R419 PolarHBondContact O-N 2.88Å; E415-R419 IonicContact OE1-CZ 2.64Å; E415-R419 IonicContact OE1-NE 2.83Å; E415-R419 PolarHBondContact OE1-NE 2.69Å; E415-R419 IonicContact OE1-NH2 3.31Å; E415-R419 PolarHBondContact OE1-NH2 3.07Å
416	G	89.7	Confident	82.3	Confident	27 Å²	27	100.2 Å²	100.2	28%	0.278	50%	0.497	S	S	.	.	H	α-helix	trans	-58	-52.9	176	0	0	0	0	0	111.9	L412 E413 E414 I418 R419 E420	L412-G416 PolarHBondContact O-N 3.48Å; E413-G416 PolarHBondContact O-N 3.25Å; E414-G416 VanDerWaalsContact C-N 3.34Å; E414-G416 PolarHBondContact O-N 3.07Å; G416-I418 VanDerWaalsContact C-N 3.34Å; G416-I418 PolarHBondContact O-N 2.8Å; G416-R419 WeakPolarHBondContact O-CB 3.12Å; G416-R419 PolarHBondContact O-N 2.66Å; G416-R419 VanDerWaalsContact O-N 3.14Å; G416-E420 PolarHBondContact O-N 3.26Å
417	R	91.4	Very high	81.3	Confident	126 Å²	126	102.8 Å²	102.8	48%	0.475	51%	0.507	S	S	.	.	H	α-helix	trans	-58	-44.5	178	-162.2	-169.3	73.4	-131.1	-12.5	112.1	E413 E414 R419 E420 E421	E413-R417 PolarHBondContact O-N 2.86Å; E414-R417 PolarHBondContact O-N 3.05Å; R417-R419 VanDerWaalsContact C-N 3.33Å; R417-R419 PolarHBondContact O-N 2.84Å; R417-E420 PolarHBondContact O-N 3.37Å; R417-E421 WeakPolarHBondContact CD-OE1 3.32Å; R417-E421 WeakPolarHBondContact CG-OE1 3.36Å; R417-E421 IonicContact CZ-OE1 2.78Å; R417-E421 IonicContact NE-OE1 2.69Å; R417-E421 PolarHBondContact NE-OE1 3.08Å; R417-E421 WeakPolarHBondContact O-CB 3.46Å; R417-E421 VanDerWaalsContact O-CG 3.32Å; R417-E421 WeakPolarHBondContact O-CG 3.24Å; R417-E421 PolarHBondContact O-N 2.71Å
418	I	89.8	Confident	79.8	Confident	72 Å²	72	105 Å²	105	37%	0.369	52%	0.522	S	S	.	.	H	α-helix	trans	-65.1	-35.9	178.9	-68.4	167.4	0	0	0	111.4	E414 E415 G416 M422	E414-I418 HydrophobicContact CG-CD1 3.86Å; E414-I418 WeakPolarHBondContact O-CB 3.06Å; E414-I418 WeakPolarHBondContact O-CD1 3.41Å; E414-I418 VanDerWaalsContact O-CG1 3.24Å; E414-I418 WeakPolarHBondContact O-CG1 3.12Å; E414-I418 PolarHBondContact O-N 3.46Å; E415-I418 PolarHBondContact O-N 2.79Å; G416-I418 VanDerWaalsContact C-N 3.34Å; G416-I418 PolarHBondContact O-N 2.8Å; I418-M422 HydrophobicContact CG2-CE 4.49Å; I418-M422 WeakPolarHBondContact O-CG 3.36Å; I418-M422 PolarHBondContact O-N 2.8Å
419	R	88.6	Confident	79.8	Confident	159 Å²	159	105.7 Å²	105.7	60%	0.6	53%	0.531	S	S	*	.	H	α-helix	trans	-66.3	-40.2	174.1	-74.4	166.3	172.6	-107.1	8.4	112.1	E415 G416 R417 M422 G423	E415-R419 WeakPolarHBondContact O-CB 3.08Å; E415-R419 VanDerWaalsContact O-CG 3.27Å; E415-R419 WeakPolarHBondContact O-CG 3.36Å; E415-R419 PolarHBondContact O-N 2.88Å; E415-R419 IonicContact OE1-CZ 2.64Å; E415-R419 IonicContact OE1-NE 2.83Å; E415-R419 PolarHBondContact OE1-NE 2.69Å; E415-R419 IonicContact OE1-NH2 3.31Å; E415-R419 PolarHBondContact OE1-NH2 3.07Å; G416-R419 WeakPolarHBondContact O-CB 3.12Å; G416-R419 PolarHBondContact O-N 2.66Å; G416-R419 VanDerWaalsContact O-N 3.14Å; R417-R419 VanDerWaalsContact C-N 3.33Å; R417-R419 PolarHBondContact O-N 2.84Å; R419-M422 PolarHBondContact O-N 3.05Å; R419-G423 PolarHBondContact O-N 2.56Å
420	E	88.1	Confident	79.8	Confident	143 Å²	143	107.6 Å²	107.6	67%	0.668	54%	0.542	S	S	*	.	H	α-helix	trans	-67.6	-42.1	175.7	-69.6	176.9	176.8	0	0	112.3	G416 R417 G423 S424	G416-E420 PolarHBondContact O-N 3.26Å; R417-E420 PolarHBondContact O-N 3.37Å; E420-G423 PolarHBondContact O-N 3.36Å; E420-S424 WeakPolarHBondContact O-CB 3.13Å; E420-S424 PolarHBondContact O-N 3.43Å; E420-S424 PolarHBondContact O-OG 3.44Å
421	E	87.5	Confident	79.5	Confident	96 Å²	96	105.9 Å²	105.9	45%	0.449	54%	0.539	S	S	.	.	H	α-helix	trans	-59.8	-44.1	173.3	-73.7	169	-161.9	0	0	111.4	R417 S424 T425	R417-E421 WeakPolarHBondContact CD-OE1 3.32Å; R417-E421 WeakPolarHBondContact CG-OE1 3.36Å; R417-E421 IonicContact CZ-OE1 2.78Å; R417-E421 IonicContact NE-OE1 2.69Å; R417-E421 PolarHBondContact NE-OE1 3.08Å; R417-E421 WeakPolarHBondContact O-CB 3.46Å; R417-E421 VanDerWaalsContact O-CG 3.32Å; R417-E421 WeakPolarHBondContact O-CG 3.24Å; R417-E421 PolarHBondContact O-N 2.71Å; E421-S424 PolarHBondContact O-OG 3.05Å; E421-T425 WeakPolarHBondContact O-CB 3.36Å; E421-T425 PolarHBondContact O-N 3.21Å; E421-T425 PolarHBondContact O-OG1 2.96Å
422	M	83.8	Confident	78.9	Confident	126 Å²	126	106.6 Å²	106.6	62%	0.621	54%	0.541	S	S	*	.	H	α-helix	trans	-67.8	-44.3	175.7	-72.8	-161.5	-59.6	0	0	112.7	I418 R419 T425 S426	I418-M422 HydrophobicContact CG2-CE 4.49Å; I418-M422 WeakPolarHBondContact O-CG 3.36Å; I418-M422 PolarHBondContact O-N 2.8Å; R419-M422 PolarHBondContact O-N 3.05Å; M422-T425 PolarHBondContact O-N 3.5Å; M422-T425 VanDerWaalsContact O-N 3.16Å; M422-S426 PolarHBondContact O-N 2.73Å; M422-S426 PolarHBondContact O-OG 3.04Å
423	G	77.9	Confident	78.5	Confident	33 Å²	33	108.5 Å²	108.5	34%	0.34	55%	0.55	S	S	.	*	H	α-helix	trans	-61.7	-45.6	179.5	0	0	0	0	0	112.8	R419 E420 T425 S426	R419-G423 PolarHBondContact O-N 2.56Å; E420-G423 PolarHBondContact O-N 3.36Å; G423-T425 PolarHBondContact O-N 3.23Å; G423-S426 PolarHBondContact O-N 3.42Å; G423-S426 VanDerWaalsContact O-N 3.09Å; G423-S426 PolarHBondContact O-OG 3.07Å
424	S	68.6	Low	77.8	Confident	70 Å²	70	107.3 Å²	107.3	49%	0.49	55%	0.548	S	S	.	.	H	α-helix	trans	-71.4	-7.1	177.1	59.9	0	0	0	0	114.6	E420 E421	E420-S424 WeakPolarHBondContact O-CB 3.13Å; E420-S424 PolarHBondContact O-N 3.43Å; E420-S424 PolarHBondContact O-OG 3.44Å; E421-S424 PolarHBondContact O-OG 3.05Å
425	T	62.6	Low	76.9	Confident	101 Å²	101	108.4 Å²	108.4	62%	0.62	56%	0.556	S	S	*	*	H	α-helix	trans	-94.6	-13.9	171.6	-55.2	0	0	0	0	112.4	E421 M422 G423	E421-T425 WeakPolarHBondContact O-CB 3.36Å; E421-T425 PolarHBondContact O-N 3.21Å; E421-T425 PolarHBondContact O-OG1 2.96Å; M422-T425 PolarHBondContact O-N 3.5Å; M422-T425 VanDerWaalsContact O-N 3.16Å; G423-T425 PolarHBondContact O-N 3.23Å
426	S	59.1	Low	75.8	Confident	90 Å²	90	110.3 Å²	110.3	63%	0.629	57%	0.569	S	S	*	*	H	α-helix	trans	-89.4	-12.2	175.4	34.9	0	0	0	0	115.5	M422 G423	M422-S426 PolarHBondContact O-N 2.73Å; M422-S426 PolarHBondContact O-OG 3.04Å; G423-S426 PolarHBondContact O-N 3.42Å; G423-S426 VanDerWaalsContact O-N 3.09Å; G423-S426 PolarHBondContact O-OG 3.07Å
427	D	54.2	Low	74.6	Confident	152 Å²	152	117.3 Å²	117.3	81%	0.813	59%	0.593	S	S	*	*			trans	-98	29	174.5	-73.7	-35.5	0	0	0	112.7
428	K	44.2	Very low	73.1	Confident	239 Å²	239	116.5 Å²	116.5	100%	1.039	60%	0.603	S	S	*	*			trans	-141.5	0	179.2	-75.5	179.8	-178.9	162.4	0	112.5

Retrieved 428 of 428 residues in 151.6 ms (Link to these results)

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