A0A077YZB7_TRITR Loading...

Actin family protein

AlphaFold DB , UniProt , Accession A0A077YZB7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 404 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.6	Very low	28	Very low	247 Å²	247	112.8 Å²	112.8	100%	1.217	58%	0.584	S	S	*	*				0	81.8	0	-164.8	178.3	-94.5	0	0	105.2
2	L	26.9	Very low	28	Very low	90 Å²	90	111.8 Å²	111.8	47%	0.471	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-85.1	125.6	-176	-75.6	159.8	0	0	0	107.3	I373	L2-I373 HydrophobicContact CD2-CG2 3.8Å
3	L	24.5	Very low	28.2	Very low	157 Å²	157	112.8 Å²	112.8	82%	0.822	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-72.1	127.7	176	-81	156.9	0	0	0	108	L5	L3-L5 PolarHBondContact O-N 2.76Å
4	P	26.9	Very low	28.6	Very low	62 Å²	62	109.9 Å²	109.9	40%	0.403	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-59.1	128.9	177	21.4	-29.9	0	0	0	109.5	H6 N7	P4-H6 PolarHBondContact O-N 2.97Å; P4-N7 PolarHBondContact O-N 3.46Å
5	L	34.3	Very low	28.7	Very low	25 Å²	25	108.9 Å²	108.9	13%	0.131	59%	0.592	C	S	.	*	G	3₁₀ helix	trans	-56.9	-7	178.5	-73.4	178.7	0	0	0	114.1	L3 N7 C8 L83 A201 W362 I373	L3-L5 PolarHBondContact O-N 2.76Å; L5-N7 PolarHBondContact O-N 3.46Å; L5-N7 VanDerWaalsContact O-N 3.09Å; L5-C8 HydrophobicContact CD2-CB 4.49Å; L5-C8 PolarHBondContact O-N 2.82Å; L5-L83 HydrophobicContact CD1-CD2 4.42Å; L5-L83 HydrophobicContact CD2-CD2 3.33Å; L5-A201 WeakPolarHBondContact CD1-O 3.12Å; L5-W362 HydrophobicContact CB-CZ2 4.32Å; L5-W362 HydrophobicContact CD1-CH2 3.79Å; L5-W362 HydrophobicContact CD1-CZ2 3.72Å; L5-W362 HydrophobicContact CD1-CZ3 4.36Å; L5-I373 HydrophobicContact CD1-CD1 4.3Å; L5-I373 HydrophobicContact CD2-CD1 4.49Å
6	H	29.4	Very low	29.1	Very low	180 Å²	180	110.1 Å²	110.1	83%	0.833	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-56.1	-19.1	172.2	-77.1	-70.4	0	0	0	114	P4	P4-H6 PolarHBondContact O-N 2.97Å
7	N	26.4	Very low	29.9	Very low	141 Å²	141	106.9 Å²	106.9	75%	0.754	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-110.1	10	179.4	-73.6	-15.6	0	0	0	115.1	P4 L5 T9	P4-N7 PolarHBondContact O-N 3.46Å; L5-N7 PolarHBondContact O-N 3.46Å; L5-N7 VanDerWaalsContact O-N 3.09Å; N7-T9 PolarHBondContact O-N 3.45Å
8	C	29	Very low	30.4	Very low	51 Å²	51	101.7 Å²	101.7	35%	0.345	54%	0.541	S	S	.	.			trans	-80.8	113.1	175.1	-72.3	0	0	0	0	111	L5 F10	L5-C8 HydrophobicContact CD2-CB 4.49Å; L5-C8 PolarHBondContact O-N 2.82Å; C8-F10 HydrophobicContact CB-CE2 4.5Å; C8-F10 PolarHBondContact O-N 2.84Å
9	T	26.4	Very low	30.7	Very low	85 Å²	85	98.1 Å²	98.1	52%	0.521	52%	0.521	S	S	.	.			trans	-72.3	108	165.2	43.2	0	0	0	0	109	N7 E11	N7-T9 PolarHBondContact O-N 3.45Å; T9-E11 PolarHBondContact O-N 2.7Å
10	F	30.8	Very low	30.9	Very low	64 Å²	64	95.2 Å²	95.2	28%	0.281	51%	0.508	S	S	.	.			trans	-74.1	101.4	169.7	-69.4	-88.3	0	0	0	108.2	C8 S12 L85	C8-F10 HydrophobicContact CB-CE2 4.5Å; C8-F10 PolarHBondContact O-N 2.84Å; F10-S12 PolarHBondContact O-N 3.33Å; F10-L85 HydrophobicContact CD1-CD2 4.3Å; F10-L85 HydrophobicContact CD1-CG 4.06Å; F10-L85 HydrophobicContact CE1-CD2 4.08Å; F10-L85 HydrophobicContact CE1-CG 4.33Å
11	E	28.5	Very low	31.2	Very low	139 Å²	139	91.1 Å²	91.1	65%	0.65	49%	0.487	S	S	*	.			trans	-60.5	122.9	166.5	-82.6	170.1	-156.6	0	0	108.5	T9 L13 K82	T9-E11 PolarHBondContact O-N 2.7Å; E11-L13 PolarHBondContact O-N 3.43Å; E11-L13 VanDerWaalsContact O-N 3.14Å; E11-K82 IonicContact OE1-NZ 2.65Å; E11-K82 PolarHBondContact OE1-NZ 2.88Å
12	S	28.4	Very low	31.6	Very low	101 Å²	101	79.5 Å²	79.5	71%	0.706	43%	0.43	S	S	*	.			trans	-64.9	108.6	-174.5	56.3	0	0	0	0	111	F10	F10-S12 PolarHBondContact O-N 3.33Å
13	L	30.4	Very low	32	Very low	125 Å²	125	83.3 Å²	83.3	65%	0.654	44%	0.438	S	S	*	.			trans	-112.4	102.8	160.1	-78.8	164.6	0	0	0	108.5	E11 V51	E11-L13 PolarHBondContact O-N 3.43Å; E11-L13 VanDerWaalsContact O-N 3.14Å; L13-V51 HydrophobicContact CD2-CG1 4.16Å
14	S	33.8	Very low	32.5	Very low	72 Å²	72	79 Å²	79	50%	0.503	42%	0.42	S	S	.	.			trans	27.9	112.4	157.2	54.6	0	0	0	0	118.9	W16	S14-W16 PolarHBondContact O-N 3.19Å; S14-W16 VanDerWaalsContact O-N 3.14Å
15	T	29.6	Very low	32.8	Very low	95 Å²	95	78.6 Å²	78.6	58%	0.583	41%	0.414	S	S	*	.			trans	-12	92.8	150.8	47.3	0	0	0	0	118.6
16	W	35.6	Very low	32.7	Very low	127 Å²	127	79.4 Å²	79.4	48%	0.481	42%	0.416	S	S	.	.			trans	-109.6	73.9	158.2	-65.1	87.9	0	0	0	110.8	S14 P20 F109 Y110	S14-W16 PolarHBondContact O-N 3.19Å; S14-W16 VanDerWaalsContact O-N 3.14Å; W16-P20 HydrophobicContact CE3-CB 4.42Å; W16-P20 HydrophobicContact CE3-CG 3.83Å; W16-P20 HydrophobicContact CZ3-CB 4.26Å; W16-P20 HydrophobicContact CZ3-CG 4.18Å; W16-F109 AromaticContact CE3-CE1 3.89Å; W16-F109 HydrophobicContact CE3-CE1 3.89Å; W16-F109 HydrophobicContact CE3-CZ 4.3Å; W16-F109 AromaticContact CZ3-CE1 3.7Å; W16-F109 HydrophobicContact CZ3-CE1 3.7Å; W16-F109 HydrophobicContact CZ3-CZ 4.27Å; W16-Y110 AromaticContact CH2-CE1 3.7Å; W16-Y110 HydrophobicContact CH2-CE1 3.7Å; W16-Y110 HydrophobicContact CZ2-CE1 4.47Å; W16-Y110 AromaticContact CZ3-CE1 3.96Å; W16-Y110 HydrophobicContact CZ3-CE1 3.96Å
17	N	42.6	Very low	32.7	Very low	56 Å²	56	79.8 Å²	79.8	30%	0.299	42%	0.415	S	S	.	.	S	Bend	trans	-75.6	170	161.4	-101.5	-55.6	0	0	0	109.3	L19 P20 K268	N17-L19 HydrophobicContact CB-CB 4Å; N17-L19 HydrophobicContact CB-CD1 3.77Å; N17-L19 HydrophobicContact CB-CG 4.12Å; N17-L19 PolarHBondContact O-N 3.4Å; N17-P20 WeakPolarHBondContact O-CD 3.39Å; N17-P20 WeakPolarHBondContact O-CG 3.36Å; N17-K268 PolarHBondContact ND2-NZ 2.89Å; N17-K268 PolarHBondContact OD1-NZ 3.42Å
18	V	39.2	Very low	32.8	Very low	13 Å²	13	74 Å²	74	8%	0.079	39%	0.385	C	S	.	.	S	Bend	trans	-58.6	-1.6	166.4	-179.3	0	0	0	0	112.9	L21 L22 R263 Y264 E267	V18-L21 HydrophobicContact CG1-CB 4.33Å; V18-L21 VanDerWaalsContact O-CB 3.23Å; V18-L21 WeakPolarHBondContact O-CB 3.41Å; V18-L21 PolarHBondContact O-N 3.11Å; V18-L22 HydrophobicContact CG1-CG 4.47Å; V18-L22 PolarHBondContact O-N 3.12Å; V18-L22 VanDerWaalsContact O-N 3.07Å; V18-R263 HydrophobicContact CG2-CG 4.2Å; V18-Y264 HydrophobicContact CB-CD2 4.12Å; V18-Y264 HydrophobicContact CG1-CD2 4.2Å; V18-E267 WeakPolarHBondContact CG2-OE2 3.35Å
19	L	35.3	Very low	32.6	Very low	33 Å²	33	81.1 Å²	81.1	17%	0.173	41%	0.41	C	S	.	.	H	α-helix	trans	-63.1	-50.2	-178.5	-84.3	156.9	0	0	0	115	N17 L21 L22 R23 V35 Y264	N17-L19 HydrophobicContact CB-CB 4Å; N17-L19 HydrophobicContact CB-CD1 3.77Å; N17-L19 HydrophobicContact CB-CG 4.12Å; N17-L19 PolarHBondContact O-N 3.4Å; L19-L21 PolarHBondContact O-N 2.61Å; L19-L22 PolarHBondContact O-N 2.56Å; L19-R23 PolarHBondContact O-N 2.85Å; L19-V35 HydrophobicContact CD1-CG2 4.46Å; L19-Y264 HydrophobicContact CD2-CE2 3.95Å; L19-Y264 HydrophobicContact CG-CE2 3.96Å
20	P	36.1	Very low	32.7	Very low	40 Å²	40	79.6 Å²	79.6	26%	0.26	40%	0.395	S	S	.	.	H	α-helix	trans	-54.3	-37.5	169.1	8.2	-25.6	0	0	0	113.3	W16 N17 L22 R23 C24	W16-P20 HydrophobicContact CE3-CB 4.42Å; W16-P20 HydrophobicContact CE3-CG 3.83Å; W16-P20 HydrophobicContact CZ3-CB 4.26Å; W16-P20 HydrophobicContact CZ3-CG 4.18Å; N17-P20 WeakPolarHBondContact O-CD 3.39Å; N17-P20 WeakPolarHBondContact O-CG 3.36Å; P20-L22 VanDerWaalsContact C-N 3.35Å; P20-L22 PolarHBondContact O-N 2.82Å; P20-R23 PolarHBondContact O-N 3.45Å; P20-C24 WeakPolarHBondContact O-CB 3.31Å; P20-C24 PolarHBondContact O-N 3.12Å
21	L	36	Very low	32.6	Very low	10 Å²	10	81.2 Å²	81.2	5%	0.052	41%	0.413	C	S	.	.	H	α-helix	trans	-63.9	-39	177.7	-148.8	147.3	0	0	0	111.7	V18 L19 L25 P91 F109 N260	V18-L21 HydrophobicContact CG1-CB 4.33Å; V18-L21 VanDerWaalsContact O-CB 3.23Å; V18-L21 WeakPolarHBondContact O-CB 3.41Å; V18-L21 PolarHBondContact O-N 3.11Å; L19-L21 PolarHBondContact O-N 2.61Å; L21-L25 HydrophobicContact CD2-CD1 3.61Å; L21-L25 WeakPolarHBondContact O-CB 3.19Å; L21-L25 VanDerWaalsContact O-CG 3.24Å; L21-L25 WeakPolarHBondContact O-CG 3.4Å; L21-L25 PolarHBondContact O-N 3.49Å; L21-P91 HydrophobicContact CD1-CG 4.09Å; L21-F109 HydrophobicContact CB-CE2 3.58Å; L21-F109 HydrophobicContact CB-CZ 4.29Å; L21-F109 HydrophobicContact CD1-CD2 3.72Å; L21-F109 HydrophobicContact CD1-CE2 3.29Å; L21-F109 HydrophobicContact CD1-CZ 4.21Å; L21-F109 HydrophobicContact CG-CD2 3.93Å; L21-F109 HydrophobicContact CG-CE2 3.39Å; L21-F109 HydrophobicContact CG-CZ 4.46Å; L21-N260 HydrophobicContact CD2-CB 3.43Å; L21-N260 VanDerWaalsContact CD2-CB 3.43Å; L21-N260 WeakPolarHBondContact CD2-ND2 3.25Å
22	L	34.6	Very low	32.7	Very low	4 Å²	4	79.8 Å²	79.8	2%	0.021	41%	0.41	C	S	.	.	H	α-helix	trans	-77.3	-32	174	-69.4	-179.6	0	0	0	114.1	V18 L19 P20 Y26 L261 Y264	V18-L22 HydrophobicContact CG1-CG 4.47Å; V18-L22 PolarHBondContact O-N 3.12Å; V18-L22 VanDerWaalsContact O-N 3.07Å; L19-L22 PolarHBondContact O-N 2.56Å; P20-L22 VanDerWaalsContact C-N 3.35Å; P20-L22 PolarHBondContact O-N 2.82Å; L22-Y26 HydrophobicContact CD2-CD2 4.15Å; L22-Y26 PolarHBondContact O-N 2.93Å; L22-L261 HydrophobicContact CD2-CD1 3.31Å; L22-L261 HydrophobicContact CD2-CG 3.75Å; L22-Y264 HydrophobicContact CD1-CD1 3.66Å; L22-Y264 HydrophobicContact CD1-CD2 3.21Å; L22-Y264 HydrophobicContact CD1-CE1 3.99Å; L22-Y264 HydrophobicContact CD1-CE2 3.52Å; L22-Y264 HydrophobicContact CD1-CG 3.26Å; L22-Y264 HydrophobicContact CG-CD2 4.29Å; L22-Y264 HydrophobicContact CG-CG 4.39Å
23	R	34.2	Very low	32.7	Very low	170 Å²	170	82.4 Å²	82.4	64%	0.642	41%	0.411	S	S	*	.	H	α-helix	trans	-61	-46.8	174.3	-89.7	-175.7	171.7	177.4	-1	111	L19 P20 K27	L19-R23 PolarHBondContact O-N 2.85Å; P20-R23 PolarHBondContact O-N 3.45Å; R23-K27 PolarHBondContact O-N 3.34Å
24	C	35.1	Very low	32.8	Very low	67 Å²	67	81 Å²	81	45%	0.453	41%	0.409	S	S	.	.	H	α-helix	trans	-71	-39.7	-177.9	-156.5	0	0	0	0	111.6	P20 D112	P20-C24 WeakPolarHBondContact O-CB 3.31Å; P20-C24 PolarHBondContact O-N 3.12Å; C24-D112 PolarHBondContact SG-OD1 3.44Å; C24-D112 VanDerWaalsContact SG-OD1 3.41Å
25	L	32.4	Very low	32.7	Very low	53 Å²	53	80.5 Å²	80.5	28%	0.277	40%	0.403	S	S	.	.	H	α-helix	trans	-83.5	-26.4	-176.7	-68.2	177.5	0	0	0	115.6	L21 K257	L21-L25 HydrophobicContact CD2-CD1 3.61Å; L21-L25 WeakPolarHBondContact O-CB 3.19Å; L21-L25 VanDerWaalsContact O-CG 3.24Å; L21-L25 WeakPolarHBondContact O-CG 3.4Å; L21-L25 PolarHBondContact O-N 3.49Å; L25-K257 HydrophobicContact CD1-CB 4.12Å; L25-K257 HydrophobicContact CD1-CG 4.02Å; L25-K257 HydrophobicContact CD2-CD 3.83Å; L25-K257 HydrophobicContact CD2-CG 3.88Å; L25-K257 HydrophobicContact CG-CG 4.49Å
26	Y	33	Very low	32.7	Very low	41 Å²	41	81.9 Å²	81.9	16%	0.161	40%	0.401	C	S	.	.	H	α-helix	trans	-130.2	4.6	-167.7	-72.6	-90	0	0	0	116.3	L22 V28 F251 K257 L261	L22-Y26 HydrophobicContact CD2-CD2 4.15Å; L22-Y26 PolarHBondContact O-N 2.93Å; Y26-V28 VanDerWaalsContact CB-CG2 3.46Å; Y26-V28 PolarHBondContact O-N 2.68Å; Y26-F251 HydrophobicContact CE1-CE1 4.29Å; Y26-K257 HydrophobicContact CE2-CB 4.22Å; Y26-L261 HydrophobicContact CD2-CD1 3.63Å; Y26-L261 HydrophobicContact CE1-CD1 4.23Å; Y26-L261 HydrophobicContact CE1-CD2 4.49Å; Y26-L261 HydrophobicContact CE2-CD1 2.99Å; Y26-L261 HydrophobicContact CE2-CG 4.34Å; Y26-L261 HydrophobicContact CG-CD1 4.49Å; Y26-L261 WeakPolarHBondContact OH-CD1 3.38Å
27	K	29.4	Very low	32.5	Very low	188 Å²	188	78.4 Å²	78.4	82%	0.817	40%	0.399	S	S	*	.			trans	46.4	36.4	-176.4	-66.7	-172.8	178.1	180	0	113.1	R23 K29	R23-K27 PolarHBondContact O-N 3.34Å; K27-K29 PolarHBondContact O-N 3.05Å
28	V	28.3	Very low	32	Very low	20 Å²	20	82.8 Å²	82.8	12%	0.121	41%	0.412	C	S	.	.			trans	-82.6	112.5	-176	-166	0	0	0	0	109.9	Y26 Y30 N273	Y26-V28 VanDerWaalsContact CB-CG2 3.46Å; Y26-V28 PolarHBondContact O-N 2.68Å; V28-Y30 HydrophobicContact CB-CD2 3.95Å; V28-Y30 HydrophobicContact CB-CE2 3.64Å; V28-Y30 HydrophobicContact CG1-CD2 3.55Å; V28-Y30 HydrophobicContact CG1-CE2 3.18Å; V28-Y30 HydrophobicContact CG1-CG 4.35Å; V28-Y30 HydrophobicContact CG2-CE2 4.43Å; V28-Y30 PolarHBondContact O-N 3.44Å; V28-N273 HydrophobicContact CG1-CB 4.3Å
29	K	25.5	Very low	31.6	Very low	200 Å²	200	84.9 Å²	84.9	87%	0.87	42%	0.423	S	S	*	.			trans	-71.8	113.2	164	-79.7	-175.6	175.8	-178.7	0	108.5	K27 N273	K27-K29 PolarHBondContact O-N 3.05Å; K29-N273 PolarHBondContact O-ND2 2.78Å
30	Y	28.3	Very low	31.5	Very low	54 Å²	54	87 Å²	87	21%	0.212	45%	0.445	C	S	.	.			trans	-102.4	137.3	169.4	-82.6	-83.2	0	0	0	110.5	V28 L272 N273	V28-Y30 HydrophobicContact CB-CD2 3.95Å; V28-Y30 HydrophobicContact CB-CE2 3.64Å; V28-Y30 HydrophobicContact CG1-CD2 3.55Å; V28-Y30 HydrophobicContact CG1-CE2 3.18Å; V28-Y30 HydrophobicContact CG1-CG 4.35Å; V28-Y30 HydrophobicContact CG2-CE2 4.43Å; V28-Y30 PolarHBondContact O-N 3.44Å; Y30-L272 WeakPolarHBondContact OH-CA 3.18Å; Y30-L272 WeakPolarHBondContact OH-CB 3.44Å; Y30-L272 WeakPolarHBondContact OH-CD2 3.49Å; Y30-L272 VanDerWaalsContact OH-CG 3.27Å; Y30-L272 WeakPolarHBondContact OH-CG 3.48Å; Y30-N273 HydrophobicContact CD1-CB 3.75Å; Y30-N273 WeakPolarHBondContact CD1-ND2 3.4Å; Y30-N273 HydrophobicContact CE1-CB 3.44Å; Y30-N273 VanDerWaalsContact CE1-CB 3.44Å; Y30-N273 VanDerWaalsContact CE1-N 3.27Å; Y30-N273 PolarHBondContact OH-N 2.78Å
31	C	27.6	Very low	31.6	Very low	97 Å²	97	93 Å²	93	66%	0.655	47%	0.47	S	S	*	.			trans	-63.7	131.9	164.9	-90.6	0	0	0	0	109.1	E33 P34	C31-E33 PolarHBondContact O-N 2.89Å; C31-E33 VanDerWaalsContact O-N 3.13Å; C31-P34 VanDerWaalsContact O-CD 3.26Å; C31-P34 WeakPolarHBondContact O-CD 3.41Å
32	N	30.4	Very low	31.4	Very low	109 Å²	109	96.6 Å²	96.6	58%	0.583	49%	0.488	S	S	*	.	S	Bend	trans	-70.7	-0	-174.2	-75.7	-26.4	0	0	0	115	K36	N32-K36 PolarHBondContact O-N 3.43Å
33	E	30.4	Very low	31.1	Very low	157 Å²	157	101.7 Å²	101.7	73%	0.734	52%	0.522	S	S	*	.	H	α-helix	trans	-69.9	-41.1	-171.5	-66.2	-151.4	155.3	0	0	116.1	C31 V35 K36 A37	C31-E33 PolarHBondContact O-N 2.89Å; C31-E33 VanDerWaalsContact O-N 3.13Å; E33-V35 VanDerWaalsContact C-N 3.27Å; E33-V35 PolarHBondContact O-N 3.17Å; E33-K36 PolarHBondContact O-N 3.25Å; E33-A37 PolarHBondContact O-N 3.48Å
34	P	31.6	Very low	31	Very low	95 Å²	95	100.3 Å²	100.3	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-71.1	-24.7	-177.8	-16.9	30.7	0	0	0	113.1	C31 Y38	C31-P34 VanDerWaalsContact O-CD 3.26Å; C31-P34 WeakPolarHBondContact O-CD 3.41Å; P34-Y38 PolarHBondContact O-N 3.4Å
35	V	30.7	Very low	30.7	Very low	61 Å²	61	100.4 Å²	100.4	37%	0.37	53%	0.533	S	S	.	.	H	α-helix	trans	-75.8	-40.4	175.8	177.7	0	0	0	0	109.9	L19 E33 A37 Y38 L39	L19-V35 HydrophobicContact CD1-CG2 4.46Å; E33-V35 VanDerWaalsContact C-N 3.27Å; E33-V35 PolarHBondContact O-N 3.17Å; V35-A37 VanDerWaalsContact C-N 3.35Å; V35-A37 PolarHBondContact O-N 3.04Å; V35-Y38 PolarHBondContact O-N 3.39Å; V35-L39 HydrophobicContact CG1-CD1 3.74Å; V35-L39 HydrophobicContact CG1-CG 4.3Å; V35-L39 WeakPolarHBondContact O-CB 3.41Å; V35-L39 WeakPolarHBondContact O-CG 3.17Å; V35-L39 PolarHBondContact O-N 3.05Å
36	K	29.7	Very low	30.6	Very low	125 Å²	125	106.9 Å²	106.9	54%	0.543	56%	0.562	S	S	.	*	H	α-helix	trans	-61.3	-40.2	170.8	-82.4	-172.8	170.4	-172.1	0	112.6	N32 E33 L39 A40	N32-K36 PolarHBondContact O-N 3.43Å; E33-K36 PolarHBondContact O-N 3.25Å; K36-L39 PolarHBondContact O-N 2.87Å; K36-A40 VanDerWaalsContact O-CB 3.29Å; K36-A40 WeakPolarHBondContact O-CB 3.44Å; K36-A40 PolarHBondContact O-N 3.23Å
37	A	31.5	Very low	30.4	Very low	54 Å²	54	111.1 Å²	111.1	45%	0.446	58%	0.583	S	S	.	*	H	α-helix	trans	-65.3	-38.5	177.1	0	0	0	0	0	113.1	E33 V35 H41	E33-A37 PolarHBondContact O-N 3.48Å; V35-A37 VanDerWaalsContact C-N 3.35Å; V35-A37 PolarHBondContact O-N 3.04Å; A37-H41 PolarHBondContact O-CD2 3.4Å
38	Y	31.8	Very low	30.3	Very low	147 Å²	147	106.2 Å²	106.2	58%	0.576	57%	0.573	S	S	*	*	H	α-helix	trans	-73.2	-37.9	176.6	-175.6	-97.5	0	0	0	112.6	P34 V35 A40 H41 L42	P34-Y38 PolarHBondContact O-N 3.4Å; V35-Y38 PolarHBondContact O-N 3.39Å; Y38-A40 VanDerWaalsContact C-N 3.33Å; Y38-H41 PolarHBondContact O-N 2.72Å; Y38-L42 HydrophobicContact CE1-CD1 4.46Å
39	L	32.2	Very low	30.3	Very low	57 Å²	57	112.3 Å²	112.3	30%	0.298	60%	0.604	S	S	.	*	H	α-helix	trans	-69.7	-30.2	176.9	-68.3	171.1	0	0	0	112.3	V35 K36 H41 L42	V35-L39 HydrophobicContact CG1-CD1 3.74Å; V35-L39 HydrophobicContact CG1-CG 4.3Å; V35-L39 WeakPolarHBondContact O-CB 3.41Å; V35-L39 WeakPolarHBondContact O-CG 3.17Å; V35-L39 PolarHBondContact O-N 3.05Å; K36-L39 PolarHBondContact O-N 2.87Å; L39-H41 PolarHBondContact O-N 3.46Å; L39-L42 HydrophobicContact CD2-CD1 4.19Å; L39-L42 PolarHBondContact O-N 2.75Å
40	A	33.8	Very low	30.3	Very low	78 Å²	78	111.4 Å²	111.4	65%	0.645	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-15.3	176.6	0	0	0	0	0	114.6	K36 Y38	K36-A40 VanDerWaalsContact O-CB 3.29Å; K36-A40 WeakPolarHBondContact O-CB 3.44Å; K36-A40 PolarHBondContact O-N 3.23Å; Y38-A40 VanDerWaalsContact C-N 3.33Å
41	H	37	Very low	30.4	Very low	166 Å²	166	112.1 Å²	112.1	77%	0.769	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-0.9	178.8	-68.6	-53.8	0	0	0	113.9	A37 Y38 L39	A37-H41 PolarHBondContact O-CD2 3.4Å; Y38-H41 PolarHBondContact O-N 2.72Å; L39-H41 PolarHBondContact O-N 3.46Å
42	L	31.3	Very low	30.2	Very low	85 Å²	85	114.3 Å²	114.3	45%	0.445	62%	0.618	S	S	.	*	S	Bend	trans	-84.5	140.1	172.6	-69.6	169.9	0	0	0	109.5	Y38 L39 F44	Y38-L42 HydrophobicContact CE1-CD1 4.46Å; L39-L42 HydrophobicContact CD2-CD1 4.19Å; L39-L42 PolarHBondContact O-N 2.75Å; L42-F44 PolarHBondContact O-N 3.37Å
43	P	28.7	Very low	30	Very low	112 Å²	112	113.2 Å²	113.2	73%	0.727	62%	0.617	S	S	*	*	S	Bend	trans	-68.9	8.9	-174.4	-14.5	28.7	0	0	0	115.4
44	F	33	Very low	29.8	Very low	141 Å²	141	111.1 Å²	111.1	62%	0.618	61%	0.61	S	S	*	*			trans	-145.9	98.8	-175.1	-56.6	-74.6	0	0	0	109.1	L42	L42-F44 PolarHBondContact O-N 3.37Å
45	G	27.8	Very low	29.7	Very low	69 Å²	69	114.3 Å²	114.3	71%	0.711	61%	0.61	S	S	*	*			trans	-133.9	104.5	-179.5	0	0	0	0	0	112
46	Q	30	Very low	29.5	Very low	189 Å²	189	114.9 Å²	114.9	88%	0.883	62%	0.617	S	S	*	*			trans	-140.3	120	139.2	-79.1	-157.6	-25.1	0	0	107.8
47	E	28.9	Very low	29.6	Very low	130 Å²	130	118.2 Å²	118.2	61%	0.607	63%	0.631	S	S	*	*			trans	-66.7	124.2	172.4	-70.5	175.3	150.1	0	0	109
48	S	28.1	Very low	29.8	Very low	85 Å²	85	121.4 Å²	121.4	59%	0.594	64%	0.636	S	S	*	*			trans	-111	103.9	155.9	67.3	0	0	0	0	108.6	Q50	S48-Q50 PolarHBondContact O-N 3.36Å
49	D	27.5	Very low	30	Very low	147 Å²	147	124.3 Å²	124.3	79%	0.786	65%	0.648	S	S	*	*	S	Bend	trans	-67.9	67.7	168.7	-75.5	-36.3	0	0	0	110.1
50	Q	26.7	Very low	31	Very low	181 Å²	181	126.4 Å²	126.4	85%	0.846	66%	0.655	S	S	*	*			trans	172.7	89.9	167	-102.5	172.9	22.8	0	0	107.3	S48	S48-Q50 PolarHBondContact O-N 3.36Å
51	V	29.4	Very low	32.1	Very low	69 Å²	69	126.2 Å²	126.2	42%	0.418	65%	0.645	S	S	.	*			trans	-131.3	83.4	165	-169.8	0	0	0	0	106.7	L13 I54	L13-V51 HydrophobicContact CD2-CG1 4.16Å; V51-I54 HydrophobicContact CG1-CD1 4.49Å; V51-I54 HydrophobicContact CG1-CG1 4.43Å
52	D	24.5	Very low	33.5	Very low	144 Å²	144	121.2 Å²	121.2	77%	0.77	62%	0.624	S	S	*	*			trans	-44.6	139.8	150	-90.6	-38.4	0	0	0	107.6	I54	D52-I54 PolarHBondContact O-N 3.08Å
53	P	25.4	Very low	36.1	Very low	85 Å²	85	122.5 Å²	122.5	55%	0.552	63%	0.626	S	S	*	*			trans	-60.7	110.1	176.4	27.2	-31	0	0	0	106.5	W55	P53-W55 PolarHBondContact O-N 2.91Å
54	I	27.2	Very low	39.1	Very low	114 Å²	114	117.4 Å²	117.4	59%	0.585	59%	0.592	S	S	*	*			trans	-67.1	80.6	178.8	-59.8	176.1	0	0	0	106.2	V51 D52 S56	V51-I54 HydrophobicContact CG1-CD1 4.49Å; V51-I54 HydrophobicContact CG1-CG1 4.43Å; D52-I54 PolarHBondContact O-N 3.08Å; I54-S56 WeakPolarHBondContact CG2-OG 3.24Å; I54-S56 PolarHBondContact O-N 2.67Å
55	W	28.7	Very low	42.1	Very low	161 Å²	161	110.7 Å²	110.7	61%	0.61	56%	0.563	S	S	*	*			trans	-81	26.5	168.9	-68.5	105.7	0	0	0	110.7	P53	P53-W55 PolarHBondContact O-N 2.91Å
56	S	26.7	Very low	45.2	Very low	74 Å²	74	107.4 Å²	107.4	52%	0.517	53%	0.529	S	S	.	.	S	Bend	trans	-118.7	104.4	-173.3	51.5	0	0	0	0	111.5	I54	I54-S56 WeakPolarHBondContact CG2-OG 3.24Å; I54-S56 PolarHBondContact O-N 2.67Å
57	K	30.6	Very low	48.3	Very low	195 Å²	195	98.4 Å²	98.4	85%	0.848	49%	0.487	S	S	*	.			trans	67.3	46.9	154.6	-56.4	-179	178	178.5	0	118.1
58	H	36.2	Very low	51.3	Low	120 Å²	120	92.5 Å²	92.5	56%	0.556	46%	0.46	S	S	*	.			trans	-87.7	121	153.8	-70.8	-22.6	0	0	0	109.7	F60	H58-F60 PolarHBondContact O-N 3.17Å; H58-F60 VanDerWaalsContact O-N 3.11Å
59	Y	37.5	Very low	54	Low	209 Å²	209	88.6 Å²	88.6	82%	0.82	43%	0.432	S	S	*	.			trans	-62.7	110.5	171.3	-78	-92.3	0	0	0	107.5	V61	Y59-V61 PolarHBondContact O-N 3.21Å; Y59-V61 VanDerWaalsContact O-N 3.1Å
60	F	51.2	Low	56.4	Low	100 Å²	100	81.8 Å²	81.8	44%	0.439	40%	0.397	S	S	.	.			trans	-66.9	110.4	173	-57.2	-72	0	0	0	108.2	H58 L62 L78	H58-F60 PolarHBondContact O-N 3.17Å; H58-F60 VanDerWaalsContact O-N 3.11Å; F60-L62 PolarHBondContact O-N 3.34Å; F60-L78 HydrophobicContact CD1-CD1 4.08Å; F60-L78 HydrophobicContact CE1-CB 4.43Å; F60-L78 HydrophobicContact CE1-CD1 3.38Å; F60-L78 HydrophobicContact CZ-CD1 3.93Å
61	V	57.1	Low	58.5	Low	74 Å²	74	74 Å²	74	45%	0.448	36%	0.363	S	S	.	.	S	Bend	trans	-57.6	-44.4	174.8	-168.3	0	0	0	0	109.9	Y59 D81	Y59-V61 PolarHBondContact O-N 3.21Å; Y59-V61 VanDerWaalsContact O-N 3.1Å; V61-D81 HydrophobicContact CG2-CB 4.14Å; V61-D81 WeakPolarHBondContact CG2-OD1 3.43Å
62	L	66.5	Low	60.4	Low	62 Å²	62	73.1 Å²	73.1	33%	0.325	36%	0.358	S	S	.	.	S	Bend	trans	-133.8	130.2	-179.7	-63.4	172.4	0	0	0	109.2	F60 I64 V79	F60-L62 PolarHBondContact O-N 3.34Å; L62-I64 HydrophobicContact CB-CD1 3.85Å; L62-I64 HydrophobicContact CB-CG1 3.99Å; L62-I64 HydrophobicContact CD1-CD1 4.06Å; L62-I64 HydrophobicContact CG-CD1 4.47Å; L62-I64 PolarHBondContact O-N 3.25Å; L62-V79 HydrophobicContact CB-CG1 4.41Å; L62-V79 HydrophobicContact CD1-CG1 4.44Å
63	K	87.5	Confident	62.9	Low	112 Å²	112	66.3 Å²	66.3	49%	0.487	32%	0.322	S	S	.	.			trans	-79.1	65.9	174.1	-67.2	-173.5	179	-179	0	110.1	S157 F158 Q159	K63-S157 WeakPolarHBondContact CD-O 3.41Å; K63-F158 VanDerWaalsContact C-CD1 3.41Å; K63-F158 HydrophobicContact CB-CD1 3.86Å; K63-F158 HydrophobicContact CB-CE1 4.04Å; K63-F158 HydrophobicContact CB-CG 4.22Å; K63-F158 HydrophobicContact CG-CE1 4.43Å; K63-F158 CarbonylContact O-C 3.49Å; K63-F158 VanDerWaalsContact O-CA 3.27Å; K63-F158 WeakPolarHBondContact O-CA 3.14Å; K63-F158 WeakPolarHBondContact O-CD1 3.4Å; K63-Q159 PolarHBondContact O-N 2.83Å
64	I	91.7	Very high	65.6	Low	4 Å²	4	62.4 Å²	62.4	2%	0.021	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.5	179.4	-52.3	171	0	0	0	109.2	L62 V79 Q159 A375	L62-I64 HydrophobicContact CB-CD1 3.85Å; L62-I64 HydrophobicContact CB-CG1 3.99Å; L62-I64 HydrophobicContact CD1-CD1 4.06Å; L62-I64 HydrophobicContact CG-CD1 4.47Å; L62-I64 PolarHBondContact O-N 3.25Å; I64-V79 HydrophobicContact CB-CB 4.4Å; I64-V79 HydrophobicContact CB-CG2 3.88Å; I64-V79 HydrophobicContact CG2-CG2 4.21Å; I64-V79 PolarHBondContact O-N 2.82Å; I64-V79 VanDerWaalsContact O-N 3.1Å; I64-Q159 WeakPolarHBondContact CA-O 2.83Å; I64-Q159 HydrophobicContact CG1-CB 4.2Å; I64-Q159 HydrophobicContact CG2-CB 4.47Å; I64-A375 WeakPolarHBondContact CD1-O 3.43Å; I64-A375 HydrophobicContact CG2-CB 3.89Å
65	C	94.4	Very high	68.5	Low	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	135	171.9	-175.8	0	0	0	0	109.4	L78 I153 Q159 L160 L161	C65-L78 HydrophobicContact CB-CD2 3.95Å; C65-I153 HydrophobicContact CB-CD1 3.86Å; C65-Q159 PolarHBondContact N-O 3.28Å; C65-L160 HydrophobicContact CB-CD1 4.03Å; C65-L160 CarbonylContact O-C 3.55Å; C65-L160 WeakPolarHBondContact O-CA 3.34Å; C65-L161 PolarHBondContact O-N 2.96Å
66	V	94.5	Very high	71.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.8	174	175.1	0	0	0	0	108.4	V76 G77 V79 L161 F368 A371 K372 A375	V66-V76 VanDerWaalsContact O-CA 3.32Å; V66-V76 WeakPolarHBondContact O-CA 3.32Å; V66-G77 PolarHBondContact N-O 3.02Å; V66-G77 PolarHBondContact O-N 2.91Å; V66-V79 HydrophobicContact CG2-CG2 4.24Å; V66-L161 WeakPolarHBondContact CA-O 3.24Å; V66-L161 HydrophobicContact CG2-CB 4.4Å; V66-F368 HydrophobicContact CB-CE2 4.21Å; V66-F368 HydrophobicContact CG1-CD2 3.91Å; V66-F368 HydrophobicContact CG1-CE2 3.77Å; V66-A371 HydrophobicContact CG1-CB 3.42Å; V66-A371 VanDerWaalsContact CG1-CB 3.42Å; V66-K372 HydrophobicContact CB-CG 4.48Å; V66-K372 HydrophobicContact CG2-CG 4.09Å; V66-A375 HydrophobicContact CG2-CB 3.9Å
67	V	94.3	Very high	74.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	112.7	174.2	179.2	0	0	0	0	108.7	I69 T74 V76 F144 I147 F148 L160 L161 L162 S163	V67-I69 HydrophobicContact CG1-CD1 4.13Å; V67-I69 HydrophobicContact CG1-CG1 3.77Å; V67-T74 HydrophobicContact CG1-CG2 4.34Å; V67-V76 HydrophobicContact CG1-CG2 4.28Å; V67-V76 HydrophobicContact CG2-CG1 3.93Å; V67-V76 HydrophobicContact CG2-CG2 4.25Å; V67-F144 HydrophobicContact CG1-CE1 4.14Å; V67-I147 HydrophobicContact CG1-CD1 4.38Å; V67-F148 HydrophobicContact CG2-CE1 4.44Å; V67-L160 HydrophobicContact CB-CD1 4.22Å; V67-L160 HydrophobicContact CG2-CD1 3.66Å; V67-L161 PolarHBondContact N-O 3.42Å; V67-L162 HydrophobicContact CB-CD1 4.14Å; V67-L162 HydrophobicContact CG1-CD1 4.05Å; V67-L162 CarbonylContact O-C 3.53Å; V67-L162 WeakPolarHBondContact O-CA 3.18Å; V67-S163 PolarHBondContact O-N 3.1Å
68	E	91.2	Very high	77.5	Confident	7 Å²	7	37.2 Å²	37.2	3%	0.033	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	118.4	169.8	-179.2	-150.7	119.4	0	0	109.3	T74 R75 Q194 F368	E68-T74 CarbonylContact O-C 3.56Å; E68-T74 VanDerWaalsContact O-CA 3.24Å; E68-T74 WeakPolarHBondContact O-CA 3.43Å; E68-T74 WeakPolarHBondContact O-CG2 3.39Å; E68-R75 HydrophobicContact CB-CB 4.25Å; E68-R75 PolarHBondContact N-O 3.19Å; E68-R75 PolarHBondContact O-N 2.93Å; E68-R75 IonicContact OE1-CZ 2.88Å; E68-R75 IonicContact OE1-NH1 3.04Å; E68-R75 PolarHBondContact OE1-NH1 2.97Å; E68-R75 WeakPolarHBondContact OE2-CD 3.46Å; E68-Q194 HydrophobicContact CG-CG 4.25Å; E68-F368 HydrophobicContact CB-CD2 4.19Å; E68-F368 VanDerWaalsContact OE2-CA 3.32Å; E68-F368 WeakPolarHBondContact OE2-CA 3.48Å; E68-F368 WeakPolarHBondContact OE2-CB 3.21Å; E68-F368 PolarHBondContact OE2-N 3.03Å
69	I	86.4	Confident	80	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	92	177.1	-53.1	-175.3	0	0	0	109	V67 T74 L129 F130 F144 L162 S163 P165 Q194	V67-I69 HydrophobicContact CG1-CD1 4.13Å; V67-I69 HydrophobicContact CG1-CG1 3.77Å; I69-T74 HydrophobicContact CG1-CG2 4.27Å; I69-L129 HydrophobicContact CG2-CB 4.43Å; I69-F130 HydrophobicContact CB-CD2 4.21Å; I69-F130 HydrophobicContact CB-CE2 4.4Å; I69-F130 HydrophobicContact CD1-CD2 3.99Å; I69-F130 HydrophobicContact CD1-CE2 3.3Å; I69-F130 HydrophobicContact CD1-CZ 3.99Å; I69-F130 HydrophobicContact CG1-CE2 4.4Å; I69-F130 HydrophobicContact CG2-CD2 3.7Å; I69-F130 HydrophobicContact CG2-CE2 4.06Å; I69-F144 HydrophobicContact CD1-CE1 3.97Å; I69-F144 HydrophobicContact CD1-CZ 3.79Å; I69-L162 HydrophobicContact CD1-CD1 3.8Å; I69-L162 HydrophobicContact CG1-CD1 4.04Å; I69-S163 PolarHBondContact N-O 3.33Å; I69-P165 WeakPolarHBondContact O-CD 3.33Å; I69-Q194 VanDerWaalsContact C-NE2 3.27Å; I69-Q194 PolarHBondContact O-NE2 2.95Å
70	G	76.9	Confident	82.1	Confident	5 Å²	5	23.3 Å²	23.3	5%	0.052	12%	0.121	C	C	.	.			trans	-75.9	168.3	179.1	0	0	0	0	0	113.7	C72 S73 S92	G70-C72 PolarHBondContact O-N 3.27Å; G70-S73 VanDerWaalsContact CA-O 3.25Å; G70-S73 WeakPolarHBondContact CA-O 3.47Å; G70-S73 PolarHBondContact N-O 2.87Å; G70-S92 WeakPolarHBondContact O-CB 3.32Å; G70-S92 PolarHBondContact O-OG 3.27Å; G70-S92 VanDerWaalsContact O-OG 3.13Å
71	S	70.7	Confident	83.1	Confident	18 Å²	18	24.3 Å²	24.3	13%	0.126	13%	0.131	C	C	.	.	S	Bend	trans	-69.5	-16.6	173.6	60.6	0	0	0	0	114.1	N214	S71-N214 PolarHBondContact OG-N 2.88Å
72	C	70.5	Confident	84	Confident	49 Å²	49	26.2 Å²	26.2	33%	0.331	13%	0.133	S	C	.	.	S	Bend	trans	-123.5	-34.2	-175.3	-176.4	0	0	0	0	112.4	G70 P91 S92 N214 R263	G70-C72 PolarHBondContact O-N 3.27Å; C72-P91 WeakPolarHBondContact O-CA 3.37Å; C72-S92 PolarHBondContact O-N 3.33Å; C72-N214 HydrophobicContact CB-CB 4.43Å; C72-R263 PolarHBondContact O-NH1 3.02Å; C72-R263 VanDerWaalsContact SG-CZ 3.59Å; C72-R263 PolarHBondContact SG-NH1 3.46Å; C72-R263 VanDerWaalsContact SG-NH1 3.45Å
73	S	76.1	Confident	84.4	Confident	2 Å²	2	25 Å²	25	1%	0.014	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	147	-174.2	53	0	0	0	0	111.6	G70 R75 F89 F90 S92	G70-S73 VanDerWaalsContact CA-O 3.25Å; G70-S73 WeakPolarHBondContact CA-O 3.47Å; G70-S73 PolarHBondContact N-O 2.87Å; S73-R75 PolarHBondContact OG-NH1 2.96Å; S73-R75 PolarHBondContact OG-NH2 3.37Å; S73-F89 VanDerWaalsContact CB-CZ 3.46Å; S73-F89 WeakPolarHBondContact OG-CE2 3.39Å; S73-F89 WeakPolarHBondContact OG-CZ 3.45Å; S73-F90 CarbonylContact C-O 3.55Å; S73-F90 WeakPolarHBondContact CA-O 3.3Å; S73-F90 WeakPolarHBondContact CB-O 3.45Å; S73-S92 VanDerWaalsContact CA-OG 3.26Å; S73-S92 WeakPolarHBondContact CA-OG 3.27Å; S73-S92 PolarHBondContact N-OG 3.36Å; S73-S92 PolarHBondContact O-OG 2.88Å
74	T	82.6	Confident	84	Confident	3 Å²	3	21.4 Å²	21.4	2%	0.018	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	136.3	176.1	-59.2	0	0	0	0	108.8	V67 E68 I69 V76 F89 F90 S92 I147	V67-T74 HydrophobicContact CG1-CG2 4.34Å; E68-T74 CarbonylContact O-C 3.56Å; E68-T74 VanDerWaalsContact O-CA 3.24Å; E68-T74 WeakPolarHBondContact O-CA 3.43Å; E68-T74 WeakPolarHBondContact O-CG2 3.39Å; I69-T74 HydrophobicContact CG1-CG2 4.27Å; T74-V76 HydrophobicContact CG2-CG2 4.08Å; T74-F89 WeakPolarHBondContact O-CA 3.26Å; T74-F90 HydrophobicContact CG2-CE1 3.71Å; T74-F90 HydrophobicContact CG2-CE2 4.18Å; T74-F90 HydrophobicContact CG2-CZ 3.46Å; T74-F90 VanDerWaalsContact CG2-CZ 3.46Å; T74-F90 PolarHBondContact N-O 2.95Å; T74-F90 PolarHBondContact O-N 3.23Å; T74-F90 VanDerWaalsContact O-N 3.08Å; T74-S92 PolarHBondContact N-OG 2.95Å; T74-S92 PolarHBondContact OG1-OG 3.06Å; T74-I147 HydrophobicContact CG2-CD1 4.3Å
75	R	88.6	Confident	83.6	Confident	9 Å²	9	24.8 Å²	24.8	3%	0.034	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	133.5	176.1	-67.7	164.3	-174.7	80.6	3	108.6	E68 S73 P86 L88 F89 Y364 H365 F368	E68-R75 HydrophobicContact CB-CB 4.25Å; E68-R75 PolarHBondContact N-O 3.19Å; E68-R75 PolarHBondContact O-N 2.93Å; E68-R75 IonicContact OE1-CZ 2.88Å; E68-R75 IonicContact OE1-NH1 3.04Å; E68-R75 PolarHBondContact OE1-NH1 2.97Å; E68-R75 WeakPolarHBondContact OE2-CD 3.46Å; S73-R75 PolarHBondContact OG-NH1 2.96Å; S73-R75 PolarHBondContact OG-NH2 3.37Å; R75-P86 HydrophobicContact CB-CB 3.93Å; R75-P86 HydrophobicContact CB-CG 3.74Å; R75-P86 HydrophobicContact CG-CB 4.24Å; R75-P86 HydrophobicContact CG-CG 3.71Å; R75-L88 WeakPolarHBondContact CA-O 3.24Å; R75-F89 HydrophobicContact CG-CD2 3.5Å; R75-F89 VanDerWaalsContact CG-CD2 3.5Å; R75-F89 HydrophobicContact CG-CE2 3.85Å; R75-Y364 PolarHBondContact NE-O 2.68Å; R75-Y364 PolarHBondContact NH2-O 2.98Å; R75-H365 PolarHBondContact NE-ND1 3.43Å; R75-F368 HydrophobicContact CB-CB 4.3Å; R75-F368 HydrophobicContact CB-CD2 3.51Å; R75-F368 HydrophobicContact CB-CE2 3.98Å; R75-F368 HydrophobicContact CB-CG 3.98Å
76	V	91.6	Very high	83.1	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.3	178.9	-172	0	0	0	0	109.7	V66 V67 T74 P86 H87 L88 F90 I147 M151	V66-V76 VanDerWaalsContact O-CA 3.32Å; V66-V76 WeakPolarHBondContact O-CA 3.32Å; V67-V76 HydrophobicContact CG1-CG2 4.28Å; V67-V76 HydrophobicContact CG2-CG1 3.93Å; V67-V76 HydrophobicContact CG2-CG2 4.25Å; T74-V76 HydrophobicContact CG2-CG2 4.08Å; V76-P86 CarbonylContact O-C 3.56Å; V76-P86 WeakPolarHBondContact O-CA 3.3Å; V76-H87 PolarHBondContact O-N 3.2Å; V76-L88 HydrophobicContact CB-CB 4.04Å; V76-L88 HydrophobicContact CB-CD1 4.37Å; V76-L88 HydrophobicContact CB-CG 4.48Å; V76-L88 HydrophobicContact CG2-CB 4.37Å; V76-L88 PolarHBondContact N-O 3.11Å; V76-L88 PolarHBondContact O-N 3.15Å; V76-F90 HydrophobicContact CG2-CE1 4.18Å; V76-I147 HydrophobicContact CB-CG2 4.24Å; V76-I147 HydrophobicContact CG1-CG2 3.72Å; V76-I147 HydrophobicContact CG2-CD1 4.19Å; V76-I147 HydrophobicContact CG2-CG1 4.26Å; V76-I147 HydrophobicContact CG2-CG2 3.71Å; V76-M151 HydrophobicContact CB-SD 4.4Å; V76-M151 HydrophobicContact CG1-CE 4.31Å; V76-M151 HydrophobicContact CG1-CG 3.79Å; V76-M151 HydrophobicContact CG1-SD 3.9Å
77	G	91.6	Very high	82.6	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	173.2	168.3	0	0	0	0	0	112.5	V66 H87	V66-G77 PolarHBondContact N-O 3.02Å; V66-G77 PolarHBondContact O-N 2.91Å; G77-H87 VanDerWaalsContact CA-ND1 3.31Å; G77-H87 WeakPolarHBondContact CA-ND1 3.47Å
78	L	91.2	Very high	82.1	Confident	5 Å²	5	29.9 Å²	29.9	3%	0.026	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	153.2	175.5	-56	178	0	0	0	110	F60 C65 M151 I153 F158 K372	F60-L78 HydrophobicContact CD1-CD1 4.08Å; F60-L78 HydrophobicContact CE1-CB 4.43Å; F60-L78 HydrophobicContact CE1-CD1 3.38Å; F60-L78 HydrophobicContact CZ-CD1 3.93Å; C65-L78 HydrophobicContact CB-CD2 3.95Å; L78-M151 HydrophobicContact CD1-CE 4.16Å; L78-M151 HydrophobicContact CD2-CE 3.93Å; L78-M151 HydrophobicContact CG-CE 3.61Å; L78-I153 HydrophobicContact CD1-CG2 4.23Å; L78-I153 HydrophobicContact CD2-CG2 3.99Å; L78-F158 HydrophobicContact CD2-CD1 4.46Å; L78-F158 HydrophobicContact CD2-CE1 4.03Å; L78-K372 VanDerWaalsContact O-CE 3.29Å; L78-K372 WeakPolarHBondContact O-CE 3.45Å; L78-K372 PolarHBondContact O-NZ 3.49Å
79	V	87.9	Confident	81.5	Confident	3 Å²	3	31.4 Å²	31.4	2%	0.018	17%	0.165	C	C	.	.			trans	-72.7	133.9	166.7	-179.4	0	0	0	0	108.7	L62 I64 V66 A375 D376	L62-V79 HydrophobicContact CB-CG1 4.41Å; L62-V79 HydrophobicContact CD1-CG1 4.44Å; I64-V79 HydrophobicContact CB-CB 4.4Å; I64-V79 HydrophobicContact CB-CG2 3.88Å; I64-V79 HydrophobicContact CG2-CG2 4.21Å; I64-V79 PolarHBondContact O-N 2.82Å; I64-V79 VanDerWaalsContact O-N 3.1Å; V66-V79 HydrophobicContact CG2-CG2 4.24Å; V79-A375 HydrophobicContact CG2-CB 3.4Å; V79-D376 HydrophobicContact CG1-CB 3.88Å
80	Q	81.9	Confident	80.8	Confident	34 Å²	34	31.6 Å²	31.6	16%	0.159	17%	0.165	C	C	.	.			trans	-137.6	167.2	-175.9	-61.6	176	-82.3	0	0	108.5	K82 T84 H87	Q80-K82 PolarHBondContact O-N 3.2Å; Q80-T84 VanDerWaalsContact OE1-CG2 3.3Å; Q80-T84 PolarHBondContact OE1-OG1 3.47Å; Q80-H87 PolarHBondContact OE1-CE1 3.47Å; Q80-H87 VanDerWaalsContact OE1-CE1 3.26Å
81	D	72.6	Confident	80.5	Confident	122 Å²	122	31.9 Å²	31.9	65%	0.652	17%	0.166	S	C	*	.	S	Bend	trans	-53	-28.5	177.4	-66.5	-71.8	0	0	0	114	V61	V61-D81 HydrophobicContact CG2-CB 4.14Å; V61-D81 WeakPolarHBondContact CG2-OD1 3.43Å
82	K	74.7	Confident	80.4	Confident	114 Å²	114	31.2 Å²	31.2	50%	0.496	16%	0.162	S	C	.	.	S	Bend	trans	-119.1	148.1	176.8	-62.3	-176.3	-172.8	176.9	0	110	E11 Q80 T84	E11-K82 IonicContact OE1-NZ 2.65Å; E11-K82 PolarHBondContact OE1-NZ 2.88Å; Q80-K82 PolarHBondContact O-N 3.2Å; K82-T84 PolarHBondContact O-N 2.99Å
83	L	76.2	Confident	80.1	Confident	37 Å²	37	30.2 Å²	30.2	19%	0.194	15%	0.154	C	C	.	.			trans	-67.9	117.5	171.8	-173.2	66.6	0	0	0	110.2	L5 L369 K372	L5-L83 HydrophobicContact CD1-CD2 4.42Å; L5-L83 HydrophobicContact CD2-CD2 3.33Å; L83-L369 HydrophobicContact CD1-CD2 4.03Å; L83-L369 HydrophobicContact CD2-CB 4.43Å; L83-L369 HydrophobicContact CD2-CD2 3.99Å; L83-L369 HydrophobicContact CG-CD2 3.91Å; L83-K372 HydrophobicContact CD1-CB 3.46Å; L83-K372 VanDerWaalsContact CD1-CB 3.46Å; L83-K372 HydrophobicContact CD1-CD 3.86Å; L83-K372 HydrophobicContact CD1-CG 4.3Å
84	T	79	Confident	79.3	Confident	35 Å²	35	31.3 Å²	31.3	22%	0.215	16%	0.159	C	C	.	.			trans	-116.2	158.9	180	56	0	0	0	0	111.9	Q80 K82 K372	Q80-T84 VanDerWaalsContact OE1-CG2 3.3Å; Q80-T84 PolarHBondContact OE1-OG1 3.47Å; K82-T84 PolarHBondContact O-N 2.99Å; T84-K372 PolarHBondContact O-NZ 3.31Å; T84-K372 PolarHBondContact OG1-NZ 3.28Å
85	L	82	Confident	77.8	Confident	76 Å²	76	31.2 Å²	31.2	40%	0.398	16%	0.159	S	C	.	.			trans	-64	170.5	168.6	-70.7	178.9	0	0	0	111.7	F10 K372	F10-L85 HydrophobicContact CD1-CD2 4.3Å; F10-L85 HydrophobicContact CD1-CG 4.06Å; F10-L85 HydrophobicContact CE1-CD2 4.08Å; F10-L85 HydrophobicContact CE1-CG 4.33Å; L85-K372 PolarHBondContact O-NZ 3.49Å
86	P	83.9	Confident	76.1	Confident	24 Å²	24	32.9 Å²	32.9	16%	0.156	17%	0.167	C	C	.	.			trans	-58.3	138.9	175.2	-20.7	30.1	0	0	0	112.2	R75 V76 L88 F368	R75-P86 HydrophobicContact CB-CB 3.93Å; R75-P86 HydrophobicContact CB-CG 3.74Å; R75-P86 HydrophobicContact CG-CB 4.24Å; R75-P86 HydrophobicContact CG-CG 3.71Å; V76-P86 CarbonylContact O-C 3.56Å; V76-P86 WeakPolarHBondContact O-CA 3.3Å; P86-L88 WeakPolarHBondContact CB-O 3.29Å; P86-F368 HydrophobicContact CB-CD1 4.38Å; P86-F368 HydrophobicContact CB-CE1 3.9Å; P86-F368 HydrophobicContact CB-CE2 4.34Å; P86-F368 HydrophobicContact CB-CZ 3.87Å; P86-F368 HydrophobicContact CG-CD1 3.58Å; P86-F368 HydrophobicContact CG-CD2 4.4Å; P86-F368 HydrophobicContact CG-CE1 3.57Å; P86-F368 HydrophobicContact CG-CE2 4.4Å; P86-F368 HydrophobicContact CG-CG 4Å; P86-F368 HydrophobicContact CG-CZ 3.99Å
87	H	85.4	Confident	74.3	Confident	74 Å²	74	33.1 Å²	33.1	34%	0.343	17%	0.169	S	C	.	.	S	Bend	trans	-74.8	-38.1	171.1	-64.7	62.8	0	0	0	110.9	V76 G77 Q80 M151	V76-H87 PolarHBondContact O-N 3.2Å; G77-H87 VanDerWaalsContact CA-ND1 3.31Å; G77-H87 WeakPolarHBondContact CA-ND1 3.47Å; Q80-H87 PolarHBondContact OE1-CE1 3.47Å; Q80-H87 VanDerWaalsContact OE1-CE1 3.26Å; H87-M151 HydrophobicContact CB-CE 3.91Å; H87-M151 HydrophobicContact CB-SD 3.84Å
88	L	83	Confident	72.5	Confident	9 Å²	9	38 Å²	38	5%	0.047	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.1	170.8	-53.7	174.1	0	0	0	109.9	R75 V76 P86 F90 L106 K150 M151	R75-L88 WeakPolarHBondContact CA-O 3.24Å; V76-L88 HydrophobicContact CB-CB 4.04Å; V76-L88 HydrophobicContact CB-CD1 4.37Å; V76-L88 HydrophobicContact CB-CG 4.48Å; V76-L88 HydrophobicContact CG2-CB 4.37Å; V76-L88 PolarHBondContact N-O 3.11Å; V76-L88 PolarHBondContact O-N 3.15Å; P86-L88 WeakPolarHBondContact CB-O 3.29Å; L88-F90 HydrophobicContact CB-CD1 4.27Å; L88-F90 HydrophobicContact CB-CE1 4.34Å; L88-L106 HydrophobicContact CD1-CD1 4.33Å; L88-K150 HydrophobicContact CD1-CB 4.05Å; L88-K150 HydrophobicContact CD1-CG 4.04Å; L88-K150 HydrophobicContact CD2-CG 3.75Å; L88-M151 HydrophobicContact CD1-CG 3.67Å; L88-M151 HydrophobicContact CD1-SD 3.64Å; L88-M151 HydrophobicContact CG-CG 4.34Å; L88-M151 HydrophobicContact CG-SD 3.62Å
89	F	78	Confident	71.1	Confident	39 Å²	39	42.1 Å²	42.1	17%	0.171	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	113.3	175.6	-178.9	-114.4	0	0	0	110.1	S73 T74 R75 Y364	S73-F89 VanDerWaalsContact CB-CZ 3.46Å; S73-F89 WeakPolarHBondContact OG-CE2 3.39Å; S73-F89 WeakPolarHBondContact OG-CZ 3.45Å; T74-F89 WeakPolarHBondContact O-CA 3.26Å; R75-F89 HydrophobicContact CG-CD2 3.5Å; R75-F89 VanDerWaalsContact CG-CD2 3.5Å; R75-F89 HydrophobicContact CG-CE2 3.85Å; F89-Y364 HydrophobicContact CE1-CE1 4.2Å; F89-Y364 HydrophobicContact CE2-CE1 4.33Å; F89-Y364 AromaticContact CZ-CE1 3.82Å; F89-Y364 HydrophobicContact CZ-CE1 3.82Å; F89-Y364 AromaticContact CZ-CZ 3.64Å; F89-Y364 WeakPolarHBondContact CZ-OH 3.25Å
90	F	73.6	Confident	69.6	Low	6 Å²	6	44 Å²	44	3%	0.026	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	156.5	-173.2	60.4	-81	0	0	0	111.9	S73 T74 V76 L88 L106 I147	S73-F90 CarbonylContact C-O 3.55Å; S73-F90 WeakPolarHBondContact CA-O 3.3Å; S73-F90 WeakPolarHBondContact CB-O 3.45Å; T74-F90 HydrophobicContact CG2-CE1 3.71Å; T74-F90 HydrophobicContact CG2-CE2 4.18Å; T74-F90 HydrophobicContact CG2-CZ 3.46Å; T74-F90 VanDerWaalsContact CG2-CZ 3.46Å; T74-F90 PolarHBondContact N-O 2.95Å; T74-F90 PolarHBondContact O-N 3.23Å; T74-F90 VanDerWaalsContact O-N 3.08Å; V76-F90 HydrophobicContact CG2-CE1 4.18Å; L88-F90 HydrophobicContact CB-CD1 4.27Å; L88-F90 HydrophobicContact CB-CE1 4.34Å; F90-L106 HydrophobicContact CB-CD1 4.24Å; F90-L106 HydrophobicContact CD1-CD1 3.3Å; F90-L106 HydrophobicContact CD2-CB 4.29Å; F90-L106 HydrophobicContact CD2-CD1 4.06Å; F90-L106 HydrophobicContact CE1-CD1 3.5Å; F90-L106 VanDerWaalsContact CE1-CD1 3.5Å; F90-L106 HydrophobicContact CE2-CB 4.28Å; F90-L106 HydrophobicContact CE2-CD1 4.22Å; F90-L106 HydrophobicContact CG-CD1 3.61Å; F90-L106 HydrophobicContact CZ-CD1 3.94Å; F90-I147 HydrophobicContact CE1-CG1 4.15Å; F90-I147 HydrophobicContact CZ-CD1 3.87Å; F90-I147 HydrophobicContact CZ-CG1 3.72Å
91	P	69.6	Low	68.4	Low	10 Å²	10	48.9 Å²	48.9	7%	0.065	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	138	175.1	-23.2	34.2	0	0	0	112.2	L21 C72 V93	L21-P91 HydrophobicContact CD1-CG 4.09Å; C72-P91 WeakPolarHBondContact O-CA 3.37Å; P91-V93 HydrophobicContact CB-CB 4.48Å; P91-V93 HydrophobicContact CB-CG2 3.95Å; P91-V93 PolarHBondContact O-N 3.36Å
92	S	69.6	Low	67.5	Low	5 Å²	5	44 Å²	44	4%	0.035	23%	0.233	C	C	.	.	S	Bend	trans	-79.9	60.3	177.5	-54.9	0	0	0	0	111.1	G70 C72 S73 T74	G70-S92 WeakPolarHBondContact O-CB 3.32Å; G70-S92 PolarHBondContact O-OG 3.27Å; G70-S92 VanDerWaalsContact O-OG 3.13Å; C72-S92 PolarHBondContact O-N 3.33Å; S73-S92 VanDerWaalsContact CA-OG 3.26Å; S73-S92 WeakPolarHBondContact CA-OG 3.27Å; S73-S92 PolarHBondContact N-OG 3.36Å; S73-S92 PolarHBondContact O-OG 2.88Å; T74-S92 PolarHBondContact N-OG 2.95Å; T74-S92 PolarHBondContact OG1-OG 3.06Å
93	V	62.5	Low	66.4	Low	28 Å²	28	41.2 Å²	41.2	17%	0.17	22%	0.221	C	C	.	.			trans	-127.5	145.2	-172.8	-175.1	0	0	0	0	109.1	P91 H105 L123	P91-V93 HydrophobicContact CB-CB 4.48Å; P91-V93 HydrophobicContact CB-CG2 3.95Å; P91-V93 PolarHBondContact O-N 3.36Å; V93-H105 HydrophobicContact CB-CB 4.48Å; V93-H105 WeakPolarHBondContact O-CB 3.46Å; V93-H105 PolarHBondContact O-N 2.96Å; V93-L123 HydrophobicContact CG1-CD1 3.51Å
94	L	59.3	Low	65.2	Low	24 Å²	24	39.5 Å²	39.5	13%	0.126	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	136.5	172.5	-75.8	150.8	0	0	0	108.8	L123 L129 K139 V143	L94-L123 WeakPolarHBondContact O-CD1 3.17Å; L94-L129 HydrophobicContact CD1-CD1 3.58Å; L94-L129 HydrophobicContact CD1-CG 4.14Å; L94-L129 HydrophobicContact CG-CD1 3.92Å; L94-K139 HydrophobicContact CD1-CB 3.61Å; L94-K139 HydrophobicContact CD1-CD 4.07Å; L94-K139 HydrophobicContact CD1-CG 4.38Å; L94-K139 HydrophobicContact CD2-CB 3.99Å; L94-K139 HydrophobicContact CG-CB 4.43Å; L94-V143 HydrophobicContact CD2-CG2 3.47Å; L94-V143 VanDerWaalsContact CD2-CG2 3.47Å; L94-V143 HydrophobicContact CG-CG2 4.19Å
95	A	52.4	Low	63.9	Low	2 Å²	2	38.3 Å²	38.3	2%	0.017	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	149.8	168.6	0	0	0	0	0	108.7	F103 F118 Y120	A95-F103 PolarHBondContact N-O 3.33Å; A95-F103 PolarHBondContact O-N 3.13Å; A95-F118 HydrophobicContact CB-CD1 4.14Å; A95-Y120 HydrophobicContact CB-CD1 3.89Å; A95-Y120 HydrophobicContact CB-CE1 3.52Å
96	E	52.8	Low	62.5	Low	43 Å²	43	34.9 Å²	34.9	20%	0.201	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	140	168.5	-160.9	161.1	169.1	0	0	107.3	R101 F118 V119 K139	E96-R101 CarbonylContact C-O 3.41Å; E96-R101 WeakPolarHBondContact CA-O 3.03Å; E96-F118 CarbonylContact O-C 3.49Å; E96-V119 CarbonylContact C-O 3.49Å; E96-V119 PolarHBondContact N-O 2.9Å; E96-V119 CarbonylContact O-C 3.56Å; E96-V119 WeakPolarHBondContact O-CA 3.43Å; E96-V119 PolarHBondContact O-N 2.65Å; E96-K139 IonicContact OE2-NZ 2.79Å; E96-K139 PolarHBondContact OE2-NZ 2.96Å
97	T	53.6	Low	60.7	Low	6 Å²	6	37.1 Å²	37.1	4%	0.037	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	160.5	171.1	42.6	0	0	0	0	110	D99 G100 R101 F103 I116 F118	T97-D99 WeakPolarHBondContact CB-OD1 3.23Å; T97-D99 PolarHBondContact O-N 3.17Å; T97-D99 VanDerWaalsContact O-N 3.08Å; T97-D99 PolarHBondContact OG1-OD1 2.76Å; T97-G100 PolarHBondContact O-N 2.68Å; T97-R101 PolarHBondContact N-O 2.9Å; T97-R101 WeakPolarHBondContact OG1-CA 2.78Å; T97-R101 VanDerWaalsContact OG1-CB 3.25Å; T97-R101 WeakPolarHBondContact OG1-CB 3.31Å; T97-R101 PolarHBondContact OG1-N 2.88Å; T97-R101 VanDerWaalsContact OG1-N 3.1Å; T97-R101 PolarHBondContact OG1-O 2.86Å; T97-F103 HydrophobicContact CG2-CD2 3.83Å; T97-F103 HydrophobicContact CG2-CE2 3.47Å; T97-F103 VanDerWaalsContact CG2-CE2 3.47Å; T97-I116 HydrophobicContact CG2-CG2 3.68Å; T97-F118 HydrophobicContact CG2-CD1 3.35Å; T97-F118 HydrophobicContact CG2-CE1 3.31Å; T97-F118 HydrophobicContact CG2-CG 4.28Å; T97-F118 HydrophobicContact CG2-CZ 4.22Å
98	T	54.4	Low	58.9	Low	102 Å²	102	34.7 Å²	34.7	63%	0.626	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-25.9	172.1	45.7	0	0	0	0	113.4	D117 V119	T98-D117 HydrophobicContact CG2-CB 4.37Å; T98-V119 HydrophobicContact CG2-CG2 3.37Å
99	D	61.1	Low	57.1	Low	91 Å²	91	35.9 Å²	35.9	49%	0.487	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	11.3	178.7	66.8	8.3	0	0	0	114.5	T97 R101	T97-D99 WeakPolarHBondContact CB-OD1 3.23Å; T97-D99 PolarHBondContact O-N 3.17Å; T97-D99 VanDerWaalsContact O-N 3.08Å; T97-D99 PolarHBondContact OG1-OD1 2.76Å; D99-R101 VanDerWaalsContact C-N 3.32Å; D99-R101 VanDerWaalsContact CG-NE 3.33Å; D99-R101 PolarHBondContact O-N 2.81Å; D99-R101 WeakPolarHBondContact OD1-CG 3.33Å; D99-R101 IonicContact OD1-CZ 3.06Å; D99-R101 PolarHBondContact OD1-N 3.22Å; D99-R101 IonicContact OD1-NE 2.74Å; D99-R101 PolarHBondContact OD1-NE 2.92Å; D99-R101 VanDerWaalsContact OD1-NE 3.11Å; D99-R101 IonicContact OD1-NH2 2.7Å; D99-R101 IonicContact OD2-CZ 3.93Å; D99-R101 IonicContact OD2-NE 3.68Å; D99-R101 PolarHBondContact OD2-NE 2.84Å; D99-R101 IonicContact OD2-NH2 3.97Å; D99-R101 PolarHBondContact OD2-NH2 2.89Å
100	G	55.3	Low	55.5	Low	42 Å²	42	37.4 Å²	37.4	43%	0.433	20%	0.199	S	C	.	.	S	Bend	trans	80.8	5	175.2	0	0	0	0	0	115	T97 S102	T97-G100 PolarHBondContact O-N 2.68Å; G100-S102 PolarHBondContact O-N 3.38Å
101	R	56.7	Low	53.8	Low	138 Å²	138	41.9 Å²	41.9	52%	0.521	22%	0.22	S	C	.	.			trans	-75.3	116.5	170.9	-61.1	178.3	-75.4	169.3	-5.7	109.2	E96 T97 D99 F103	E96-R101 CarbonylContact C-O 3.41Å; E96-R101 WeakPolarHBondContact CA-O 3.03Å; T97-R101 PolarHBondContact N-O 2.9Å; T97-R101 WeakPolarHBondContact OG1-CA 2.78Å; T97-R101 VanDerWaalsContact OG1-CB 3.25Å; T97-R101 WeakPolarHBondContact OG1-CB 3.31Å; T97-R101 PolarHBondContact OG1-N 2.88Å; T97-R101 VanDerWaalsContact OG1-N 3.1Å; T97-R101 PolarHBondContact OG1-O 2.86Å; D99-R101 VanDerWaalsContact C-N 3.32Å; D99-R101 VanDerWaalsContact CG-NE 3.33Å; D99-R101 PolarHBondContact O-N 2.81Å; D99-R101 WeakPolarHBondContact OD1-CG 3.33Å; D99-R101 IonicContact OD1-CZ 3.06Å; D99-R101 PolarHBondContact OD1-N 3.22Å; D99-R101 IonicContact OD1-NE 2.74Å; D99-R101 PolarHBondContact OD1-NE 2.92Å; D99-R101 VanDerWaalsContact OD1-NE 3.11Å; D99-R101 IonicContact OD1-NH2 2.7Å; D99-R101 IonicContact OD2-CZ 3.93Å; D99-R101 IonicContact OD2-NE 3.68Å; D99-R101 PolarHBondContact OD2-NE 2.84Å; D99-R101 IonicContact OD2-NH2 3.97Å; D99-R101 PolarHBondContact OD2-NH2 2.89Å; R101-F103 HydrophobicContact CB-CD2 4.33Å; R101-F103 HydrophobicContact CB-CE2 3.53Å; R101-F103 HydrophobicContact CB-CZ 4.05Å; R101-F103 VanDerWaalsContact O-CD2 3.28Å; R101-F103 WeakPolarHBondContact O-CD2 3.35Å
102	S	53.7	Low	52.2	Low	20 Å²	20	47.7 Å²	47.7	14%	0.14	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	140.1	172.7	-69.3	0	0	0	0	110.3	G100 K139 Q142	G100-S102 PolarHBondContact O-N 3.38Å; S102-K139 WeakPolarHBondContact OG-CE 3.43Å; S102-Q142 VanDerWaalsContact CB-OE1 3.32Å; S102-Q142 PolarHBondContact O-OE1 3.35Å
103	F	51.4	Low	50.8	Low	54 Å²	54	51.9 Å²	51.9	24%	0.237	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	134.8	174	-66.7	-90.7	0	0	0	109.1	A95 T97 R101 L107 F118	A95-F103 PolarHBondContact N-O 3.33Å; A95-F103 PolarHBondContact O-N 3.13Å; T97-F103 HydrophobicContact CG2-CD2 3.83Å; T97-F103 HydrophobicContact CG2-CE2 3.47Å; T97-F103 VanDerWaalsContact CG2-CE2 3.47Å; R101-F103 HydrophobicContact CB-CD2 4.33Å; R101-F103 HydrophobicContact CB-CE2 3.53Å; R101-F103 HydrophobicContact CB-CZ 4.05Å; R101-F103 VanDerWaalsContact O-CD2 3.28Å; R101-F103 WeakPolarHBondContact O-CD2 3.35Å; F103-L107 HydrophobicContact CD1-CD1 4.43Å; F103-F118 HydrophobicContact CB-CE1 4.35Å; F103-F118 HydrophobicContact CD2-CD1 4.42Å; F103-F118 AromaticContact CD2-CE1 3.63Å; F103-F118 HydrophobicContact CD2-CE1 3.63Å; F103-F118 HydrophobicContact CE2-CE1 4.13Å; F103-F118 HydrophobicContact CG-CE1 4.1Å
104	S	51.6	Low	49.8	Very low	2 Å²	2	57.6 Å²	57.6	1%	0.014	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	140.6	167.9	69.1	0	0	0	0	109.1	L106 L107 A108 A146	S104-L106 PolarHBondContact O-N 3.27Å; S104-L107 WeakPolarHBondContact O-CB 3.27Å; S104-L107 PolarHBondContact O-N 3.2Å; S104-A108 PolarHBondContact O-N 3.2Å; S104-A146 VanDerWaalsContact OG-CB 3.26Å; S104-A146 WeakPolarHBondContact OG-CB 3.42Å
105	H	52	Low	48.8	Very low	9 Å²	9	65.4 Å²	65.4	4%	0.042	33%	0.334	C	S	.	.	H	α-helix	trans	-61.9	-16.1	176.5	-161.9	-53.3	0	0	0	111.5	V93 L107 A108 F109	V93-H105 HydrophobicContact CB-CB 4.48Å; V93-H105 WeakPolarHBondContact O-CB 3.46Å; V93-H105 PolarHBondContact O-N 2.96Å; H105-L107 VanDerWaalsContact C-N 3.31Å; H105-L107 PolarHBondContact O-N 2.93Å; H105-A108 PolarHBondContact O-N 2.88Å; H105-F109 WeakPolarHBondContact O-CB 3.42Å; H105-F109 PolarHBondContact O-N 3.39Å
106	L	52.5	Low	48.3	Very low	4 Å²	4	68.2 Å²	68.2	2%	0.021	35%	0.348	C	S	.	.	H	α-helix	trans	-56.4	-46.3	167.8	-164.7	88.9	0	0	0	110.8	L88 F90 S104 F109 Y110 A146 K150	L88-L106 HydrophobicContact CD1-CD1 4.33Å; F90-L106 HydrophobicContact CB-CD1 4.24Å; F90-L106 HydrophobicContact CD1-CD1 3.3Å; F90-L106 HydrophobicContact CD2-CB 4.29Å; F90-L106 HydrophobicContact CD2-CD1 4.06Å; F90-L106 HydrophobicContact CE1-CD1 3.5Å; F90-L106 VanDerWaalsContact CE1-CD1 3.5Å; F90-L106 HydrophobicContact CE2-CB 4.28Å; F90-L106 HydrophobicContact CE2-CD1 4.22Å; F90-L106 HydrophobicContact CG-CD1 3.61Å; F90-L106 HydrophobicContact CZ-CD1 3.94Å; S104-L106 PolarHBondContact O-N 3.27Å; L106-F109 PolarHBondContact O-N 2.85Å; L106-Y110 HydrophobicContact CD1-CD2 4.43Å; L106-Y110 HydrophobicContact CD1-CE2 3.85Å; L106-Y110 HydrophobicContact CG-CD2 4.2Å; L106-Y110 HydrophobicContact CG-CE2 4.12Å; L106-Y110 WeakPolarHBondContact O-CD2 3.47Å; L106-Y110 PolarHBondContact O-N 3Å; L106-A146 VanDerWaalsContact CD2-C 3.48Å; L106-A146 HydrophobicContact CD2-CB 3.92Å; L106-A146 WeakPolarHBondContact CD2-O 3.36Å; L106-K150 HydrophobicContact CD2-CB 3.84Å; L106-K150 HydrophobicContact CD2-CG 4.25Å
107	L	46.9	Very low	47.8	Very low	72 Å²	72	72.7 Å²	72.7	38%	0.377	37%	0.374	S	S	.	.	H	α-helix	trans	-69.1	-40	177.3	-66.8	168.5	0	0	0	111.7	F103 S104 H105 F109 Q111 A146	F103-L107 HydrophobicContact CD1-CD1 4.43Å; S104-L107 WeakPolarHBondContact O-CB 3.27Å; S104-L107 PolarHBondContact O-N 3.2Å; H105-L107 VanDerWaalsContact C-N 3.31Å; H105-L107 PolarHBondContact O-N 2.93Å; L107-F109 VanDerWaalsContact C-N 3.27Å; L107-F109 PolarHBondContact O-N 3.47Å; L107-Q111 PolarHBondContact O-N 3.33Å; L107-A146 HydrophobicContact CD1-CB 4.31Å; L107-A146 HydrophobicContact CG-CB 4.16Å
108	A	46.8	Very low	47.1	Very low	23 Å²	23	74.4 Å²	74.4	19%	0.19	38%	0.381	C	S	.	.	H	α-helix	trans	-69.3	-21.7	176.5	0	0	0	0	0	113.8	S104 H105	S104-A108 PolarHBondContact O-N 3.2Å; H105-A108 PolarHBondContact O-N 2.88Å
109	F	45.2	Very low	46.1	Very low	33 Å²	33	72.5 Å²	72.5	15%	0.145	37%	0.369	C	S	.	.	H	α-helix	trans	-85.1	-26.6	-176.5	-169.4	-112.9	0	0	0	113.2	W16 L21 H105 L106 L107	W16-F109 AromaticContact CE3-CE1 3.89Å; W16-F109 HydrophobicContact CE3-CE1 3.89Å; W16-F109 HydrophobicContact CE3-CZ 4.3Å; W16-F109 AromaticContact CZ3-CE1 3.7Å; W16-F109 HydrophobicContact CZ3-CE1 3.7Å; W16-F109 HydrophobicContact CZ3-CZ 4.27Å; L21-F109 HydrophobicContact CB-CE2 3.58Å; L21-F109 HydrophobicContact CB-CZ 4.29Å; L21-F109 HydrophobicContact CD1-CD2 3.72Å; L21-F109 HydrophobicContact CD1-CE2 3.29Å; L21-F109 HydrophobicContact CD1-CZ 4.21Å; L21-F109 HydrophobicContact CG-CD2 3.93Å; L21-F109 HydrophobicContact CG-CE2 3.39Å; L21-F109 HydrophobicContact CG-CZ 4.46Å; H105-F109 WeakPolarHBondContact O-CB 3.42Å; H105-F109 PolarHBondContact O-N 3.39Å; L106-F109 PolarHBondContact O-N 2.85Å; L107-F109 VanDerWaalsContact C-N 3.27Å; L107-F109 PolarHBondContact O-N 3.47Å
110	Y	44.3	Very low	45.2	Very low	71 Å²	71	71.2 Å²	71.2	28%	0.278	36%	0.358	S	S	.	.	H	α-helix	trans	-108.1	-7.3	-172.9	-72.2	-66.7	0	0	0	114.9	W16 L106	W16-Y110 AromaticContact CH2-CE1 3.7Å; W16-Y110 HydrophobicContact CH2-CE1 3.7Å; W16-Y110 HydrophobicContact CZ2-CE1 4.47Å; W16-Y110 AromaticContact CZ3-CE1 3.96Å; W16-Y110 HydrophobicContact CZ3-CE1 3.96Å; L106-Y110 HydrophobicContact CD1-CD2 4.43Å; L106-Y110 HydrophobicContact CD1-CE2 3.85Å; L106-Y110 HydrophobicContact CG-CD2 4.2Å; L106-Y110 HydrophobicContact CG-CE2 4.12Å; L106-Y110 WeakPolarHBondContact O-CD2 3.47Å; L106-Y110 PolarHBondContact O-N 3Å
111	Q	37.4	Very low	44.2	Very low	100 Å²	100	75 Å²	75	47%	0.467	36%	0.364	S	S	.	.	S	Bend	trans	-113	122.2	176.6	-74.4	177.6	-44.7	0	0	109.4	L107 F113	L107-Q111 PolarHBondContact O-N 3.33Å; Q111-F113 VanDerWaalsContact C-N 3.29Å; Q111-F113 HydrophobicContact CB-CD1 4.43Å; Q111-F113 HydrophobicContact CB-CD2 3.43Å; Q111-F113 VanDerWaalsContact CB-CD2 3.43Å; Q111-F113 HydrophobicContact CB-CE1 4.06Å; Q111-F113 HydrophobicContact CB-CE2 3.01Å; Q111-F113 HydrophobicContact CB-CG 4.17Å; Q111-F113 HydrophobicContact CB-CZ 3.37Å; Q111-F113 HydrophobicContact CG-CE2 3.83Å; Q111-F113 HydrophobicContact CG-CZ 3.86Å; Q111-F113 WeakPolarHBondContact O-CD2 3.47Å; Q111-F113 PolarHBondContact O-N 3.04Å
112	D	35.8	Very low	43	Very low	133 Å²	133	77.7 Å²	77.7	71%	0.711	38%	0.38	S	S	*	.			trans	-63.7	86.5	173.1	-83.3	-40.2	0	0	0	109.5	C24	C24-D112 PolarHBondContact SG-OD1 3.44Å; C24-D112 VanDerWaalsContact SG-OD1 3.41Å
113	F	42.2	Very low	42.1	Very low	92 Å²	92	79.2 Å²	79.2	40%	0.404	39%	0.386	S	S	.	.			trans	-104.7	89.5	179.6	-68	-56.2	0	0	0	111	Q111 E115 I116	Q111-F113 VanDerWaalsContact C-N 3.29Å; Q111-F113 HydrophobicContact CB-CD1 4.43Å; Q111-F113 HydrophobicContact CB-CD2 3.43Å; Q111-F113 VanDerWaalsContact CB-CD2 3.43Å; Q111-F113 HydrophobicContact CB-CE1 4.06Å; Q111-F113 HydrophobicContact CB-CE2 3.01Å; Q111-F113 HydrophobicContact CB-CG 4.17Å; Q111-F113 HydrophobicContact CB-CZ 3.37Å; Q111-F113 HydrophobicContact CG-CE2 3.83Å; Q111-F113 HydrophobicContact CG-CZ 3.86Å; Q111-F113 WeakPolarHBondContact O-CD2 3.47Å; Q111-F113 PolarHBondContact O-N 3.04Å; F113-E115 PolarHBondContact O-N 3.49Å; F113-I116 HydrophobicContact CD1-CD1 4.17Å; F113-I116 HydrophobicContact CE1-CD1 4.46Å; F113-I116 HydrophobicContact CG-CD1 4.34Å
114	N	39.6	Very low	41.1	Very low	148 Å²	148	79.9 Å²	79.9	79%	0.791	40%	0.401	S	S	*	.	S	Bend	trans	-78.1	-0.7	171.5	-74.4	-48.4	0	0	0	113.6
115	E	39.4	Very low	40.2	Very low	188 Å²	188	82.4 Å²	82.4	88%	0.879	42%	0.422	S	S	*	.	S	Bend	trans	-126.4	1.7	-166	-65.8	-171.2	169.3	0	0	116.2	F113	F113-E115 PolarHBondContact O-N 3.49Å
116	I	41.1	Very low	39.5	Very low	62 Å²	62	86.6 Å²	86.6	32%	0.318	45%	0.445	S	S	.	.			trans	-114.9	115.2	-176.4	-56.2	175.3	0	0	0	110.7	T97 F113 F118	T97-I116 HydrophobicContact CG2-CG2 3.68Å; F113-I116 HydrophobicContact CD1-CD1 4.17Å; F113-I116 HydrophobicContact CE1-CD1 4.46Å; F113-I116 HydrophobicContact CG-CD1 4.34Å; I116-F118 HydrophobicContact CB-CD2 4.26Å; I116-F118 HydrophobicContact CB-CE2 3.69Å; I116-F118 HydrophobicContact CB-CZ 4.03Å; I116-F118 HydrophobicContact CD1-CZ 4.46Å; I116-F118 HydrophobicContact CG2-CD1 4.38Å; I116-F118 HydrophobicContact CG2-CD2 4.02Å; I116-F118 HydrophobicContact CG2-CE1 4.02Å; I116-F118 HydrophobicContact CG2-CE2 3.64Å; I116-F118 HydrophobicContact CG2-CG 4.38Å; I116-F118 HydrophobicContact CG2-CZ 3.63Å; I116-F118 VanDerWaalsContact O-CD2 3.24Å; I116-F118 WeakPolarHBondContact O-CD2 3.47Å; I116-F118 PolarHBondContact O-N 3.1Å
117	D	42	Very low	38.9	Very low	136 Å²	136	87.5 Å²	87.5	73%	0.727	45%	0.452	S	S	*	.			trans	-72.5	101.3	169.9	-81.8	-30.9	0	0	0	110	T98	T98-D117 HydrophobicContact CG2-CB 4.37Å
118	F	39.5	Very low	39	Very low	42 Å²	42	84.3 Å²	84.3	18%	0.184	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.6	172.2	-67	-84.4	0	0	0	110.9	A95 E96 T97 F103 I116 Y120	A95-F118 HydrophobicContact CB-CD1 4.14Å; E96-F118 CarbonylContact O-C 3.49Å; T97-F118 HydrophobicContact CG2-CD1 3.35Å; T97-F118 HydrophobicContact CG2-CE1 3.31Å; T97-F118 HydrophobicContact CG2-CG 4.28Å; T97-F118 HydrophobicContact CG2-CZ 4.22Å; F103-F118 HydrophobicContact CB-CE1 4.35Å; F103-F118 HydrophobicContact CD2-CD1 4.42Å; F103-F118 AromaticContact CD2-CE1 3.63Å; F103-F118 HydrophobicContact CD2-CE1 3.63Å; F103-F118 HydrophobicContact CE2-CE1 4.13Å; F103-F118 HydrophobicContact CG-CE1 4.1Å; I116-F118 HydrophobicContact CB-CD2 4.26Å; I116-F118 HydrophobicContact CB-CE2 3.69Å; I116-F118 HydrophobicContact CB-CZ 4.03Å; I116-F118 HydrophobicContact CD1-CZ 4.46Å; I116-F118 HydrophobicContact CG2-CD1 4.38Å; I116-F118 HydrophobicContact CG2-CD2 4.02Å; I116-F118 HydrophobicContact CG2-CE1 4.02Å; I116-F118 HydrophobicContact CG2-CE2 3.64Å; I116-F118 HydrophobicContact CG2-CG 4.38Å; I116-F118 HydrophobicContact CG2-CZ 3.63Å; I116-F118 VanDerWaalsContact O-CD2 3.24Å; I116-F118 WeakPolarHBondContact O-CD2 3.47Å; I116-F118 PolarHBondContact O-N 3.1Å; F118-Y120 HydrophobicContact CB-CD2 4.04Å; F118-Y120 HydrophobicContact CB-CE2 3.72Å; F118-Y120 PolarHBondContact O-N 3.43Å
119	V	34.5	Very low	39.5	Very low	63 Å²	63	83.9 Å²	83.9	38%	0.382	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	97.4	160.4	-174.3	0	0	0	0	106.7	E96 T98 E121	E96-V119 CarbonylContact C-O 3.49Å; E96-V119 PolarHBondContact N-O 2.9Å; E96-V119 CarbonylContact O-C 3.56Å; E96-V119 WeakPolarHBondContact O-CA 3.43Å; E96-V119 PolarHBondContact O-N 2.65Å; T98-V119 HydrophobicContact CG2-CG2 3.37Å; V119-E121 HydrophobicContact CG1-CB 3.95Å; V119-E121 HydrophobicContact CG1-CG 4.1Å; V119-E121 PolarHBondContact O-N 2.85Å
120	Y	40.9	Very low	40.1	Very low	63 Å²	63	82.3 Å²	82.3	25%	0.247	42%	0.423	C	S	.	.			trans	-68.3	76.9	163.5	-68.2	-91.2	0	0	0	108	A95 F118 K122 C256	A95-Y120 HydrophobicContact CB-CD1 3.89Å; A95-Y120 HydrophobicContact CB-CE1 3.52Å; F118-Y120 HydrophobicContact CB-CD2 4.04Å; F118-Y120 HydrophobicContact CB-CE2 3.72Å; F118-Y120 PolarHBondContact O-N 3.43Å; Y120-K122 PolarHBondContact O-N 3.42Å; Y120-K122 VanDerWaalsContact O-N 3.08Å; Y120-C256 HydrophobicContact CD1-CB 3.7Å; Y120-C256 VanDerWaalsContact CD1-SG 3.58Å; Y120-C256 HydrophobicContact CD2-CB 3.94Å; Y120-C256 HydrophobicContact CE1-CB 4.2Å; Y120-C256 HydrophobicContact CE2-CB 4.44Å; Y120-C256 HydrophobicContact CG-CB 3.54Å
121	E	34.3	Very low	40.4	Very low	123 Å²	123	79.8 Å²	79.8	58%	0.575	42%	0.415	S	S	*	.			trans	-65.6	113.5	-169.8	-151.9	-170.6	-171.4	0	0	109.7	V119 L123	V119-E121 HydrophobicContact CG1-CB 3.95Å; V119-E121 HydrophobicContact CG1-CG 4.1Å; V119-E121 PolarHBondContact O-N 2.85Å; E121-L123 VanDerWaalsContact C-N 3.32Å; E121-L123 PolarHBondContact O-N 3.1Å
122	K	31.7	Very low	41.1	Very low	194 Å²	194	76.4 Å²	76.4	84%	0.843	40%	0.403	S	S	*	.			trans	39.7	47.4	160.9	-83.6	178.4	174.5	170.1	0	116.1	Y120 A124	Y120-K122 PolarHBondContact O-N 3.42Å; Y120-K122 VanDerWaalsContact O-N 3.08Å; K122-A124 PolarHBondContact O-N 3.11Å
123	L	34.8	Very low	42	Very low	52 Å²	52	76.8 Å²	76.8	27%	0.272	41%	0.405	S	S	.	.			trans	-80.1	63.2	171.5	-72.9	163	0	0	0	110.1	V93 L94 E121 A125	V93-L123 HydrophobicContact CG1-CD1 3.51Å; L94-L123 WeakPolarHBondContact O-CD1 3.17Å; E121-L123 VanDerWaalsContact C-N 3.32Å; E121-L123 PolarHBondContact O-N 3.1Å; L123-A125 PolarHBondContact O-N 2.7Å; L123-A125 VanDerWaalsContact O-N 3.11Å
124	A	30.2	Very low	42.8	Very low	68 Å²	68	83 Å²	83	56%	0.562	43%	0.426	S	S	*	.			trans	-70.8	95.2	175.2	0	0	0	0	0	109.2	K122 N126	K122-A124 PolarHBondContact O-N 3.11Å; A124-N126 WeakPolarHBondContact O-CB 3.12Å; A124-N126 PolarHBondContact O-N 3.39Å
125	A	34.4	Very low	44.1	Very low	55 Å²	55	77.2 Å²	77.2	46%	0.455	40%	0.395	S	S	.	.	S	Bend	trans	51.1	-4	162.7	0	0	0	0	0	118.9	L123 N214	L123-A125 PolarHBondContact O-N 2.7Å; L123-A125 VanDerWaalsContact O-N 3.11Å; A125-N214 PolarHBondContact O-ND2 2.73Å
126	N	35.5	Very low	45.8	Very low	96 Å²	96	71.6 Å²	71.6	51%	0.513	37%	0.371	S	S	.	.			trans	-120.4	12.4	-171.8	-73.1	-35.5	0	0	0	111.2	A124 A128	A124-N126 WeakPolarHBondContact O-CB 3.12Å; A124-N126 PolarHBondContact O-N 3.39Å; N126-A128 VanDerWaalsContact C-N 3.34Å; N126-A128 PolarHBondContact O-N 3.02Å
127	S	40	Very low	47.7	Very low	23 Å²	23	71.6 Å²	71.6	16%	0.161	37%	0.371	C	S	.	.			trans	-85	5.3	-169.5	48.3	0	0	0	0	115.8	L129	S127-L129 PolarHBondContact O-N 3.4Å
128	A	49.9	Very low	49.5	Very low	5 Å²	5	70.5 Å²	70.5	4%	0.041	37%	0.365	C	S	.	.	S	Bend	trans	-67.2	121.6	166.8	0	0	0	0	0	107.3	N126 F130 C131	N126-A128 VanDerWaalsContact C-N 3.34Å; N126-A128 PolarHBondContact O-N 3.02Å; A128-F130 PolarHBondContact O-N 3.43Å; A128-C131 HydrophobicContact CB-CB 3.66Å; A128-C131 WeakPolarHBondContact CB-SG 3.39Å; A128-C131 PolarHBondContact O-N 3.27Å
129	L	57.5	Low	51.2	Low	14 Å²	14	70.9 Å²	70.9	7%	0.073	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-36.3	-39.3	-174.4	-106.6	71.4	0	0	0	112.7	I69 L94 S127 L135 V140 V143	I69-L129 HydrophobicContact CG2-CB 4.43Å; L94-L129 HydrophobicContact CD1-CD1 3.58Å; L94-L129 HydrophobicContact CD1-CG 4.14Å; L94-L129 HydrophobicContact CG-CD1 3.92Å; S127-L129 PolarHBondContact O-N 3.4Å; L129-L135 VanDerWaalsContact O-CD1 3.32Å; L129-L135 WeakPolarHBondContact O-CD1 3.22Å; L129-V140 HydrophobicContact CD2-CB 4.2Å; L129-V140 HydrophobicContact CD2-CG1 4.28Å; L129-V140 HydrophobicContact CD2-CG2 3.83Å; L129-V140 HydrophobicContact CG-CG2 4.08Å; L129-V143 HydrophobicContact CD1-CG2 4.29Å; L129-V143 HydrophobicContact CD2-CB 4.04Å; L129-V143 HydrophobicContact CD2-CG1 4.09Å; L129-V143 HydrophobicContact CD2-CG2 4.06Å
130	F	56.6	Low	53.4	Low	1 Å²	1	68 Å²	68	0%	0.004	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-2.6	-173	-67	-94.3	0	0	0	116.1	I69 A128 L135 V140 F144 L164 V168 V176	I69-F130 HydrophobicContact CB-CD2 4.21Å; I69-F130 HydrophobicContact CB-CE2 4.4Å; I69-F130 HydrophobicContact CD1-CD2 3.99Å; I69-F130 HydrophobicContact CD1-CE2 3.3Å; I69-F130 HydrophobicContact CD1-CZ 3.99Å; I69-F130 HydrophobicContact CG1-CE2 4.4Å; I69-F130 HydrophobicContact CG2-CD2 3.7Å; I69-F130 HydrophobicContact CG2-CE2 4.06Å; A128-F130 PolarHBondContact O-N 3.43Å; F130-L135 HydrophobicContact CD1-CD1 3.5Å; F130-L135 HydrophobicContact CE1-CD1 3.73Å; F130-L135 HydrophobicContact CG-CD1 3.98Å; F130-L135 HydrophobicContact CZ-CD1 4.3Å; F130-V140 HydrophobicContact CE2-CG1 4.38Å; F130-V140 HydrophobicContact CZ-CG1 3.89Å; F130-F144 HydrophobicContact CZ-CE2 4.36Å; F130-F144 HydrophobicContact CZ-CZ 4.36Å; F130-L164 HydrophobicContact CB-CD2 4.29Å; F130-L164 HydrophobicContact CD1-CD1 4.34Å; F130-L164 HydrophobicContact CD1-CD2 3.61Å; F130-L164 HydrophobicContact CD2-CD2 3.99Å; F130-L164 HydrophobicContact CE1-CD2 3.82Å; F130-L164 HydrophobicContact CE2-CD2 4.27Å; F130-L164 HydrophobicContact CG-CD2 3.68Å; F130-L164 HydrophobicContact CZ-CD2 4.18Å; F130-V168 HydrophobicContact CB-CG1 4.46Å; F130-V168 HydrophobicContact CB-CG2 4.03Å; F130-V168 HydrophobicContact CD1-CG1 4.37Å; F130-V176 HydrophobicContact CD1-CG2 4.37Å; F130-V176 HydrophobicContact CE1-CB 3.96Å; F130-V176 HydrophobicContact CE1-CG1 3.84Å; F130-V176 HydrophobicContact CE1-CG2 3.31Å; F130-V176 HydrophobicContact CZ-CB 4.46Å; F130-V176 HydrophobicContact CZ-CG1 3.97Å; F130-V176 HydrophobicContact CZ-CG2 3.81Å
131	C	51.1	Low	55.6	Low	17 Å²	17	65.2 Å²	65.2	12%	0.115	34%	0.339	C	S	.	.	S	Bend	trans	-94.5	0.8	-173.2	-76.4	0	0	0	0	115	A128 K215	A128-C131 HydrophobicContact CB-CB 3.66Å; A128-C131 WeakPolarHBondContact CB-SG 3.39Å; A128-C131 PolarHBondContact O-N 3.27Å; C131-K215 PolarHBondContact O-NZ 2.68Å; C131-K215 VanDerWaalsContact O-NZ 3.17Å
132	S	53.1	Low	57.7	Low	29 Å²	29	62.4 Å²	62.4	20%	0.203	33%	0.325	C	S	.	.	S	Bend	trans	-124.2	150.1	179.3	85.6	0	0	0	0	111.4	R134 L135 K172	S132-R134 PolarHBondContact O-N 2.82Å; S132-R134 VanDerWaalsContact O-N 3.12Å; S132-R134 PolarHBondContact OG-N 3.49Å; S132-R134 VanDerWaalsContact OG-N 3.16Å; S132-L135 PolarHBondContact O-N 3.49Å; S132-K172 WeakPolarHBondContact O-CE 3.11Å; S132-K172 PolarHBondContact O-NZ 3.48Å
133	D	53.7	Low	60.1	Low	141 Å²	141	53.4 Å²	53.4	75%	0.754	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-4.4	168.2	-65	-32.3	0	0	0	114.4	K172	D133-K172 IonicContact OD1-NZ 3.66Å; D133-K172 PolarHBondContact OD1-NZ 3.33Å
134	R	58.8	Low	62.7	Low	224 Å²	224	50.9 Å²	50.9	85%	0.845	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	27.8	178.1	-47.5	-174.1	-155.3	-173.5	4.6	112.5	S132 N136	S132-R134 PolarHBondContact O-N 2.82Å; S132-R134 VanDerWaalsContact O-N 3.12Å; S132-R134 PolarHBondContact OG-N 3.49Å; S132-R134 VanDerWaalsContact OG-N 3.16Å; R134-N136 PolarHBondContact O-N 3.21Å
135	L	67.9	Low	65.4	Low	25 Å²	25	53.3 Å²	53.3	13%	0.131	27%	0.268	C	S	.	.			trans	-55	117.7	172.7	177.1	143.5	0	0	0	108.3	L129 F130 S132 L137 V140 K172 V176	L129-L135 VanDerWaalsContact O-CD1 3.32Å; L129-L135 WeakPolarHBondContact O-CD1 3.22Å; F130-L135 HydrophobicContact CD1-CD1 3.5Å; F130-L135 HydrophobicContact CE1-CD1 3.73Å; F130-L135 HydrophobicContact CG-CD1 3.98Å; F130-L135 HydrophobicContact CZ-CD1 4.3Å; S132-L135 PolarHBondContact O-N 3.49Å; L135-L137 HydrophobicContact CD2-CD2 3.66Å; L135-L137 HydrophobicContact CD2-CG 3.95Å; L135-V140 HydrophobicContact CD1-CG2 3.97Å; L135-V140 HydrophobicContact CD2-CG2 4.14Å; L135-V140 HydrophobicContact CG-CG2 3.82Å; L135-K172 HydrophobicContact CB-CD 3.74Å; L135-K172 HydrophobicContact CB-CG 4.24Å; L135-K172 HydrophobicContact CD1-CB 4.44Å; L135-K172 HydrophobicContact CD1-CD 4.31Å; L135-K172 HydrophobicContact CD2-CG 4.43Å; L135-K172 HydrophobicContact CG-CD 4.48Å; L135-V176 HydrophobicContact CD1-CG2 4.36Å; L135-V176 HydrophobicContact CD2-CG2 4.48Å
136	N	74.8	Confident	67.8	Low	70 Å²	70	51 Å²	51	37%	0.374	25%	0.249	S	C	.	.			trans	-99	113.5	176.4	177.6	-51.9	0	0	0	107.9	R134 D138 K139 V140	R134-N136 PolarHBondContact O-N 3.21Å; N136-D138 VanDerWaalsContact C-N 3.31Å; N136-D138 PolarHBondContact O-N 3.42Å; N136-D138 WeakPolarHBondContact OD1-CB 3.26Å; N136-D138 PolarHBondContact OD1-N 2.94Å; N136-K139 HydrophobicContact CB-CB 4.26Å; N136-K139 HydrophobicContact CB-CD 4.19Å; N136-K139 HydrophobicContact CB-CG 4.12Å; N136-K139 PolarHBondContact O-N 3Å; N136-K139 PolarHBondContact OD1-N 2.86Å; N136-V140 WeakPolarHBondContact O-CG2 3.49Å; N136-V140 PolarHBondContact O-N 3.39Å
137	L	80.9	Confident	70.2	Confident	63 Å²	63	46.4 Å²	46.4	33%	0.33	23%	0.225	S	C	.	.	H	α-helix	trans	-63.1	-34.8	-175.5	-74.3	167.7	0	0	0	112.8	L135 K139 V140 T141 D175 V176	L135-L137 HydrophobicContact CD2-CD2 3.66Å; L135-L137 HydrophobicContact CD2-CG 3.95Å; L137-K139 VanDerWaalsContact C-N 3.32Å; L137-K139 PolarHBondContact O-N 3.24Å; L137-V140 PolarHBondContact O-N 2.89Å; L137-T141 WeakPolarHBondContact O-CB 3.14Å; L137-T141 PolarHBondContact O-N 3.21Å; L137-T141 PolarHBondContact O-OG1 3.18Å; L137-D175 HydrophobicContact CD1-CB 3.81Å; L137-D175 HydrophobicContact CD2-CB 3.8Å; L137-D175 HydrophobicContact CG-CB 4.35Å; L137-V176 HydrophobicContact CD2-CG2 4.09Å
138	D	80	Confident	72.7	Confident	113 Å²	113	45.5 Å²	45.5	60%	0.604	22%	0.218	S	C	*	.	H	α-helix	trans	-62.7	-43.3	177.3	-59.2	-36	0	0	0	110.7	N136 T141 Q142	N136-D138 VanDerWaalsContact C-N 3.31Å; N136-D138 PolarHBondContact O-N 3.42Å; N136-D138 WeakPolarHBondContact OD1-CB 3.26Å; N136-D138 PolarHBondContact OD1-N 2.94Å; D138-T141 WeakPolarHBondContact O-CB 3.32Å; D138-T141 PolarHBondContact O-N 2.85Å; D138-Q142 WeakPolarHBondContact O-CG 3.46Å; D138-Q142 PolarHBondContact O-N 3.38Å
139	K	75.5	Confident	74.5	Confident	50 Å²	50	51.3 Å²	51.3	22%	0.217	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-40.9	176.9	-63.6	-172	-178.8	-164.7	0	111.7	L94 E96 S102 N136 L137 T141 Q142 V143	L94-K139 HydrophobicContact CD1-CB 3.61Å; L94-K139 HydrophobicContact CD1-CD 4.07Å; L94-K139 HydrophobicContact CD1-CG 4.38Å; L94-K139 HydrophobicContact CD2-CB 3.99Å; L94-K139 HydrophobicContact CG-CB 4.43Å; E96-K139 IonicContact OE2-NZ 2.79Å; E96-K139 PolarHBondContact OE2-NZ 2.96Å; S102-K139 WeakPolarHBondContact OG-CE 3.43Å; N136-K139 HydrophobicContact CB-CB 4.26Å; N136-K139 HydrophobicContact CB-CD 4.19Å; N136-K139 HydrophobicContact CB-CG 4.12Å; N136-K139 PolarHBondContact O-N 3Å; N136-K139 PolarHBondContact OD1-N 2.86Å; L137-K139 VanDerWaalsContact C-N 3.32Å; L137-K139 PolarHBondContact O-N 3.24Å; K139-T141 VanDerWaalsContact C-N 3.31Å; K139-T141 PolarHBondContact O-N 3.1Å; K139-Q142 PolarHBondContact O-N 3.11Å; K139-V143 WeakPolarHBondContact O-CG2 3.44Å; K139-V143 PolarHBondContact O-N 2.95Å; K139-V143 VanDerWaalsContact O-N 3.16Å
140	V	80.6	Confident	75.7	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-60.5	-43.6	174.1	173.1	0	0	0	0	110.8	L129 F130 L135 N136 L137 Q142 V143 F144 V176 L179	L129-V140 HydrophobicContact CD2-CB 4.2Å; L129-V140 HydrophobicContact CD2-CG1 4.28Å; L129-V140 HydrophobicContact CD2-CG2 3.83Å; L129-V140 HydrophobicContact CG-CG2 4.08Å; F130-V140 HydrophobicContact CE2-CG1 4.38Å; F130-V140 HydrophobicContact CZ-CG1 3.89Å; L135-V140 HydrophobicContact CD1-CG2 3.97Å; L135-V140 HydrophobicContact CD2-CG2 4.14Å; L135-V140 HydrophobicContact CG-CG2 3.82Å; N136-V140 WeakPolarHBondContact O-CG2 3.49Å; N136-V140 PolarHBondContact O-N 3.39Å; L137-V140 PolarHBondContact O-N 2.89Å; V140-Q142 PolarHBondContact O-N 2.82Å; V140-V143 WeakPolarHBondContact O-CB 3.21Å; V140-V143 PolarHBondContact O-N 3.34Å; V140-F144 HydrophobicContact CG1-CD2 3.65Å; V140-F144 HydrophobicContact CG1-CE2 3.42Å; V140-F144 VanDerWaalsContact CG1-CE2 3.42Å; V140-F144 WeakPolarHBondContact O-CD2 3.3Å; V140-F144 PolarHBondContact O-N 3.49Å; V140-V176 HydrophobicContact CG1-CG2 4.34Å; V140-L179 HydrophobicContact CG1-CD2 4.08Å
141	T	85.6	Confident	77.1	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-45.8	178.6	-57.7	0	0	0	0	111.5	L137 D138 K139 V143 F144 R145 L179 E183 F184	L137-T141 WeakPolarHBondContact O-CB 3.14Å; L137-T141 PolarHBondContact O-N 3.21Å; L137-T141 PolarHBondContact O-OG1 3.18Å; D138-T141 WeakPolarHBondContact O-CB 3.32Å; D138-T141 PolarHBondContact O-N 2.85Å; K139-T141 VanDerWaalsContact C-N 3.31Å; K139-T141 PolarHBondContact O-N 3.1Å; T141-V143 VanDerWaalsContact C-N 3.31Å; T141-V143 PolarHBondContact O-N 3Å; T141-F144 PolarHBondContact O-N 2.81Å; T141-R145 VanDerWaalsContact CG2-CZ 3.41Å; T141-R145 VanDerWaalsContact CG2-NH2 3.34Å; T141-R145 WeakPolarHBondContact O-CG 3.32Å; T141-R145 PolarHBondContact O-N 2.97Å; T141-L179 HydrophobicContact CG2-CD1 3.98Å; T141-L179 WeakPolarHBondContact OG1-CD1 3.45Å; T141-L179 VanDerWaalsContact OG1-CD2 3.29Å; T141-L179 WeakPolarHBondContact OG1-CD2 3.44Å; T141-E183 WeakPolarHBondContact CG2-OE1 3.16Å; T141-F184 HydrophobicContact CG2-CE2 4.17Å; T141-F184 HydrophobicContact CG2-CZ 4.08Å
142	Q	80	Confident	79	Confident	64 Å²	64	57.8 Å²	57.8	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-61.5	-38.2	176.4	-70	172.2	35.6	0	0	112.7	S102 D138 K139 V140 A146	S102-Q142 VanDerWaalsContact CB-OE1 3.32Å; S102-Q142 PolarHBondContact O-OE1 3.35Å; D138-Q142 WeakPolarHBondContact O-CG 3.46Å; D138-Q142 PolarHBondContact O-N 3.38Å; K139-Q142 PolarHBondContact O-N 3.11Å; V140-Q142 PolarHBondContact O-N 2.82Å; Q142-A146 WeakPolarHBondContact O-CB 3.48Å; Q142-A146 PolarHBondContact O-N 2.9Å
143	V	81	Confident	80.7	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.03	29%	0.287	C	S	.	.	H	α-helix	trans	-64	-46.5	175.3	170.5	0	0	0	0	110.7	L94 L129 K139 V140 T141 A146 I147	L94-V143 HydrophobicContact CD2-CG2 3.47Å; L94-V143 VanDerWaalsContact CD2-CG2 3.47Å; L94-V143 HydrophobicContact CG-CG2 4.19Å; L129-V143 HydrophobicContact CD1-CG2 4.29Å; L129-V143 HydrophobicContact CD2-CB 4.04Å; L129-V143 HydrophobicContact CD2-CG1 4.09Å; L129-V143 HydrophobicContact CD2-CG2 4.06Å; K139-V143 WeakPolarHBondContact O-CG2 3.44Å; K139-V143 PolarHBondContact O-N 2.95Å; K139-V143 VanDerWaalsContact O-N 3.16Å; V140-V143 WeakPolarHBondContact O-CB 3.21Å; V140-V143 PolarHBondContact O-N 3.34Å; T141-V143 VanDerWaalsContact C-N 3.31Å; T141-V143 PolarHBondContact O-N 3Å; V143-A146 PolarHBondContact O-N 3.47Å; V143-I147 HydrophobicContact CG1-CD1 3.82Å; V143-I147 HydrophobicContact CG1-CG1 4.42Å; V143-I147 VanDerWaalsContact O-CG1 3.25Å; V143-I147 WeakPolarHBondContact O-CG1 3.37Å; V143-I147 PolarHBondContact O-N 3.48Å
144	F	88.7	Confident	82.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-44.4	177.5	-78.9	-52.5	0	0	0	112.7	V67 I69 F130 V140 T141 A146 I147 F148 L162 V176 L179 L180 F184	V67-F144 HydrophobicContact CG1-CE1 4.14Å; I69-F144 HydrophobicContact CD1-CE1 3.97Å; I69-F144 HydrophobicContact CD1-CZ 3.79Å; F130-F144 HydrophobicContact CZ-CE2 4.36Å; F130-F144 HydrophobicContact CZ-CZ 4.36Å; V140-F144 HydrophobicContact CG1-CD2 3.65Å; V140-F144 HydrophobicContact CG1-CE2 3.42Å; V140-F144 VanDerWaalsContact CG1-CE2 3.42Å; V140-F144 WeakPolarHBondContact O-CD2 3.3Å; V140-F144 PolarHBondContact O-N 3.49Å; T141-F144 PolarHBondContact O-N 2.81Å; F144-A146 PolarHBondContact O-N 3.46Å; F144-I147 HydrophobicContact CD1-CD1 4.24Å; F144-I147 WeakPolarHBondContact O-CB 3.2Å; F144-I147 PolarHBondContact O-N 3.04Å; F144-F148 HydrophobicContact CB-CD2 4.36Å; F144-F148 HydrophobicContact CB-CE2 3.68Å; F144-F148 HydrophobicContact CB-CZ 4Å; F144-F148 HydrophobicContact CD1-CE1 4.34Å; F144-F148 HydrophobicContact CD1-CE2 4.26Å; F144-F148 AromaticContact CD1-CZ 3.68Å; F144-F148 HydrophobicContact CD1-CZ 3.68Å; F144-F148 HydrophobicContact CG-CE2 4.26Å; F144-F148 HydrophobicContact CG-CZ 4.14Å; F144-F148 WeakPolarHBondContact O-CD2 3.41Å; F144-F148 WeakPolarHBondContact O-CG 3.44Å; F144-F148 PolarHBondContact O-N 3.19Å; F144-L162 HydrophobicContact CE1-CD1 4.22Å; F144-L162 HydrophobicContact CZ-CD1 4.04Å; F144-L162 HydrophobicContact CZ-CD2 4.48Å; F144-V176 HydrophobicContact CE2-CG1 4.1Å; F144-V176 HydrophobicContact CZ-CG1 4.42Å; F144-L179 HydrophobicContact CD2-CD2 4.14Å; F144-L179 HydrophobicContact CE2-CD2 4.5Å; F144-L180 HydrophobicContact CD1-CD2 4.4Å; F144-L180 HydrophobicContact CD2-CD2 4.15Å; F144-L180 HydrophobicContact CE1-CD2 4.35Å; F144-L180 HydrophobicContact CE2-CD2 4.08Å; F144-L180 HydrophobicContact CG-CD2 4.31Å; F144-L180 HydrophobicContact CZ-CD1 4.45Å; F144-L180 HydrophobicContact CZ-CD2 4.2Å; F144-F184 HydrophobicContact CB-CE1 4.25Å; F144-F184 HydrophobicContact CB-CE2 3.74Å; F144-F184 HydrophobicContact CB-CZ 3.48Å; F144-F184 VanDerWaalsContact CB-CZ 3.48Å; F144-F184 HydrophobicContact CD2-CE2 4.45Å; F144-F184 HydrophobicContact CG-CE2 4.46Å
145	R	88.6	Confident	84.4	Confident	118 Å²	118	46 Å²	46	45%	0.445	24%	0.241	S	C	.	.	H	α-helix	trans	-54.5	-51.7	173.7	-71.7	179.9	-168.3	146.3	1.7	111.1	T141 I147 F148 D149 E183 F184	T141-R145 VanDerWaalsContact CG2-CZ 3.41Å; T141-R145 VanDerWaalsContact CG2-NH2 3.34Å; T141-R145 WeakPolarHBondContact O-CG 3.32Å; T141-R145 PolarHBondContact O-N 2.97Å; R145-I147 VanDerWaalsContact C-N 3.31Å; R145-I147 PolarHBondContact O-N 3.19Å; R145-F148 PolarHBondContact O-N 3Å; R145-F148 VanDerWaalsContact O-N 3.15Å; R145-D149 WeakPolarHBondContact O-CB 3.31Å; R145-D149 PolarHBondContact O-N 2.84Å; R145-E183 IonicContact CZ-OE1 3.71Å; R145-E183 IonicContact NE-OE1 3.92Å; R145-E183 IonicContact NH2-OE1 2.76Å; R145-E183 PolarHBondContact NH2-OE1 3.18Å; R145-F184 HydrophobicContact CB-CE1 4.48Å; R145-F184 HydrophobicContact CG-CE1 3.62Å; R145-F184 HydrophobicContact CG-CZ 3.7Å
146	A	82.9	Confident	85.8	Confident	7 Å²	7	46.6 Å²	46.6	6%	0.058	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-39.7	178.8	0	0	0	0	0	112.9	S104 L106 L107 Q142 V143 F144 K150	S104-A146 VanDerWaalsContact OG-CB 3.26Å; S104-A146 WeakPolarHBondContact OG-CB 3.42Å; L106-A146 VanDerWaalsContact CD2-C 3.48Å; L106-A146 HydrophobicContact CD2-CB 3.92Å; L106-A146 WeakPolarHBondContact CD2-O 3.36Å; L107-A146 HydrophobicContact CD1-CB 4.31Å; L107-A146 HydrophobicContact CG-CB 4.16Å; Q142-A146 WeakPolarHBondContact O-CB 3.48Å; Q142-A146 PolarHBondContact O-N 2.9Å; V143-A146 PolarHBondContact O-N 3.47Å; F144-A146 PolarHBondContact O-N 3.46Å; A146-K150 VanDerWaalsContact O-CB 3.25Å; A146-K150 WeakPolarHBondContact O-CB 3.36Å; A146-K150 PolarHBondContact O-N 3.24Å; A146-K150 VanDerWaalsContact O-N 3.08Å
147	I	87.5	Confident	86.7	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-51.5	174.7	-71.9	166.1	0	0	0	110.3	V67 T74 V76 F90 V143 F144 R145 K150 M151	V67-I147 HydrophobicContact CG1-CD1 4.38Å; T74-I147 HydrophobicContact CG2-CD1 4.3Å; V76-I147 HydrophobicContact CB-CG2 4.24Å; V76-I147 HydrophobicContact CG1-CG2 3.72Å; V76-I147 HydrophobicContact CG2-CD1 4.19Å; V76-I147 HydrophobicContact CG2-CG1 4.26Å; V76-I147 HydrophobicContact CG2-CG2 3.71Å; F90-I147 HydrophobicContact CE1-CG1 4.15Å; F90-I147 HydrophobicContact CZ-CD1 3.87Å; F90-I147 HydrophobicContact CZ-CG1 3.72Å; V143-I147 HydrophobicContact CG1-CD1 3.82Å; V143-I147 HydrophobicContact CG1-CG1 4.42Å; V143-I147 VanDerWaalsContact O-CG1 3.25Å; V143-I147 WeakPolarHBondContact O-CG1 3.37Å; V143-I147 PolarHBondContact O-N 3.48Å; F144-I147 HydrophobicContact CD1-CD1 4.24Å; F144-I147 WeakPolarHBondContact O-CB 3.2Å; F144-I147 PolarHBondContact O-N 3.04Å; R145-I147 VanDerWaalsContact C-N 3.31Å; R145-I147 PolarHBondContact O-N 3.19Å; I147-K150 PolarHBondContact O-N 3.08Å; I147-M151 HydrophobicContact CG2-CG 4.26Å; I147-M151 WeakPolarHBondContact O-CB 3.4Å; I147-M151 VanDerWaalsContact O-CG 3.23Å; I147-M151 WeakPolarHBondContact O-CG 3.31Å; I147-M151 PolarHBondContact O-N 3.47Å
148	F	91.5	Very high	87.4	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.013	23%	0.229	C	C	.	.	H	α-helix	trans	-70.1	-38.7	-172.8	-56	-32.3	0	0	0	112.3	V67 F144 R145 K150 M151 G152 I153 P155 L180 F184 F186	V67-F148 HydrophobicContact CG2-CE1 4.44Å; F144-F148 HydrophobicContact CB-CD2 4.36Å; F144-F148 HydrophobicContact CB-CE2 3.68Å; F144-F148 HydrophobicContact CB-CZ 4Å; F144-F148 HydrophobicContact CD1-CE1 4.34Å; F144-F148 HydrophobicContact CD1-CE2 4.26Å; F144-F148 AromaticContact CD1-CZ 3.68Å; F144-F148 HydrophobicContact CD1-CZ 3.68Å; F144-F148 HydrophobicContact CG-CE2 4.26Å; F144-F148 HydrophobicContact CG-CZ 4.14Å; F144-F148 WeakPolarHBondContact O-CD2 3.41Å; F144-F148 WeakPolarHBondContact O-CG 3.44Å; F144-F148 PolarHBondContact O-N 3.19Å; R145-F148 PolarHBondContact O-N 3Å; R145-F148 VanDerWaalsContact O-N 3.15Å; F148-K150 PolarHBondContact O-N 3.22Å; F148-M151 PolarHBondContact O-N 2.92Å; F148-G152 PolarHBondContact O-N 3.15Å; F148-I153 HydrophobicContact CB-CG1 3.92Å; F148-I153 HydrophobicContact CD1-CD1 3.69Å; F148-I153 HydrophobicContact CD1-CG1 4.06Å; F148-I153 HydrophobicContact CE1-CD1 4.34Å; F148-I153 HydrophobicContact CG-CD1 4.34Å; F148-I153 HydrophobicContact CG-CG1 4.28Å; F148-I153 PolarHBondContact O-N 2.91Å; F148-I153 VanDerWaalsContact O-N 3.1Å; F148-P155 HydrophobicContact CB-CG 4.15Å; F148-P155 HydrophobicContact CD2-CG 3.63Å; F148-P155 HydrophobicContact CE2-CG 4.25Å; F148-P155 HydrophobicContact CG-CG 3.97Å; F148-L180 HydrophobicContact CZ-CD2 4.36Å; F148-F184 AromaticContact CD2-CD1 3.65Å; F148-F184 HydrophobicContact CD2-CD1 3.65Å; F148-F184 AromaticContact CD2-CE1 3.6Å; F148-F184 HydrophobicContact CD2-CE1 3.6Å; F148-F184 HydrophobicContact CD2-CG 4.44Å; F148-F184 HydrophobicContact CD2-CZ 4.37Å; F148-F184 AromaticContact CE2-CD1 3.6Å; F148-F184 HydrophobicContact CE2-CD1 3.6Å; F148-F184 HydrophobicContact CE2-CD2 4.37Å; F148-F184 AromaticContact CE2-CE1 3.67Å; F148-F184 HydrophobicContact CE2-CE1 3.67Å; F148-F184 HydrophobicContact CE2-CE2 4.43Å; F148-F184 AromaticContact CE2-CG 3.95Å; F148-F184 HydrophobicContact CE2-CG 3.95Å; F148-F184 HydrophobicContact CE2-CZ 4.1Å; F148-F186 HydrophobicContact CD1-CZ 4.3Å; F148-F186 HydrophobicContact CD2-CE2 4.44Å; F148-F186 HydrophobicContact CD2-CZ 4.39Å; F148-F186 HydrophobicContact CE1-CE2 4.22Å; F148-F186 AromaticContact CE1-CZ 3.69Å; F148-F186 HydrophobicContact CE1-CZ 3.69Å; F148-F186 AromaticContact CE2-CE2 3.58Å; F148-F186 HydrophobicContact CE2-CE2 3.58Å; F148-F186 AromaticContact CE2-CZ 3.79Å; F148-F186 HydrophobicContact CE2-CZ 3.79Å; F148-F186 AromaticContact CZ-CE2 3.46Å; F148-F186 HydrophobicContact CZ-CE2 3.46Å; F148-F186 VanDerWaalsContact CZ-CE2 3.46Å; F148-F186 AromaticContact CZ-CZ 3.42Å; F148-F186 HydrophobicContact CZ-CZ 3.42Å; F148-F186 VanDerWaalsContact CZ-CZ 3.42Å
149	D	87.8	Confident	88.1	Confident	128 Å²	128	39.2 Å²	39.2	68%	0.684	21%	0.208	S	C	*	.	H	α-helix	trans	-59.6	-46.8	172.6	-67.5	-16.9	0	0	0	110.7	R145 M151 G152	R145-D149 WeakPolarHBondContact O-CB 3.31Å; R145-D149 PolarHBondContact O-N 2.84Å; D149-M151 PolarHBondContact O-N 2.99Å; D149-G152 PolarHBondContact O-N 2.81Å; D149-G152 VanDerWaalsContact O-N 3.12Å
150	K	83.9	Confident	89	Confident	97 Å²	97	36.8 Å²	36.8	42%	0.422	20%	0.198	S	C	.	.	H	α-helix	trans	-69.9	-32.2	-179.6	-168.6	64.9	173.9	-176.9	0	113.1	L88 L106 A146 I147 F148	L88-K150 HydrophobicContact CD1-CB 4.05Å; L88-K150 HydrophobicContact CD1-CG 4.04Å; L88-K150 HydrophobicContact CD2-CG 3.75Å; L106-K150 HydrophobicContact CD2-CB 3.84Å; L106-K150 HydrophobicContact CD2-CG 4.25Å; A146-K150 VanDerWaalsContact O-CB 3.25Å; A146-K150 WeakPolarHBondContact O-CB 3.36Å; A146-K150 PolarHBondContact O-N 3.24Å; A146-K150 VanDerWaalsContact O-N 3.08Å; I147-K150 PolarHBondContact O-N 3.08Å; F148-K150 PolarHBondContact O-N 3.22Å
151	M	86.2	Confident	89.7	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.015	20%	0.198	C	C	.	.	H	α-helix	trans	-75.8	-12.1	173.3	-72	-62.6	-62.1	0	0	112.8	V76 L78 H87 L88 I147 F148 D149 I153	V76-M151 HydrophobicContact CB-SD 4.4Å; V76-M151 HydrophobicContact CG1-CE 4.31Å; V76-M151 HydrophobicContact CG1-CG 3.79Å; V76-M151 HydrophobicContact CG1-SD 3.9Å; L78-M151 HydrophobicContact CD1-CE 4.16Å; L78-M151 HydrophobicContact CD2-CE 3.93Å; L78-M151 HydrophobicContact CG-CE 3.61Å; H87-M151 HydrophobicContact CB-CE 3.91Å; H87-M151 HydrophobicContact CB-SD 3.84Å; L88-M151 HydrophobicContact CD1-CG 3.67Å; L88-M151 HydrophobicContact CD1-SD 3.64Å; L88-M151 HydrophobicContact CG-CG 4.34Å; L88-M151 HydrophobicContact CG-SD 3.62Å; I147-M151 HydrophobicContact CG2-CG 4.26Å; I147-M151 WeakPolarHBondContact O-CB 3.4Å; I147-M151 VanDerWaalsContact O-CG 3.23Å; I147-M151 WeakPolarHBondContact O-CG 3.31Å; I147-M151 PolarHBondContact O-N 3.47Å; F148-M151 PolarHBondContact O-N 2.92Å; D149-M151 PolarHBondContact O-N 2.99Å; M151-I153 VanDerWaalsContact C-N 3.26Å; M151-I153 HydrophobicContact CB-CG1 4.2Å; M151-I153 HydrophobicContact CB-CG2 4.12Å; M151-I153 PolarHBondContact O-N 3.39Å
152	G	89.1	Confident	90.1	Very high	67 Å²	67	36.5 Å²	36.5	69%	0.691	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	29.7	-175.6	0	0	0	0	0	113.3	F148 D149	F148-G152 PolarHBondContact O-N 3.15Å; D149-G152 PolarHBondContact O-N 2.81Å; D149-G152 VanDerWaalsContact O-N 3.12Å
153	I	90.6	Very high	90.7	Very high	15 Å²	15	33.5 Å²	33.5	8%	0.077	18%	0.182	C	C	.	.			trans	-102.4	142.4	-179.7	67.3	173	0	0	0	111.5	C65 L78 F148 M151 P155 F158	C65-I153 HydrophobicContact CB-CD1 3.86Å; L78-I153 HydrophobicContact CD1-CG2 4.23Å; L78-I153 HydrophobicContact CD2-CG2 3.99Å; F148-I153 HydrophobicContact CB-CG1 3.92Å; F148-I153 HydrophobicContact CD1-CD1 3.69Å; F148-I153 HydrophobicContact CD1-CG1 4.06Å; F148-I153 HydrophobicContact CE1-CD1 4.34Å; F148-I153 HydrophobicContact CG-CD1 4.34Å; F148-I153 HydrophobicContact CG-CG1 4.28Å; F148-I153 PolarHBondContact O-N 2.91Å; F148-I153 VanDerWaalsContact O-N 3.1Å; M151-I153 VanDerWaalsContact C-N 3.26Å; M151-I153 HydrophobicContact CB-CG1 4.2Å; M151-I153 HydrophobicContact CB-CG2 4.12Å; M151-I153 PolarHBondContact O-N 3.39Å; I153-P155 WeakPolarHBondContact O-CD 3.43Å; I153-F158 HydrophobicContact CB-CD2 4.08Å; I153-F158 HydrophobicContact CB-CE2 3.8Å; I153-F158 HydrophobicContact CB-CZ 4.11Å; I153-F158 HydrophobicContact CG2-CD2 4.5Å; I153-F158 HydrophobicContact CG2-CE1 4.06Å; I153-F158 HydrophobicContact CG2-CE2 3.93Å; I153-F158 HydrophobicContact CG2-CZ 3.68Å
154	H	94.3	Very high	90.9	Very high	116 Å²	116	33.4 Å²	33.4	54%	0.537	18%	0.181	S	C	.	.			trans	-95.5	103.7	168.5	179.2	-119.1	0	0	0	108.5	P156 S157 F158	H154-P156 VanDerWaalsContact C-N 3.33Å; H154-P156 VanDerWaalsContact CE1-CG 3.47Å; H154-P156 WeakPolarHBondContact CE1-CG 3.39Å; H154-P156 VanDerWaalsContact O-N 3.14Å; H154-S157 PolarHBondContact ND1-OG 3.39Å; H154-S157 VanDerWaalsContact O-CB 3.31Å; H154-S157 WeakPolarHBondContact O-CB 2.85Å; H154-S157 PolarHBondContact O-N 3.26Å; H154-F158 WeakPolarHBondContact O-CD2 2.95Å
155	P	95.8	Very high	90.5	Very high	16 Å²	16	34 Å²	34	10%	0.104	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-49.9	-39.3	-171.3	-30.9	39	0	0	0	115.9	F148 I153 S157 F158 F184 F186	F148-P155 HydrophobicContact CB-CG 4.15Å; F148-P155 HydrophobicContact CD2-CG 3.63Å; F148-P155 HydrophobicContact CE2-CG 4.25Å; F148-P155 HydrophobicContact CG-CG 3.97Å; I153-P155 WeakPolarHBondContact O-CD 3.43Å; P155-S157 PolarHBondContact O-N 3.01Å; P155-F158 PolarHBondContact O-N 3.13Å; P155-F184 HydrophobicContact CB-CB 4.13Å; P155-F184 VanDerWaalsContact CB-O 3.3Å; P155-F184 WeakPolarHBondContact CB-O 3.48Å; P155-F184 HydrophobicContact CG-CD1 4.2Å; P155-F186 HydrophobicContact CB-CD1 4.19Å; P155-F186 HydrophobicContact CB-CD2 4Å; P155-F186 HydrophobicContact CB-CE1 3.89Å; P155-F186 HydrophobicContact CB-CE2 3.68Å; P155-F186 HydrophobicContact CB-CG 4.25Å; P155-F186 HydrophobicContact CB-CZ 3.62Å; P155-F186 HydrophobicContact CG-CE2 4.33Å; P155-F186 HydrophobicContact CG-CZ 4.13Å; P155-F186 WeakPolarHBondContact O-CD1 3.4Å
156	P	96.2	Very high	89.8	Confident	38 Å²	38	29.2 Å²	29.2	25%	0.247	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-60.3	-17.4	175.2	-22.3	31.9	0	0	0	115.7	H154 Q185 K187	H154-P156 VanDerWaalsContact C-N 3.33Å; H154-P156 VanDerWaalsContact CE1-CG 3.47Å; H154-P156 WeakPolarHBondContact CE1-CG 3.39Å; H154-P156 VanDerWaalsContact O-N 3.14Å; P156-Q185 VanDerWaalsContact CA-O 3.26Å; P156-Q185 WeakPolarHBondContact CA-O 3.47Å; P156-Q185 HydrophobicContact CB-CB 4.5Å; P156-Q185 HydrophobicContact CG-CB 4.04Å; P156-K187 VanDerWaalsContact O-CE 3.27Å; P156-K187 WeakPolarHBondContact O-CE 3.43Å; P156-K187 VanDerWaalsContact O-CG 3.24Å; P156-K187 WeakPolarHBondContact O-CG 3.29Å
157	S	94.2	Very high	89.3	Confident	37 Å²	37	34.1 Å²	34.1	26%	0.259	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-86.8	-11.6	177.3	-63.6	0	0	0	0	113.3	K63 H154 P155 K187	K63-S157 WeakPolarHBondContact CD-O 3.41Å; H154-S157 PolarHBondContact ND1-OG 3.39Å; H154-S157 VanDerWaalsContact O-CB 3.31Å; H154-S157 WeakPolarHBondContact O-CB 2.85Å; H154-S157 PolarHBondContact O-N 3.26Å; P155-S157 PolarHBondContact O-N 3.01Å; S157-K187 PolarHBondContact O-NZ 3.03Å
158	F	94.8	Very high	88.6	Confident	17 Å²	17	35 Å²	35	8%	0.075	20%	0.198	C	C	.	.			trans	-119.4	158.4	-168.9	-74.8	-103	0	0	0	112.5	K63 L78 I153 H154 P155 F186 K187	K63-F158 VanDerWaalsContact C-CD1 3.41Å; K63-F158 HydrophobicContact CB-CD1 3.86Å; K63-F158 HydrophobicContact CB-CE1 4.04Å; K63-F158 HydrophobicContact CB-CG 4.22Å; K63-F158 HydrophobicContact CG-CE1 4.43Å; K63-F158 CarbonylContact O-C 3.49Å; K63-F158 VanDerWaalsContact O-CA 3.27Å; K63-F158 WeakPolarHBondContact O-CA 3.14Å; K63-F158 WeakPolarHBondContact O-CD1 3.4Å; L78-F158 HydrophobicContact CD2-CD1 4.46Å; L78-F158 HydrophobicContact CD2-CE1 4.03Å; I153-F158 HydrophobicContact CB-CD2 4.08Å; I153-F158 HydrophobicContact CB-CE2 3.8Å; I153-F158 HydrophobicContact CB-CZ 4.11Å; I153-F158 HydrophobicContact CG2-CD2 4.5Å; I153-F158 HydrophobicContact CG2-CE1 4.06Å; I153-F158 HydrophobicContact CG2-CE2 3.93Å; I153-F158 HydrophobicContact CG2-CZ 3.68Å; H154-F158 WeakPolarHBondContact O-CD2 2.95Å; P155-F158 PolarHBondContact O-N 3.13Å; F158-F186 HydrophobicContact CB-CD1 4.19Å; F158-F186 HydrophobicContact CB-CE1 4.04Å; F158-F186 WeakPolarHBondContact O-CD1 3.28Å; F158-K187 WeakPolarHBondContact O-CB 3.36Å; F158-K187 PolarHBondContact O-N 3.41Å
159	Q	94.9	Very high	87.9	Confident	36 Å²	36	37 Å²	37	17%	0.168	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	158.2	155.2	-64.4	174.3	-14.6	0	0	109	K63 I64 C65 K187 G188 L384	K63-Q159 PolarHBondContact O-N 2.83Å; I64-Q159 WeakPolarHBondContact CA-O 2.83Å; I64-Q159 HydrophobicContact CG1-CB 4.2Å; I64-Q159 HydrophobicContact CG2-CB 4.47Å; C65-Q159 PolarHBondContact N-O 3.28Å; Q159-K187 HydrophobicContact CG-CB 4.18Å; Q159-G188 CarbonylContact C-O 3.52Å; Q159-G188 VanDerWaalsContact CA-O 3.3Å; Q159-G188 WeakPolarHBondContact CA-O 3.49Å; Q159-L384 HydrophobicContact CB-CD1 4.29Å; Q159-L384 HydrophobicContact CG-CD1 4.21Å; Q159-L384 HydrophobicContact CG-CD2 4.37Å
160	L	95.4	Very high	87.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.6	178.9	-179.9	69.8	0	0	0	110.5	C65 V67 L180 F186 G188 V189 A190	C65-L160 HydrophobicContact CB-CD1 4.03Å; C65-L160 CarbonylContact O-C 3.55Å; C65-L160 WeakPolarHBondContact O-CA 3.34Å; V67-L160 HydrophobicContact CB-CD1 4.22Å; V67-L160 HydrophobicContact CG2-CD1 3.66Å; L160-L180 HydrophobicContact CD2-CD1 3.69Å; L160-L180 HydrophobicContact CD2-CD2 3.53Å; L160-L180 HydrophobicContact CD2-CG 4.09Å; L160-F186 HydrophobicContact CB-CD1 3.73Å; L160-F186 HydrophobicContact CB-CD2 4.35Å; L160-F186 HydrophobicContact CB-CE1 3.79Å; L160-F186 HydrophobicContact CB-CE2 4.4Å; L160-F186 HydrophobicContact CB-CG 4.03Å; L160-F186 HydrophobicContact CB-CZ 4.13Å; L160-F186 HydrophobicContact CD1-CE1 4.41Å; L160-F186 HydrophobicContact CD1-CZ 4.23Å; L160-F186 HydrophobicContact CD2-CD2 4.15Å; L160-F186 HydrophobicContact CD2-CE2 3.84Å; L160-F186 HydrophobicContact CD2-CZ 4.06Å; L160-F186 HydrophobicContact CG-CE1 4.48Å; L160-F186 HydrophobicContact CG-CZ 4.39Å; L160-G188 PolarHBondContact N-O 2.94Å; L160-V189 HydrophobicContact CB-CG2 4.37Å; L160-V189 CarbonylContact O-C 3.57Å; L160-V189 VanDerWaalsContact O-CA 3.29Å; L160-V189 WeakPolarHBondContact O-CA 3.4Å; L160-A190 PolarHBondContact O-N 3.32Å
161	L	95.1	Very high	87.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	112.6	163	-167.4	167.5	0	0	0	108.5	C65 V66 V67 A190 E192 L197 A371 V374 A375	C65-L161 PolarHBondContact O-N 2.96Å; V66-L161 WeakPolarHBondContact CA-O 3.24Å; V66-L161 HydrophobicContact CG2-CB 4.4Å; V67-L161 PolarHBondContact N-O 3.42Å; L161-A190 CarbonylContact C-O 3.56Å; L161-A190 WeakPolarHBondContact CA-O 3.34Å; L161-A190 HydrophobicContact CG-CB 4.25Å; L161-E192 HydrophobicContact CD2-CB 4.23Å; L161-E192 HydrophobicContact CD2-CG 4.32Å; L161-L197 HydrophobicContact CD2-CD1 4.34Å; L161-A371 HydrophobicContact CD1-CB 4.4Å; L161-A371 WeakPolarHBondContact CD1-O 3.33Å; L161-A371 HydrophobicContact CD2-CB 3.75Å; L161-V374 HydrophobicContact CD1-CB 4.05Å; L161-V374 HydrophobicContact CD1-CG1 3.86Å; L161-A375 HydrophobicContact CD1-CB 4.06Å
162	L	94	Very high	87.4	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	118.7	178.8	179.9	67.5	0	0	0	110.2	V67 I69 F144 L164 V176 L180 A190 I191 E192	V67-L162 HydrophobicContact CB-CD1 4.14Å; V67-L162 HydrophobicContact CG1-CD1 4.05Å; V67-L162 CarbonylContact O-C 3.53Å; V67-L162 WeakPolarHBondContact O-CA 3.18Å; I69-L162 HydrophobicContact CD1-CD1 3.8Å; I69-L162 HydrophobicContact CG1-CD1 4.04Å; F144-L162 HydrophobicContact CE1-CD1 4.22Å; F144-L162 HydrophobicContact CZ-CD1 4.04Å; F144-L162 HydrophobicContact CZ-CD2 4.48Å; L162-L164 HydrophobicContact CD1-CD2 4.31Å; L162-L164 HydrophobicContact CD2-CD1 4.23Å; L162-L164 HydrophobicContact CD2-CD2 3.98Å; L162-L164 HydrophobicContact CD2-CG 4.11Å; L162-L164 HydrophobicContact CG-CD2 4Å; L162-L164 HydrophobicContact CG-CG 4.08Å; L162-V176 HydrophobicContact CD2-CG1 3.82Å; L162-L180 HydrophobicContact CD2-CD1 3.89Å; L162-A190 PolarHBondContact N-O 3.37Å; L162-I191 HydrophobicContact CB-CG1 4.38Å; L162-I191 HydrophobicContact CD2-CD1 4.47Å; L162-I191 HydrophobicContact CD2-CG1 4.49Å; L162-I191 CarbonylContact O-C 3.46Å; L162-I191 WeakPolarHBondContact O-CA 3.35Å; L162-E192 PolarHBondContact O-N 2.91Å
163	S	91.6	Very high	87.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	124.1	172.7	179.9	0	0	0	0	111.1	V67 I69 E192 Q194 L197	V67-S163 PolarHBondContact O-N 3.1Å; I69-S163 PolarHBondContact N-O 3.33Å; S163-E192 WeakPolarHBondContact CA-O 3.42Å; S163-Q194 WeakPolarHBondContact OG-CG 3.27Å; S163-L197 VanDerWaalsContact CB-CD1 3.46Å; S163-L197 VanDerWaalsContact OG-CD1 3.26Å; S163-L197 WeakPolarHBondContact OG-CD1 3.26Å
164	L	87	Confident	87.2	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.016	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	154.8	-178.3	-65.5	179.6	0	0	0	112.1	F130 L162 V168 V173 I191 E192 Q194	F130-L164 HydrophobicContact CB-CD2 4.29Å; F130-L164 HydrophobicContact CD1-CD1 4.34Å; F130-L164 HydrophobicContact CD1-CD2 3.61Å; F130-L164 HydrophobicContact CD2-CD2 3.99Å; F130-L164 HydrophobicContact CE1-CD2 3.82Å; F130-L164 HydrophobicContact CE2-CD2 4.27Å; F130-L164 HydrophobicContact CG-CD2 3.68Å; F130-L164 HydrophobicContact CZ-CD2 4.18Å; L162-L164 HydrophobicContact CD1-CD2 4.31Å; L162-L164 HydrophobicContact CD2-CD1 4.23Å; L162-L164 HydrophobicContact CD2-CD2 3.98Å; L162-L164 HydrophobicContact CD2-CG 4.11Å; L162-L164 HydrophobicContact CG-CD2 4Å; L162-L164 HydrophobicContact CG-CG 4.08Å; L164-V168 HydrophobicContact CB-CG2 4.25Å; L164-V173 HydrophobicContact CD1-CG2 4.16Å; L164-I191 HydrophobicContact CD1-CG2 3.68Å; L164-I191 HydrophobicContact CG-CG2 4.15Å; L164-E192 PolarHBondContact N-O 3.15Å; L164-Q194 WeakPolarHBondContact O-CG 3.37Å; L164-Q194 PolarHBondContact O-N 2.93Å; L164-Q194 VanDerWaalsContact O-N 3.11Å
165	P	79	Confident	86.9	Confident	12 Å²	12	29 Å²	29	8%	0.078	16%	0.16	C	C	.	.			trans	-60.1	160.7	171.8	-22.4	35.1	0	0	0	112.8	I69 I167	I69-P165 WeakPolarHBondContact O-CD 3.33Å; P165-I167 VanDerWaalsContact C-N 3.31Å; P165-I167 PolarHBondContact O-N 2.93Å
166	L	74.1	Confident	86.6	Confident	19 Å²	19	28.2 Å²	28.2	10%	0.099	16%	0.155	C	C	.	.	S	Bend	trans	-55.2	-38.5	-174.3	-179.5	60.6	0	0	0	114.8	R193 V195 V219 F226 A229	L166-R193 VanDerWaalsContact CD1-CD 3.44Å; L166-R193 HydrophobicContact CD1-CG 4.46Å; L166-V195 HydrophobicContact CD1-CG2 4.34Å; L166-V219 HydrophobicContact CD1-CG2 4.12Å; L166-V219 HydrophobicContact CD2-CG2 3.43Å; L166-V219 VanDerWaalsContact CD2-CG2 3.43Å; L166-V219 HydrophobicContact CG-CG2 4.41Å; L166-F226 HydrophobicContact CD1-CE1 4.21Å; L166-A229 HydrophobicContact CD1-CB 4.29Å; L166-A229 HydrophobicContact CD2-CB 3.95Å; L166-A229 HydrophobicContact CG-CB 4.49Å
167	I	71.9	Confident	86.4	Confident	110 Å²	110	26.5 Å²	26.5	56%	0.564	14%	0.144	S	C	*	.			trans	-115.6	95.6	-175.3	-54.1	-178.4	0	0	0	109	P165 S231	P165-I167 VanDerWaalsContact C-N 3.31Å; P165-I167 PolarHBondContact O-N 2.93Å; I167-S231 VanDerWaalsContact CD1-CB 3.41Å
168	V	73.8	Confident	86.4	Confident	18 Å²	18	29.4 Å²	29.4	11%	0.109	15%	0.149	C	C	.	.			trans	-129.1	133.2	168.2	-174.1	0	0	0	0	107.4	F130 L164 K172 V173	F130-V168 HydrophobicContact CB-CG1 4.46Å; F130-V168 HydrophobicContact CB-CG2 4.03Å; F130-V168 HydrophobicContact CD1-CG1 4.37Å; L164-V168 HydrophobicContact CB-CG2 4.25Å; V168-K172 HydrophobicContact CG1-CB 4.11Å; V168-K172 HydrophobicContact CG1-CD 4.47Å; V168-V173 HydrophobicContact CB-CG2 3.99Å; V168-V173 HydrophobicContact CG1-CG2 3.68Å
169	S	76.8	Confident	86.4	Confident	45 Å²	45	29.3 Å²	29.3	32%	0.315	15%	0.149	S	C	.	.			trans	-66.9	141.9	-179.2	62.8	0	0	0	0	111	S171 K172 V173	S169-S171 VanDerWaalsContact C-N 3.25Å; S169-S171 PolarHBondContact O-N 3.42Å; S169-K172 PolarHBondContact O-N 3.48Å; S169-K172 WeakPolarHBondContact OG-CD 3.29Å; S169-K172 VanDerWaalsContact OG-CE 3.24Å; S169-K172 WeakPolarHBondContact OG-CE 3.49Å; S169-K172 WeakPolarHBondContact OG-CG 3.32Å; S169-K172 PolarHBondContact OG-NZ 3.09Å; S169-V173 PolarHBondContact O-N 3.31Å; S169-V173 VanDerWaalsContact O-N 3.15Å
170	R	81	Confident	86.4	Confident	98 Å²	98	27.6 Å²	27.6	37%	0.37	14%	0.141	S	C	.	.	H	α-helix	trans	-49.9	-44.8	179.9	171.8	171.3	176.9	129.7	6.3	112.8	K172 V173 I174 I394 S397 L399	R170-K172 VanDerWaalsContact C-N 3.33Å; R170-K172 PolarHBondContact O-N 3.16Å; R170-V173 PolarHBondContact O-N 3.08Å; R170-I174 HydrophobicContact CG-CD1 3.8Å; R170-I174 HydrophobicContact CG-CG1 4.46Å; R170-I174 VanDerWaalsContact O-CG1 3.32Å; R170-I174 WeakPolarHBondContact O-CG1 3.38Å; R170-I174 PolarHBondContact O-N 3.33Å; R170-I394 PolarHBondContact NH2-O 2.78Å; R170-S397 PolarHBondContact NH1-O 3.15Å; R170-S397 PolarHBondContact NH2-O 3.41Å; R170-L399 HydrophobicContact CB-CB 4.24Å; R170-L399 HydrophobicContact CG-CB 3.63Å; R170-L399 HydrophobicContact CG-CD1 4.11Å; R170-L399 HydrophobicContact CG-CG 4.46Å
171	S	83	Confident	86.5	Confident	73 Å²	73	27.6 Å²	27.6	51%	0.51	14%	0.141	S	C	.	.	H	α-helix	trans	-54.4	-48.1	178	-168.3	0	0	0	0	111.9	S169 V173 I174 D175	S169-S171 VanDerWaalsContact C-N 3.25Å; S169-S171 PolarHBondContact O-N 3.42Å; S171-V173 PolarHBondContact O-N 3.27Å; S171-I174 WeakPolarHBondContact O-CB 3.18Å; S171-I174 PolarHBondContact O-N 3.13Å; S171-D175 PolarHBondContact O-N 2.86Å; S171-D175 VanDerWaalsContact O-OD2 3.13Å
172	K	82.6	Confident	86.5	Confident	16 Å²	16	32.7 Å²	32.7	7%	0.07	17%	0.165	C	C	.	.	H	α-helix	trans	-68.5	-36.8	-178.6	-66	173.2	-159.6	147.6	0	112.7	S132 D133 L135 V168 S169 R170 I174 D175 V176	S132-K172 WeakPolarHBondContact O-CE 3.11Å; S132-K172 PolarHBondContact O-NZ 3.48Å; D133-K172 IonicContact OD1-NZ 3.66Å; D133-K172 PolarHBondContact OD1-NZ 3.33Å; L135-K172 HydrophobicContact CB-CD 3.74Å; L135-K172 HydrophobicContact CB-CG 4.24Å; L135-K172 HydrophobicContact CD1-CB 4.44Å; L135-K172 HydrophobicContact CD1-CD 4.31Å; L135-K172 HydrophobicContact CD2-CG 4.43Å; L135-K172 HydrophobicContact CG-CD 4.48Å; V168-K172 HydrophobicContact CG1-CB 4.11Å; V168-K172 HydrophobicContact CG1-CD 4.47Å; S169-K172 PolarHBondContact O-N 3.48Å; S169-K172 WeakPolarHBondContact OG-CD 3.29Å; S169-K172 VanDerWaalsContact OG-CE 3.24Å; S169-K172 WeakPolarHBondContact OG-CE 3.49Å; S169-K172 WeakPolarHBondContact OG-CG 3.32Å; S169-K172 PolarHBondContact OG-NZ 3.09Å; R170-K172 VanDerWaalsContact C-N 3.33Å; R170-K172 PolarHBondContact O-N 3.16Å; K172-I174 VanDerWaalsContact C-N 3.26Å; K172-I174 PolarHBondContact O-N 3.22Å; K172-D175 PolarHBondContact O-N 3.01Å; K172-V176 WeakPolarHBondContact O-CB 3.4Å; K172-V176 WeakPolarHBondContact O-CG2 3.43Å; K172-V176 PolarHBondContact O-N 2.95Å
173	V	86.5	Confident	86.5	Confident	9 Å²	9	37.5 Å²	37.5	6%	0.055	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-42.8	175.1	179.8	0	0	0	0	109.5	L164 V168 S169 R170 S171 V176 L177 I191 L399	L164-V173 HydrophobicContact CD1-CG2 4.16Å; V168-V173 HydrophobicContact CB-CG2 3.99Å; V168-V173 HydrophobicContact CG1-CG2 3.68Å; S169-V173 PolarHBondContact O-N 3.31Å; S169-V173 VanDerWaalsContact O-N 3.15Å; R170-V173 PolarHBondContact O-N 3.08Å; S171-V173 PolarHBondContact O-N 3.27Å; V173-V176 PolarHBondContact O-N 3.37Å; V173-L177 VanDerWaalsContact O-CB 3.26Å; V173-L177 WeakPolarHBondContact O-CB 3.47Å; V173-L177 PolarHBondContact O-N 3.46Å; V173-I191 HydrophobicContact CG1-CD1 3.79Å; V173-I191 HydrophobicContact CG1-CG2 4.23Å; V173-L399 HydrophobicContact CB-CD2 4Å; V173-L399 HydrophobicContact CG1-CD2 3.45Å; V173-L399 VanDerWaalsContact CG1-CD2 3.45Å
174	I	89	Confident	86.7	Confident	15 Å²	15	38.6 Å²	38.6	8%	0.077	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-45.3	175.5	-65.7	167.5	0	0	0	111.1	R170 S171 K172 V176 L177 R178 I394 L399	R170-I174 HydrophobicContact CG-CD1 3.8Å; R170-I174 HydrophobicContact CG-CG1 4.46Å; R170-I174 VanDerWaalsContact O-CG1 3.32Å; R170-I174 WeakPolarHBondContact O-CG1 3.38Å; R170-I174 PolarHBondContact O-N 3.33Å; S171-I174 WeakPolarHBondContact O-CB 3.18Å; S171-I174 PolarHBondContact O-N 3.13Å; K172-I174 VanDerWaalsContact C-N 3.26Å; K172-I174 PolarHBondContact O-N 3.22Å; I174-V176 VanDerWaalsContact C-N 3.3Å; I174-V176 PolarHBondContact O-N 3.04Å; I174-L177 WeakPolarHBondContact O-CB 3.35Å; I174-L177 PolarHBondContact O-N 3.26Å; I174-R178 HydrophobicContact CG2-CG 4.44Å; I174-R178 WeakPolarHBondContact O-CG 3.43Å; I174-R178 PolarHBondContact O-N 3.07Å; I174-I394 HydrophobicContact CD1-CG2 3.84Å; I174-I394 HydrophobicContact CG1-CG1 4.36Å; I174-I394 HydrophobicContact CG1-CG2 4.33Å; I174-I394 HydrophobicContact CG2-CD1 3.89Å; I174-L399 HydrophobicContact CD1-CD1 3.96Å; I174-L399 HydrophobicContact CG1-CD1 3.64Å
175	D	88.9	Confident	87.2	Confident	46 Å²	46	43.7 Å²	43.7	25%	0.246	22%	0.216	C	C	.	.	H	α-helix	trans	-62.4	-40.2	-179.3	-64.1	-29.9	0	0	0	111.8	L137 S171 K172 R178 L179	L137-D175 HydrophobicContact CD1-CB 3.81Å; L137-D175 HydrophobicContact CD2-CB 3.8Å; L137-D175 HydrophobicContact CG-CB 4.35Å; S171-D175 PolarHBondContact O-N 2.86Å; S171-D175 VanDerWaalsContact O-OD2 3.13Å; K172-D175 PolarHBondContact O-N 3.01Å; D175-R178 PolarHBondContact O-N 3.16Å; D175-R178 IonicContact OD1-NH1 3.48Å; D175-R178 PolarHBondContact OD1-NH1 3.24Å; D175-L179 WeakPolarHBondContact O-CB 3.42Å; D175-L179 PolarHBondContact O-N 3.29Å
176	V	89.3	Confident	88.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-71.7	-37.3	175.9	170.6	0	0	0	0	111.9	F130 L135 L137 V140 F144 L162 K172 V173 I174 R178 L179 L180	F130-V176 HydrophobicContact CD1-CG2 4.37Å; F130-V176 HydrophobicContact CE1-CB 3.96Å; F130-V176 HydrophobicContact CE1-CG1 3.84Å; F130-V176 HydrophobicContact CE1-CG2 3.31Å; F130-V176 HydrophobicContact CZ-CB 4.46Å; F130-V176 HydrophobicContact CZ-CG1 3.97Å; F130-V176 HydrophobicContact CZ-CG2 3.81Å; L135-V176 HydrophobicContact CD1-CG2 4.36Å; L135-V176 HydrophobicContact CD2-CG2 4.48Å; L137-V176 HydrophobicContact CD2-CG2 4.09Å; V140-V176 HydrophobicContact CG1-CG2 4.34Å; F144-V176 HydrophobicContact CE2-CG1 4.1Å; F144-V176 HydrophobicContact CZ-CG1 4.42Å; L162-V176 HydrophobicContact CD2-CG1 3.82Å; K172-V176 WeakPolarHBondContact O-CB 3.4Å; K172-V176 WeakPolarHBondContact O-CG2 3.43Å; K172-V176 PolarHBondContact O-N 2.95Å; V173-V176 PolarHBondContact O-N 3.37Å; I174-V176 VanDerWaalsContact C-N 3.3Å; I174-V176 PolarHBondContact O-N 3.04Å; V176-R178 VanDerWaalsContact C-N 3.34Å; V176-L179 WeakPolarHBondContact O-CB 3.26Å; V176-L179 PolarHBondContact O-N 3.05Å; V176-L180 HydrophobicContact CG1-CD1 3.72Å; V176-L180 HydrophobicContact CG1-CG 4.31Å; V176-L180 WeakPolarHBondContact O-CB 3.38Å; V176-L180 WeakPolarHBondContact O-CD1 3.34Å; V176-L180 WeakPolarHBondContact O-CG 3.29Å; V176-L180 PolarHBondContact O-N 2.84Å
177	L	92.7	Very high	89	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-59.9	-45.5	172.8	178.7	64.3	0	0	0	111.2	V173 I174 L180 L181 V189 I191 I385 M390 I394	V173-L177 VanDerWaalsContact O-CB 3.26Å; V173-L177 WeakPolarHBondContact O-CB 3.47Å; V173-L177 PolarHBondContact O-N 3.46Å; I174-L177 WeakPolarHBondContact O-CB 3.35Å; I174-L177 PolarHBondContact O-N 3.26Å; L177-L180 PolarHBondContact O-N 3.38Å; L177-L181 HydrophobicContact CD1-CD1 3.64Å; L177-L181 HydrophobicContact CD1-CG 4.14Å; L177-L181 HydrophobicContact CG-CD1 3.97Å; L177-L181 WeakPolarHBondContact O-CB 3.38Å; L177-L181 PolarHBondContact O-N 3.17Å; L177-V189 HydrophobicContact CD1-CB 3.88Å; L177-V189 HydrophobicContact CD1-CG1 3.94Å; L177-I191 HydrophobicContact CB-CD1 4.09Å; L177-I191 HydrophobicContact CD1-CD1 4.12Å; L177-I385 HydrophobicContact CD1-CB 4.25Å; L177-I385 HydrophobicContact CD1-CD1 4.25Å; L177-I385 HydrophobicContact CD1-CG2 4.31Å; L177-I385 HydrophobicContact CD2-CD1 3.83Å; L177-I385 HydrophobicContact CD2-CG2 4.21Å; L177-M390 HydrophobicContact CD2-CG 4.27Å; L177-I394 HydrophobicContact CD2-CG1 4.33Å
178	R	93.7	Very high	90.1	Very high	99 Å²	99	42.9 Å²	42.9	37%	0.374	21%	0.207	S	C	.	.	H	α-helix	trans	-61.4	-46.9	175.2	-73.5	176.8	-176.1	140.4	-3	111.6	I174 D175 V176 L180 L181 Q182 M390	I174-R178 HydrophobicContact CG2-CG 4.44Å; I174-R178 WeakPolarHBondContact O-CG 3.43Å; I174-R178 PolarHBondContact O-N 3.07Å; D175-R178 PolarHBondContact O-N 3.16Å; D175-R178 IonicContact OD1-NH1 3.48Å; D175-R178 PolarHBondContact OD1-NH1 3.24Å; V176-R178 VanDerWaalsContact C-N 3.34Å; R178-L180 VanDerWaalsContact C-N 3.31Å; R178-L180 PolarHBondContact O-N 3.12Å; R178-L181 PolarHBondContact O-N 3.03Å; R178-Q182 WeakPolarHBondContact O-CA 3.44Å; R178-Q182 WeakPolarHBondContact O-CB 3.37Å; R178-Q182 WeakPolarHBondContact O-CG 3.06Å; R178-Q182 PolarHBondContact O-N 2.82Å; R178-M390 HydrophobicContact CG-CE 4.36Å; R178-M390 HydrophobicContact CG-SD 4.06Å
179	L	94.3	Very high	91.1	Very high	14 Å²	14	42 Å²	42	7%	0.073	20%	0.201	C	C	.	.	I	π-helix	trans	-53.6	-49.3	175.2	173.2	66.1	0	0	0	111.5	V140 T141 F144 D175 V176 E183 F184	V140-L179 HydrophobicContact CG1-CD2 4.08Å; T141-L179 HydrophobicContact CG2-CD1 3.98Å; T141-L179 WeakPolarHBondContact OG1-CD1 3.45Å; T141-L179 VanDerWaalsContact OG1-CD2 3.29Å; T141-L179 WeakPolarHBondContact OG1-CD2 3.44Å; F144-L179 HydrophobicContact CD2-CD2 4.14Å; F144-L179 HydrophobicContact CE2-CD2 4.5Å; D175-L179 WeakPolarHBondContact O-CB 3.42Å; D175-L179 PolarHBondContact O-N 3.29Å; V176-L179 WeakPolarHBondContact O-CB 3.26Å; V176-L179 PolarHBondContact O-N 3.05Å; L179-E183 HydrophobicContact CD1-CB 3.95Å; L179-E183 HydrophobicContact CD1-CG 4.37Å; L179-E183 WeakPolarHBondContact CD1-OE2 3.39Å; L179-E183 VanDerWaalsContact O-CB 3.3Å; L179-E183 WeakPolarHBondContact O-CB 3.3Å; L179-E183 PolarHBondContact O-N 2.78Å; L179-E183 VanDerWaalsContact O-N 3.08Å; L179-F184 HydrophobicContact CD1-CD2 4.19Å; L179-F184 HydrophobicContact CD1-CE2 3.91Å; L179-F184 HydrophobicContact CD2-CE2 4.23Å; L179-F184 HydrophobicContact CG-CD2 4.02Å; L179-F184 HydrophobicContact CG-CE2 3.86Å; L179-F184 PolarHBondContact O-N 3.31Å
180	L	95.5	Very high	91.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.186	C	C	.	.	I	π-helix	trans	-69.3	-39.5	-177.2	-67.7	166.5	0	0	0	112.8	F144 F148 L160 L162 V176 L177 R178 F184 Q185 F186 V189	F144-L180 HydrophobicContact CD1-CD2 4.4Å; F144-L180 HydrophobicContact CD2-CD2 4.15Å; F144-L180 HydrophobicContact CE1-CD2 4.35Å; F144-L180 HydrophobicContact CE2-CD2 4.08Å; F144-L180 HydrophobicContact CG-CD2 4.31Å; F144-L180 HydrophobicContact CZ-CD1 4.45Å; F144-L180 HydrophobicContact CZ-CD2 4.2Å; F148-L180 HydrophobicContact CZ-CD2 4.36Å; L160-L180 HydrophobicContact CD2-CD1 3.69Å; L160-L180 HydrophobicContact CD2-CD2 3.53Å; L160-L180 HydrophobicContact CD2-CG 4.09Å; L162-L180 HydrophobicContact CD2-CD1 3.89Å; V176-L180 HydrophobicContact CG1-CD1 3.72Å; V176-L180 HydrophobicContact CG1-CG 4.31Å; V176-L180 WeakPolarHBondContact O-CB 3.38Å; V176-L180 WeakPolarHBondContact O-CD1 3.34Å; V176-L180 WeakPolarHBondContact O-CG 3.29Å; V176-L180 PolarHBondContact O-N 2.84Å; L177-L180 PolarHBondContact O-N 3.38Å; R178-L180 VanDerWaalsContact C-N 3.31Å; R178-L180 PolarHBondContact O-N 3.12Å; L180-F184 HydrophobicContact CD2-CD2 4.2Å; L180-Q185 PolarHBondContact O-N 3.01Å; L180-F186 HydrophobicContact CB-CD2 4.32Å; L180-F186 HydrophobicContact CD2-CD2 4.22Å; L180-F186 HydrophobicContact CD2-CE2 3.98Å; L180-F186 WeakPolarHBondContact O-CD2 3.32Å; L180-F186 PolarHBondContact O-N 2.94Å; L180-F186 VanDerWaalsContact O-N 3.17Å; L180-V189 HydrophobicContact CB-CG2 3.8Å; L180-V189 HydrophobicContact CD1-CG1 4.07Å
181	L	95.9	Very high	92.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.174	C	C	.	.	I	π-helix	trans	-82.3	-39.4	-178.9	-74.8	175.7	0	0	0	113.2	L177 R178 Q185 V189 I385 Q387 M390	L177-L181 HydrophobicContact CD1-CD1 3.64Å; L177-L181 HydrophobicContact CD1-CG 4.14Å; L177-L181 HydrophobicContact CG-CD1 3.97Å; L177-L181 WeakPolarHBondContact O-CB 3.38Å; L177-L181 PolarHBondContact O-N 3.17Å; R178-L181 PolarHBondContact O-N 3.03Å; L181-Q185 VanDerWaalsContact O-CA 3.24Å; L181-Q185 WeakPolarHBondContact O-CA 3.22Å; L181-V189 HydrophobicContact CD2-CB 4.28Å; L181-V189 HydrophobicContact CD2-CG2 3.69Å; L181-V189 HydrophobicContact CG-CB 4.38Å; L181-V189 HydrophobicContact CG-CG2 3.88Å; L181-I385 HydrophobicContact CD1-CG2 3.96Å; L181-Q387 HydrophobicContact CB-CG 4.01Å; L181-Q387 PolarHBondContact O-NE2 3.16Å; L181-M390 HydrophobicContact CD1-CB 4.42Å; L181-M390 HydrophobicContact CD1-CG 4.15Å; L181-M390 HydrophobicContact CD1-SD 3.93Å
182	Q	95.5	Very high	92.7	Very high	107 Å²	107	32.9 Å²	32.9	50%	0.5	15%	0.15	S	C	.	.	I	π-helix	trans	-94.8	-43.8	-171.9	-60.2	179.9	-32.1	0	0	112.5	R178 Q185	R178-Q182 WeakPolarHBondContact O-CA 3.44Å; R178-Q182 WeakPolarHBondContact O-CB 3.37Å; R178-Q182 WeakPolarHBondContact O-CG 3.06Å; R178-Q182 PolarHBondContact O-N 2.82Å; Q182-Q185 WeakPolarHBondContact O-CG 3.4Å
183	E	94.6	Very high	92.8	Very high	101 Å²	101	33.4 Å²	33.4	47%	0.472	15%	0.152	S	C	.	.	I	π-helix	trans	-87.6	-51.8	-177.2	-167.2	-177.4	141.8	0	0	111.7	T141 R145 L179 Q185	T141-E183 WeakPolarHBondContact CG2-OE1 3.16Å; R145-E183 IonicContact CZ-OE1 3.71Å; R145-E183 IonicContact NE-OE1 3.92Å; R145-E183 IonicContact NH2-OE1 2.76Å; R145-E183 PolarHBondContact NH2-OE1 3.18Å; L179-E183 HydrophobicContact CD1-CB 3.95Å; L179-E183 HydrophobicContact CD1-CG 4.37Å; L179-E183 WeakPolarHBondContact CD1-OE2 3.39Å; L179-E183 VanDerWaalsContact O-CB 3.3Å; L179-E183 WeakPolarHBondContact O-CB 3.3Å; L179-E183 PolarHBondContact O-N 2.78Å; L179-E183 VanDerWaalsContact O-N 3.08Å; E183-Q185 VanDerWaalsContact C-N 3.3Å
184	F	96.5	Very high	92.9	Very high	23 Å²	23	33.4 Å²	33.4	10%	0.101	15%	0.151	C	C	.	.	S	Bend	trans	-78.6	-15.6	175.1	-70.4	-78.9	0	0	0	113	T141 F144 R145 F148 P155 L179 L180 F186	T141-F184 HydrophobicContact CG2-CE2 4.17Å; T141-F184 HydrophobicContact CG2-CZ 4.08Å; F144-F184 HydrophobicContact CB-CE1 4.25Å; F144-F184 HydrophobicContact CB-CE2 3.74Å; F144-F184 HydrophobicContact CB-CZ 3.48Å; F144-F184 VanDerWaalsContact CB-CZ 3.48Å; F144-F184 HydrophobicContact CD2-CE2 4.45Å; F144-F184 HydrophobicContact CG-CE2 4.46Å; R145-F184 HydrophobicContact CB-CE1 4.48Å; R145-F184 HydrophobicContact CG-CE1 3.62Å; R145-F184 HydrophobicContact CG-CZ 3.7Å; F148-F184 AromaticContact CD2-CD1 3.65Å; F148-F184 HydrophobicContact CD2-CD1 3.65Å; F148-F184 AromaticContact CD2-CE1 3.6Å; F148-F184 HydrophobicContact CD2-CE1 3.6Å; F148-F184 HydrophobicContact CD2-CG 4.44Å; F148-F184 HydrophobicContact CD2-CZ 4.37Å; F148-F184 AromaticContact CE2-CD1 3.6Å; F148-F184 HydrophobicContact CE2-CD1 3.6Å; F148-F184 HydrophobicContact CE2-CD2 4.37Å; F148-F184 AromaticContact CE2-CE1 3.67Å; F148-F184 HydrophobicContact CE2-CE1 3.67Å; F148-F184 HydrophobicContact CE2-CE2 4.43Å; F148-F184 AromaticContact CE2-CG 3.95Å; F148-F184 HydrophobicContact CE2-CG 3.95Å; F148-F184 HydrophobicContact CE2-CZ 4.1Å; P155-F184 HydrophobicContact CB-CB 4.13Å; P155-F184 VanDerWaalsContact CB-O 3.3Å; P155-F184 WeakPolarHBondContact CB-O 3.48Å; P155-F184 HydrophobicContact CG-CD1 4.2Å; L179-F184 HydrophobicContact CD1-CD2 4.19Å; L179-F184 HydrophobicContact CD1-CE2 3.91Å; L179-F184 HydrophobicContact CD2-CE2 4.23Å; L179-F184 HydrophobicContact CG-CD2 4.02Å; L179-F184 HydrophobicContact CG-CE2 3.86Å; L179-F184 PolarHBondContact O-N 3.31Å; L180-F184 HydrophobicContact CD2-CD2 4.2Å; F184-F186 VanDerWaalsContact C-N 3.28Å; F184-F186 HydrophobicContact CB-CD2 3.85Å; F184-F186 HydrophobicContact CB-CE2 3.94Å; F184-F186 PolarHBondContact O-N 3.16Å
185	Q	97	Very high	92.9	Very high	111 Å²	111	32.8 Å²	32.8	52%	0.519	15%	0.148	S	C	.	.			trans	59	32.5	174.1	-58.9	-178.3	-39.2	0	0	114.6	P156 L180 L181 Q182 E183	P156-Q185 VanDerWaalsContact CA-O 3.26Å; P156-Q185 WeakPolarHBondContact CA-O 3.47Å; P156-Q185 HydrophobicContact CB-CB 4.5Å; P156-Q185 HydrophobicContact CG-CB 4.04Å; L180-Q185 PolarHBondContact O-N 3.01Å; L181-Q185 VanDerWaalsContact O-CA 3.24Å; L181-Q185 WeakPolarHBondContact O-CA 3.22Å; Q182-Q185 WeakPolarHBondContact O-CG 3.4Å; E183-Q185 VanDerWaalsContact C-N 3.3Å
186	F	96.8	Very high	92.9	Very high	3 Å²	3	30.9 Å²	30.9	1%	0.013	14%	0.138	C	C	.	.			trans	-54.1	144.2	173	-83.2	-81.9	0	0	0	111.5	F148 P155 F158 L160 L180 F184 G188 V189	F148-F186 HydrophobicContact CD1-CZ 4.3Å; F148-F186 HydrophobicContact CD2-CE2 4.44Å; F148-F186 HydrophobicContact CD2-CZ 4.39Å; F148-F186 HydrophobicContact CE1-CE2 4.22Å; F148-F186 AromaticContact CE1-CZ 3.69Å; F148-F186 HydrophobicContact CE1-CZ 3.69Å; F148-F186 AromaticContact CE2-CE2 3.58Å; F148-F186 HydrophobicContact CE2-CE2 3.58Å; F148-F186 AromaticContact CE2-CZ 3.79Å; F148-F186 HydrophobicContact CE2-CZ 3.79Å; F148-F186 AromaticContact CZ-CE2 3.46Å; F148-F186 HydrophobicContact CZ-CE2 3.46Å; F148-F186 VanDerWaalsContact CZ-CE2 3.46Å; F148-F186 AromaticContact CZ-CZ 3.42Å; F148-F186 HydrophobicContact CZ-CZ 3.42Å; F148-F186 VanDerWaalsContact CZ-CZ 3.42Å; P155-F186 HydrophobicContact CB-CD1 4.19Å; P155-F186 HydrophobicContact CB-CD2 4Å; P155-F186 HydrophobicContact CB-CE1 3.89Å; P155-F186 HydrophobicContact CB-CE2 3.68Å; P155-F186 HydrophobicContact CB-CG 4.25Å; P155-F186 HydrophobicContact CB-CZ 3.62Å; P155-F186 HydrophobicContact CG-CE2 4.33Å; P155-F186 HydrophobicContact CG-CZ 4.13Å; P155-F186 WeakPolarHBondContact O-CD1 3.4Å; F158-F186 HydrophobicContact CB-CD1 4.19Å; F158-F186 HydrophobicContact CB-CE1 4.04Å; F158-F186 WeakPolarHBondContact O-CD1 3.28Å; L160-F186 HydrophobicContact CB-CD1 3.73Å; L160-F186 HydrophobicContact CB-CD2 4.35Å; L160-F186 HydrophobicContact CB-CE1 3.79Å; L160-F186 HydrophobicContact CB-CE2 4.4Å; L160-F186 HydrophobicContact CB-CG 4.03Å; L160-F186 HydrophobicContact CB-CZ 4.13Å; L160-F186 HydrophobicContact CD1-CE1 4.41Å; L160-F186 HydrophobicContact CD1-CZ 4.23Å; L160-F186 HydrophobicContact CD2-CD2 4.15Å; L160-F186 HydrophobicContact CD2-CE2 3.84Å; L160-F186 HydrophobicContact CD2-CZ 4.06Å; L160-F186 HydrophobicContact CG-CE1 4.48Å; L160-F186 HydrophobicContact CG-CZ 4.39Å; L180-F186 HydrophobicContact CB-CD2 4.32Å; L180-F186 HydrophobicContact CD2-CD2 4.22Å; L180-F186 HydrophobicContact CD2-CE2 3.98Å; L180-F186 WeakPolarHBondContact O-CD2 3.32Å; L180-F186 PolarHBondContact O-N 2.94Å; L180-F186 VanDerWaalsContact O-N 3.17Å; F184-F186 VanDerWaalsContact C-N 3.28Å; F184-F186 HydrophobicContact CB-CD2 3.85Å; F184-F186 HydrophobicContact CB-CE2 3.94Å; F184-F186 PolarHBondContact O-N 3.16Å; F186-G188 PolarHBondContact O-N 3.45Å; F186-V189 HydrophobicContact CB-CG2 3.95Å
187	K	94.6	Very high	92.9	Very high	121 Å²	121	30.9 Å²	30.9	53%	0.526	14%	0.138	S	C	.	.	S	Bend	trans	-59.5	-31.6	177.7	-68.4	-176.3	172.4	172.5	0	112.7	P156 S157 F158 Q159	P156-K187 VanDerWaalsContact O-CE 3.27Å; P156-K187 WeakPolarHBondContact O-CE 3.43Å; P156-K187 VanDerWaalsContact O-CG 3.24Å; P156-K187 WeakPolarHBondContact O-CG 3.29Å; S157-K187 PolarHBondContact O-NZ 3.03Å; F158-K187 WeakPolarHBondContact O-CB 3.36Å; F158-K187 PolarHBondContact O-N 3.41Å; Q159-K187 HydrophobicContact CG-CB 4.18Å
188	G	94.1	Very high	92.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173	153.2	174.4	0	0	0	0	0	110.4	Q159 L160 F186 L384 I385	Q159-G188 CarbonylContact C-O 3.52Å; Q159-G188 VanDerWaalsContact CA-O 3.3Å; Q159-G188 WeakPolarHBondContact CA-O 3.49Å; L160-G188 PolarHBondContact N-O 2.94Å; F186-G188 PolarHBondContact O-N 3.45Å; G188-L384 VanDerWaalsContact C-CD1 3.49Å; G188-I385 CarbonylContact C-O 3.46Å; G188-I385 WeakPolarHBondContact CA-O 3.43Å
189	V	95.1	Very high	92.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	126.2	-177.2	-179.9	0	0	0	0	108.5	L160 L177 L180 L181 F186 I191 I385	L160-V189 HydrophobicContact CB-CG2 4.37Å; L160-V189 CarbonylContact O-C 3.57Å; L160-V189 VanDerWaalsContact O-CA 3.29Å; L160-V189 WeakPolarHBondContact O-CA 3.4Å; L177-V189 HydrophobicContact CD1-CB 3.88Å; L177-V189 HydrophobicContact CD1-CG1 3.94Å; L180-V189 HydrophobicContact CB-CG2 3.8Å; L180-V189 HydrophobicContact CD1-CG1 4.07Å; L181-V189 HydrophobicContact CD2-CB 4.28Å; L181-V189 HydrophobicContact CD2-CG2 3.69Å; L181-V189 HydrophobicContact CG-CB 4.38Å; L181-V189 HydrophobicContact CG-CG2 3.88Å; F186-V189 HydrophobicContact CB-CG2 3.95Å; V189-I191 HydrophobicContact CG1-CD1 4.38Å; V189-I191 HydrophobicContact CG1-CG1 3.91Å; V189-I385 PolarHBondContact N-O 3.01Å; V189-I385 WeakPolarHBondContact O-CB 3.24Å; V189-I385 PolarHBondContact O-N 2.61Å
190	A	93.1	Very high	92.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	136.3	166.8	0	0	0	0	0	108.6	L160 L161 L162 T380 I383	L160-A190 PolarHBondContact O-N 3.32Å; L161-A190 CarbonylContact C-O 3.56Å; L161-A190 WeakPolarHBondContact CA-O 3.34Å; L161-A190 HydrophobicContact CG-CB 4.25Å; L162-A190 PolarHBondContact N-O 3.37Å; A190-T380 HydrophobicContact CB-CG2 4.21Å; A190-I383 HydrophobicContact CB-CD1 3.86Å; A190-I383 HydrophobicContact CB-CG1 3.83Å
191	I	91.6	Very high	91.8	Very high	23 Å²	23	27.9 Å²	27.9	12%	0.118	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.2	179.6	-56.6	-176.4	0	0	0	109.6	L162 L164 V173 L177 V189	L162-I191 HydrophobicContact CB-CG1 4.38Å; L162-I191 HydrophobicContact CD2-CD1 4.47Å; L162-I191 HydrophobicContact CD2-CG1 4.49Å; L162-I191 CarbonylContact O-C 3.46Å; L162-I191 WeakPolarHBondContact O-CA 3.35Å; L164-I191 HydrophobicContact CD1-CG2 3.68Å; L164-I191 HydrophobicContact CG-CG2 4.15Å; V173-I191 HydrophobicContact CG1-CD1 3.79Å; V173-I191 HydrophobicContact CG1-CG2 4.23Å; L177-I191 HydrophobicContact CB-CD1 4.09Å; L177-I191 HydrophobicContact CD1-CD1 4.12Å; V189-I191 HydrophobicContact CG1-CD1 4.38Å; V189-I191 HydrophobicContact CG1-CG1 3.91Å
192	E	88.5	Confident	91.4	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	154.5	-169.2	-81.6	-74.4	-160.5	0	0	114.7	L161 L162 S163 L164 L197 I383 V403	L161-E192 HydrophobicContact CD2-CB 4.23Å; L161-E192 HydrophobicContact CD2-CG 4.32Å; L162-E192 PolarHBondContact O-N 2.91Å; S163-E192 WeakPolarHBondContact CA-O 3.42Å; L164-E192 PolarHBondContact N-O 3.15Å; E192-L197 HydrophobicContact CB-CD1 3.57Å; E192-L197 HydrophobicContact CB-CD2 4.08Å; E192-L197 HydrophobicContact CB-CG 3.91Å; E192-L197 HydrophobicContact CG-CD1 4.45Å; E192-L197 HydrophobicContact CG-CD2 4.09Å; E192-L197 HydrophobicContact CG-CG 4.45Å; E192-I383 HydrophobicContact CG-CD1 4.1Å; E192-I383 WeakPolarHBondContact OE1-CD1 3.32Å; E192-V403 HydrophobicContact CG-CG2 4.3Å; E192-V403 WeakPolarHBondContact OE1-CB 3.45Å; E192-V403 WeakPolarHBondContact OE1-CG1 3.47Å; E192-V403 VanDerWaalsContact OE1-CG2 3.23Å; E192-V403 WeakPolarHBondContact OE1-CG2 2.84Å; E192-V403 VanDerWaalsContact OE2-CB 3.31Å; E192-V403 WeakPolarHBondContact OE2-CB 3.41Å; E192-V403 WeakPolarHBondContact OE2-CG2 3.39Å
193	R	86.6	Confident	90.9	Very high	26 Å²	26	28.9 Å²	28.9	10%	0.098	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	134.7	172.4	-95.4	-175.9	-68.7	-123.5	13.5	110.5	L166 V195 N196 L197 F226 G400 I401	L166-R193 VanDerWaalsContact CD1-CD 3.44Å; L166-R193 HydrophobicContact CD1-CG 4.46Å; R193-V195 HydrophobicContact CB-CG2 4.08Å; R193-V195 PolarHBondContact O-N 3.11Å; R193-N196 HydrophobicContact CB-CB 4.38Å; R193-N196 PolarHBondContact O-N 2.82Å; R193-L197 WeakPolarHBondContact O-CG 3.43Å; R193-L197 PolarHBondContact O-N 2.87Å; R193-F226 VanDerWaalsContact CZ-CZ 3.41Å; R193-F226 VanDerWaalsContact NE-CE1 3.29Å; R193-G400 PolarHBondContact NH1-O 2.65Å; R193-G400 PolarHBondContact NH2-O 3.21Å; R193-G400 VanDerWaalsContact NH2-O 3.17Å; R193-I401 HydrophobicContact CB-CB 4.45Å; R193-I401 HydrophobicContact CB-CG2 3.86Å; R193-I401 HydrophobicContact CG-CB 3.7Å; R193-I401 HydrophobicContact CG-CD1 3.47Å; R193-I401 VanDerWaalsContact CG-CD1 3.47Å; R193-I401 HydrophobicContact CG-CG1 3.56Å; R193-I401 HydrophobicContact CG-CG2 3.66Å; R193-I401 VanDerWaalsContact CZ-O 3.29Å; R193-I401 PolarHBondContact NH2-O 2.7Å
194	Q	88.4	Confident	90.6	Very high	10 Å²	10	24.8 Å²	24.8	5%	0.047	12%	0.121	C	C	.	.	H	α-helix	trans	-51.4	-42.9	172.9	-77.1	166.8	-8.5	0	0	113	E68 I69 S163 L164 N196 L197 A198 S367	E68-Q194 HydrophobicContact CG-CG 4.25Å; I69-Q194 VanDerWaalsContact C-NE2 3.27Å; I69-Q194 PolarHBondContact O-NE2 2.95Å; S163-Q194 WeakPolarHBondContact OG-CG 3.27Å; L164-Q194 WeakPolarHBondContact O-CG 3.37Å; L164-Q194 PolarHBondContact O-N 2.93Å; L164-Q194 VanDerWaalsContact O-N 3.11Å; Q194-N196 PolarHBondContact O-N 3.04Å; Q194-L197 PolarHBondContact O-N 2.89Å; Q194-A198 WeakPolarHBondContact O-CB 3.4Å; Q194-A198 PolarHBondContact O-N 2.91Å; Q194-S367 WeakPolarHBondContact O-CB 3.23Å; Q194-S367 PolarHBondContact O-OG 3.42Å
195	V	88.7	Confident	90.1	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-66.7	-35.8	-177.6	-64	0	0	0	0	113.4	L166 R193 A198 L199 V209 D211 V219 F226	L166-V195 HydrophobicContact CD1-CG2 4.34Å; R193-V195 HydrophobicContact CB-CG2 4.08Å; R193-V195 PolarHBondContact O-N 3.11Å; V195-A198 PolarHBondContact O-N 2.86Å; V195-L199 PolarHBondContact O-N 2.86Å; V195-L199 VanDerWaalsContact O-N 3.08Å; V195-V209 HydrophobicContact CB-CB 4.36Å; V195-V209 HydrophobicContact CB-CG1 4.13Å; V195-V209 HydrophobicContact CG1-CG1 4.08Å; V195-D211 HydrophobicContact CG1-CB 4.26Å; V195-V219 HydrophobicContact CB-CG2 4.4Å; V195-V219 HydrophobicContact CG1-CG2 3.97Å; V195-V219 HydrophobicContact CG2-CB 4.45Å; V195-V219 HydrophobicContact CG2-CG1 4.37Å; V195-V219 HydrophobicContact CG2-CG2 4.16Å; V195-F226 HydrophobicContact CG2-CE1 3.83Å; V195-F226 HydrophobicContact CG2-CZ 3.87Å
196	N	87.5	Confident	89.9	Confident	7 Å²	7	26.3 Å²	26.3	4%	0.037	13%	0.128	C	C	.	.	H	α-helix	trans	-66.5	-50.4	176.8	-83	4.5	0	0	0	110.9	R193 Q194 A198 L199 I200 F226 V403	R193-N196 HydrophobicContact CB-CB 4.38Å; R193-N196 PolarHBondContact O-N 2.82Å; Q194-N196 PolarHBondContact O-N 3.04Å; N196-A198 PolarHBondContact O-N 3.08Å; N196-L199 WeakPolarHBondContact O-CB 3.25Å; N196-L199 PolarHBondContact O-N 3.24Å; N196-L199 VanDerWaalsContact O-N 3.1Å; N196-I200 WeakPolarHBondContact O-CG1 3.38Å; N196-I200 PolarHBondContact O-N 3.02Å; N196-F226 WeakPolarHBondContact ND2-CE2 3.16Å; N196-F226 WeakPolarHBondContact OD1-CE2 3.32Å; N196-F226 WeakPolarHBondContact OD1-CZ 3.39Å; N196-V403 PolarHBondContact ND2-O 3.48Å
197	L	90.8	Very high	89.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.5	-41.3	178.6	-62.8	170.2	0	0	0	110.6	L161 S163 E192 R193 Q194 L199 I200 A201 S367 G370 A371 V374	L161-L197 HydrophobicContact CD2-CD1 4.34Å; S163-L197 VanDerWaalsContact CB-CD1 3.46Å; S163-L197 VanDerWaalsContact OG-CD1 3.26Å; S163-L197 WeakPolarHBondContact OG-CD1 3.26Å; E192-L197 HydrophobicContact CB-CD1 3.57Å; E192-L197 HydrophobicContact CB-CD2 4.08Å; E192-L197 HydrophobicContact CB-CG 3.91Å; E192-L197 HydrophobicContact CG-CD1 4.45Å; E192-L197 HydrophobicContact CG-CD2 4.09Å; E192-L197 HydrophobicContact CG-CG 4.45Å; R193-L197 WeakPolarHBondContact O-CG 3.43Å; R193-L197 PolarHBondContact O-N 2.87Å; Q194-L197 PolarHBondContact O-N 2.89Å; L197-L199 VanDerWaalsContact C-N 3.33Å; L197-L199 PolarHBondContact O-N 3.27Å; L197-I200 PolarHBondContact O-N 3.42Å; L197-A201 PolarHBondContact O-N 3.32Å; L197-S367 VanDerWaalsContact CB-O 3.3Å; L197-S367 WeakPolarHBondContact CB-O 3.46Å; L197-G370 WeakPolarHBondContact O-CA 3.37Å; L197-A371 HydrophobicContact CD1-CB 3.77Å; L197-A371 HydrophobicContact CD2-CB 4.26Å; L197-A371 HydrophobicContact CG-CB 4.46Å; L197-V374 HydrophobicContact CD2-CB 4.23Å; L197-V374 HydrophobicContact CD2-CG2 3.76Å
198	A	90.5	Very high	89.8	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.6	-40.8	176.5	0	0	0	0	0	112.7	Q194 V195 N196 A201 L202 V328 A366	Q194-A198 WeakPolarHBondContact O-CB 3.4Å; Q194-A198 PolarHBondContact O-N 2.91Å; V195-A198 PolarHBondContact O-N 2.86Å; N196-A198 PolarHBondContact O-N 3.08Å; A198-A201 PolarHBondContact O-N 3.48Å; A198-L202 WeakPolarHBondContact O-CD1 3.43Å; A198-L202 VanDerWaalsContact O-CG 3.29Å; A198-L202 WeakPolarHBondContact O-CG 3.25Å; A198-L202 PolarHBondContact O-N 3.12Å; A198-L202 VanDerWaalsContact O-N 3.12Å; A198-V328 HydrophobicContact CB-CB 4.43Å; A198-V328 HydrophobicContact CB-CG1 4.05Å; A198-V328 HydrophobicContact CB-CG2 4.27Å; A198-A366 HydrophobicContact CB-CB 3.91Å
199	L	88.7	Confident	89.8	Confident	7 Å²	7	20.4 Å²	20.4	4%	0.037	10%	0.102	C	C	.	.	H	α-helix	trans	-65.1	-41.3	176.4	-162.2	73.4	0	0	0	111.8	V195 N196 L197 A201 L202 D203 A204 V209 I221 Y326	V195-L199 PolarHBondContact O-N 2.86Å; V195-L199 VanDerWaalsContact O-N 3.08Å; N196-L199 WeakPolarHBondContact O-CB 3.25Å; N196-L199 PolarHBondContact O-N 3.24Å; N196-L199 VanDerWaalsContact O-N 3.1Å; L197-L199 VanDerWaalsContact C-N 3.33Å; L197-L199 PolarHBondContact O-N 3.27Å; L199-A201 VanDerWaalsContact C-N 3.34Å; L199-A201 PolarHBondContact O-N 2.91Å; L199-L202 CarbonylContact O-C 3.57Å; L199-L202 PolarHBondContact O-N 2.84Å; L199-L202 VanDerWaalsContact O-N 3.13Å; L199-D203 PolarHBondContact O-N 2.81Å; L199-A204 HydrophobicContact CD1-CB 3.63Å; L199-A204 HydrophobicContact CG-CB 3.89Å; L199-A204 WeakPolarHBondContact CG-O 3.3Å; L199-A204 PolarHBondContact O-N 2.82Å; L199-A204 VanDerWaalsContact O-N 3.09Å; L199-V209 HydrophobicContact CB-CG2 4.31Å; L199-V209 HydrophobicContact CD1-CG2 3.78Å; L199-I221 HydrophobicContact CD2-CB 4.14Å; L199-I221 HydrophobicContact CD2-CD1 4.01Å; L199-I221 HydrophobicContact CD2-CG2 3.85Å; L199-Y326 HydrophobicContact CD1-CD2 3.76Å; L199-Y326 HydrophobicContact CD1-CE2 3.85Å; L199-Y326 HydrophobicContact CD1-CG 4.48Å
200	I	87.2	Confident	89.8	Confident	42 Å²	42	20.4 Å²	20.4	22%	0.215	10%	0.102	C	C	.	.	H	α-helix	trans	-60.1	-43.8	174	-67.7	168.8	0	0	0	110.9	N196 L197 L202 D203 I373 V374	N196-I200 WeakPolarHBondContact O-CG1 3.38Å; N196-I200 PolarHBondContact O-N 3.02Å; L197-I200 PolarHBondContact O-N 3.42Å; I200-L202 PolarHBondContact O-N 2.82Å; I200-D203 PolarHBondContact O-N 2.83Å; I200-D203 VanDerWaalsContact O-N 3.08Å; I200-I373 HydrophobicContact CG2-CB 4.38Å; I200-I373 HydrophobicContact CG2-CG2 3.97Å; I200-V374 HydrophobicContact CD1-CG2 3.47Å; I200-V374 VanDerWaalsContact CD1-CG2 3.47Å; I200-V374 HydrophobicContact CG2-CG2 4.19Å
201	A	87.1	Confident	89.7	Confident	3 Å²	3	21.1 Å²	21.1	3%	0.025	11%	0.106	C	C	.	.	H	α-helix	trans	-61.5	-34.8	177	0	0	0	0	0	112.1	L5 L197 A198 L199 D203 W362 A366 L369	L5-A201 WeakPolarHBondContact CD1-O 3.12Å; L197-A201 PolarHBondContact O-N 3.32Å; A198-A201 PolarHBondContact O-N 3.48Å; L199-A201 VanDerWaalsContact C-N 3.34Å; L199-A201 PolarHBondContact O-N 2.91Å; A201-D203 PolarHBondContact O-N 2.74Å; A201-W362 HydrophobicContact CB-CH2 4.08Å; A201-W362 HydrophobicContact CB-CZ3 3.86Å; A201-W362 VanDerWaalsContact O-CH2 3.25Å; A201-W362 WeakPolarHBondContact O-CH2 3.42Å; A201-A366 WeakPolarHBondContact CB-O 3.36Å; A201-L369 HydrophobicContact CB-CB 4.33Å
202	L	86.5	Confident	89.5	Confident	34 Å²	34	20 Å²	20	18%	0.178	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	3.7	178.7	-67.8	162.8	0	0	0	113.3	A198 L199 I200 A204 Y326 V328 A360 W362	A198-L202 WeakPolarHBondContact O-CD1 3.43Å; A198-L202 VanDerWaalsContact O-CG 3.29Å; A198-L202 WeakPolarHBondContact O-CG 3.25Å; A198-L202 PolarHBondContact O-N 3.12Å; A198-L202 VanDerWaalsContact O-N 3.12Å; L199-L202 CarbonylContact O-C 3.57Å; L199-L202 PolarHBondContact O-N 2.84Å; L199-L202 VanDerWaalsContact O-N 3.13Å; I200-L202 PolarHBondContact O-N 2.82Å; L202-A204 PolarHBondContact O-N 2.74Å; L202-Y326 HydrophobicContact CB-CD1 4.39Å; L202-Y326 HydrophobicContact CD1-CD1 3.78Å; L202-Y326 HydrophobicContact CD1-CG 3.94Å; L202-V328 HydrophobicContact CD1-CG1 3.95Å; L202-A360 HydrophobicContact CD2-CB 3.79Å; L202-W362 HydrophobicContact CD2-CH2 3.6Å; L202-W362 HydrophobicContact CD2-CZ2 4.22Å; L202-W362 HydrophobicContact CD2-CZ3 4.15Å; L202-W362 HydrophobicContact CG-CH2 4.03Å; L202-W362 HydrophobicContact CG-CZ3 4.45Å
203	D	85.9	Confident	89	Confident	94 Å²	94	20.6 Å²	20.6	50%	0.503	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	40.8	-175.7	-163.8	34.1	0	0	0	112.5	L199 I200 A201	L199-D203 PolarHBondContact O-N 2.81Å; I200-D203 PolarHBondContact O-N 2.83Å; I200-D203 VanDerWaalsContact O-N 3.08Å; A201-D203 PolarHBondContact O-N 2.74Å
204	A	87.7	Confident	88.3	Confident	14 Å²	14	20.7 Å²	20.7	12%	0.116	11%	0.109	C	C	.	.			trans	-119.2	156.2	179.5	0	0	0	0	0	111	L199 L202 Y326	L199-A204 HydrophobicContact CD1-CB 3.63Å; L199-A204 HydrophobicContact CG-CB 3.89Å; L199-A204 WeakPolarHBondContact CG-O 3.3Å; L199-A204 PolarHBondContact O-N 2.82Å; L199-A204 VanDerWaalsContact O-N 3.09Å; L202-A204 PolarHBondContact O-N 2.74Å; A204-Y326 HydrophobicContact CB-CE1 4.19Å; A204-Y326 HydrophobicContact CB-CE2 3.95Å; A204-Y326 WeakPolarHBondContact CB-OH 3.24Å
205	K	86.7	Confident	87.6	Confident	141 Å²	141	22.8 Å²	22.8	61%	0.613	12%	0.118	S	C	*	.	S	Bend	trans	-123	-19.3	174	-67.3	-173.2	173.1	-168.7	0	113.8	D223 G224	K205-D223 PolarHBondContact O-N 3.13Å; K205-G224 PolarHBondContact O-N 3.32Å
206	T	91.1	Very high	87.4	Confident	25 Å²	25	23 Å²	23	15%	0.153	12%	0.119	C	C	.	.	S	Bend	trans	-133.1	139.5	-176.8	-63.7	0	0	0	0	108.4	I221 Y222 D223 E320 L321 Y326	T206-I221 CarbonylContact C-O 3.59Å; T206-I221 WeakPolarHBondContact CA-O 3.43Å; T206-Y222 HydrophobicContact CG2-CD2 3.49Å; T206-Y222 VanDerWaalsContact CG2-CD2 3.49Å; T206-Y222 HydrophobicContact CG2-CE2 4.03Å; T206-Y222 HydrophobicContact CG2-CG 4.18Å; T206-D223 PolarHBondContact OG1-N 3.3Å; T206-E320 HydrophobicContact CG2-CG 3.73Å; T206-L321 HydrophobicContact CG2-CD2 4.5Å; T206-Y326 WeakPolarHBondContact O-CE2 3.48Å
207	G	94	Very high	87.5	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.6	-175	170.2	0	0	0	0	0	114	I221 S324	G207-I221 PolarHBondContact N-O 3.43Å; G207-I221 PolarHBondContact O-N 3.34Å; G207-S324 CarbonylContact C-O 3.53Å; G207-S324 WeakPolarHBondContact CA-O 3.23Å; G207-S324 WeakPolarHBondContact CA-OG 3.36Å
208	V	96.2	Very high	87.6	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	111.6	175.2	-177.1	0	0	0	0	109.5	V210 I218 V219 A220 V306 I310 L321 S324 I325 Y326	V208-V210 HydrophobicContact CG1-CG2 4.16Å; V208-I218 HydrophobicContact CG1-CG2 3.6Å; V208-V219 CarbonylContact C-O 3.55Å; V208-V219 VanDerWaalsContact CA-O 3.28Å; V208-V219 WeakPolarHBondContact CA-O 3.42Å; V208-A220 HydrophobicContact CG2-CB 4.38Å; V208-V306 HydrophobicContact CG1-CG1 4.47Å; V208-I310 HydrophobicContact CG2-CD1 3.99Å; V208-I310 HydrophobicContact CG2-CG1 3.63Å; V208-L321 HydrophobicContact CG2-CB 3.95Å; V208-L321 HydrophobicContact CG2-CD2 4.06Å; V208-L321 HydrophobicContact CG2-CG 4.45Å; V208-S324 PolarHBondContact N-O 3.04Å; V208-I325 HydrophobicContact CB-CG1 4.36Å; V208-I325 CarbonylContact O-C 3.59Å; V208-I325 WeakPolarHBondContact O-CA 3.25Å; V208-Y326 PolarHBondContact O-N 2.98Å
209	V	95	Very high	87.7	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	119.7	172.8	-175.8	0	0	0	0	109.1	V195 L199 I218 V219 I221 V328	V195-V209 HydrophobicContact CB-CB 4.36Å; V195-V209 HydrophobicContact CB-CG1 4.13Å; V195-V209 HydrophobicContact CG1-CG1 4.08Å; L199-V209 HydrophobicContact CB-CG2 4.31Å; L199-V209 HydrophobicContact CD1-CG2 3.78Å; V209-I218 WeakPolarHBondContact O-CA 3.29Å; V209-V219 PolarHBondContact N-O 3.12Å; V209-V219 PolarHBondContact O-N 2.79Å; V209-I221 HydrophobicContact CG2-CD1 4.17Å; V209-V328 HydrophobicContact CG1-CG1 4.42Å; V209-V328 HydrophobicContact CG1-CG2 3.59Å
210	V	94.7	Very high	87.9	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	89.9	175.7	-175.7	0	0	0	0	107.9	V208 M212 L216 S217 I218 L302 V306 I325 Y326 L327 V328	V208-V210 HydrophobicContact CG1-CG2 4.16Å; V210-M212 HydrophobicContact CG1-CG 3.86Å; V210-M212 HydrophobicContact CG1-SD 4.26Å; V210-M212 PolarHBondContact O-N 3.47Å; V210-L216 HydrophobicContact CG1-CD1 3.87Å; V210-S217 CarbonylContact C-O 3.54Å; V210-S217 WeakPolarHBondContact CA-O 3.32Å; V210-I218 HydrophobicContact CG1-CG1 4.21Å; V210-I218 HydrophobicContact CG2-CG1 4.44Å; V210-L302 HydrophobicContact CG1-CD1 3.93Å; V210-V306 HydrophobicContact CG2-CG2 3.78Å; V210-I325 HydrophobicContact CG2-CG2 3.92Å; V210-Y326 PolarHBondContact N-O 3.01Å; V210-L327 HydrophobicContact CB-CD2 3.78Å; V210-L327 HydrophobicContact CG1-CD2 3.92Å; V210-L327 HydrophobicContact CG2-CD2 4.34Å; V210-V328 PolarHBondContact O-N 2.9Å
211	D	91	Very high	88.2	Confident	16 Å²	16	20.8 Å²	20.8	9%	0.086	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	107	177.9	-176.3	3.1	0	0	0	110.7	V195 L216 S217 V328	V195-D211 HydrophobicContact CG1-CB 4.26Å; D211-L216 CarbonylContact O-C 3.37Å; D211-L216 WeakPolarHBondContact O-CA 3.25Å; D211-S217 PolarHBondContact N-O 2.78Å; D211-S217 PolarHBondContact O-N 3.41Å; D211-V328 VanDerWaalsContact CA-CG2 3.48Å; D211-V328 HydrophobicContact CB-CG2 3.58Å
212	M	87.2	Confident	88.3	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	82.5	-178.1	-49.2	-171.7	65.5	0	0	110.1	V210 L216 L289 L302 V328 G329 G330 M331 L337	V210-M212 HydrophobicContact CG1-CG 3.86Å; V210-M212 HydrophobicContact CG1-SD 4.26Å; V210-M212 PolarHBondContact O-N 3.47Å; M212-L216 HydrophobicContact CG-CD1 3.84Å; M212-L289 HydrophobicContact CE-CD1 4.01Å; M212-L289 HydrophobicContact CE-CD2 4.21Å; M212-L302 HydrophobicContact CE-CD1 4.45Å; M212-L302 HydrophobicContact CE-CD2 3.83Å; M212-L302 HydrophobicContact SD-CD2 4.01Å; M212-V328 PolarHBondContact N-O 3.35Å; M212-G329 CarbonylContact O-C 3.57Å; M212-G330 PolarHBondContact O-N 3.43Å; M212-G330 VanDerWaalsContact O-N 3.16Å; M212-M331 HydrophobicContact CB-CB 3.69Å; M212-M331 VanDerWaalsContact O-CB 3.28Å; M212-M331 WeakPolarHBondContact O-CB 3.05Å; M212-M331 PolarHBondContact O-N 3.2Å; M212-L337 HydrophobicContact CE-CD2 4.34Å; M212-L337 HydrophobicContact SD-CD2 3.73Å
213	G	78.6	Confident	88.3	Confident	12 Å²	12	28.3 Å²	28.3	12%	0.124	14%	0.142	C	C	.	.	S	Bend	trans	-96.2	-141.8	171.1	0	0	0	0	0	112.3	K215 M331	G213-K215 VanDerWaalsContact C-N 3.26Å; G213-K215 CarbonylContact C-O 3.54Å; G213-K215 WeakPolarHBondContact CA-O 3.18Å; G213-K215 PolarHBondContact N-O 3.34Å; G213-M331 WeakPolarHBondContact O-CG 3.11Å
214	N	70.3	Confident	88	Confident	29 Å²	29	24.4 Å²	24.4	16%	0.155	12%	0.124	C	C	.	.	S	Bend	trans	-71.5	-28.5	166	-166	29.3	0	0	0	111.1	S71 C72 A125 N237	S71-N214 PolarHBondContact OG-N 2.88Å; C72-N214 HydrophobicContact CB-CB 4.43Å; A125-N214 PolarHBondContact O-ND2 2.73Å; N214-N237 PolarHBondContact OD1-ND2 3.01Å
215	K	75.4	Confident	87.6	Confident	54 Å²	54	29 Å²	29	24%	0.235	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	149.4	164.4	-61	-174.1	-179.5	-175.4	0	108.9	C131 G213	C131-K215 PolarHBondContact O-NZ 2.68Å; C131-K215 VanDerWaalsContact O-NZ 3.17Å; G213-K215 VanDerWaalsContact C-N 3.26Å; G213-K215 CarbonylContact C-O 3.54Å; G213-K215 WeakPolarHBondContact CA-O 3.18Å; G213-K215 PolarHBondContact N-O 3.34Å
216	L	84.3	Confident	87.4	Confident	4 Å²	4	25 Å²	25	2%	0.021	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	126.5	169.2	172.1	65.4	0	0	0	108.3	V210 D211 M212 I218 S231 Y232 L234 L302 L305	V210-L216 HydrophobicContact CG1-CD1 3.87Å; D211-L216 CarbonylContact O-C 3.37Å; D211-L216 WeakPolarHBondContact O-CA 3.25Å; M212-L216 HydrophobicContact CG-CD1 3.84Å; L216-I218 HydrophobicContact CD1-CD1 4.42Å; L216-I218 HydrophobicContact CD1-CG1 4.12Å; L216-I218 HydrophobicContact CD2-CD1 4.01Å; L216-I218 HydrophobicContact CD2-CG1 4.5Å; L216-I218 HydrophobicContact CG-CD1 4.23Å; L216-I218 HydrophobicContact CG-CG1 4.17Å; L216-S231 CarbonylContact O-C 3.47Å; L216-S231 VanDerWaalsContact O-CA 3.27Å; L216-S231 WeakPolarHBondContact O-CA 3.43Å; L216-S231 PolarHBondContact O-OG 3.07Å; L216-Y232 HydrophobicContact CD2-CD2 4.14Å; L216-Y232 HydrophobicContact CG-CD2 4.38Å; L216-Y232 PolarHBondContact N-O 3.19Å; L216-Y232 PolarHBondContact O-N 2.65Å; L216-L234 HydrophobicContact CB-CD1 4.04Å; L216-L234 HydrophobicContact CB-CD2 3.92Å; L216-L234 HydrophobicContact CB-CG 3.8Å; L216-L234 HydrophobicContact CD2-CD2 4.36Å; L216-L302 HydrophobicContact CD1-CD1 3.84Å; L216-L302 HydrophobicContact CD2-CD1 3.81Å; L216-L302 HydrophobicContact CG-CD1 4.49Å; L216-L305 HydrophobicContact CD2-CD1 3.82Å
217	S	88.4	Confident	86.9	Confident	10 Å²	10	26.2 Å²	26.2	7%	0.07	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130	169.5	-51.4	0	0	0	0	109.5	V210 D211 F230	V210-S217 CarbonylContact C-O 3.54Å; V210-S217 WeakPolarHBondContact CA-O 3.32Å; D211-S217 PolarHBondContact N-O 2.78Å; D211-S217 PolarHBondContact O-N 3.41Å; S217-F230 CarbonylContact C-O 3.53Å; S217-F230 VanDerWaalsContact CA-O 3.3Å; S217-F230 WeakPolarHBondContact CA-O 3.4Å
218	I	92.8	Very high	86.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	116.9	176.9	-62.2	163.9	0	0	0	107.1	V208 V209 V210 L216 F230 Y232 L302 L305 V306 C309	V208-I218 HydrophobicContact CG1-CG2 3.6Å; V209-I218 WeakPolarHBondContact O-CA 3.29Å; V210-I218 HydrophobicContact CG1-CG1 4.21Å; V210-I218 HydrophobicContact CG2-CG1 4.44Å; L216-I218 HydrophobicContact CD1-CD1 4.42Å; L216-I218 HydrophobicContact CD1-CG1 4.12Å; L216-I218 HydrophobicContact CD2-CD1 4.01Å; L216-I218 HydrophobicContact CD2-CG1 4.5Å; L216-I218 HydrophobicContact CG-CD1 4.23Å; L216-I218 HydrophobicContact CG-CG1 4.17Å; I218-F230 PolarHBondContact N-O 3.5Å; I218-F230 PolarHBondContact O-N 3.18Å; I218-Y232 HydrophobicContact CD1-CD2 4.5Å; I218-Y232 HydrophobicContact CD1-CE2 4.25Å; I218-L302 HydrophobicContact CD1-CD1 4.41Å; I218-L305 HydrophobicContact CD1-CB 3.56Å; I218-V306 HydrophobicContact CD1-CG2 3.9Å; I218-V306 HydrophobicContact CG1-CG2 4.36Å; I218-V306 HydrophobicContact CG2-CG2 4.36Å; I218-C309 HydrophobicContact CG2-CB 3.67Å
219	V	92.6	Very high	85.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	122.7	-173.4	-174.7	0	0	0	0	109.8	L166 V195 V208 V209 I221 F226 L228 A229	L166-V219 HydrophobicContact CD1-CG2 4.12Å; L166-V219 HydrophobicContact CD2-CG2 3.43Å; L166-V219 VanDerWaalsContact CD2-CG2 3.43Å; L166-V219 HydrophobicContact CG-CG2 4.41Å; V195-V219 HydrophobicContact CB-CG2 4.4Å; V195-V219 HydrophobicContact CG1-CG2 3.97Å; V195-V219 HydrophobicContact CG2-CB 4.45Å; V195-V219 HydrophobicContact CG2-CG1 4.37Å; V195-V219 HydrophobicContact CG2-CG2 4.16Å; V208-V219 CarbonylContact C-O 3.55Å; V208-V219 VanDerWaalsContact CA-O 3.28Å; V208-V219 WeakPolarHBondContact CA-O 3.42Å; V209-V219 PolarHBondContact N-O 3.12Å; V209-V219 PolarHBondContact O-N 2.79Å; V219-I221 HydrophobicContact CG1-CD1 4.19Å; V219-I221 HydrophobicContact CG1-CG1 3.79Å; V219-F226 HydrophobicContact CG1-CD1 3.48Å; V219-F226 VanDerWaalsContact CG1-CD1 3.48Å; V219-F226 HydrophobicContact CG1-CE1 3.44Å; V219-F226 VanDerWaalsContact CG1-CE1 3.44Å; V219-L228 CarbonylContact C-O 3.59Å; V219-L228 WeakPolarHBondContact CA-O 3.13Å; V219-A229 HydrophobicContact CG1-CB 4.44Å; V219-A229 HydrophobicContact CG2-CB 4.21Å
220	A	94.4	Very high	84.8	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.6	170.1	0	0	0	0	0	109.4	V208 L227 L228 L321	V208-A220 HydrophobicContact CG2-CB 4.38Å; A220-L227 HydrophobicContact CB-CB 4.16Å; A220-L227 PolarHBondContact O-N 2.78Å; A220-L228 PolarHBondContact N-O 3.38Å; A220-L228 PolarHBondContact O-N 2.7Å; A220-L321 HydrophobicContact CB-CD1 4.08Å; A220-L321 HydrophobicContact CB-CD2 4.26Å
221	I	91.9	Very high	84	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.8	179.9	-57.1	173.7	0	0	0	107.7	L199 T206 G207 V209 V219 D225 F226	L199-I221 HydrophobicContact CD2-CB 4.14Å; L199-I221 HydrophobicContact CD2-CD1 4.01Å; L199-I221 HydrophobicContact CD2-CG2 3.85Å; T206-I221 CarbonylContact C-O 3.59Å; T206-I221 WeakPolarHBondContact CA-O 3.43Å; G207-I221 PolarHBondContact N-O 3.43Å; G207-I221 PolarHBondContact O-N 3.34Å; V209-I221 HydrophobicContact CG2-CD1 4.17Å; V219-I221 HydrophobicContact CG1-CD1 4.19Å; V219-I221 HydrophobicContact CG1-CG1 3.79Å; I221-D225 CarbonylContact C-O 3.55Å; I221-D225 VanDerWaalsContact CA-O 3.31Å; I221-D225 WeakPolarHBondContact CA-O 3.48Å; I221-F226 HydrophobicContact CD1-CZ 4.39Å
222	Y	90.5	Very high	83.2	Confident	90 Å²	90	36.9 Å²	36.9	35%	0.353	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	116.6	177.7	-171.6	-84.2	0	0	0	110.2	T206 G224 D225 L227 N317 E320	T206-Y222 HydrophobicContact CG2-CD2 3.49Å; T206-Y222 VanDerWaalsContact CG2-CD2 3.49Å; T206-Y222 HydrophobicContact CG2-CE2 4.03Å; T206-Y222 HydrophobicContact CG2-CG 4.18Å; Y222-G224 PolarHBondContact O-N 2.85Å; Y222-D225 PolarHBondContact N-O 2.71Å; Y222-D225 WeakPolarHBondContact O-CB 3.28Å; Y222-D225 PolarHBondContact O-N 3.17Å; Y222-L227 HydrophobicContact CG-CD1 4.42Å; Y222-N317 HydrophobicContact CD2-CB 3.79Å; Y222-N317 HydrophobicContact CE2-CB 4Å; Y222-N317 HydrophobicContact CG-CB 4.47Å; Y222-E320 HydrophobicContact CE2-CB 4.49Å
223	D	86.9	Confident	82.4	Confident	104 Å²	104	40.6 Å²	40.6	56%	0.556	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.5	40.4	-173.7	-157.7	25.3	0	0	0	113.8	K205 T206 D225	K205-D223 PolarHBondContact O-N 3.13Å; T206-D223 PolarHBondContact OG1-N 3.3Å; D223-D225 VanDerWaalsContact C-N 3.3Å; D223-D225 PolarHBondContact O-N 3.29Å
224	G	78	Confident	81.8	Confident	12 Å²	12	41.1 Å²	41.1	12%	0.124	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	-23.5	-175.9	0	0	0	0	0	114.6	K205 Y222 I404	K205-G224 PolarHBondContact O-N 3.32Å; Y222-G224 PolarHBondContact O-N 2.85Å; G224-I404 WeakPolarHBondContact CA-OXT 3.39Å
225	D	80.4	Confident	81.6	Confident	111 Å²	111	42.8 Å²	42.8	59%	0.594	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	134	-176.8	-72.6	-42.2	0	0	0	113	I221 Y222 D223 L227	I221-D225 CarbonylContact C-O 3.55Å; I221-D225 VanDerWaalsContact CA-O 3.31Å; I221-D225 WeakPolarHBondContact CA-O 3.48Å; Y222-D225 PolarHBondContact N-O 2.71Å; Y222-D225 WeakPolarHBondContact O-CB 3.28Å; Y222-D225 PolarHBondContact O-N 3.17Å; D223-D225 VanDerWaalsContact C-N 3.3Å; D223-D225 PolarHBondContact O-N 3.29Å; D225-L227 PolarHBondContact O-N 3.26Å
226	F	82.2	Confident	81.1	Confident	56 Å²	56	40.3 Å²	40.3	25%	0.246	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	112.4	173.1	-78.5	-105.3	0	0	0	110.2	L166 R193 V195 N196 V219 I221	L166-F226 HydrophobicContact CD1-CE1 4.21Å; R193-F226 VanDerWaalsContact CZ-CZ 3.41Å; R193-F226 VanDerWaalsContact NE-CE1 3.29Å; V195-F226 HydrophobicContact CG2-CE1 3.83Å; V195-F226 HydrophobicContact CG2-CZ 3.87Å; N196-F226 WeakPolarHBondContact ND2-CE2 3.16Å; N196-F226 WeakPolarHBondContact OD1-CE2 3.32Å; N196-F226 WeakPolarHBondContact OD1-CZ 3.39Å; V219-F226 HydrophobicContact CG1-CD1 3.48Å; V219-F226 VanDerWaalsContact CG1-CD1 3.48Å; V219-F226 HydrophobicContact CG1-CE1 3.44Å; V219-F226 VanDerWaalsContact CG1-CE1 3.44Å; I221-F226 HydrophobicContact CD1-CZ 4.39Å
227	L	79.5	Confident	80.1	Confident	51 Å²	51	41.8 Å²	41.8	27%	0.267	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-47.1	172.6	-59.7	-179.2	0	0	0	110.8	A220 Y222 D225 N317 L321	A220-L227 HydrophobicContact CB-CB 4.16Å; A220-L227 PolarHBondContact O-N 2.78Å; Y222-L227 HydrophobicContact CG-CD1 4.42Å; D225-L227 PolarHBondContact O-N 3.26Å; L227-N317 HydrophobicContact CD1-CB 4.08Å; L227-N317 WeakPolarHBondContact CD1-ND2 3.48Å; L227-L321 HydrophobicContact CD1-CD1 4.07Å
228	L	81.6	Confident	79.2	Confident	49 Å²	49	46.2 Å²	46.2	26%	0.257	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	146.4	-172.8	-166.1	57.9	0	0	0	111.9	V219 A220 F230	V219-L228 CarbonylContact C-O 3.59Å; V219-L228 WeakPolarHBondContact CA-O 3.13Å; A220-L228 PolarHBondContact N-O 3.38Å; A220-L228 PolarHBondContact O-N 2.7Å; L228-F230 HydrophobicContact CD1-CE2 4.3Å; L228-F230 HydrophobicContact CD1-CZ 4.22Å; L228-F230 HydrophobicContact CD2-CD2 4.43Å; L228-F230 HydrophobicContact CD2-CE2 3.31Å; L228-F230 HydrophobicContact CD2-CZ 3.55Å; L228-F230 HydrophobicContact CG-CD2 4.23Å; L228-F230 HydrophobicContact CG-CE2 3.47Å; L228-F230 VanDerWaalsContact CG-CE2 3.47Å; L228-F230 HydrophobicContact CG-CZ 3.85Å
229	A	81	Confident	77.9	Confident	45 Å²	45	47.3 Å²	47.3	37%	0.372	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	131.9	-177.3	0	0	0	0	0	110.3	L166 V219	L166-A229 HydrophobicContact CD1-CB 4.29Å; L166-A229 HydrophobicContact CD2-CB 3.95Å; L166-A229 HydrophobicContact CG-CB 4.49Å; V219-A229 HydrophobicContact CG1-CB 4.44Å; V219-A229 HydrophobicContact CG2-CB 4.21Å
230	F	79.9	Confident	76.6	Confident	46 Å²	46	47.6 Å²	47.6	20%	0.202	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	143.9	170	-60.6	-84.6	0	0	0	110.3	S217 I218 L228 Y232 C309	S217-F230 CarbonylContact C-O 3.53Å; S217-F230 VanDerWaalsContact CA-O 3.3Å; S217-F230 WeakPolarHBondContact CA-O 3.4Å; I218-F230 PolarHBondContact N-O 3.5Å; I218-F230 PolarHBondContact O-N 3.18Å; L228-F230 HydrophobicContact CD1-CE2 4.3Å; L228-F230 HydrophobicContact CD1-CZ 4.22Å; L228-F230 HydrophobicContact CD2-CD2 4.43Å; L228-F230 HydrophobicContact CD2-CE2 3.31Å; L228-F230 HydrophobicContact CD2-CZ 3.55Å; L228-F230 HydrophobicContact CG-CD2 4.23Å; L228-F230 HydrophobicContact CG-CE2 3.47Å; L228-F230 VanDerWaalsContact CG-CE2 3.47Å; L228-F230 HydrophobicContact CG-CZ 3.85Å; F230-Y232 HydrophobicContact CB-CD2 4.2Å; F230-Y232 HydrophobicContact CB-CE2 3.28Å; F230-Y232 WeakPolarHBondContact CB-OH 3.45Å; F230-Y232 VanDerWaalsContact CD1-OH 3.23Å; F230-Y232 WeakPolarHBondContact CD1-OH 3.47Å; F230-Y232 HydrophobicContact CG-CE2 4.12Å; F230-Y232 AromaticContact CG-CZ 3.97Å; F230-Y232 VanDerWaalsContact CG-OH 3.28Å; F230-Y232 WeakPolarHBondContact CG-OH 3.47Å; F230-C309 HydrophobicContact CD2-CB 3.9Å; F230-C309 HydrophobicContact CE2-CB 3.88Å
231	S	76.4	Confident	75.4	Confident	40 Å²	40	49.4 Å²	49.4	28%	0.28	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	132.7	170.4	-165.2	0	0	0	0	109.8	I167 L216	I167-S231 VanDerWaalsContact CD1-CB 3.41Å; L216-S231 CarbonylContact O-C 3.47Å; L216-S231 VanDerWaalsContact O-CA 3.27Å; L216-S231 WeakPolarHBondContact O-CA 3.43Å; L216-S231 PolarHBondContact O-OG 3.07Å
232	Y	75.5	Confident	74.5	Confident	60 Å²	60	52.6 Å²	52.6	24%	0.235	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.3	-176.5	-55.4	-82.5	0	0	0	109.9	L216 I218 F230 L305	L216-Y232 HydrophobicContact CD2-CD2 4.14Å; L216-Y232 HydrophobicContact CG-CD2 4.38Å; L216-Y232 PolarHBondContact N-O 3.19Å; L216-Y232 PolarHBondContact O-N 2.65Å; I218-Y232 HydrophobicContact CD1-CD2 4.5Å; I218-Y232 HydrophobicContact CD1-CE2 4.25Å; F230-Y232 HydrophobicContact CB-CD2 4.2Å; F230-Y232 HydrophobicContact CB-CE2 3.28Å; F230-Y232 WeakPolarHBondContact CB-OH 3.45Å; F230-Y232 VanDerWaalsContact CD1-OH 3.23Å; F230-Y232 WeakPolarHBondContact CD1-OH 3.47Å; F230-Y232 HydrophobicContact CG-CE2 4.12Å; F230-Y232 AromaticContact CG-CZ 3.97Å; F230-Y232 VanDerWaalsContact CG-OH 3.28Å; F230-Y232 WeakPolarHBondContact CG-OH 3.47Å; Y232-L305 HydrophobicContact CD1-CD1 4.39Å; Y232-L305 HydrophobicContact CD1-CD2 4.27Å; Y232-L305 HydrophobicContact CD2-CD1 3.86Å; Y232-L305 HydrophobicContact CD2-CD2 4.42Å; Y232-L305 HydrophobicContact CE1-CD2 3.68Å; Y232-L305 HydrophobicContact CE2-CB 4.29Å; Y232-L305 HydrophobicContact CE2-CD1 4.02Å; Y232-L305 HydrophobicContact CE2-CD2 3.84Å; Y232-L305 HydrophobicContact CE2-CG 4.28Å; Y232-L305 HydrophobicContact CG-CD1 4.06Å; Y232-L305 VanDerWaalsContact CZ-CD2 3.45Å
233	S	69.2	Low	73.4	Confident	79 Å²	79	52.4 Å²	52.4	55%	0.552	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	131.3	168.6	-176.9	0	0	0	0	109.3	E235	S233-E235 PolarHBondContact O-N 2.67Å; S233-E235 PolarHBondContact OG-OE1 3.09Å; S233-E235 VanDerWaalsContact OG-OE1 3.12Å
234	L	66.2	Low	72.4	Confident	22 Å²	22	47.4 Å²	47.4	12%	0.115	24%	0.243	C	C	.	.			trans	-90.3	100.2	171.4	-72.2	172.8	0	0	0	109.3	L216 M236 L289	L216-L234 HydrophobicContact CB-CD1 4.04Å; L216-L234 HydrophobicContact CB-CD2 3.92Å; L216-L234 HydrophobicContact CB-CG 3.8Å; L216-L234 HydrophobicContact CD2-CD2 4.36Å; L234-M236 HydrophobicContact CD1-CE 4.39Å; L234-M236 PolarHBondContact O-N 3.21Å; L234-L289 HydrophobicContact CD2-CD2 4.03Å
235	E	66.8	Low	72.1	Confident	64 Å²	64	48.4 Å²	48.4	30%	0.299	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-3.9	174.8	-66.2	-56.7	123.4	0	0	113.8	S233 N237 R238 L239 L297	S233-E235 PolarHBondContact O-N 2.67Å; S233-E235 PolarHBondContact OG-OE1 3.09Å; S233-E235 VanDerWaalsContact OG-OE1 3.12Å; E235-N237 VanDerWaalsContact C-N 3.26Å; E235-N237 PolarHBondContact O-N 3.25Å; E235-R238 WeakPolarHBondContact O-CB 3.39Å; E235-R238 PolarHBondContact O-N 3.39Å; E235-R238 IonicContact OE2-CZ 3.15Å; E235-R238 IonicContact OE2-NE 3.93Å; E235-R238 PolarHBondContact OE2-NE 2.78Å; E235-R238 IonicContact OE2-NH2 3.15Å; E235-L239 PolarHBondContact O-N 2.82Å; E235-L297 HydrophobicContact CB-CD1 3.89Å; E235-L297 HydrophobicContact CB-CD2 4.18Å; E235-L297 HydrophobicContact CG-CD2 4.25Å
236	M	64.5	Low	71.7	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-51.8	-42.5	178.3	-172.2	168.9	39	0	0	113	L234 L239 L240 T285 M288 L289 M331 F334	L234-M236 HydrophobicContact CD1-CE 4.39Å; L234-M236 PolarHBondContact O-N 3.21Å; M236-L239 PolarHBondContact O-N 2.65Å; M236-L240 VanDerWaalsContact O-CB 3.27Å; M236-L240 WeakPolarHBondContact O-CB 3.21Å; M236-L240 PolarHBondContact O-N 3.1Å; M236-T285 HydrophobicContact CG-CG2 3.41Å; M236-T285 VanDerWaalsContact CG-CG2 3.41Å; M236-T285 HydrophobicContact SD-CG2 3.88Å; M236-M288 HydrophobicContact CB-CE 3.35Å; M236-M288 HydrophobicContact CG-CE 3.73Å; M236-M288 HydrophobicContact SD-CE 4.49Å; M236-L289 HydrophobicContact CE-CD2 4.29Å; M236-L289 HydrophobicContact SD-CD2 4.27Å; M236-L289 HydrophobicContact SD-CG 4.5Å; M236-M331 HydrophobicContact CE-CB 4.47Å; M236-M331 HydrophobicContact CE-CE 3.15Å; M236-M331 HydrophobicContact CE-CG 4.01Å; M236-M331 HydrophobicContact CE-SD 3.92Å; M236-M331 HydrophobicContact SD-CE 3.88Å; M236-F334 HydrophobicContact CE-CE2 4.11Å; M236-F334 HydrophobicContact CE-CZ 4.46Å; M236-F334 HydrophobicContact SD-CE2 3.74Å; M236-F334 HydrophobicContact SD-CZ 3.87Å
237	N	64.3	Low	71	Confident	35 Å²	35	50.8 Å²	50.8	19%	0.187	26%	0.262	C	S	.	.	H	α-helix	trans	-65.3	-40.9	179.5	-81.3	-22.8	0	0	0	111.8	N214 E235 R241 K266	N214-N237 PolarHBondContact OD1-ND2 3.01Å; E235-N237 VanDerWaalsContact C-N 3.26Å; E235-N237 PolarHBondContact O-N 3.25Å; N237-R241 WeakPolarHBondContact O-CB 3.3Å; N237-R241 PolarHBondContact O-N 3.31Å; N237-R241 VanDerWaalsContact O-N 3.1Å; N237-K266 PolarHBondContact OD1-NZ 3.17Å
238	R	67.8	Low	70.1	Confident	103 Å²	103	51.5 Å²	51.5	39%	0.389	28%	0.282	S	S	.	.	H	α-helix	trans	-68	-42.4	178	-172.1	-174.1	63.2	77.4	-0.8	111	E235 R241 N242	E235-R238 WeakPolarHBondContact O-CB 3.39Å; E235-R238 PolarHBondContact O-N 3.39Å; E235-R238 IonicContact OE2-CZ 3.15Å; E235-R238 IonicContact OE2-NE 3.93Å; E235-R238 PolarHBondContact OE2-NE 2.78Å; E235-R238 IonicContact OE2-NH2 3.15Å; R238-R241 WeakPolarHBondContact O-CB 3.31Å; R238-N242 PolarHBondContact NH1-ND2 3.3Å; R238-N242 WeakPolarHBondContact O-CB 3.29Å; R238-N242 PolarHBondContact O-N 3.39Å; R238-N242 PolarHBondContact O-OD1 3.13Å
239	L	67	Low	69.2	Low	23 Å²	23	51.7 Å²	51.7	12%	0.12	28%	0.279	C	S	.	.	H	α-helix	trans	-73.4	-42.8	-178	-72.7	174	0	0	0	113.1	E235 M236 R241 N242 R243 M288 W295 L297	E235-L239 PolarHBondContact O-N 2.82Å; M236-L239 PolarHBondContact O-N 2.65Å; L239-R241 VanDerWaalsContact C-N 3.3Å; L239-R241 PolarHBondContact O-N 3.32Å; L239-N242 PolarHBondContact O-N 2.85Å; L239-R243 WeakPolarHBondContact O-CB 3.5Å; L239-R243 VanDerWaalsContact O-CG 3.24Å; L239-R243 WeakPolarHBondContact O-CG 3.47Å; L239-R243 PolarHBondContact O-N 3.44Å; L239-M288 HydrophobicContact CB-SD 4.17Å; L239-M288 HydrophobicContact CD1-CG 4.29Å; L239-M288 HydrophobicContact CD1-SD 3.25Å; L239-M288 WeakPolarHBondContact CD1-SD 3.33Å; L239-M288 HydrophobicContact CG-SD 4.31Å; L239-W295 HydrophobicContact CD1-CB 3.96Å; L239-W295 HydrophobicContact CD1-CG 4.43Å; L239-L297 HydrophobicContact CD1-CD1 3.52Å; L239-L297 HydrophobicContact CD1-CD2 4.07Å; L239-L297 HydrophobicContact CD1-CG 3.87Å
240	L	65.2	Low	68.1	Low	6 Å²	6	53.1 Å²	53.1	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-42.7	174.2	-179.6	64.2	0	0	0	110.5	M236 N242 R243 L244 L262 K266 M278 T285	M236-L240 VanDerWaalsContact O-CB 3.27Å; M236-L240 WeakPolarHBondContact O-CB 3.21Å; M236-L240 PolarHBondContact O-N 3.1Å; L240-N242 PolarHBondContact O-N 3.42Å; L240-R243 PolarHBondContact O-N 2.88Å; L240-L244 HydrophobicContact CD1-CD1 4.04Å; L240-L244 HydrophobicContact CD1-CD2 4.46Å; L240-L244 HydrophobicContact CD1-CG 4.01Å; L240-L244 HydrophobicContact CG-CD1 3.93Å; L240-L244 HydrophobicContact CG-CG 4.27Å; L240-L244 WeakPolarHBondContact O-CB 3.4Å; L240-L244 VanDerWaalsContact O-CG 3.26Å; L240-L244 WeakPolarHBondContact O-CG 3.25Å; L240-L244 PolarHBondContact O-N 2.98Å; L240-L262 HydrophobicContact CB-CD1 4.17Å; L240-L262 HydrophobicContact CD2-CD1 3.46Å; L240-L262 VanDerWaalsContact CD2-CD1 3.46Å; L240-L262 HydrophobicContact CD2-CG 4.17Å; L240-L262 HydrophobicContact CG-CD1 3.54Å; L240-K266 HydrophobicContact CD2-CD 3.84Å; L240-K266 HydrophobicContact CD2-CG 3.4Å; L240-M278 HydrophobicContact CD1-CE 4.23Å; L240-T285 HydrophobicContact CB-CG2 4.04Å; L240-T285 HydrophobicContact CD1-CG2 4.3Å; L240-T285 WeakPolarHBondContact CD1-OG1 3.33Å; L240-T285 HydrophobicContact CD2-CG2 4.35Å; L240-T285 HydrophobicContact CG-CG2 4.45Å
241	R	68.8	Low	66.9	Low	38 Å²	38	53.6 Å²	53.6	14%	0.143	30%	0.3	C	S	.	.	H	α-helix	trans	-53.8	-53.7	172.8	-177.5	-163.5	-53.9	-130.2	-10.4	111.5	N237 R238 L239 R243 L244 A245 F253 D254 L262	N237-R241 WeakPolarHBondContact O-CB 3.3Å; N237-R241 PolarHBondContact O-N 3.31Å; N237-R241 VanDerWaalsContact O-N 3.1Å; R238-R241 WeakPolarHBondContact O-CB 3.31Å; L239-R241 VanDerWaalsContact C-N 3.3Å; L239-R241 PolarHBondContact O-N 3.32Å; R241-R243 VanDerWaalsContact C-N 3.32Å; R241-R243 PolarHBondContact O-N 2.78Å; R241-L244 PolarHBondContact O-N 2.89Å; R241-A245 VanDerWaalsContact O-CB 3.3Å; R241-A245 WeakPolarHBondContact O-CB 3.17Å; R241-A245 PolarHBondContact O-N 3.4Å; R241-F253 HydrophobicContact CB-CB 4.22Å; R241-F253 HydrophobicContact CG-CB 3.43Å; R241-F253 VanDerWaalsContact CG-CB 3.43Å; R241-F253 PolarHBondContact NH1-O 2.97Å; R241-D254 VanDerWaalsContact CD-OD1 3.3Å; R241-D254 WeakPolarHBondContact CD-OD1 3.46Å; R241-D254 IonicContact CZ-OD1 2.69Å; R241-D254 IonicContact NE-OD1 3.19Å; R241-D254 IonicContact NH1-OD1 3.99Å; R241-D254 PolarHBondContact NH1-OD1 3.23Å; R241-L262 HydrophobicContact CB-CD2 4.32Å
242	N	72.3	Confident	66	Low	68 Å²	68	54.4 Å²	54.4	36%	0.364	31%	0.306	S	S	.	.	H	α-helix	trans	-60.6	-41.2	179.9	-70.1	1	0	0	0	112.1	R238 L239 L240 N246	R238-N242 PolarHBondContact NH1-ND2 3.3Å; R238-N242 WeakPolarHBondContact O-CB 3.29Å; R238-N242 PolarHBondContact O-N 3.39Å; R238-N242 PolarHBondContact O-OD1 3.13Å; L239-N242 PolarHBondContact O-N 2.85Å; L240-N242 PolarHBondContact O-N 3.42Å; N242-N246 WeakPolarHBondContact O-CB 3.49Å; N242-N246 PolarHBondContact O-N 2.84Å; N242-N246 PolarHBondContact O-ND2 2.86Å; N242-N246 PolarHBondContact O-OD1 2.78Å
243	R	68.5	Low	65.2	Low	86 Å²	86	51.6 Å²	51.6	33%	0.325	30%	0.295	S	S	.	.	H	α-helix	trans	-63.9	-45.7	177.9	-73.6	-92.1	-109.3	-147.7	-9.8	111.8	L239 L240 R241 N246 K247 E284	L239-R243 WeakPolarHBondContact O-CB 3.5Å; L239-R243 VanDerWaalsContact O-CG 3.24Å; L239-R243 WeakPolarHBondContact O-CG 3.47Å; L239-R243 PolarHBondContact O-N 3.44Å; L240-R243 PolarHBondContact O-N 2.88Å; R241-R243 VanDerWaalsContact C-N 3.32Å; R241-R243 PolarHBondContact O-N 2.78Å; R243-N246 PolarHBondContact O-N 3.28Å; R243-K247 PolarHBondContact O-N 2.9Å; R243-E284 IonicContact CZ-OE2 3.31Å; R243-E284 IonicContact NE-OE2 3.78Å; R243-E284 IonicContact NH1-OE2 2.62Å; R243-E284 IonicContact NH2-OE1 2.77Å; R243-E284 IonicContact NH2-OE2 3.68Å; R243-E284 PolarHBondContact NH2-OE2 2.76Å
244	L	66.3	Low	64.3	Low	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-69.9	-39.1	179.1	-66	177.9	0	0	0	112.2	L240 R241 N246 K247 Y249 F253 L262 V265 M278	L240-L244 HydrophobicContact CD1-CD1 4.04Å; L240-L244 HydrophobicContact CD1-CD2 4.46Å; L240-L244 HydrophobicContact CD1-CG 4.01Å; L240-L244 HydrophobicContact CG-CD1 3.93Å; L240-L244 HydrophobicContact CG-CG 4.27Å; L240-L244 WeakPolarHBondContact O-CB 3.4Å; L240-L244 VanDerWaalsContact O-CG 3.26Å; L240-L244 WeakPolarHBondContact O-CG 3.25Å; L240-L244 PolarHBondContact O-N 2.98Å; R241-L244 PolarHBondContact O-N 2.89Å; L244-N246 VanDerWaalsContact C-N 3.31Å; L244-N246 PolarHBondContact O-N 3.28Å; L244-K247 PolarHBondContact O-N 3.47Å; L244-Y249 HydrophobicContact CD2-CE2 4.27Å; L244-Y249 WeakPolarHBondContact O-CD2 3.36Å; L244-F253 HydrophobicContact CB-CD2 3.73Å; L244-F253 HydrophobicContact CB-CE1 4.46Å; L244-F253 HydrophobicContact CB-CE2 3.28Å; L244-F253 HydrophobicContact CB-CG 4.49Å; L244-F253 HydrophobicContact CB-CZ 3.69Å; L244-F253 HydrophobicContact CD1-CD1 4.45Å; L244-F253 HydrophobicContact CD1-CE1 4Å; L244-F253 HydrophobicContact CD1-CE2 4.31Å; L244-F253 HydrophobicContact CD1-CZ 3.92Å; L244-F253 HydrophobicContact CG-CE2 4.4Å; L244-F253 HydrophobicContact CG-CZ 4.39Å; L244-L262 HydrophobicContact CD1-CD1 3.53Å; L244-V265 HydrophobicContact CD1-CG1 4.48Å; L244-M278 HydrophobicContact CD2-CE 3.71Å; L244-M278 HydrophobicContact CD2-SD 3.34Å; L244-M278 WeakPolarHBondContact CD2-SD 3.34Å
245	A	70	Confident	63.3	Low	32 Å²	32	53.6 Å²	53.6	26%	0.264	31%	0.306	S	S	.	.	H	α-helix	trans	-60.7	-42.7	174.7	0	0	0	0	0	111.1	R241 K247 G248 F253	R241-A245 VanDerWaalsContact O-CB 3.3Å; R241-A245 WeakPolarHBondContact O-CB 3.17Å; R241-A245 PolarHBondContact O-N 3.4Å; A245-K247 PolarHBondContact O-N 3.38Å; A245-G248 PolarHBondContact O-N 3.04Å; A245-G248 VanDerWaalsContact O-N 3.13Å; A245-F253 HydrophobicContact CB-CD2 4.45Å
246	N	72.8	Confident	62.3	Low	138 Å²	138	51.6 Å²	51.6	74%	0.738	30%	0.299	S	S	*	.	H	α-helix	trans	-67.1	-16.5	178.5	-71.3	-11.2	0	0	0	114.1	N242 R243 L244 G248	N242-N246 WeakPolarHBondContact O-CB 3.49Å; N242-N246 PolarHBondContact O-N 2.84Å; N242-N246 PolarHBondContact O-ND2 2.86Å; N242-N246 PolarHBondContact O-OD1 2.78Å; R243-N246 PolarHBondContact O-N 3.28Å; L244-N246 VanDerWaalsContact C-N 3.31Å; L244-N246 PolarHBondContact O-N 3.28Å; N246-G248 PolarHBondContact O-N 3.3Å
247	K	67.9	Low	61.5	Low	80 Å²	80	56.4 Å²	56.4	35%	0.348	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-5.3	174	-80.9	-156.5	172.5	-172	0	113.9	R243 L244 A245 Y249 E277 E281	R243-K247 PolarHBondContact O-N 2.9Å; L244-K247 PolarHBondContact O-N 3.47Å; A245-K247 PolarHBondContact O-N 3.38Å; K247-Y249 HydrophobicContact CB-CD2 3.7Å; K247-Y249 HydrophobicContact CB-CE2 3.37Å; K247-Y249 HydrophobicContact CB-CG 4.45Å; K247-Y249 HydrophobicContact CD-CE2 3.52Å; K247-Y249 WeakPolarHBondContact CD-OH 3.35Å; K247-Y249 HydrophobicContact CG-CE2 4.04Å; K247-Y249 PolarHBondContact O-N 3.39Å; K247-E277 PolarHBondContact NZ-O 2.84Å; K247-E281 VanDerWaalsContact CE-CD 3.41Å; K247-E281 WeakPolarHBondContact CE-OE1 3.4Å; K247-E281 IonicContact NZ-OE1 2.63Å; K247-E281 PolarHBondContact NZ-OE1 2.8Å; K247-E281 IonicContact NZ-OE2 3.25Å; K247-E281 PolarHBondContact NZ-OE2 2.94Å
248	G	61.2	Low	61	Low	66 Å²	66	56.1 Å²	56.1	68%	0.68	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	24.6	174.3	0	0	0	0	0	114.2	A245 N246 G250	A245-G248 PolarHBondContact O-N 3.04Å; A245-G248 VanDerWaalsContact O-N 3.13Å; N246-G248 PolarHBondContact O-N 3.3Å; G248-G250 PolarHBondContact O-N 2.89Å
249	Y	61.3	Low	60.3	Low	53 Å²	53	54.1 Å²	54.1	21%	0.208	31%	0.312	C	S	.	.	S	Bend	trans	-67.4	0.1	175.8	-62.9	-58.6	0	0	0	114.3	L244 K247 F251 S275 I276 E277	L244-Y249 HydrophobicContact CD2-CE2 4.27Å; L244-Y249 WeakPolarHBondContact O-CD2 3.36Å; K247-Y249 HydrophobicContact CB-CD2 3.7Å; K247-Y249 HydrophobicContact CB-CE2 3.37Å; K247-Y249 HydrophobicContact CB-CG 4.45Å; K247-Y249 HydrophobicContact CD-CE2 3.52Å; K247-Y249 WeakPolarHBondContact CD-OH 3.35Å; K247-Y249 HydrophobicContact CG-CE2 4.04Å; K247-Y249 PolarHBondContact O-N 3.39Å; Y249-F251 VanDerWaalsContact C-N 3.32Å; Y249-F251 WeakPolarHBondContact O-CD2 3.47Å; Y249-S275 WeakPolarHBondContact CE1-O 3.4Å; Y249-I276 HydrophobicContact CD1-CG1 4.16Å; Y249-I276 HydrophobicContact CD2-CG2 4.3Å; Y249-I276 HydrophobicContact CE1-CB 4.41Å; Y249-I276 HydrophobicContact CE1-CG1 4.36Å; Y249-I276 HydrophobicContact CE1-CG2 4.32Å; Y249-I276 HydrophobicContact CE2-CG2 3.8Å; Y249-I276 HydrophobicContact CG-CG1 4.27Å; Y249-E277 PolarHBondContact OH-O 3.11Å; Y249-E277 VanDerWaalsContact OH-O 3.14Å
250	G	57.5	Low	59.7	Low	74 Å²	74	53.7 Å²	53.7	76%	0.763	31%	0.31	S	S	*	.	S	Bend	trans	78.3	13.2	-176.8	0	0	0	0	0	114.4	G248	G248-G250 PolarHBondContact O-N 2.89Å
251	F	55.4	Low	59.3	Low	56 Å²	56	53.8 Å²	53.8	25%	0.246	31%	0.311	C	S	.	.			trans	-116.5	134.1	175.8	-58	-68.7	0	0	0	109.7	Y26 Y249 F253 E258 I276	Y26-F251 HydrophobicContact CE1-CE1 4.29Å; Y249-F251 VanDerWaalsContact C-N 3.32Å; Y249-F251 WeakPolarHBondContact O-CD2 3.47Å; F251-F253 VanDerWaalsContact C-N 3.27Å; F251-F253 HydrophobicContact CB-CD1 4.49Å; F251-F253 HydrophobicContact CB-CD2 3.79Å; F251-F253 HydrophobicContact CB-CE1 4.3Å; F251-F253 HydrophobicContact CB-CE2 3.55Å; F251-F253 HydrophobicContact CB-CG 4.26Å; F251-F253 HydrophobicContact CB-CZ 3.83Å; F251-F253 HydrophobicContact CD2-CE2 4.49Å; F251-F253 HydrophobicContact CD2-CZ 4.13Å; F251-F253 HydrophobicContact CG-CE2 4.45Å; F251-F253 HydrophobicContact CG-CZ 4.31Å; F251-E258 HydrophobicContact CB-CG 4.45Å; F251-E258 HydrophobicContact CD1-CG 3.88Å; F251-E258 WeakPolarHBondContact CD1-OE1 3.48Å; F251-I276 HydrophobicContact CE2-CD1 4.38Å
252	S	57.6	Low	58.9	Low	58 Å²	58	52.1 Å²	52.1	41%	0.406	31%	0.305	S	S	.	.			trans	-79.8	-18.3	169.3	61.4	0	0	0	0	111.8	D254 E258	S252-D254 PolarHBondContact O-N 2.76Å; S252-D254 WeakPolarHBondContact OG-CB 3.28Å; S252-D254 PolarHBondContact OG-N 2.82Å; S252-E258 PolarHBondContact N-OE2 3.22Å; S252-E258 PolarHBondContact OG-OE2 2.83Å
253	F	57.9	Low	58.3	Low	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.293	C	S	.	.	S	Bend	trans	57.9	18.8	-168.2	-62.4	-89.8	0	0	0	113.5	R241 L244 A245 F251 E258 Q259 L262	R241-F253 HydrophobicContact CB-CB 4.22Å; R241-F253 HydrophobicContact CG-CB 3.43Å; R241-F253 VanDerWaalsContact CG-CB 3.43Å; R241-F253 PolarHBondContact NH1-O 2.97Å; L244-F253 HydrophobicContact CB-CD2 3.73Å; L244-F253 HydrophobicContact CB-CE1 4.46Å; L244-F253 HydrophobicContact CB-CE2 3.28Å; L244-F253 HydrophobicContact CB-CG 4.49Å; L244-F253 HydrophobicContact CB-CZ 3.69Å; L244-F253 HydrophobicContact CD1-CD1 4.45Å; L244-F253 HydrophobicContact CD1-CE1 4Å; L244-F253 HydrophobicContact CD1-CE2 4.31Å; L244-F253 HydrophobicContact CD1-CZ 3.92Å; L244-F253 HydrophobicContact CG-CE2 4.4Å; L244-F253 HydrophobicContact CG-CZ 4.39Å; A245-F253 HydrophobicContact CB-CD2 4.45Å; F251-F253 VanDerWaalsContact C-N 3.27Å; F251-F253 HydrophobicContact CB-CD1 4.49Å; F251-F253 HydrophobicContact CB-CD2 3.79Å; F251-F253 HydrophobicContact CB-CE1 4.3Å; F251-F253 HydrophobicContact CB-CE2 3.55Å; F251-F253 HydrophobicContact CB-CG 4.26Å; F251-F253 HydrophobicContact CB-CZ 3.83Å; F251-F253 HydrophobicContact CD2-CE2 4.49Å; F251-F253 HydrophobicContact CD2-CZ 4.13Å; F251-F253 HydrophobicContact CG-CE2 4.45Å; F251-F253 HydrophobicContact CG-CZ 4.31Å; F253-E258 WeakPolarHBondContact CA-OE2 3.35Å; F253-E258 HydrophobicContact CD1-CB 4.23Å; F253-E258 PolarHBondContact N-OE2 3.01Å; F253-Q259 WeakPolarHBondContact O-CG 3.22Å; F253-L262 HydrophobicContact CD1-CB 4.3Å; F253-L262 HydrophobicContact CD1-CD1 4.44Å
254	D	51.6	Low	57.8	Low	95 Å²	95	47 Å²	47	51%	0.508	28%	0.281	S	S	.	.			trans	-89	-36.9	175.4	-72.7	-39.7	0	0	0	112.4	R241 S252 Q259	R241-D254 VanDerWaalsContact CD-OD1 3.3Å; R241-D254 WeakPolarHBondContact CD-OD1 3.46Å; R241-D254 IonicContact CZ-OD1 2.69Å; R241-D254 IonicContact NE-OD1 3.19Å; R241-D254 IonicContact NH1-OD1 3.99Å; R241-D254 PolarHBondContact NH1-OD1 3.23Å; S252-D254 PolarHBondContact O-N 2.76Å; S252-D254 WeakPolarHBondContact OG-CB 3.28Å; S252-D254 PolarHBondContact OG-N 2.82Å; D254-Q259 PolarHBondContact O-NE2 3.49Å
255	A	45.2	Very low	57.5	Low	48 Å²	48	47.4 Å²	47.4	40%	0.397	28%	0.283	S	S	.	.	S	Bend	trans	-63.6	142.1	178.8	0	0	0	0	0	111	K257 E258 Q259	A255-K257 PolarHBondContact O-N 3.45Å; A255-K257 VanDerWaalsContact O-N 3.16Å; A255-E258 HydrophobicContact CB-CB 4.46Å; A255-E258 HydrophobicContact CB-CG 4.06Å; A255-E258 CarbonylContact O-C 3.58Å; A255-E258 WeakPolarHBondContact O-CA 3.25Å; A255-E258 WeakPolarHBondContact O-CB 3.28Å; A255-E258 PolarHBondContact O-N 3.08Å; A255-Q259 PolarHBondContact O-N 3.38Å
256	C	46.1	Very low	57.1	Low	22 Å²	22	47.3 Å²	47.3	15%	0.149	28%	0.276	C	S	.	.	H	α-helix	trans	-55.3	-37.9	-177.7	-172.3	0	0	0	0	112.8	Y120 E258 Q259 N260	Y120-C256 HydrophobicContact CD1-CB 3.7Å; Y120-C256 VanDerWaalsContact CD1-SG 3.58Å; Y120-C256 HydrophobicContact CD2-CB 3.94Å; Y120-C256 HydrophobicContact CE1-CB 4.2Å; Y120-C256 HydrophobicContact CE2-CB 4.44Å; Y120-C256 HydrophobicContact CG-CB 3.54Å; C256-E258 VanDerWaalsContact C-N 3.28Å; C256-E258 PolarHBondContact O-N 2.93Å; C256-Q259 PolarHBondContact O-N 2.89Å; C256-N260 PolarHBondContact O-N 2.8Å; C256-N260 VanDerWaalsContact O-N 3.11Å; C256-N260 PolarHBondContact O-ND2 3.45Å
257	K	47.6	Very low	56.4	Low	104 Å²	104	44 Å²	44	45%	0.452	26%	0.256	S	S	.	.	H	α-helix	trans	-60.2	-39.2	174.9	-60.6	-173.9	179	-177.8	0	111.6	L25 Y26 A255 N260 L261	L25-K257 HydrophobicContact CD1-CB 4.12Å; L25-K257 HydrophobicContact CD1-CG 4.02Å; L25-K257 HydrophobicContact CD2-CD 3.83Å; L25-K257 HydrophobicContact CD2-CG 3.88Å; L25-K257 HydrophobicContact CG-CG 4.49Å; Y26-K257 HydrophobicContact CE2-CB 4.22Å; A255-K257 PolarHBondContact O-N 3.45Å; A255-K257 VanDerWaalsContact O-N 3.16Å; K257-N260 WeakPolarHBondContact O-CB 3.49Å; K257-N260 PolarHBondContact O-N 2.98Å; K257-L261 VanDerWaalsContact O-CD1 3.23Å; K257-L261 WeakPolarHBondContact O-CD1 3.21Å; K257-L261 PolarHBondContact O-N 3.45Å
258	E	52	Low	55.8	Low	29 Å²	29	42.5 Å²	42.5	14%	0.136	25%	0.25	C	S	.	.	H	α-helix	trans	-80	-30.4	-179.8	-56.7	174.6	177.5	0	0	112.5	F251 S252 F253 A255 C256 N260 L261 L262	F251-E258 HydrophobicContact CB-CG 4.45Å; F251-E258 HydrophobicContact CD1-CG 3.88Å; F251-E258 WeakPolarHBondContact CD1-OE1 3.48Å; S252-E258 PolarHBondContact N-OE2 3.22Å; S252-E258 PolarHBondContact OG-OE2 2.83Å; F253-E258 WeakPolarHBondContact CA-OE2 3.35Å; F253-E258 HydrophobicContact CD1-CB 4.23Å; F253-E258 PolarHBondContact N-OE2 3.01Å; A255-E258 HydrophobicContact CB-CB 4.46Å; A255-E258 HydrophobicContact CB-CG 4.06Å; A255-E258 CarbonylContact O-C 3.58Å; A255-E258 WeakPolarHBondContact O-CA 3.25Å; A255-E258 WeakPolarHBondContact O-CB 3.28Å; A255-E258 PolarHBondContact O-N 3.08Å; C256-E258 VanDerWaalsContact C-N 3.28Å; C256-E258 PolarHBondContact O-N 2.93Å; E258-N260 VanDerWaalsContact C-N 3.26Å; E258-N260 PolarHBondContact O-N 3.26Å; E258-L261 CarbonylContact O-C 3.6Å; E258-L261 WeakPolarHBondContact O-CA 3.38Å; E258-L261 VanDerWaalsContact O-CB 3.29Å; E258-L261 WeakPolarHBondContact O-CB 3.43Å; E258-L261 PolarHBondContact O-N 2.87Å; E258-L261 VanDerWaalsContact O-N 3.1Å; E258-L262 PolarHBondContact O-N 2.84Å
259	Q	53.6	Low	55.2	Low	61 Å²	61	44 Å²	44	29%	0.285	24%	0.239	S	C	.	.	H	α-helix	trans	-65.4	-32.3	170.6	-67	-170.5	26.5	0	0	111.9	F253 D254 A255 C256 L262 R263	F253-Q259 WeakPolarHBondContact O-CG 3.22Å; D254-Q259 PolarHBondContact O-NE2 3.49Å; A255-Q259 PolarHBondContact O-N 3.38Å; C256-Q259 PolarHBondContact O-N 2.89Å; Q259-L262 WeakPolarHBondContact O-CB 3.26Å; Q259-L262 PolarHBondContact O-N 2.98Å; Q259-R263 PolarHBondContact O-N 3.29Å
260	N	55.3	Low	54.2	Low	14 Å²	14	43.4 Å²	43.4	8%	0.075	25%	0.248	C	C	.	.	H	α-helix	trans	-69.8	-33.8	170.1	-78.6	-40.6	0	0	0	112.5	L21 C256 K257 E258 R263 Y264	L21-N260 HydrophobicContact CD2-CB 3.43Å; L21-N260 VanDerWaalsContact CD2-CB 3.43Å; L21-N260 WeakPolarHBondContact CD2-ND2 3.25Å; C256-N260 PolarHBondContact O-N 2.8Å; C256-N260 VanDerWaalsContact O-N 3.11Å; C256-N260 PolarHBondContact O-ND2 3.45Å; K257-N260 WeakPolarHBondContact O-CB 3.49Å; K257-N260 PolarHBondContact O-N 2.98Å; E258-N260 VanDerWaalsContact C-N 3.26Å; E258-N260 PolarHBondContact O-N 3.26Å; N260-R263 WeakPolarHBondContact O-CB 3.41Å; N260-R263 PolarHBondContact O-N 2.86Å; N260-Y264 PolarHBondContact O-N 2.74Å
261	L	55.8	Low	53.1	Low	7 Å²	7	43.4 Å²	43.4	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-43.7	166.7	-94.7	76.8	0	0	0	111.4	L22 Y26 K257 E258 R263 Y264 V265	L22-L261 HydrophobicContact CD2-CD1 3.31Å; L22-L261 HydrophobicContact CD2-CG 3.75Å; Y26-L261 HydrophobicContact CD2-CD1 3.63Å; Y26-L261 HydrophobicContact CE1-CD1 4.23Å; Y26-L261 HydrophobicContact CE1-CD2 4.49Å; Y26-L261 HydrophobicContact CE2-CD1 2.99Å; Y26-L261 HydrophobicContact CE2-CG 4.34Å; Y26-L261 HydrophobicContact CG-CD1 4.49Å; Y26-L261 WeakPolarHBondContact OH-CD1 3.38Å; K257-L261 VanDerWaalsContact O-CD1 3.23Å; K257-L261 WeakPolarHBondContact O-CD1 3.21Å; K257-L261 PolarHBondContact O-N 3.45Å; E258-L261 CarbonylContact O-C 3.6Å; E258-L261 WeakPolarHBondContact O-CA 3.38Å; E258-L261 VanDerWaalsContact O-CB 3.29Å; E258-L261 WeakPolarHBondContact O-CB 3.43Å; E258-L261 PolarHBondContact O-N 2.87Å; E258-L261 VanDerWaalsContact O-N 3.1Å; L261-R263 VanDerWaalsContact C-N 3.27Å; L261-R263 PolarHBondContact O-N 2.9Å; L261-Y264 CarbonylContact O-C 3.5Å; L261-Y264 WeakPolarHBondContact O-CB 3.44Å; L261-Y264 PolarHBondContact O-N 2.99Å; L261-Y264 VanDerWaalsContact O-N 3.11Å; L261-V265 WeakPolarHBondContact O-CB 3.48Å; L261-V265 VanDerWaalsContact O-CG2 3.26Å; L261-V265 WeakPolarHBondContact O-CG2 3.25Å; L261-V265 PolarHBondContact O-N 2.84Å
262	L	60.1	Low	52.5	Low	4 Å²	4	41.7 Å²	41.7	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-56.7	-44.7	176.1	-173.7	71.6	0	0	0	110.5	L240 R241 L244 F253 E258 Q259 V265 K266	L240-L262 HydrophobicContact CB-CD1 4.17Å; L240-L262 HydrophobicContact CD2-CD1 3.46Å; L240-L262 VanDerWaalsContact CD2-CD1 3.46Å; L240-L262 HydrophobicContact CD2-CG 4.17Å; L240-L262 HydrophobicContact CG-CD1 3.54Å; R241-L262 HydrophobicContact CB-CD2 4.32Å; L244-L262 HydrophobicContact CD1-CD1 3.53Å; F253-L262 HydrophobicContact CD1-CB 4.3Å; F253-L262 HydrophobicContact CD1-CD1 4.44Å; E258-L262 PolarHBondContact O-N 2.84Å; Q259-L262 WeakPolarHBondContact O-CB 3.26Å; Q259-L262 PolarHBondContact O-N 2.98Å; L262-V265 PolarHBondContact O-N 3.05Å; L262-K266 HydrophobicContact CG-CD 4.36Å; L262-K266 WeakPolarHBondContact O-CG 3.44Å; L262-K266 PolarHBondContact O-N 3.35Å
263	R	61.1	Low	51.8	Low	29 Å²	29	43.3 Å²	43.3	11%	0.109	24%	0.239	C	C	.	.	H	α-helix	trans	-59.1	-49.1	173.2	-177.7	-178.8	-177.8	152.6	7.3	111.5	V18 C72 Q259 N260 L261 V265 K266 E267 Y364	V18-R263 HydrophobicContact CG2-CG 4.2Å; C72-R263 PolarHBondContact O-NH1 3.02Å; C72-R263 VanDerWaalsContact SG-CZ 3.59Å; C72-R263 PolarHBondContact SG-NH1 3.46Å; C72-R263 VanDerWaalsContact SG-NH1 3.45Å; Q259-R263 PolarHBondContact O-N 3.29Å; N260-R263 WeakPolarHBondContact O-CB 3.41Å; N260-R263 PolarHBondContact O-N 2.86Å; L261-R263 VanDerWaalsContact C-N 3.27Å; L261-R263 PolarHBondContact O-N 2.9Å; R263-V265 VanDerWaalsContact C-N 3.34Å; R263-V265 PolarHBondContact O-N 3.19Å; R263-K266 WeakPolarHBondContact O-CB 3.26Å; R263-K266 PolarHBondContact O-N 2.9Å; R263-E267 HydrophobicContact CG-CG 4.36Å; R263-E267 VanDerWaalsContact CG-OE1 3.25Å; R263-E267 WeakPolarHBondContact CG-OE1 3.28Å; R263-E267 IonicContact CZ-OE1 3.46Å; R263-E267 IonicContact NE-OE1 2.84Å; R263-E267 PolarHBondContact NE-OE1 3.14Å; R263-E267 IonicContact NH2-OE1 3.39Å; R263-E267 WeakPolarHBondContact O-CB 3.17Å; R263-E267 WeakPolarHBondContact O-CG 3.45Å; R263-E267 PolarHBondContact O-N 3Å; R263-Y364 PolarHBondContact NH2-OH 3.35Å
264	Y	57.7	Low	51.2	Low	18 Å²	18	50.3 Å²	50.3	7%	0.071	27%	0.265	C	S	.	.	H	α-helix	trans	-59.5	-43.8	176.9	179.5	-91.3	0	0	0	112.4	V18 L19 L22 N260 L261 K266 E267 K268 L272	V18-Y264 HydrophobicContact CB-CD2 4.12Å; V18-Y264 HydrophobicContact CG1-CD2 4.2Å; L19-Y264 HydrophobicContact CD2-CE2 3.95Å; L19-Y264 HydrophobicContact CG-CE2 3.96Å; L22-Y264 HydrophobicContact CD1-CD1 3.66Å; L22-Y264 HydrophobicContact CD1-CD2 3.21Å; L22-Y264 HydrophobicContact CD1-CE1 3.99Å; L22-Y264 HydrophobicContact CD1-CE2 3.52Å; L22-Y264 HydrophobicContact CD1-CG 3.26Å; L22-Y264 HydrophobicContact CG-CD2 4.29Å; L22-Y264 HydrophobicContact CG-CG 4.39Å; N260-Y264 PolarHBondContact O-N 2.74Å; L261-Y264 CarbonylContact O-C 3.5Å; L261-Y264 WeakPolarHBondContact O-CB 3.44Å; L261-Y264 PolarHBondContact O-N 2.99Å; L261-Y264 VanDerWaalsContact O-N 3.11Å; Y264-K266 VanDerWaalsContact C-N 3.27Å; Y264-K266 PolarHBondContact O-N 3.14Å; Y264-E267 PolarHBondContact O-N 2.81Å; Y264-K268 HydrophobicContact CD1-CB 4.32Å; Y264-K268 HydrophobicContact CD1-CG 4.34Å; Y264-K268 HydrophobicContact CD2-CG 3.88Å; Y264-K268 HydrophobicContact CE1-CB 3.97Å; Y264-K268 HydrophobicContact CE1-CG 3.99Å; Y264-K268 HydrophobicContact CE2-CB 4.42Å; Y264-K268 HydrophobicContact CE2-CD 4.5Å; Y264-K268 HydrophobicContact CE2-CG 3.53Å; Y264-K268 HydrophobicContact CG-CG 4.3Å; Y264-K268 VanDerWaalsContact O-CB 3.31Å; Y264-K268 WeakPolarHBondContact O-CB 3.23Å; Y264-K268 PolarHBondContact O-N 3.25Å; Y264-L272 HydrophobicContact CD1-CD1 3.79Å; Y264-L272 HydrophobicContact CD1-CD2 4.1Å; Y264-L272 HydrophobicContact CD1-CG 4.01Å; Y264-L272 HydrophobicContact CE1-CD1 3.73Å; Y264-L272 HydrophobicContact CE1-CD2 4.03Å; Y264-L272 HydrophobicContact CE1-CG 3.62Å
265	V	59.2	Low	51	Low	8 Å²	8	51.1 Å²	51.1	5%	0.048	28%	0.278	C	S	.	.	H	α-helix	trans	-62.7	-36.2	177.7	169.5	0	0	0	0	111.1	L244 L261 L262 R263 L272 M278	L244-V265 HydrophobicContact CD1-CG1 4.48Å; L261-V265 WeakPolarHBondContact O-CB 3.48Å; L261-V265 VanDerWaalsContact O-CG2 3.26Å; L261-V265 WeakPolarHBondContact O-CG2 3.25Å; L261-V265 PolarHBondContact O-N 2.84Å; L262-V265 PolarHBondContact O-N 3.05Å; R263-V265 VanDerWaalsContact C-N 3.34Å; R263-V265 PolarHBondContact O-N 3.19Å; V265-L272 HydrophobicContact CG2-CD1 3.65Å; V265-M278 HydrophobicContact CG1-CE 3.79Å; V265-M278 HydrophobicContact CG1-CG 4.08Å; V265-M278 HydrophobicContact CG1-SD 4.21Å
266	K	61.4	Low	51.3	Low	30 Å²	30	49.2 Å²	49.2	13%	0.13	26%	0.262	C	S	.	.	H	α-helix	trans	-70	-40.1	174.4	-70.5	168.7	67.6	-168.9	0	112.6	N237 L240 L262 R263 Y264 M331	N237-K266 PolarHBondContact OD1-NZ 3.17Å; L240-K266 HydrophobicContact CD2-CD 3.84Å; L240-K266 HydrophobicContact CD2-CG 3.4Å; L262-K266 HydrophobicContact CG-CD 4.36Å; L262-K266 WeakPolarHBondContact O-CG 3.44Å; L262-K266 PolarHBondContact O-N 3.35Å; R263-K266 WeakPolarHBondContact O-CB 3.26Å; R263-K266 PolarHBondContact O-N 2.9Å; Y264-K266 VanDerWaalsContact C-N 3.27Å; Y264-K266 PolarHBondContact O-N 3.14Å; K266-M331 WeakPolarHBondContact CE-SD 3.35Å; K266-M331 PolarHBondContact NZ-SD 3.48Å
267	E	58.8	Low	51.5	Low	68 Å²	68	55.7 Å²	55.7	32%	0.318	29%	0.289	S	S	.	.	H	α-helix	trans	-82.6	-25.6	-176.5	-70.9	178.1	-171.3	0	0	113.2	V18 R263 Y264	V18-E267 WeakPolarHBondContact CG2-OE2 3.35Å; R263-E267 HydrophobicContact CG-CG 4.36Å; R263-E267 VanDerWaalsContact CG-OE1 3.25Å; R263-E267 WeakPolarHBondContact CG-OE1 3.28Å; R263-E267 IonicContact CZ-OE1 3.46Å; R263-E267 IonicContact NE-OE1 2.84Å; R263-E267 PolarHBondContact NE-OE1 3.14Å; R263-E267 IonicContact NH2-OE1 3.39Å; R263-E267 WeakPolarHBondContact O-CB 3.17Å; R263-E267 WeakPolarHBondContact O-CG 3.45Å; R263-E267 PolarHBondContact O-N 3Å; Y264-E267 PolarHBondContact O-N 2.81Å
268	K	54.4	Low	51.8	Low	49 Å²	49	51.3 Å²	51.3	21%	0.213	27%	0.271	C	S	.	.			trans	-110.1	113.2	179.4	-65.8	-64.3	-175.2	-174.8	0	110.5	N17 Y264 G270	N17-K268 PolarHBondContact ND2-NZ 2.89Å; N17-K268 PolarHBondContact OD1-NZ 3.42Å; Y264-K268 HydrophobicContact CD1-CB 4.32Å; Y264-K268 HydrophobicContact CD1-CG 4.34Å; Y264-K268 HydrophobicContact CD2-CG 3.88Å; Y264-K268 HydrophobicContact CE1-CB 3.97Å; Y264-K268 HydrophobicContact CE1-CG 3.99Å; Y264-K268 HydrophobicContact CE2-CB 4.42Å; Y264-K268 HydrophobicContact CE2-CD 4.5Å; Y264-K268 HydrophobicContact CE2-CG 3.53Å; Y264-K268 HydrophobicContact CG-CG 4.3Å; Y264-K268 VanDerWaalsContact O-CB 3.31Å; Y264-K268 WeakPolarHBondContact O-CB 3.23Å; Y264-K268 PolarHBondContact O-N 3.25Å; K268-G270 PolarHBondContact O-N 3.26Å
269	H	50.6	Low	52	Low	98 Å²	98	53.5 Å²	53.5	45%	0.454	29%	0.29	S	S	.	.			trans	-72.8	15.6	175.2	-58.2	-70.2	0	0	0	114.3	R282 P335	H269-R282 PolarHBondContact O-NH1 2.84Å; H269-P335 WeakPolarHBondContact CE1-CD 3.21Å; H269-P335 WeakPolarHBondContact NE2-CD 3.18Å; H269-P335 WeakPolarHBondContact NE2-CG 3.38Å
270	G	40.4	Very low	52.4	Low	39 Å²	39	56.3 Å²	56.3	40%	0.402	30%	0.302	S	S	.	.	S	Bend	trans	-122	158.8	-173.6	0	0	0	0	0	113.6	K268	K268-G270 PolarHBondContact O-N 3.26Å
271	A	34.4	Very low	52.7	Low	74 Å²	74	56.7 Å²	56.7	61%	0.612	30%	0.304	S	S	*	.			trans	-60.7	134	176	0	0	0	0	0	110.9
272	L	41	Very low	52.8	Low	20 Å²	20	59.4 Å²	59.4	11%	0.105	31%	0.314	C	S	.	.			trans	-70.1	147.8	164.4	-85.2	95.6	0	0	0	108.9	Y30 Y264 V265 R274	Y30-L272 WeakPolarHBondContact OH-CA 3.18Å; Y30-L272 WeakPolarHBondContact OH-CB 3.44Å; Y30-L272 WeakPolarHBondContact OH-CD2 3.49Å; Y30-L272 VanDerWaalsContact OH-CG 3.27Å; Y30-L272 WeakPolarHBondContact OH-CG 3.48Å; Y264-L272 HydrophobicContact CD1-CD1 3.79Å; Y264-L272 HydrophobicContact CD1-CD2 4.1Å; Y264-L272 HydrophobicContact CD1-CG 4.01Å; Y264-L272 HydrophobicContact CE1-CD1 3.73Å; Y264-L272 HydrophobicContact CE1-CD2 4.03Å; Y264-L272 HydrophobicContact CE1-CG 3.62Å; V265-L272 HydrophobicContact CG2-CD1 3.65Å; L272-R274 CarbonylContact O-C 3.58Å; L272-R274 PolarHBondContact O-N 2.99Å
273	N	43.4	Very low	53.1	Low	93 Å²	93	66.7 Å²	66.7	50%	0.497	35%	0.346	S	S	.	.	S	Bend	trans	-68.2	22.7	173.6	-89.7	0.4	0	0	0	113.4	V28 K29 Y30	V28-N273 HydrophobicContact CG1-CB 4.3Å; K29-N273 PolarHBondContact O-ND2 2.78Å; Y30-N273 HydrophobicContact CD1-CB 3.75Å; Y30-N273 WeakPolarHBondContact CD1-ND2 3.4Å; Y30-N273 HydrophobicContact CE1-CB 3.44Å; Y30-N273 VanDerWaalsContact CE1-CB 3.44Å; Y30-N273 VanDerWaalsContact CE1-N 3.27Å; Y30-N273 PolarHBondContact OH-N 2.78Å
274	R	44.8	Very low	53.4	Low	146 Å²	146	67.3 Å²	67.3	55%	0.551	35%	0.349	S	S	*	.	S	Bend	trans	-142.1	111.9	164.4	-74	-173.5	175.9	169.1	0.9	107.6	L272 I276	L272-R274 CarbonylContact O-C 3.58Å; L272-R274 PolarHBondContact O-N 2.99Å; R274-I276 PolarHBondContact O-N 3.08Å
275	S	49	Very low	53.7	Low	112 Å²	112	67 Å²	67	78%	0.783	35%	0.349	S	S	*	.	S	Bend	trans	24.2	19	157.8	59	0	0	0	0	122.9	Y249 E277	Y249-S275 WeakPolarHBondContact CE1-O 3.4Å; S275-E277 PolarHBondContact O-N 2.67Å
276	I	50.8	Low	54.3	Low	9 Å²	9	68.2 Å²	68.2	5%	0.046	36%	0.357	C	S	.	.			trans	-98.5	86.5	172.7	-53.2	178.6	0	0	0	108.3	Y249 F251 R274 M278	Y249-I276 HydrophobicContact CD1-CG1 4.16Å; Y249-I276 HydrophobicContact CD2-CG2 4.3Å; Y249-I276 HydrophobicContact CE1-CB 4.41Å; Y249-I276 HydrophobicContact CE1-CG1 4.36Å; Y249-I276 HydrophobicContact CE1-CG2 4.32Å; Y249-I276 HydrophobicContact CE2-CG2 3.8Å; Y249-I276 HydrophobicContact CG-CG1 4.27Å; F251-I276 HydrophobicContact CE2-CD1 4.38Å; R274-I276 PolarHBondContact O-N 3.08Å; I276-M278 HydrophobicContact CG2-CG 3.89Å; I276-M278 HydrophobicContact CG2-SD 3.9Å; I276-M278 PolarHBondContact O-N 2.46Å
277	E	50.9	Low	55.3	Low	157 Å²	157	68.3 Å²	68.3	73%	0.734	36%	0.358	S	S	*	.			trans	-72.9	105.2	167.5	-74.4	-171.8	172.4	0	0	110	K247 Y249 S275	K247-E277 PolarHBondContact NZ-O 2.84Å; Y249-E277 PolarHBondContact OH-O 3.11Å; Y249-E277 VanDerWaalsContact OH-O 3.14Å; S275-E277 PolarHBondContact O-N 2.67Å
278	M	53	Low	56.3	Low	12 Å²	12	65.6 Å²	65.6	6%	0.059	35%	0.345	C	S	.	.			trans	-97	111.4	170.4	-66	-61.7	-72.2	0	0	107.4	L240 L244 V265 I276 E281 R282	L240-M278 HydrophobicContact CD1-CE 4.23Å; L244-M278 HydrophobicContact CD2-CE 3.71Å; L244-M278 HydrophobicContact CD2-SD 3.34Å; L244-M278 WeakPolarHBondContact CD2-SD 3.34Å; V265-M278 HydrophobicContact CG1-CE 3.79Å; V265-M278 HydrophobicContact CG1-CG 4.08Å; V265-M278 HydrophobicContact CG1-SD 4.21Å; I276-M278 HydrophobicContact CG2-CG 3.89Å; I276-M278 HydrophobicContact CG2-SD 3.9Å; I276-M278 PolarHBondContact O-N 2.46Å; M278-E281 HydrophobicContact CE-CB 3.67Å; M278-R282 HydrophobicContact CB-CG 3.89Å; M278-R282 HydrophobicContact CE-CG 3.89Å; M278-R282 PolarHBondContact O-NE 3.47Å; M278-R282 PolarHBondContact O-NH2 2.58Å
279	S	57.2	Low	57.8	Low	76 Å²	76	63.7 Å²	63.7	53%	0.531	34%	0.338	S	S	.	.	S	Bend	trans	-117.4	-74.5	176.8	57.2	0	0	0	0	108.7	E281 F283	S279-E281 PolarHBondContact N-OE2 3.08Å; S279-F283 WeakPolarHBondContact O-CD2 3.11Å
280	Q	61.8	Low	59.6	Low	119 Å²	119	59.5 Å²	59.5	56%	0.556	32%	0.318	S	S	*	.	S	Bend	trans	-80.3	-30.8	-174.6	-165.6	174.2	-31.5	0	0	112.7	R282 F283 E284	Q280-R282 PolarHBondContact O-N 2.72Å; Q280-R282 VanDerWaalsContact O-N 3.16Å; Q280-F283 PolarHBondContact O-N 3.12Å; Q280-F283 VanDerWaalsContact O-N 3.13Å; Q280-E284 HydrophobicContact CG-CG 4.04Å; Q280-E284 WeakPolarHBondContact CG-OE1 3.48Å; Q280-E284 PolarHBondContact NE2-OE1 2.8Å; Q280-E284 WeakPolarHBondContact O-CG 3.28Å; Q280-E284 PolarHBondContact O-N 3.45Å
281	E	61.5	Low	61.9	Low	22 Å²	22	59 Å²	59	10%	0.103	31%	0.308	C	S	.	.	H	α-helix	trans	-65.5	-28.4	-170.1	-60	71.1	-156.2	0	0	112.4	K247 M278 S279 T285	K247-E281 VanDerWaalsContact CE-CD 3.41Å; K247-E281 WeakPolarHBondContact CE-OE1 3.4Å; K247-E281 IonicContact NZ-OE1 2.63Å; K247-E281 PolarHBondContact NZ-OE1 2.8Å; K247-E281 IonicContact NZ-OE2 3.25Å; K247-E281 PolarHBondContact NZ-OE2 2.94Å; M278-E281 HydrophobicContact CE-CB 3.67Å; S279-E281 PolarHBondContact N-OE2 3.08Å; E281-T285 VanDerWaalsContact O-CB 3.25Å; E281-T285 WeakPolarHBondContact O-CB 3.1Å; E281-T285 PolarHBondContact O-N 3.36Å; E281-T285 PolarHBondContact O-OG1 3.46Å
282	R	56.4	Low	64.4	Low	65 Å²	65	55.8 Å²	55.8	25%	0.245	28%	0.281	C	S	.	.	H	α-helix	trans	-67.9	-39.9	179.5	-64	-171.5	-82.7	-151.6	9.4	111.4	H269 M278 Q280 T286	H269-R282 PolarHBondContact O-NH1 2.84Å; M278-R282 HydrophobicContact CB-CG 3.89Å; M278-R282 HydrophobicContact CE-CG 3.89Å; M278-R282 PolarHBondContact O-NE 3.47Å; M278-R282 PolarHBondContact O-NH2 2.58Å; Q280-R282 PolarHBondContact O-N 2.72Å; Q280-R282 VanDerWaalsContact O-N 3.16Å; R282-T286 PolarHBondContact O-N 3.48Å; R282-T286 PolarHBondContact O-OG1 2.79Å
283	F	66.6	Low	66.6	Low	157 Å²	157	61.7 Å²	61.7	69%	0.689	31%	0.306	S	S	*	.	H	α-helix	trans	-77.3	-37.1	176.5	-57.6	-73.8	0	0	0	111.6	S279 Q280 T285 T286 E287	S279-F283 WeakPolarHBondContact O-CD2 3.11Å; Q280-F283 PolarHBondContact O-N 3.12Å; Q280-F283 VanDerWaalsContact O-N 3.13Å; F283-T285 PolarHBondContact O-N 3.33Å; F283-T286 PolarHBondContact O-N 3.36Å; F283-T286 PolarHBondContact O-OG1 3.11Å; F283-E287 VanDerWaalsContact O-CB 3.27Å; F283-E287 WeakPolarHBondContact O-CB 3.41Å; F283-E287 PolarHBondContact O-N 2.71Å
284	E	68.1	Low	68.6	Low	41 Å²	41	66 Å²	66	19%	0.192	32%	0.315	C	S	.	.	H	α-helix	trans	-63.9	-41.4	176.7	-75	177.8	158.9	0	0	112.4	R243 Q280 T286 E287 M288 W295	R243-E284 IonicContact CZ-OE2 3.31Å; R243-E284 IonicContact NE-OE2 3.78Å; R243-E284 IonicContact NH1-OE2 2.62Å; R243-E284 IonicContact NH2-OE1 2.77Å; R243-E284 IonicContact NH2-OE2 3.68Å; R243-E284 PolarHBondContact NH2-OE2 2.76Å; Q280-E284 HydrophobicContact CG-CG 4.04Å; Q280-E284 WeakPolarHBondContact CG-OE1 3.48Å; Q280-E284 PolarHBondContact NE2-OE1 2.8Å; Q280-E284 WeakPolarHBondContact O-CG 3.28Å; Q280-E284 PolarHBondContact O-N 3.45Å; E284-T286 VanDerWaalsContact C-N 3.32Å; E284-T286 PolarHBondContact O-N 2.8Å; E284-E287 PolarHBondContact O-N 3.38Å; E284-M288 PolarHBondContact O-N 3.45Å; E284-W295 HydrophobicContact CB-CZ2 3.89Å; E284-W295 HydrophobicContact CG-CZ2 4.44Å; E284-W295 VanDerWaalsContact O-CH2 3.23Å; E284-W295 WeakPolarHBondContact O-CH2 3.32Å; E284-W295 WeakPolarHBondContact O-CZ2 3.16Å
285	T	64.4	Low	70.2	Confident	11 Å²	11	61.5 Å²	61.5	7%	0.067	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-34.8	-179.5	-57.7	0	0	0	0	111.7	M236 L240 E281 F283 M288	M236-T285 HydrophobicContact CG-CG2 3.41Å; M236-T285 VanDerWaalsContact CG-CG2 3.41Å; M236-T285 HydrophobicContact SD-CG2 3.88Å; L240-T285 HydrophobicContact CB-CG2 4.04Å; L240-T285 HydrophobicContact CD1-CG2 4.3Å; L240-T285 WeakPolarHBondContact CD1-OG1 3.33Å; L240-T285 HydrophobicContact CD2-CG2 4.35Å; L240-T285 HydrophobicContact CG-CG2 4.45Å; E281-T285 VanDerWaalsContact O-CB 3.25Å; E281-T285 WeakPolarHBondContact O-CB 3.1Å; E281-T285 PolarHBondContact O-N 3.36Å; E281-T285 PolarHBondContact O-OG1 3.46Å; F283-T285 PolarHBondContact O-N 3.33Å; T285-M288 WeakPolarHBondContact O-CB 3.19Å
286	T	71.4	Confident	71.8	Confident	35 Å²	35	59.6 Å²	59.6	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-77.5	-34.2	173.8	55.1	0	0	0	0	111.9	R282 F283 E284 M288 L289 F334	R282-T286 PolarHBondContact O-N 3.48Å; R282-T286 PolarHBondContact O-OG1 2.79Å; F283-T286 PolarHBondContact O-N 3.36Å; F283-T286 PolarHBondContact O-OG1 3.11Å; E284-T286 VanDerWaalsContact C-N 3.32Å; E284-T286 PolarHBondContact O-N 2.8Å; T286-M288 PolarHBondContact O-N 2.86Å; T286-L289 WeakPolarHBondContact O-CB 3.47Å; T286-L289 WeakPolarHBondContact O-CG 3.4Å; T286-L289 PolarHBondContact O-N 3.44Å; T286-F334 HydrophobicContact CG2-CB 4.21Å; T286-F334 HydrophobicContact CG2-CD1 3.58Å; T286-F334 HydrophobicContact CG2-CD2 3.72Å; T286-F334 HydrophobicContact CG2-CE1 3.68Å; T286-F334 HydrophobicContact CG2-CE2 3.77Å; T286-F334 HydrophobicContact CG2-CG 3.59Å; T286-F334 HydrophobicContact CG2-CZ 3.73Å
287	E	83	Confident	73.2	Confident	32 Å²	32	60.3 Å²	60.3	15%	0.15	30%	0.3	C	S	.	.	H	α-helix	trans	-62.7	-31	175	-177.8	57.8	-151.9	0	0	112	F283 E284 L289 F290 S291 R294 W295 R340	F283-E287 VanDerWaalsContact O-CB 3.27Å; F283-E287 WeakPolarHBondContact O-CB 3.41Å; F283-E287 PolarHBondContact O-N 2.71Å; E284-E287 PolarHBondContact O-N 3.38Å; E287-L289 PolarHBondContact O-N 3.32Å; E287-F290 PolarHBondContact O-N 3.03Å; E287-S291 PolarHBondContact O-N 2.85Å; E287-S291 PolarHBondContact OE1-OG 3.25Å; E287-R294 IonicContact OE1-NH1 3.58Å; E287-W295 HydrophobicContact CB-CH2 3.9Å; E287-W295 HydrophobicContact CB-CZ3 4.48Å; E287-W295 HydrophobicContact CG-CH2 3.93Å; E287-W295 HydrophobicContact CG-CZ3 4.28Å; E287-R340 IonicContact OE1-NH2 3.61Å; E287-R340 PolarHBondContact OE1-NH2 3.2Å; E287-R340 IonicContact OE2-CZ 3.64Å; E287-R340 IonicContact OE2-NH1 2.61Å; E287-R340 PolarHBondContact OE2-NH1 3.33Å; E287-R340 IonicContact OE2-NH2 3.02Å; E287-R340 PolarHBondContact OE2-NH2 2.98Å; E287-R340 VanDerWaalsContact OE2-NH2 3.15Å
288	M	80.1	Confident	74.7	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.049	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-26.7	172.4	-172.7	-153	67.2	0	0	112.9	M236 L239 E284 T285 T286 F290 P292 W295 L297	M236-M288 HydrophobicContact CB-CE 3.35Å; M236-M288 HydrophobicContact CG-CE 3.73Å; M236-M288 HydrophobicContact SD-CE 4.49Å; L239-M288 HydrophobicContact CB-SD 4.17Å; L239-M288 HydrophobicContact CD1-CG 4.29Å; L239-M288 HydrophobicContact CD1-SD 3.25Å; L239-M288 WeakPolarHBondContact CD1-SD 3.33Å; L239-M288 HydrophobicContact CG-SD 4.31Å; E284-M288 PolarHBondContact O-N 3.45Å; T285-M288 WeakPolarHBondContact O-CB 3.19Å; T286-M288 PolarHBondContact O-N 2.86Å; M288-F290 PolarHBondContact O-N 3.47Å; M288-P292 WeakPolarHBondContact O-CA 3.06Å; M288-P292 WeakPolarHBondContact O-CB 3.34Å; M288-P292 WeakPolarHBondContact O-CD 3.41Å; M288-W295 HydrophobicContact CB-CD2 3.93Å; M288-W295 HydrophobicContact CB-CE3 3.62Å; M288-W295 HydrophobicContact CB-CH2 4.25Å; M288-W295 HydrophobicContact CB-CZ2 4.5Å; M288-W295 HydrophobicContact CB-CZ3 3.79Å; M288-W295 HydrophobicContact CG-CB 4.42Å; M288-W295 HydrophobicContact CG-CD2 3.89Å; M288-W295 HydrophobicContact CG-CE3 3.71Å; M288-W295 HydrophobicContact CG-CG 4.18Å; M288-W295 HydrophobicContact CG-CZ3 4.38Å; M288-L297 HydrophobicContact CG-CD1 4.3Å; M288-L297 HydrophobicContact SD-CD1 4.09Å
289	L	84.2	Confident	76.2	Confident	10 Å²	10	62.4 Å²	62.4	5%	0.052	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-29.5	172.7	-62.7	171.6	0	0	0	111.7	M212 L234 M236 T286 E287 G301 L302 F334 L337	M212-L289 HydrophobicContact CE-CD1 4.01Å; M212-L289 HydrophobicContact CE-CD2 4.21Å; L234-L289 HydrophobicContact CD2-CD2 4.03Å; M236-L289 HydrophobicContact CE-CD2 4.29Å; M236-L289 HydrophobicContact SD-CD2 4.27Å; M236-L289 HydrophobicContact SD-CG 4.5Å; T286-L289 WeakPolarHBondContact O-CB 3.47Å; T286-L289 WeakPolarHBondContact O-CG 3.4Å; T286-L289 PolarHBondContact O-N 3.44Å; E287-L289 PolarHBondContact O-N 3.32Å; L289-G301 CarbonylContact O-C 3.54Å; L289-G301 WeakPolarHBondContact O-CA 3.26Å; L289-L302 WeakPolarHBondContact O-CB 2.95Å; L289-L302 PolarHBondContact O-N 3.38Å; L289-F334 HydrophobicContact CD1-CD2 3.96Å; L289-F334 HydrophobicContact CD1-CE2 3.99Å; L289-L337 HydrophobicContact CD1-CD1 4.13Å
290	F	89.9	Confident	77.8	Confident	9 Å²	9	63.7 Å²	63.7	4%	0.039	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-36.8	-179	-64.8	-82.3	0	0	0	112	E287 M288 P292 L302 H303 L337 R340 L341 E344	E287-F290 PolarHBondContact O-N 3.03Å; M288-F290 PolarHBondContact O-N 3.47Å; F290-P292 WeakPolarHBondContact O-CD 3.34Å; F290-L302 HydrophobicContact CZ-CD2 4.49Å; F290-H303 HydrophobicContact CD1-CB 4.31Å; F290-H303 AromaticContact CD1-ND1 3.66Å; F290-H303 HydrophobicContact CE1-CB 4.42Å; F290-H303 PolarHBondContact O-CE1 3.34Å; F290-L337 HydrophobicContact CE2-CD1 3.81Å; F290-L337 HydrophobicContact CZ-CD1 3.77Å; F290-R340 HydrophobicContact CD1-CG 4.16Å; F290-R340 HydrophobicContact CD2-CG 3.88Å; F290-R340 HydrophobicContact CE1-CG 3.77Å; F290-R340 HydrophobicContact CE2-CB 4.19Å; F290-R340 HydrophobicContact CE2-CG 3.45Å; F290-R340 VanDerWaalsContact CE2-CG 3.45Å; F290-R340 HydrophobicContact CG-CG 4.22Å; F290-R340 HydrophobicContact CZ-CB 3.94Å; F290-R340 HydrophobicContact CZ-CG 3.39Å; F290-L341 HydrophobicContact CE1-CB 4.27Å; F290-L341 HydrophobicContact CE1-CD1 4.15Å; F290-L341 HydrophobicContact CZ-CB 4.28Å; F290-E344 HydrophobicContact CD1-CG 3.84Å; F290-E344 HydrophobicContact CE1-CG 4.19Å
291	S	89.1	Confident	79.2	Confident	29 Å²	29	58 Å²	58	20%	0.203	29%	0.291	C	S	.	.			trans	-124	54.6	-173.5	-58.1	0	0	0	0	112.3	E287 K293 R294 W295	E287-S291 PolarHBondContact O-N 2.85Å; E287-S291 PolarHBondContact OE1-OG 3.25Å; S291-K293 PolarHBondContact O-N 3.16Å; S291-K293 VanDerWaalsContact O-N 3.1Å; S291-R294 WeakPolarHBondContact O-CB 3.5Å; S291-R294 PolarHBondContact O-N 2.63Å; S291-W295 WeakPolarHBondContact O-CZ3 3.17Å
292	P	86	Confident	80.6	Confident	6 Å²	6	57.2 Å²	57.2	4%	0.039	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-57.8	-31	-172	24	-35.7	0	0	0	113.8	M288 F290 R294 W295 L297 S299	M288-P292 WeakPolarHBondContact O-CA 3.06Å; M288-P292 WeakPolarHBondContact O-CB 3.34Å; M288-P292 WeakPolarHBondContact O-CD 3.41Å; F290-P292 WeakPolarHBondContact O-CD 3.34Å; P292-R294 PolarHBondContact O-N 3.43Å; P292-R294 VanDerWaalsContact O-N 3.15Å; P292-W295 PolarHBondContact O-N 2.96Å; P292-L297 HydrophobicContact CB-CB 4.03Å; P292-L297 HydrophobicContact CB-CD1 4.18Å; P292-L297 PolarHBondContact O-N 3.28Å; P292-S299 WeakPolarHBondContact CB-OG 3.4Å; P292-S299 WeakPolarHBondContact CG-O 3.49Å
293	K	86.9	Confident	82.5	Confident	145 Å²	145	55.1 Å²	55.1	63%	0.63	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-56.2	-29	176.3	-66.4	-178.1	179.2	177.1	0	113.8	S291 W295 G296 L297	S291-K293 PolarHBondContact O-N 3.16Å; S291-K293 VanDerWaalsContact O-N 3.1Å; K293-W295 PolarHBondContact O-N 3.46Å; K293-W295 VanDerWaalsContact O-N 3.16Å; K293-G296 PolarHBondContact O-N 3.46Å; K293-L297 WeakPolarHBondContact CA-O 3.21Å
294	R	86	Confident	83.9	Confident	183 Å²	183	50.7 Å²	50.7	69%	0.691	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-63.5	-18.3	175.3	-67.1	-179.4	178.6	-178.5	0.2	112.9	E287 S291 P292	E287-R294 IonicContact OE1-NH1 3.58Å; S291-R294 WeakPolarHBondContact O-CB 3.5Å; S291-R294 PolarHBondContact O-N 2.63Å; P292-R294 PolarHBondContact O-N 3.43Å; P292-R294 VanDerWaalsContact O-N 3.15Å
295	W	78.1	Confident	85.2	Confident	52 Å²	52	49.3 Å²	49.3	20%	0.197	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-105.9	16.6	175.5	-71.1	-93.3	0	0	0	113	L239 E284 E287 M288 S291 P292 K293 L297	L239-W295 HydrophobicContact CD1-CB 3.96Å; L239-W295 HydrophobicContact CD1-CG 4.43Å; E284-W295 HydrophobicContact CB-CZ2 3.89Å; E284-W295 HydrophobicContact CG-CZ2 4.44Å; E284-W295 VanDerWaalsContact O-CH2 3.23Å; E284-W295 WeakPolarHBondContact O-CH2 3.32Å; E284-W295 WeakPolarHBondContact O-CZ2 3.16Å; E287-W295 HydrophobicContact CB-CH2 3.9Å; E287-W295 HydrophobicContact CB-CZ3 4.48Å; E287-W295 HydrophobicContact CG-CH2 3.93Å; E287-W295 HydrophobicContact CG-CZ3 4.28Å; M288-W295 HydrophobicContact CB-CD2 3.93Å; M288-W295 HydrophobicContact CB-CE3 3.62Å; M288-W295 HydrophobicContact CB-CH2 4.25Å; M288-W295 HydrophobicContact CB-CZ2 4.5Å; M288-W295 HydrophobicContact CB-CZ3 3.79Å; M288-W295 HydrophobicContact CG-CB 4.42Å; M288-W295 HydrophobicContact CG-CD2 3.89Å; M288-W295 HydrophobicContact CG-CE3 3.71Å; M288-W295 HydrophobicContact CG-CG 4.18Å; M288-W295 HydrophobicContact CG-CZ3 4.38Å; S291-W295 WeakPolarHBondContact O-CZ3 3.17Å; P292-W295 PolarHBondContact O-N 2.96Å; K293-W295 PolarHBondContact O-N 3.46Å; K293-W295 VanDerWaalsContact O-N 3.16Å; W295-L297 PolarHBondContact O-N 3.24Å
296	G	82.2	Confident	86.7	Confident	72 Å²	72	48.8 Å²	48.8	74%	0.742	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	16	-179.6	0	0	0	0	0	113.8	K293	K293-G296 PolarHBondContact O-N 3.46Å
297	L	79.8	Confident	87.9	Confident	24 Å²	24	47.6 Å²	47.6	13%	0.126	24%	0.244	C	C	.	.			trans	-85	123.7	172.8	-61.9	-178.9	0	0	0	109.5	E235 L239 M288 P292 K293 W295 S299	E235-L297 HydrophobicContact CB-CD1 3.89Å; E235-L297 HydrophobicContact CB-CD2 4.18Å; E235-L297 HydrophobicContact CG-CD2 4.25Å; L239-L297 HydrophobicContact CD1-CD1 3.52Å; L239-L297 HydrophobicContact CD1-CD2 4.07Å; L239-L297 HydrophobicContact CD1-CG 3.87Å; M288-L297 HydrophobicContact CG-CD1 4.3Å; M288-L297 HydrophobicContact SD-CD1 4.09Å; P292-L297 HydrophobicContact CB-CB 4.03Å; P292-L297 HydrophobicContact CB-CD1 4.18Å; P292-L297 PolarHBondContact O-N 3.28Å; K293-L297 WeakPolarHBondContact CA-O 3.21Å; W295-L297 PolarHBondContact O-N 3.24Å; L297-S299 PolarHBondContact O-N 3.35Å
298	D	84.1	Confident	88.4	Confident	160 Å²	160	48.7 Å²	48.7	86%	0.856	25%	0.25	S	C	*	.			trans	-83.9	60.8	171.1	-167	25.9	0	0	0	110.8
299	S	83.8	Confident	89.1	Confident	53 Å²	53	48.2 Å²	48.2	37%	0.371	25%	0.247	S	C	.	.	S	Bend	trans	-129	160.6	176.2	63.6	0	0	0	0	110.6	P292 L297	P292-S299 WeakPolarHBondContact CB-OG 3.4Å; P292-S299 WeakPolarHBondContact CG-O 3.49Å; L297-S299 PolarHBondContact O-N 3.35Å
300	K	89.8	Confident	89.6	Confident	102 Å²	102	47.8 Å²	47.8	44%	0.443	25%	0.245	S	C	.	.			trans	-80.5	147.1	173.2	-71.3	-178	-176.8	-177.5	0	110.3	E304 L305 Q308	K300-E304 WeakPolarHBondContact CA-OE2 3.45Å; K300-E304 HydrophobicContact CB-CB 3.97Å; K300-E304 HydrophobicContact CD-CB 4.44Å; K300-E304 HydrophobicContact CG-CB 4.45Å; K300-L305 HydrophobicContact CB-CD2 3.6Å; K300-L305 HydrophobicContact CB-CG 3.84Å; K300-L305 HydrophobicContact CD-CD2 4.2Å; K300-L305 HydrophobicContact CG-CD2 4.45Å; K300-Q308 VanDerWaalsContact CD-OE1 3.3Å
301	G	91.3	Very high	89.9	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.01	27%	0.266	C	S	.	.			trans	-67	160.8	170.9	0	0	0	0	0	112	L289 H303 E304 L305	L289-G301 CarbonylContact O-C 3.54Å; L289-G301 WeakPolarHBondContact O-CA 3.26Å; G301-H303 VanDerWaalsContact C-N 3.35Å; G301-H303 PolarHBondContact O-N 3.49Å; G301-E304 PolarHBondContact N-OE2 3.08Å; G301-E304 WeakPolarHBondContact O-CA 3.28Å; G301-E304 WeakPolarHBondContact O-CB 3.43Å; G301-E304 PolarHBondContact O-N 2.99Å; G301-L305 WeakPolarHBondContact O-CG 3.01Å; G301-L305 PolarHBondContact O-N 3.39Å
302	L	92.6	Very high	90.1	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-52.6	-49.8	-179.2	178.5	62.7	0	0	0	112.1	V210 M212 L216 I218 L289 F290 E304 L305 V306 L337 L341	V210-L302 HydrophobicContact CG1-CD1 3.93Å; M212-L302 HydrophobicContact CE-CD1 4.45Å; M212-L302 HydrophobicContact CE-CD2 3.83Å; M212-L302 HydrophobicContact SD-CD2 4.01Å; L216-L302 HydrophobicContact CD1-CD1 3.84Å; L216-L302 HydrophobicContact CD2-CD1 3.81Å; L216-L302 HydrophobicContact CG-CD1 4.49Å; I218-L302 HydrophobicContact CD1-CD1 4.41Å; L289-L302 WeakPolarHBondContact O-CB 2.95Å; L289-L302 PolarHBondContact O-N 3.38Å; F290-L302 HydrophobicContact CZ-CD2 4.49Å; L302-E304 VanDerWaalsContact C-N 3.34Å; L302-E304 PolarHBondContact O-N 3.42Å; L302-L305 PolarHBondContact O-N 2.82Å; L302-V306 HydrophobicContact CD1-CG2 4.38Å; L302-V306 WeakPolarHBondContact O-CG2 3.31Å; L302-V306 PolarHBondContact O-N 3.48Å; L302-L337 HydrophobicContact CD2-CD1 4.17Å; L302-L341 HydrophobicContact CD2-CD1 4.27Å; L302-L341 HydrophobicContact CD2-CD2 4.33Å; L302-L341 HydrophobicContact CG-CD1 4.07Å
303	H	95.7	Very high	90.4	Very high	22 Å²	22	54.2 Å²	54.2	10%	0.102	28%	0.278	C	S	.	.	H	α-helix	trans	-58.6	-41.3	175.6	64.9	-60.5	0	0	0	112.9	F290 G301 N307 L341 E344 L345	F290-H303 HydrophobicContact CD1-CB 4.31Å; F290-H303 AromaticContact CD1-ND1 3.66Å; F290-H303 HydrophobicContact CE1-CB 4.42Å; F290-H303 PolarHBondContact O-CE1 3.34Å; G301-H303 VanDerWaalsContact C-N 3.35Å; G301-H303 PolarHBondContact O-N 3.49Å; H303-N307 VanDerWaalsContact O-CB 3.26Å; H303-N307 WeakPolarHBondContact O-CB 3.41Å; H303-N307 PolarHBondContact O-N 2.92Å; H303-L341 HydrophobicContact CB-CD1 3.86Å; H303-E344 HydrophobicContact CB-CB 3.65Å; H303-L345 HydrophobicContact CB-CD2 4.33Å; H303-L345 HydrophobicContact CB-CG 4.34Å; H303-L345 VanDerWaalsContact O-CD2 3.26Å; H303-L345 WeakPolarHBondContact O-CD2 3.34Å
304	E	95.4	Very high	90.8	Very high	63 Å²	63	50.5 Å²	50.5	29%	0.294	27%	0.268	S	S	.	.	H	α-helix	trans	-66.8	-39.2	175.6	-61.8	179.5	116.7	0	0	112.1	K300 G301 L302 Q308 M348	K300-E304 WeakPolarHBondContact CA-OE2 3.45Å; K300-E304 HydrophobicContact CB-CB 3.97Å; K300-E304 HydrophobicContact CD-CB 4.44Å; K300-E304 HydrophobicContact CG-CB 4.45Å; G301-E304 PolarHBondContact N-OE2 3.08Å; G301-E304 WeakPolarHBondContact O-CA 3.28Å; G301-E304 WeakPolarHBondContact O-CB 3.43Å; G301-E304 PolarHBondContact O-N 2.99Å; L302-E304 VanDerWaalsContact C-N 3.34Å; L302-E304 PolarHBondContact O-N 3.42Å; E304-Q308 VanDerWaalsContact O-CB 3.25Å; E304-Q308 WeakPolarHBondContact O-CB 3.31Å; E304-Q308 PolarHBondContact O-N 3.06Å; E304-M348 HydrophobicContact CB-CE 4.38Å; E304-M348 HydrophobicContact CG-CE 3.92Å
305	L	94.7	Very high	91.1	Very high	13 Å²	13	47.4 Å²	47.4	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-66.4	-43.1	177.2	-68	176.4	0	0	0	111.8	L216 I218 Y232 K300 G301 L302 Q308 C309	L216-L305 HydrophobicContact CD2-CD1 3.82Å; I218-L305 HydrophobicContact CD1-CB 3.56Å; Y232-L305 HydrophobicContact CD1-CD1 4.39Å; Y232-L305 HydrophobicContact CD1-CD2 4.27Å; Y232-L305 HydrophobicContact CD2-CD1 3.86Å; Y232-L305 HydrophobicContact CD2-CD2 4.42Å; Y232-L305 HydrophobicContact CE1-CD2 3.68Å; Y232-L305 HydrophobicContact CE2-CB 4.29Å; Y232-L305 HydrophobicContact CE2-CD1 4.02Å; Y232-L305 HydrophobicContact CE2-CD2 3.84Å; Y232-L305 HydrophobicContact CE2-CG 4.28Å; Y232-L305 HydrophobicContact CG-CD1 4.06Å; Y232-L305 VanDerWaalsContact CZ-CD2 3.45Å; K300-L305 HydrophobicContact CB-CD2 3.6Å; K300-L305 HydrophobicContact CB-CG 3.84Å; K300-L305 HydrophobicContact CD-CD2 4.2Å; K300-L305 HydrophobicContact CG-CD2 4.45Å; G301-L305 WeakPolarHBondContact O-CG 3.01Å; G301-L305 PolarHBondContact O-N 3.39Å; L302-L305 PolarHBondContact O-N 2.82Å; L305-Q308 PolarHBondContact O-N 3.14Å; L305-C309 PolarHBondContact O-N 2.62Å
306	V	96.3	Very high	91.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.6	-48.3	174.8	172.3	0	0	0	0	110.2	V208 V210 I218 L302 Q308 C309 I310 I325 L345	V208-V306 HydrophobicContact CG1-CG1 4.47Å; V210-V306 HydrophobicContact CG2-CG2 3.78Å; I218-V306 HydrophobicContact CD1-CG2 3.9Å; I218-V306 HydrophobicContact CG1-CG2 4.36Å; I218-V306 HydrophobicContact CG2-CG2 4.36Å; L302-V306 HydrophobicContact CD1-CG2 4.38Å; L302-V306 WeakPolarHBondContact O-CG2 3.31Å; L302-V306 PolarHBondContact O-N 3.48Å; V306-Q308 VanDerWaalsContact C-N 3.31Å; V306-Q308 PolarHBondContact O-N 2.95Å; V306-C309 WeakPolarHBondContact O-CB 3.31Å; V306-C309 PolarHBondContact O-N 3.31Å; V306-C309 VanDerWaalsContact O-N 3.11Å; V306-I310 HydrophobicContact CG1-CD1 4.01Å; V306-I310 WeakPolarHBondContact O-CG1 3.46Å; V306-I310 PolarHBondContact O-N 2.86Å; V306-I325 HydrophobicContact CG1-CD1 4.01Å; V306-I325 HydrophobicContact CG1-CG2 4.46Å; V306-L345 HydrophobicContact CB-CD2 4.26Å; V306-L345 HydrophobicContact CG1-CD1 3.94Å; V306-L345 HydrophobicContact CG1-CD2 4.14Å
307	N	96.2	Very high	92.4	Very high	9 Å²	9	49.2 Å²	49.2	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-40.8	176.2	-175.2	33.9	0	0	0	112.1	H303 C309 I310 K311 F322 L345 M348	H303-N307 VanDerWaalsContact O-CB 3.26Å; H303-N307 WeakPolarHBondContact O-CB 3.41Å; H303-N307 PolarHBondContact O-N 2.92Å; N307-C309 VanDerWaalsContact C-N 3.35Å; N307-I310 PolarHBondContact O-N 3.4Å; N307-K311 VanDerWaalsContact O-CB 3.29Å; N307-K311 WeakPolarHBondContact O-CB 3.36Å; N307-K311 WeakPolarHBondContact O-CG 3.24Å; N307-K311 PolarHBondContact O-N 3.19Å; N307-K311 VanDerWaalsContact OD1-CE 3.28Å; N307-K311 WeakPolarHBondContact OD1-CE 3.49Å; N307-F322 WeakPolarHBondContact OD1-CZ 3.21Å; N307-L345 HydrophobicContact CB-CD2 4.01Å; N307-M348 HydrophobicContact CB-CE 4.17Å; N307-M348 HydrophobicContact CB-SD 3.89Å; N307-M348 WeakPolarHBondContact ND2-CE 3.33Å
308	Q	94.7	Very high	93.2	Very high	56 Å²	56	51.8 Å²	51.8	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-61.9	-42.8	174.6	176.2	-179.7	-19.4	0	0	111.4	K300 E304 L305 V306 K311 S312	K300-Q308 VanDerWaalsContact CD-OE1 3.3Å; E304-Q308 VanDerWaalsContact O-CB 3.25Å; E304-Q308 WeakPolarHBondContact O-CB 3.31Å; E304-Q308 PolarHBondContact O-N 3.06Å; L305-Q308 PolarHBondContact O-N 3.14Å; V306-Q308 VanDerWaalsContact C-N 3.31Å; V306-Q308 PolarHBondContact O-N 2.95Å; Q308-K311 PolarHBondContact O-N 2.92Å; Q308-S312 VanDerWaalsContact O-CB 3.25Å; Q308-S312 WeakPolarHBondContact O-CB 3.33Å; Q308-S312 PolarHBondContact O-N 3.49Å; Q308-S312 PolarHBondContact O-OG 3.03Å
309	C	94.1	Very high	93.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-47.7	177.8	-173.7	0	0	0	0	111.5	I218 F230 L305 V306 N307 S312 S313	I218-C309 HydrophobicContact CG2-CB 3.67Å; F230-C309 HydrophobicContact CD2-CB 3.9Å; F230-C309 HydrophobicContact CE2-CB 3.88Å; L305-C309 PolarHBondContact O-N 2.62Å; V306-C309 WeakPolarHBondContact O-CB 3.31Å; V306-C309 PolarHBondContact O-N 3.31Å; V306-C309 VanDerWaalsContact O-N 3.11Å; N307-C309 VanDerWaalsContact C-N 3.35Å; C309-S312 PolarHBondContact O-N 2.77Å; C309-S313 PolarHBondContact O-N 2.99Å; C309-S313 PolarHBondContact O-OG 3.06Å
310	I	95.9	Very high	94.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-46.4	178.3	-61.6	169.9	0	0	0	110.8	V208 V306 N307 S312 S313 R318 L321 F322 I325	V208-I310 HydrophobicContact CG2-CD1 3.99Å; V208-I310 HydrophobicContact CG2-CG1 3.63Å; V306-I310 HydrophobicContact CG1-CD1 4.01Å; V306-I310 WeakPolarHBondContact O-CG1 3.46Å; V306-I310 PolarHBondContact O-N 2.86Å; N307-I310 PolarHBondContact O-N 3.4Å; I310-S312 PolarHBondContact O-N 2.97Å; I310-S313 VanDerWaalsContact O-CB 3.29Å; I310-S313 WeakPolarHBondContact O-CB 3.41Å; I310-S313 PolarHBondContact O-N 2.93Å; I310-R318 HydrophobicContact CG2-CB 3.92Å; I310-R318 HydrophobicContact CG2-CG 4.2Å; I310-R318 WeakPolarHBondContact O-CG 3.45Å; I310-R318 PolarHBondContact O-NE 3.16Å; I310-L321 HydrophobicContact CD1-CB 4.5Å; I310-L321 HydrophobicContact CG1-CB 4.11Å; I310-L321 HydrophobicContact CG2-CB 3.98Å; I310-L321 HydrophobicContact CG2-CD1 4.43Å; I310-F322 HydrophobicContact CB-CE1 4.25Å; I310-F322 HydrophobicContact CB-CE2 4.25Å; I310-F322 HydrophobicContact CB-CZ 3.98Å; I310-F322 HydrophobicContact CD1-CD1 3.45Å; I310-F322 VanDerWaalsContact CD1-CD1 3.45Å; I310-F322 HydrophobicContact CD1-CE1 3.53Å; I310-F322 HydrophobicContact CD1-CG 3.99Å; I310-F322 HydrophobicContact CD1-CZ 4.13Å; I310-F322 HydrophobicContact CG1-CE1 4.48Å; I310-F322 HydrophobicContact CG2-CD1 4.4Å; I310-F322 HydrophobicContact CG2-CD2 3.68Å; I310-F322 HydrophobicContact CG2-CE1 4.14Å; I310-F322 HydrophobicContact CG2-CE2 3.38Å; I310-F322 HydrophobicContact CG2-CG 4.17Å; I310-F322 HydrophobicContact CG2-CZ 3.62Å; I310-I325 HydrophobicContact CD1-CD1 4.17Å; I310-I325 HydrophobicContact CD1-CG1 4.49Å
311	K	94.4	Very high	94.6	Very high	110 Å²	110	49 Å²	49	48%	0.478	24%	0.239	S	C	.	.	H	α-helix	trans	-64.6	-23.7	178	-76.4	-176.4	176.1	-178.1	0	113.7	N307 Q308 R318	N307-K311 VanDerWaalsContact O-CB 3.29Å; N307-K311 WeakPolarHBondContact O-CB 3.36Å; N307-K311 WeakPolarHBondContact O-CG 3.24Å; N307-K311 PolarHBondContact O-N 3.19Å; N307-K311 VanDerWaalsContact OD1-CE 3.28Å; N307-K311 WeakPolarHBondContact OD1-CE 3.49Å; Q308-K311 PolarHBondContact O-N 2.92Å; K311-R318 PolarHBondContact O-NE 3.19Å; K311-R318 PolarHBondContact O-NH2 3.36Å
312	S	94	Very high	94.8	Very high	67 Å²	67	49.5 Å²	49.5	47%	0.469	24%	0.241	S	C	.	.	H	α-helix	trans	-86	-12.9	176.2	-56.3	0	0	0	0	112.4	Q308 C309 I310	Q308-S312 VanDerWaalsContact O-CB 3.25Å; Q308-S312 WeakPolarHBondContact O-CB 3.33Å; Q308-S312 PolarHBondContact O-N 3.49Å; Q308-S312 PolarHBondContact O-OG 3.03Å; C309-S312 PolarHBondContact O-N 2.77Å; I310-S312 PolarHBondContact O-N 2.97Å
313	S	93.2	Very high	95	Very high	3 Å²	3	54 Å²	54	2%	0.021	26%	0.258	C	S	.	.	S	Bend	trans	-75.8	159.7	173.1	-57.8	0	0	0	0	111.4	C309 I310 R318	C309-S313 PolarHBondContact O-N 2.99Å; C309-S313 PolarHBondContact O-OG 3.06Å; I310-S313 VanDerWaalsContact O-CB 3.29Å; I310-S313 WeakPolarHBondContact O-CB 3.41Å; I310-S313 PolarHBondContact O-N 2.93Å; S313-R318 PolarHBondContact O-NE 2.99Å; S313-R318 PolarHBondContact O-NH2 3.01Å
314	P	93.8	Very high	95	Very high	66 Å²	66	53.2 Å²	53.2	43%	0.429	25%	0.254	S	S	.	.			trans	-50.8	140.7	174.9	-27.8	35.7	0	0	0	112.4	D316 N317 R318	P314-D316 PolarHBondContact O-N 2.68Å; P314-N317 PolarHBondContact O-N 2.92Å; P314-N317 VanDerWaalsContact O-N 3.13Å; P314-R318 WeakPolarHBondContact O-CG 3.16Å
315	I	93.4	Very high	95.1	Very high	119 Å²	119	50.2 Å²	50.2	61%	0.61	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-57.7	-36.9	-170.6	-169.7	167.5	0	0	0	113	N317 R318	I315-N317 VanDerWaalsContact C-N 3.25Å; I315-N317 PolarHBondContact O-N 3.32Å; I315-R318 PolarHBondContact O-N 3.24Å
316	D	94	Very high	95.2	Very high	139 Å²	139	51 Å²	51	74%	0.743	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-66.6	-28.5	-176.6	-56.7	-41.7	0	0	0	112.4	P314	P314-D316 PolarHBondContact O-N 2.68Å
317	N	93.8	Very high	95.1	Very high	22 Å²	22	51.1 Å²	51.1	12%	0.118	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-88.6	-19	-174.6	-58.8	-7.5	0	0	0	112.1	Y222 L227 P314 I315 R319 E320 L321	Y222-N317 HydrophobicContact CD2-CB 3.79Å; Y222-N317 HydrophobicContact CE2-CB 4Å; Y222-N317 HydrophobicContact CG-CB 4.47Å; L227-N317 HydrophobicContact CD1-CB 4.08Å; L227-N317 WeakPolarHBondContact CD1-ND2 3.48Å; P314-N317 PolarHBondContact O-N 2.92Å; P314-N317 VanDerWaalsContact O-N 3.13Å; I315-N317 VanDerWaalsContact C-N 3.25Å; I315-N317 PolarHBondContact O-N 3.32Å; N317-R319 PolarHBondContact O-N 3.11Å; N317-E320 PolarHBondContact O-N 3.36Å; N317-E320 VanDerWaalsContact O-N 3.13Å; N317-L321 HydrophobicContact CB-CD1 4.29Å; N317-L321 WeakPolarHBondContact O-CG 3.38Å; N317-L321 PolarHBondContact O-N 3.4Å
318	R	95.2	Very high	94.8	Very high	79 Å²	79	50.7 Å²	50.7	30%	0.298	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-39.6	-166.8	-61.2	-172.7	-176.2	155.7	5.1	113.9	I310 K311 S313 P314 I315 E320 L321 F322	I310-R318 HydrophobicContact CG2-CB 3.92Å; I310-R318 HydrophobicContact CG2-CG 4.2Å; I310-R318 WeakPolarHBondContact O-CG 3.45Å; I310-R318 PolarHBondContact O-NE 3.16Å; K311-R318 PolarHBondContact O-NE 3.19Å; K311-R318 PolarHBondContact O-NH2 3.36Å; S313-R318 PolarHBondContact O-NE 2.99Å; S313-R318 PolarHBondContact O-NH2 3.01Å; P314-R318 WeakPolarHBondContact O-CG 3.16Å; I315-R318 PolarHBondContact O-N 3.24Å; R318-E320 VanDerWaalsContact C-N 3.3Å; R318-E320 PolarHBondContact O-N 3.24Å; R318-L321 PolarHBondContact O-N 2.86Å; R318-F322 WeakPolarHBondContact O-CD2 3.33Å; R318-F322 PolarHBondContact O-N 2.81Å
319	R	95.4	Very high	94.3	Very high	172 Å²	172	48.5 Å²	48.5	65%	0.649	23%	0.233	S	C	*	.	H	α-helix	trans	-61.8	-42.6	179.5	-72.1	-176.2	-177.4	169.9	2.2	111.1	N317 R323	N317-R319 PolarHBondContact O-N 3.11Å; R319-R323 WeakPolarHBondContact O-CG 3.45Å; R319-R323 PolarHBondContact O-N 2.76Å
320	E	95.3	Very high	93.5	Very high	84 Å²	84	49.8 Å²	49.8	39%	0.393	25%	0.246	S	C	.	.	H	α-helix	trans	-68.4	-42.8	178.1	-167.9	60.8	-166.5	0	0	111.1	T206 Y222 N317 R318 F322 R323 S324	T206-E320 HydrophobicContact CG2-CG 3.73Å; Y222-E320 HydrophobicContact CE2-CB 4.49Å; N317-E320 PolarHBondContact O-N 3.36Å; N317-E320 VanDerWaalsContact O-N 3.13Å; R318-E320 VanDerWaalsContact C-N 3.3Å; R318-E320 PolarHBondContact O-N 3.24Å; E320-F322 VanDerWaalsContact C-N 3.31Å; E320-F322 PolarHBondContact O-N 3.41Å; E320-R323 WeakPolarHBondContact O-CB 3.39Å; E320-R323 PolarHBondContact O-N 3.28Å; E320-S324 PolarHBondContact O-N 2.84Å; E320-S324 PolarHBondContact O-OG 3.33Å
321	L	96.4	Very high	92.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-35.4	177.6	-67.1	176.2	0	0	0	113.2	T206 V208 A220 L227 I310 N317 R318 R323 S324 I325	T206-L321 HydrophobicContact CG2-CD2 4.5Å; V208-L321 HydrophobicContact CG2-CB 3.95Å; V208-L321 HydrophobicContact CG2-CD2 4.06Å; V208-L321 HydrophobicContact CG2-CG 4.45Å; A220-L321 HydrophobicContact CB-CD1 4.08Å; A220-L321 HydrophobicContact CB-CD2 4.26Å; L227-L321 HydrophobicContact CD1-CD1 4.07Å; I310-L321 HydrophobicContact CD1-CB 4.5Å; I310-L321 HydrophobicContact CG1-CB 4.11Å; I310-L321 HydrophobicContact CG2-CB 3.98Å; I310-L321 HydrophobicContact CG2-CD1 4.43Å; N317-L321 HydrophobicContact CB-CD1 4.29Å; N317-L321 WeakPolarHBondContact O-CG 3.38Å; N317-L321 PolarHBondContact O-N 3.4Å; R318-L321 PolarHBondContact O-N 2.86Å; L321-R323 VanDerWaalsContact C-N 3.34Å; L321-S324 PolarHBondContact O-N 3.24Å; L321-I325 WeakPolarHBondContact O-CG1 3.49Å
322	F	97.3	Very high	92.2	Very high	12 Å²	12	45.5 Å²	45.5	5%	0.053	23%	0.228	C	C	.	.	H	α-helix	trans	-67.7	-33.3	174.1	-82.4	-63.2	0	0	0	112.9	N307 I310 R318 E320 S324 V349 V353 E354 V355 T356	N307-F322 WeakPolarHBondContact OD1-CZ 3.21Å; I310-F322 HydrophobicContact CB-CE1 4.25Å; I310-F322 HydrophobicContact CB-CE2 4.25Å; I310-F322 HydrophobicContact CB-CZ 3.98Å; I310-F322 HydrophobicContact CD1-CD1 3.45Å; I310-F322 VanDerWaalsContact CD1-CD1 3.45Å; I310-F322 HydrophobicContact CD1-CE1 3.53Å; I310-F322 HydrophobicContact CD1-CG 3.99Å; I310-F322 HydrophobicContact CD1-CZ 4.13Å; I310-F322 HydrophobicContact CG1-CE1 4.48Å; I310-F322 HydrophobicContact CG2-CD1 4.4Å; I310-F322 HydrophobicContact CG2-CD2 3.68Å; I310-F322 HydrophobicContact CG2-CE1 4.14Å; I310-F322 HydrophobicContact CG2-CE2 3.38Å; I310-F322 HydrophobicContact CG2-CG 4.17Å; I310-F322 HydrophobicContact CG2-CZ 3.62Å; R318-F322 WeakPolarHBondContact O-CD2 3.33Å; R318-F322 PolarHBondContact O-N 2.81Å; E320-F322 VanDerWaalsContact C-N 3.31Å; E320-F322 PolarHBondContact O-N 3.41Å; F322-S324 VanDerWaalsContact C-N 3.29Å; F322-S324 PolarHBondContact O-N 2.88Å; F322-V349 HydrophobicContact CD1-CG1 4.1Å; F322-V349 HydrophobicContact CD2-CG1 4.45Å; F322-V349 HydrophobicContact CE1-CG1 3.55Å; F322-V349 HydrophobicContact CE2-CG1 3.95Å; F322-V349 HydrophobicContact CZ-CG1 3.48Å; F322-V349 VanDerWaalsContact CZ-CG1 3.48Å; F322-V353 HydrophobicContact CB-CG1 3.95Å; F322-V353 HydrophobicContact CD2-CG1 3.77Å; F322-V353 HydrophobicContact CG-CG1 3.98Å; F322-E354 CarbonylContact C-O 3.17Å; F322-E354 WeakPolarHBondContact CB-O 3.48Å; F322-V355 HydrophobicContact CB-CG2 4.35Å; F322-V355 HydrophobicContact CD1-CG2 4.2Å; F322-V355 WeakPolarHBondContact O-CA 3.24Å; F322-T356 PolarHBondContact O-N 3.18Å; F322-T356 VanDerWaalsContact O-N 3.14Å
323	R	96.7	Very high	91.5	Very high	99 Å²	99	45.7 Å²	45.7	37%	0.374	22%	0.224	S	C	.	.	H	α-helix	trans	-78.2	-9.9	177.3	-72.2	173.8	166.2	159.7	0.5	114	R319 E320 L321 E354 T356 Y358	R319-R323 WeakPolarHBondContact O-CG 3.45Å; R319-R323 PolarHBondContact O-N 2.76Å; E320-R323 WeakPolarHBondContact O-CB 3.39Å; E320-R323 PolarHBondContact O-N 3.28Å; L321-R323 VanDerWaalsContact C-N 3.34Å; R323-E354 HydrophobicContact CG-CB 3.85Å; R323-E354 HydrophobicContact CG-CG 4.04Å; R323-E354 IonicContact CZ-OE2 3.39Å; R323-E354 IonicContact NE-OE2 3.75Å; R323-E354 PolarHBondContact NE-OE2 3.43Å; R323-E354 IonicContact NH2-OE2 2.8Å; R323-E354 PolarHBondContact NH2-OE2 3.36Å; R323-T356 WeakPolarHBondContact O-CB 3.34Å; R323-Y358 WeakPolarHBondContact O-CE2 3.38Å
324	S	95.6	Very high	90.6	Very high	5 Å²	5	46.4 Å²	46.4	4%	0.035	23%	0.227	C	C	.	.			trans	-135.4	62.4	-169.9	54	0	0	0	0	111.7	G207 V208 E320 L321 F322 Y326	G207-S324 CarbonylContact C-O 3.53Å; G207-S324 WeakPolarHBondContact CA-O 3.23Å; G207-S324 WeakPolarHBondContact CA-OG 3.36Å; V208-S324 PolarHBondContact N-O 3.04Å; E320-S324 PolarHBondContact O-N 2.84Å; E320-S324 PolarHBondContact O-OG 3.33Å; L321-S324 PolarHBondContact O-N 3.24Å; F322-S324 VanDerWaalsContact C-N 3.29Å; F322-S324 PolarHBondContact O-N 2.88Å; S324-Y326 WeakPolarHBondContact O-CD2 3.41Å; S324-Y326 WeakPolarHBondContact O-CE2 3.41Å
325	I	97.7	Very high	89.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	120.3	178.1	-57	171.2	0	0	0	109.2	V208 V210 V306 I310 L321 L345 V355 T356 V357 Y358	V208-I325 HydrophobicContact CB-CG1 4.36Å; V208-I325 CarbonylContact O-C 3.59Å; V208-I325 WeakPolarHBondContact O-CA 3.25Å; V210-I325 HydrophobicContact CG2-CG2 3.92Å; V306-I325 HydrophobicContact CG1-CD1 4.01Å; V306-I325 HydrophobicContact CG1-CG2 4.46Å; I310-I325 HydrophobicContact CD1-CD1 4.17Å; I310-I325 HydrophobicContact CD1-CG1 4.49Å; L321-I325 WeakPolarHBondContact O-CG1 3.49Å; I325-L345 HydrophobicContact CD1-CD1 3.46Å; I325-L345 VanDerWaalsContact CD1-CD1 3.46Å; I325-V355 HydrophobicContact CD1-CG1 4.2Å; I325-T356 PolarHBondContact N-O 2.8Å; I325-V357 HydrophobicContact CB-CG2 4.24Å; I325-V357 HydrophobicContact CD1-CG2 4.46Å; I325-V357 HydrophobicContact CG2-CG2 4.35Å; I325-V357 CarbonylContact O-C 3.57Å; I325-V357 WeakPolarHBondContact O-CA 3.36Å; I325-Y358 PolarHBondContact O-N 3.42Å
326	Y	96.1	Very high	89.1	Confident	30 Å²	30	44 Å²	44	12%	0.118	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	120	-175.7	-59.2	-80.8	0	0	0	111.4	L199 L202 A204 T206 V208 V210 S324 Y358	L199-Y326 HydrophobicContact CD1-CD2 3.76Å; L199-Y326 HydrophobicContact CD1-CE2 3.85Å; L199-Y326 HydrophobicContact CD1-CG 4.48Å; L202-Y326 HydrophobicContact CB-CD1 4.39Å; L202-Y326 HydrophobicContact CD1-CD1 3.78Å; L202-Y326 HydrophobicContact CD1-CG 3.94Å; A204-Y326 HydrophobicContact CB-CE1 4.19Å; A204-Y326 HydrophobicContact CB-CE2 3.95Å; A204-Y326 WeakPolarHBondContact CB-OH 3.24Å; T206-Y326 WeakPolarHBondContact O-CE2 3.48Å; V208-Y326 PolarHBondContact O-N 2.98Å; V210-Y326 PolarHBondContact N-O 3.01Å; S324-Y326 WeakPolarHBondContact O-CD2 3.41Å; S324-Y326 WeakPolarHBondContact O-CE2 3.41Å; Y326-Y358 AromaticContact CD1-CD2 3.98Å; Y326-Y358 HydrophobicContact CD1-CD2 3.98Å; Y326-Y358 AromaticContact CD1-CG 3.97Å; Y326-Y358 HydrophobicContact CD1-CG 3.97Å; Y326-Y358 AromaticContact CE1-CD2 3.62Å; Y326-Y358 HydrophobicContact CE1-CD2 3.62Å; Y326-Y358 HydrophobicContact CE1-CE2 4.3Å; Y326-Y358 AromaticContact CE1-CG 3.77Å; Y326-Y358 HydrophobicContact CE1-CG 3.77Å
327	L	94.1	Very high	88.8	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.3	174	-67.7	-174.1	0	0	0	110.8	V210 L337 P338 L341 V357 Y358 A359 R363	V210-L327 HydrophobicContact CB-CD2 3.78Å; V210-L327 HydrophobicContact CG1-CD2 3.92Å; V210-L327 HydrophobicContact CG2-CD2 4.34Å; L327-L337 HydrophobicContact CD1-CD2 4.25Å; L327-L337 HydrophobicContact CD1-CG 4.36Å; L327-P338 HydrophobicContact CD1-CB 4.09Å; L327-P338 HydrophobicContact CD1-CG 3.93Å; L327-L341 HydrophobicContact CD2-CD2 3.73Å; L327-V357 HydrophobicContact CD1-CG1 3.75Å; L327-V357 HydrophobicContact CD2-CG1 4.4Å; L327-V357 HydrophobicContact CG-CG1 3.69Å; L327-Y358 PolarHBondContact N-O 3.49Å; L327-A359 HydrophobicContact CB-CB 4.33Å; L327-A359 HydrophobicContact CD1-CB 4.32Å; L327-R363 WeakPolarHBondContact O-CB 3.37Å; L327-R363 VanDerWaalsContact O-CD 3.28Å; L327-R363 WeakPolarHBondContact O-CD 3.49Å
328	V	90.7	Very high	88.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	165.2	176.9	-54.4	0	0	0	0	111.5	A198 L202 V209 V210 D211 M212 S332 A366	A198-V328 HydrophobicContact CB-CB 4.43Å; A198-V328 HydrophobicContact CB-CG1 4.05Å; A198-V328 HydrophobicContact CB-CG2 4.27Å; L202-V328 HydrophobicContact CD1-CG1 3.95Å; V209-V328 HydrophobicContact CG1-CG1 4.42Å; V209-V328 HydrophobicContact CG1-CG2 3.59Å; V210-V328 PolarHBondContact O-N 2.9Å; D211-V328 VanDerWaalsContact CA-CG2 3.48Å; D211-V328 HydrophobicContact CB-CG2 3.58Å; M212-V328 PolarHBondContact N-O 3.35Å; V328-S332 WeakPolarHBondContact O-CB 3.23Å; V328-S332 PolarHBondContact O-OG 3.37Å; V328-A366 HydrophobicContact CB-CB 4.38Å; V328-A366 HydrophobicContact CG1-CB 4.04Å
329	G	83.9	Confident	88.5	Confident	10 Å²	10	39.6 Å²	39.6	10%	0.103	21%	0.205	C	C	.	.	S	Bend	trans	86.9	168.9	180	0	0	0	0	0	114.4	M212 S332 R363	M212-G329 CarbonylContact O-C 3.57Å; G329-S332 WeakPolarHBondContact O-CB 3.21Å; G329-S332 PolarHBondContact O-N 3.44Å; G329-S332 PolarHBondContact O-OG 3.33Å; G329-R363 PolarHBondContact N-O 2.9Å
330	G	77.1	Confident	88.4	Confident	27 Å²	27	34.9 Å²	34.9	28%	0.278	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-70.6	-35.3	-168.7	0	0	0	0	0	115.2	M212 S332 L333	M212-G330 PolarHBondContact O-N 3.43Å; M212-G330 VanDerWaalsContact O-N 3.16Å; G330-S332 PolarHBondContact O-N 3.25Å; G330-L333 WeakPolarHBondContact O-CB 3.1Å; G330-L333 WeakPolarHBondContact O-CG 3.49Å; G330-L333 PolarHBondContact O-N 3.48Å
331	M	79.1	Confident	88.4	Confident	20 Å²	20	30.9 Å²	30.9	10%	0.099	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-72.5	-15.8	178.3	-63.5	-50.2	-42.6	0	0	112.6	M212 G213 M236 K266 L333 F334	M212-M331 HydrophobicContact CB-CB 3.69Å; M212-M331 VanDerWaalsContact O-CB 3.28Å; M212-M331 WeakPolarHBondContact O-CB 3.05Å; M212-M331 PolarHBondContact O-N 3.2Å; G213-M331 WeakPolarHBondContact O-CG 3.11Å; M236-M331 HydrophobicContact CE-CB 4.47Å; M236-M331 HydrophobicContact CE-CE 3.15Å; M236-M331 HydrophobicContact CE-CG 4.01Å; M236-M331 HydrophobicContact CE-SD 3.92Å; M236-M331 HydrophobicContact SD-CE 3.88Å; K266-M331 WeakPolarHBondContact CE-SD 3.35Å; K266-M331 PolarHBondContact NZ-SD 3.48Å; M331-L333 PolarHBondContact O-N 3.26Å; M331-F334 HydrophobicContact CE-CD2 4.07Å; M331-F334 HydrophobicContact CE-CE1 3.95Å; M331-F334 HydrophobicContact CE-CE2 3.07Å; M331-F334 HydrophobicContact CE-CZ 3.02Å; M331-F334 WeakPolarHBondContact O-CD2 3.46Å
332	S	82.8	Confident	88.5	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-73	-6.8	174.7	78.6	0	0	0	0	113.2	V328 G329 G330 F334 R363	V328-S332 WeakPolarHBondContact O-CB 3.23Å; V328-S332 PolarHBondContact O-OG 3.37Å; G329-S332 WeakPolarHBondContact O-CB 3.21Å; G329-S332 PolarHBondContact O-N 3.44Å; G329-S332 PolarHBondContact O-OG 3.33Å; G330-S332 PolarHBondContact O-N 3.25Å; S332-F334 PolarHBondContact O-N 3.49Å; S332-R363 PolarHBondContact O-NE 3.07Å; S332-R363 VanDerWaalsContact O-NE 3.08Å; S332-R363 PolarHBondContact O-NH2 2.92Å; S332-R363 WeakPolarHBondContact OG-CD 3.12Å; S332-R363 PolarHBondContact OG-NE 3.45Å
333	L	80.6	Confident	88.5	Confident	71 Å²	71	34.4 Å²	34.4	37%	0.372	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-77.6	-2.7	179.3	-65.3	175.7	0	0	0	113.7	G330 M331 R363 Y364	G330-L333 WeakPolarHBondContact O-CB 3.1Å; G330-L333 WeakPolarHBondContact O-CG 3.49Å; G330-L333 PolarHBondContact O-N 3.48Å; M331-L333 PolarHBondContact O-N 3.26Å; L333-R363 HydrophobicContact CD2-CG 4.26Å; L333-Y364 HydrophobicContact CD1-CD2 4.39Å; L333-Y364 HydrophobicContact CD1-CG 4.25Å
334	F	74.8	Confident	88.5	Confident	19 Å²	19	31 Å²	31	8%	0.083	18%	0.179	C	C	.	.	S	Bend	trans	-58.2	128.6	177.6	-74.6	-48.6	0	0	0	111.8	M236 T286 L289 M331 S332 G336 L337	M236-F334 HydrophobicContact CE-CE2 4.11Å; M236-F334 HydrophobicContact CE-CZ 4.46Å; M236-F334 HydrophobicContact SD-CE2 3.74Å; M236-F334 HydrophobicContact SD-CZ 3.87Å; T286-F334 HydrophobicContact CG2-CB 4.21Å; T286-F334 HydrophobicContact CG2-CD1 3.58Å; T286-F334 HydrophobicContact CG2-CD2 3.72Å; T286-F334 HydrophobicContact CG2-CE1 3.68Å; T286-F334 HydrophobicContact CG2-CE2 3.77Å; T286-F334 HydrophobicContact CG2-CG 3.59Å; T286-F334 HydrophobicContact CG2-CZ 3.73Å; L289-F334 HydrophobicContact CD1-CD2 3.96Å; L289-F334 HydrophobicContact CD1-CE2 3.99Å; M331-F334 HydrophobicContact CE-CD2 4.07Å; M331-F334 HydrophobicContact CE-CE1 3.95Å; M331-F334 HydrophobicContact CE-CE2 3.07Å; M331-F334 HydrophobicContact CE-CZ 3.02Å; M331-F334 WeakPolarHBondContact O-CD2 3.46Å; S332-F334 PolarHBondContact O-N 3.49Å; F334-G336 PolarHBondContact O-N 3.36Å; F334-L337 HydrophobicContact CB-CB 4.01Å; F334-L337 HydrophobicContact CB-CD2 4.43Å; F334-L337 WeakPolarHBondContact O-CB 3.25Å; F334-L337 PolarHBondContact O-N 3.29Å
335	P	73.8	Confident	88.6	Confident	93 Å²	93	30.7 Å²	30.7	60%	0.604	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	136.1	176.8	-23.9	33.3	0	0	0	111.4	H269 L337	H269-P335 WeakPolarHBondContact CE1-CD 3.21Å; H269-P335 WeakPolarHBondContact NE2-CD 3.18Å; H269-P335 WeakPolarHBondContact NE2-CG 3.38Å; P335-L337 PolarHBondContact O-N 2.85Å
336	G	81.4	Confident	88.6	Confident	41 Å²	41	36.9 Å²	36.9	42%	0.423	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	-2.6	179.9	0	0	0	0	0	114.9	F334 E339 R340	F334-G336 PolarHBondContact O-N 3.36Å; G336-E339 WeakPolarHBondContact CA-OE2 3.15Å; G336-R340 WeakPolarHBondContact O-CB 3.3Å; G336-R340 PolarHBondContact O-N 3.01Å
337	L	86.2	Confident	88.6	Confident	7 Å²	7	43.5 Å²	43.5	4%	0.037	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-47.1	-178.9	179.9	74.4	0	0	0	113.1	M212 L289 F290 L302 L327 F334 P335 E339 R340 L341	M212-L337 HydrophobicContact CE-CD2 4.34Å; M212-L337 HydrophobicContact SD-CD2 3.73Å; L289-L337 HydrophobicContact CD1-CD1 4.13Å; F290-L337 HydrophobicContact CE2-CD1 3.81Å; F290-L337 HydrophobicContact CZ-CD1 3.77Å; L302-L337 HydrophobicContact CD2-CD1 4.17Å; L327-L337 HydrophobicContact CD1-CD2 4.25Å; L327-L337 HydrophobicContact CD1-CG 4.36Å; F334-L337 HydrophobicContact CB-CB 4.01Å; F334-L337 HydrophobicContact CB-CD2 4.43Å; F334-L337 WeakPolarHBondContact O-CB 3.25Å; F334-L337 PolarHBondContact O-N 3.29Å; P335-L337 PolarHBondContact O-N 2.85Å; L337-E339 PolarHBondContact O-N 2.79Å; L337-R340 PolarHBondContact O-N 3.44Å; L337-L341 WeakPolarHBondContact O-CB 3.49Å; L337-L341 PolarHBondContact O-N 3.34Å
338	P	90.2	Very high	88.7	Confident	17 Å²	17	46.4 Å²	46.4	11%	0.11	24%	0.239	C	C	.	.	H	α-helix	trans	-57.8	-48.2	178	-19.9	30.5	0	0	0	112	L327 R340 L341 E342 V357 A359	L327-P338 HydrophobicContact CD1-CB 4.09Å; L327-P338 HydrophobicContact CD1-CG 3.93Å; P338-R340 PolarHBondContact O-N 3.27Å; P338-L341 PolarHBondContact O-N 2.9Å; P338-E342 WeakPolarHBondContact O-CB 3.43Å; P338-E342 PolarHBondContact O-N 3.16Å; P338-V357 HydrophobicContact CB-CG1 4.17Å; P338-A359 HydrophobicContact CB-CB 3.97Å; P338-A359 HydrophobicContact CG-CB 3.45Å; P338-A359 VanDerWaalsContact CG-CB 3.45Å
339	E	94.1	Very high	88.9	Confident	124 Å²	124	47.2 Å²	47.2	58%	0.579	24%	0.244	S	C	*	.	H	α-helix	trans	-66.4	-40.8	-177.6	-59.4	75.9	-167.5	0	0	111.3	G336 L337 S343	G336-E339 WeakPolarHBondContact CA-OE2 3.15Å; L337-E339 PolarHBondContact O-N 2.79Å; E339-S343 VanDerWaalsContact O-CB 3.25Å; E339-S343 WeakPolarHBondContact O-CB 3.08Å; E339-S343 PolarHBondContact O-N 3.47Å
340	R	93.2	Very high	89.4	Confident	73 Å²	73	50.4 Å²	50.4	28%	0.275	26%	0.263	S	S	.	.	H	α-helix	trans	-64.7	-46.3	175.7	178.7	59.3	-179.7	-73.6	-2.8	111.3	E287 F290 G336 L337 P338 S343 E344	E287-R340 IonicContact OE1-NH2 3.61Å; E287-R340 PolarHBondContact OE1-NH2 3.2Å; E287-R340 IonicContact OE2-CZ 3.64Å; E287-R340 IonicContact OE2-NH1 2.61Å; E287-R340 PolarHBondContact OE2-NH1 3.33Å; E287-R340 IonicContact OE2-NH2 3.02Å; E287-R340 PolarHBondContact OE2-NH2 2.98Å; E287-R340 VanDerWaalsContact OE2-NH2 3.15Å; F290-R340 HydrophobicContact CD1-CG 4.16Å; F290-R340 HydrophobicContact CD2-CG 3.88Å; F290-R340 HydrophobicContact CE1-CG 3.77Å; F290-R340 HydrophobicContact CE2-CB 4.19Å; F290-R340 HydrophobicContact CE2-CG 3.45Å; F290-R340 VanDerWaalsContact CE2-CG 3.45Å; F290-R340 HydrophobicContact CG-CG 4.22Å; F290-R340 HydrophobicContact CZ-CB 3.94Å; F290-R340 HydrophobicContact CZ-CG 3.39Å; G336-R340 WeakPolarHBondContact O-CB 3.3Å; G336-R340 PolarHBondContact O-N 3.01Å; L337-R340 PolarHBondContact O-N 3.44Å; P338-R340 PolarHBondContact O-N 3.27Å; R340-S343 PolarHBondContact O-N 3.49Å; R340-E344 IonicContact CZ-OE1 3.88Å; R340-E344 IonicContact NE-OE1 3.35Å; R340-E344 PolarHBondContact NE-OE1 3.1Å; R340-E344 IonicContact NH2-OE1 3.56Å; R340-E344 PolarHBondContact NH2-OE1 3.23Å; R340-E344 VanDerWaalsContact NH2-OE1 3.15Å; R340-E344 WeakPolarHBondContact O-CG 3.48Å; R340-E344 PolarHBondContact O-N 2.91Å
341	L	95.5	Very high	90.2	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-45.5	179.5	179.9	60.1	0	0	0	111.4	F290 L302 H303 L327 L337 P338 E344 L345 V357	F290-L341 HydrophobicContact CE1-CB 4.27Å; F290-L341 HydrophobicContact CE1-CD1 4.15Å; F290-L341 HydrophobicContact CZ-CB 4.28Å; L302-L341 HydrophobicContact CD2-CD1 4.27Å; L302-L341 HydrophobicContact CD2-CD2 4.33Å; L302-L341 HydrophobicContact CG-CD1 4.07Å; H303-L341 HydrophobicContact CB-CD1 3.86Å; L327-L341 HydrophobicContact CD2-CD2 3.73Å; L337-L341 WeakPolarHBondContact O-CB 3.49Å; L337-L341 PolarHBondContact O-N 3.34Å; P338-L341 PolarHBondContact O-N 2.9Å; L341-E344 PolarHBondContact O-N 2.87Å; L341-L345 HydrophobicContact CD1-CD1 3.9Å; L341-L345 HydrophobicContact CD1-CG 4.13Å; L341-L345 HydrophobicContact CG-CD1 3.89Å; L341-L345 WeakPolarHBondContact O-CB 3.16Å; L341-L345 VanDerWaalsContact O-CG 3.31Å; L341-L345 WeakPolarHBondContact O-CG 3.45Å; L341-L345 PolarHBondContact O-N 2.88Å; L341-V357 HydrophobicContact CD2-CG1 4.28Å; L341-V357 HydrophobicContact CD2-CG2 4.39Å; L341-V357 HydrophobicContact CG-CG2 4.27Å
342	E	97.3	Very high	90.9	Very high	40 Å²	40	60.6 Å²	60.6	19%	0.187	32%	0.319	C	S	.	.	H	α-helix	trans	-60	-46.6	176.4	-171.8	171.8	117.7	0	0	111.5	P338 E344 L345 R346 V355 V357	P338-E342 WeakPolarHBondContact O-CB 3.43Å; P338-E342 PolarHBondContact O-N 3.16Å; E342-E344 PolarHBondContact O-N 3.15Å; E342-L345 PolarHBondContact O-N 3.44Å; E342-R346 WeakPolarHBondContact O-CB 3.42Å; E342-R346 VanDerWaalsContact O-CG 3.31Å; E342-R346 WeakPolarHBondContact O-CG 3.25Å; E342-R346 PolarHBondContact O-N 3.1Å; E342-R346 IonicContact OE1-CZ 2.82Å; E342-R346 IonicContact OE1-NE 2.67Å; E342-R346 IonicContact OE1-NH1 2.65Å; E342-R346 PolarHBondContact OE1-NH1 3.1Å; E342-R346 IonicContact OE1-NH2 2.78Å; E342-R346 PolarHBondContact OE1-NH2 3.21Å; E342-V355 HydrophobicContact CG-CG1 4.37Å; E342-V357 HydrophobicContact CB-CB 4.21Å; E342-V357 HydrophobicContact CB-CG2 3.74Å; E342-V357 HydrophobicContact CG-CG2 4.31Å; E342-V357 PolarHBondContact OE2-N 3.38Å
343	S	96.9	Very high	91.5	Very high	46 Å²	46	61.9 Å²	61.9	32%	0.322	33%	0.327	S	S	.	.	H	α-helix	trans	-59.7	-46.6	177.9	-170.2	0	0	0	0	112.6	E339 R340 R346 R347	E339-S343 VanDerWaalsContact O-CB 3.25Å; E339-S343 WeakPolarHBondContact O-CB 3.08Å; E339-S343 PolarHBondContact O-N 3.47Å; R340-S343 PolarHBondContact O-N 3.49Å; S343-R346 PolarHBondContact O-N 3.47Å; S343-R347 WeakPolarHBondContact O-CG 3.27Å; S343-R347 PolarHBondContact O-N 3.44Å; S343-R347 PolarHBondContact OG-NH2 3.16Å
344	E	97.3	Very high	92.3	Very high	26 Å²	26	63.3 Å²	63.3	12%	0.121	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-43.2	178.6	-68.2	-62.3	169.7	0	0	111.8	F290 H303 R340 L341 E342 R346 R347 M348	F290-E344 HydrophobicContact CD1-CG 3.84Å; F290-E344 HydrophobicContact CE1-CG 4.19Å; H303-E344 HydrophobicContact CB-CB 3.65Å; R340-E344 IonicContact CZ-OE1 3.88Å; R340-E344 IonicContact NE-OE1 3.35Å; R340-E344 PolarHBondContact NE-OE1 3.1Å; R340-E344 IonicContact NH2-OE1 3.56Å; R340-E344 PolarHBondContact NH2-OE1 3.23Å; R340-E344 VanDerWaalsContact NH2-OE1 3.15Å; R340-E344 WeakPolarHBondContact O-CG 3.48Å; R340-E344 PolarHBondContact O-N 2.91Å; L341-E344 PolarHBondContact O-N 2.87Å; E342-E344 PolarHBondContact O-N 3.15Å; E344-R346 PolarHBondContact O-N 3.03Å; E344-R347 PolarHBondContact O-N 3.47Å; E344-R347 IonicContact OE1-NH1 3.97Å; E344-R347 PolarHBondContact OE1-NH1 3.05Å; E344-R347 IonicContact OE2-CZ 3.11Å; E344-R347 IonicContact OE2-NH1 3.13Å; E344-R347 PolarHBondContact OE2-NH1 3.31Å; E344-M348 WeakPolarHBondContact O-CG 3.48Å; E344-M348 PolarHBondContact O-N 2.9Å
345	L	97.6	Very high	93.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.7	-40	178.3	-74.4	170.9	0	0	0	112.4	H303 V306 N307 I325 L341 E342 R347 M348 V349 V355	H303-L345 HydrophobicContact CB-CD2 4.33Å; H303-L345 HydrophobicContact CB-CG 4.34Å; H303-L345 VanDerWaalsContact O-CD2 3.26Å; H303-L345 WeakPolarHBondContact O-CD2 3.34Å; V306-L345 HydrophobicContact CB-CD2 4.26Å; V306-L345 HydrophobicContact CG1-CD1 3.94Å; V306-L345 HydrophobicContact CG1-CD2 4.14Å; N307-L345 HydrophobicContact CB-CD2 4.01Å; I325-L345 HydrophobicContact CD1-CD1 3.46Å; I325-L345 VanDerWaalsContact CD1-CD1 3.46Å; L341-L345 HydrophobicContact CD1-CD1 3.9Å; L341-L345 HydrophobicContact CD1-CG 4.13Å; L341-L345 HydrophobicContact CG-CD1 3.89Å; L341-L345 WeakPolarHBondContact O-CB 3.16Å; L341-L345 VanDerWaalsContact O-CG 3.31Å; L341-L345 WeakPolarHBondContact O-CG 3.45Å; L341-L345 PolarHBondContact O-N 2.88Å; E342-L345 PolarHBondContact O-N 3.44Å; L345-R347 PolarHBondContact O-N 2.8Å; L345-M348 HydrophobicContact CD2-SD 4.47Å; L345-M348 WeakPolarHBondContact O-CB 3.23Å; L345-M348 PolarHBondContact O-N 3.3Å; L345-V349 PolarHBondContact O-N 2.66Å; L345-V355 HydrophobicContact CB-CG1 3.77Å; L345-V355 HydrophobicContact CD1-CG1 4.2Å
346	R	97	Very high	94.5	Very high	130 Å²	130	59.4 Å²	59.4	49%	0.491	31%	0.308	S	S	.	.	H	α-helix	trans	-58	-33.9	175	-78	-178.7	180	167.5	4.8	112.8	E342 S343 E344 M348 V355	E342-R346 WeakPolarHBondContact O-CB 3.42Å; E342-R346 VanDerWaalsContact O-CG 3.31Å; E342-R346 WeakPolarHBondContact O-CG 3.25Å; E342-R346 PolarHBondContact O-N 3.1Å; E342-R346 IonicContact OE1-CZ 2.82Å; E342-R346 IonicContact OE1-NE 2.67Å; E342-R346 IonicContact OE1-NH1 2.65Å; E342-R346 PolarHBondContact OE1-NH1 3.1Å; E342-R346 IonicContact OE1-NH2 2.78Å; E342-R346 PolarHBondContact OE1-NH2 3.21Å; S343-R346 PolarHBondContact O-N 3.47Å; E344-R346 PolarHBondContact O-N 3.03Å; R346-M348 VanDerWaalsContact C-N 3.27Å; R346-M348 PolarHBondContact O-N 3.46Å; R346-V355 HydrophobicContact CG-CB 3.78Å; R346-V355 HydrophobicContact CG-CG2 4.06Å; R346-V355 PolarHBondContact NE-O 2.77Å; R346-V355 PolarHBondContact NH2-O 2.9Å
347	R	96.9	Very high	95.2	Very high	168 Å²	168	58.1 Å²	58.1	63%	0.634	29%	0.292	S	S	*	.	H	α-helix	trans	-72	-20.6	175.5	-64.7	173.8	-166.1	152.2	0.8	113.3	S343 E344 L345	S343-R347 WeakPolarHBondContact O-CG 3.27Å; S343-R347 PolarHBondContact O-N 3.44Å; S343-R347 PolarHBondContact OG-NH2 3.16Å; E344-R347 PolarHBondContact O-N 3.47Å; E344-R347 IonicContact OE1-NH1 3.97Å; E344-R347 PolarHBondContact OE1-NH1 3.05Å; E344-R347 IonicContact OE2-CZ 3.11Å; E344-R347 IonicContact OE2-NH1 3.13Å; E344-R347 PolarHBondContact OE2-NH1 3.31Å; L345-R347 PolarHBondContact O-N 2.8Å
348	M	96.3	Very high	95.7	Very high	63 Å²	63	63 Å²	63	31%	0.31	31%	0.31	S	S	.	.	H	α-helix	trans	-91.3	-9.1	-177.4	-60.9	-176.9	93	0	0	113.9	E304 N307 E344 L345 R346	E304-M348 HydrophobicContact CB-CE 4.38Å; E304-M348 HydrophobicContact CG-CE 3.92Å; N307-M348 HydrophobicContact CB-CE 4.17Å; N307-M348 HydrophobicContact CB-SD 3.89Å; N307-M348 WeakPolarHBondContact ND2-CE 3.33Å; E344-M348 WeakPolarHBondContact O-CG 3.48Å; E344-M348 PolarHBondContact O-N 2.9Å; L345-M348 HydrophobicContact CD2-SD 4.47Å; L345-M348 WeakPolarHBondContact O-CB 3.23Å; L345-M348 PolarHBondContact O-N 3.3Å; R346-M348 VanDerWaalsContact C-N 3.27Å; R346-M348 PolarHBondContact O-N 3.46Å
349	V	95.5	Very high	95.6	Very high	17 Å²	17	63.7 Å²	63.7	10%	0.103	32%	0.318	C	S	.	.	S	Bend	trans	-121.6	155	-175.9	-59.1	0	0	0	0	111.3	F322 L345 V353 V355	F322-V349 HydrophobicContact CD1-CG1 4.1Å; F322-V349 HydrophobicContact CD2-CG1 4.45Å; F322-V349 HydrophobicContact CE1-CG1 3.55Å; F322-V349 HydrophobicContact CE2-CG1 3.95Å; F322-V349 HydrophobicContact CZ-CG1 3.48Å; F322-V349 VanDerWaalsContact CZ-CG1 3.48Å; L345-V349 PolarHBondContact O-N 2.66Å; V349-V353 HydrophobicContact CB-CB 4.08Å; V349-V353 HydrophobicContact CB-CG1 4.25Å; V349-V353 HydrophobicContact CG2-CB 3.98Å; V349-V353 HydrophobicContact CG2-CG1 4.16Å; V349-V355 HydrophobicContact CG2-CG2 3.67Å
350	P	95	Very high	95.1	Very high	76 Å²	76	58.6 Å²	58.6	49%	0.494	30%	0.297	S	S	.	.			trans	-56.4	147.5	173.2	-28	38	0	0	0	112.4	N352 V353	P350-N352 WeakPolarHBondContact CB-OD1 3.29Å; P350-N352 PolarHBondContact O-N 2.93Å; P350-V353 HydrophobicContact CB-CG2 4.4Å; P350-V353 WeakPolarHBondContact O-CB 3.44Å; P350-V353 PolarHBondContact O-N 3.5Å
351	P	93.5	Very high	94.5	Very high	140 Å²	140	60.7 Å²	60.7	91%	0.909	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-20.5	-176.4	-26.5	34.6	0	0	0	115.8	V353	P351-V353 VanDerWaalsContact C-N 3.32Å
352	N	93.5	Very high	93.8	Very high	121 Å²	121	63 Å²	63	65%	0.647	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-4.6	176.9	65.3	-56.4	0	0	0	113.7	P350	P350-N352 WeakPolarHBondContact CB-OD1 3.29Å; P350-N352 PolarHBondContact O-N 2.93Å
353	V	95.3	Very high	93.2	Very high	27 Å²	27	62.4 Å²	62.4	16%	0.164	33%	0.325	C	S	.	.	S	Bend	trans	-93.9	115.3	172.8	-179.6	0	0	0	0	108.2	F322 V349 P350 P351	F322-V353 HydrophobicContact CB-CG1 3.95Å; F322-V353 HydrophobicContact CD2-CG1 3.77Å; F322-V353 HydrophobicContact CG-CG1 3.98Å; V349-V353 HydrophobicContact CB-CB 4.08Å; V349-V353 HydrophobicContact CB-CG1 4.25Å; V349-V353 HydrophobicContact CG2-CB 3.98Å; V349-V353 HydrophobicContact CG2-CG1 4.16Å; P350-V353 HydrophobicContact CB-CG2 4.4Å; P350-V353 WeakPolarHBondContact O-CB 3.44Å; P350-V353 PolarHBondContact O-N 3.5Å; P351-V353 VanDerWaalsContact C-N 3.32Å
354	E	96.2	Very high	92.5	Very high	101 Å²	101	62 Å²	62	47%	0.472	32%	0.316	S	S	.	.			trans	-75.7	136.3	175.1	-177.3	-179.2	-174.5	0	0	110.3	F322 R323	F322-E354 CarbonylContact C-O 3.17Å; F322-E354 WeakPolarHBondContact CB-O 3.48Å; R323-E354 HydrophobicContact CG-CB 3.85Å; R323-E354 HydrophobicContact CG-CG 4.04Å; R323-E354 IonicContact CZ-OE2 3.39Å; R323-E354 IonicContact NE-OE2 3.75Å; R323-E354 PolarHBondContact NE-OE2 3.43Å; R323-E354 IonicContact NH2-OE2 2.8Å; R323-E354 PolarHBondContact NH2-OE2 3.36Å
355	V	97.8	Very high	92	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.006	32%	0.318	C	S	.	.			trans	-125.5	128.1	176.8	-178.2	0	0	0	0	108.5	F322 I325 E342 L345 R346 V349	F322-V355 HydrophobicContact CB-CG2 4.35Å; F322-V355 HydrophobicContact CD1-CG2 4.2Å; F322-V355 WeakPolarHBondContact O-CA 3.24Å; I325-V355 HydrophobicContact CD1-CG1 4.2Å; E342-V355 HydrophobicContact CG-CG1 4.37Å; L345-V355 HydrophobicContact CB-CG1 3.77Å; L345-V355 HydrophobicContact CD1-CG1 4.2Å; R346-V355 HydrophobicContact CG-CB 3.78Å; R346-V355 HydrophobicContact CG-CG2 4.06Å; R346-V355 PolarHBondContact NE-O 2.77Å; R346-V355 PolarHBondContact NH2-O 2.9Å; V349-V355 HydrophobicContact CG2-CG2 3.67Å
356	T	97.5	Very high	91.6	Very high	29 Å²	29	62.3 Å²	62.3	18%	0.178	32%	0.318	C	S	.	.			trans	-137.1	127.6	-178.5	-51.6	0	0	0	0	110	F322 R323 I325 Y358	F322-T356 PolarHBondContact O-N 3.18Å; F322-T356 VanDerWaalsContact O-N 3.14Å; R323-T356 WeakPolarHBondContact O-CB 3.34Å; I325-T356 PolarHBondContact N-O 2.8Å; T356-Y358 HydrophobicContact CG2-CD2 4.24Å; T356-Y358 HydrophobicContact CG2-CE1 4.18Å; T356-Y358 HydrophobicContact CG2-CE2 3.63Å
357	V	97.3	Very high	91.3	Very high	14 Å²	14	56.6 Å²	56.6	9%	0.085	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.4	177.3	-178.8	0	0	0	0	110.1	I325 L327 P338 L341 E342	I325-V357 HydrophobicContact CB-CG2 4.24Å; I325-V357 HydrophobicContact CD1-CG2 4.46Å; I325-V357 HydrophobicContact CG2-CG2 4.35Å; I325-V357 CarbonylContact O-C 3.57Å; I325-V357 WeakPolarHBondContact O-CA 3.36Å; L327-V357 HydrophobicContact CD1-CG1 3.75Å; L327-V357 HydrophobicContact CD2-CG1 4.4Å; L327-V357 HydrophobicContact CG-CG1 3.69Å; P338-V357 HydrophobicContact CB-CG1 4.17Å; L341-V357 HydrophobicContact CD2-CG1 4.28Å; L341-V357 HydrophobicContact CD2-CG2 4.39Å; L341-V357 HydrophobicContact CG-CG2 4.27Å; E342-V357 HydrophobicContact CB-CB 4.21Å; E342-V357 HydrophobicContact CB-CG2 3.74Å; E342-V357 HydrophobicContact CG-CG2 4.31Å; E342-V357 PolarHBondContact OE2-N 3.38Å
358	Y	94.9	Very high	91.1	Very high	109 Å²	109	48.6 Å²	48.6	43%	0.427	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.4	177.4	-63.2	-85.9	0	0	0	110.9	R323 I325 Y326 L327 T356	R323-Y358 WeakPolarHBondContact O-CE2 3.38Å; I325-Y358 PolarHBondContact O-N 3.42Å; Y326-Y358 AromaticContact CD1-CD2 3.98Å; Y326-Y358 HydrophobicContact CD1-CD2 3.98Å; Y326-Y358 AromaticContact CD1-CG 3.97Å; Y326-Y358 HydrophobicContact CD1-CG 3.97Å; Y326-Y358 AromaticContact CE1-CD2 3.62Å; Y326-Y358 HydrophobicContact CE1-CD2 3.62Å; Y326-Y358 HydrophobicContact CE1-CE2 4.3Å; Y326-Y358 AromaticContact CE1-CG 3.77Å; Y326-Y358 HydrophobicContact CE1-CG 3.77Å; L327-Y358 PolarHBondContact N-O 3.49Å; T356-Y358 HydrophobicContact CG2-CD2 4.24Å; T356-Y358 HydrophobicContact CG2-CE1 4.18Å; T356-Y358 HydrophobicContact CG2-CE2 3.63Å
359	A	89.2	Confident	90.7	Very high	33 Å²	33	45.6 Å²	45.6	27%	0.273	25%	0.253	S	S	.	.			trans	-138.3	83.9	178.7	0	0	0	0	0	110.8	L327 P338	L327-A359 HydrophobicContact CB-CB 4.33Å; L327-A359 HydrophobicContact CD1-CB 4.32Å; P338-A359 HydrophobicContact CB-CB 3.97Å; P338-A359 HydrophobicContact CG-CB 3.45Å; P338-A359 VanDerWaalsContact CG-CB 3.45Å
360	A	83.7	Confident	90.4	Very high	16 Å²	16	44.8 Å²	44.8	13%	0.132	25%	0.248	C	C	.	.			trans	-58.2	141.3	178.1	0	0	0	0	0	111.2	L202 W362 R363	L202-A360 HydrophobicContact CD2-CB 3.79Å; A360-W362 HydrophobicContact CB-CD2 3.96Å; A360-W362 HydrophobicContact CB-CE3 4.31Å; A360-W362 HydrophobicContact CB-CG 4.5Å; A360-W362 HydrophobicContact CB-CH2 4.16Å; A360-W362 HydrophobicContact CB-CZ2 3.81Å; A360-W362 HydrophobicContact CB-CZ3 4.4Å; A360-W362 PolarHBondContact O-N 2.95Å; A360-R363 HydrophobicContact CB-CB 4.34Å; A360-R363 WeakPolarHBondContact O-CB 3.23Å; A360-R363 VanDerWaalsContact O-CD 3.31Å; A360-R363 WeakPolarHBondContact O-CD 3.41Å; A360-R363 WeakPolarHBondContact O-CG 3.46Å; A360-R363 PolarHBondContact O-N 3.11Å; A360-R363 PolarHBondContact O-NH1 2.94Å
361	P	80.3	Confident	90.3	Very high	117 Å²	117	41.1 Å²	41.1	76%	0.76	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-32.8	178.3	-26.7	35	0	0	0	113.4
362	W	81.1	Confident	90.1	Very high	50 Å²	50	34.8 Å²	34.8	19%	0.189	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	8.9	179.9	48.6	-101.9	0	0	0	113.8	L5 A201 L202 A360 Y364 H365 A366 L369	L5-W362 HydrophobicContact CB-CZ2 4.32Å; L5-W362 HydrophobicContact CD1-CH2 3.79Å; L5-W362 HydrophobicContact CD1-CZ2 3.72Å; L5-W362 HydrophobicContact CD1-CZ3 4.36Å; A201-W362 HydrophobicContact CB-CH2 4.08Å; A201-W362 HydrophobicContact CB-CZ3 3.86Å; A201-W362 VanDerWaalsContact O-CH2 3.25Å; A201-W362 WeakPolarHBondContact O-CH2 3.42Å; L202-W362 HydrophobicContact CD2-CH2 3.6Å; L202-W362 HydrophobicContact CD2-CZ2 4.22Å; L202-W362 HydrophobicContact CD2-CZ3 4.15Å; L202-W362 HydrophobicContact CG-CH2 4.03Å; L202-W362 HydrophobicContact CG-CZ3 4.45Å; A360-W362 HydrophobicContact CB-CD2 3.96Å; A360-W362 HydrophobicContact CB-CE3 4.31Å; A360-W362 HydrophobicContact CB-CG 4.5Å; A360-W362 HydrophobicContact CB-CH2 4.16Å; A360-W362 HydrophobicContact CB-CZ2 3.81Å; A360-W362 HydrophobicContact CB-CZ3 4.4Å; A360-W362 PolarHBondContact O-N 2.95Å; W362-Y364 PolarHBondContact O-N 3.23Å; W362-H365 PolarHBondContact O-N 3.05Å; W362-A366 HydrophobicContact CE3-CB 4.33Å; W362-A366 HydrophobicContact CZ3-CB 3.89Å; W362-L369 HydrophobicContact CB-CD1 4.44Å; W362-L369 HydrophobicContact CD2-CD1 4.17Å; W362-L369 HydrophobicContact CE3-CD1 3.72Å; W362-L369 HydrophobicContact CG-CD1 4.49Å; W362-L369 HydrophobicContact CZ3-CD1 4.38Å
363	R	83.7	Confident	89.8	Confident	27 Å²	27	30.3 Å²	30.3	10%	0.102	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-55	-18.7	-175	67.9	-170.6	172.2	-85.7	10.6	115.7	L327 G329 S332 L333 A360 H365 A366	L327-R363 WeakPolarHBondContact O-CB 3.37Å; L327-R363 VanDerWaalsContact O-CD 3.28Å; L327-R363 WeakPolarHBondContact O-CD 3.49Å; G329-R363 PolarHBondContact N-O 2.9Å; S332-R363 PolarHBondContact O-NE 3.07Å; S332-R363 VanDerWaalsContact O-NE 3.08Å; S332-R363 PolarHBondContact O-NH2 2.92Å; S332-R363 WeakPolarHBondContact OG-CD 3.12Å; S332-R363 PolarHBondContact OG-NE 3.45Å; L333-R363 HydrophobicContact CD2-CG 4.26Å; A360-R363 HydrophobicContact CB-CB 4.34Å; A360-R363 WeakPolarHBondContact O-CB 3.23Å; A360-R363 VanDerWaalsContact O-CD 3.31Å; A360-R363 WeakPolarHBondContact O-CD 3.41Å; A360-R363 WeakPolarHBondContact O-CG 3.46Å; A360-R363 PolarHBondContact O-N 3.11Å; A360-R363 PolarHBondContact O-NH1 2.94Å; R363-H365 PolarHBondContact O-N 3.18Å; R363-A366 WeakPolarHBondContact O-CB 3.47Å; R363-A366 PolarHBondContact O-N 3.27Å
364	Y	83.3	Confident	89.4	Confident	37 Å²	37	29.1 Å²	29.1	15%	0.145	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-63.1	-26.1	172.2	-176.3	-131.5	0	0	0	114.1	R75 F89 R263 L333 W362	R75-Y364 PolarHBondContact NE-O 2.68Å; R75-Y364 PolarHBondContact NH2-O 2.98Å; F89-Y364 HydrophobicContact CE1-CE1 4.2Å; F89-Y364 HydrophobicContact CE2-CE1 4.33Å; F89-Y364 AromaticContact CZ-CE1 3.82Å; F89-Y364 HydrophobicContact CZ-CE1 3.82Å; F89-Y364 AromaticContact CZ-CZ 3.64Å; F89-Y364 WeakPolarHBondContact CZ-OH 3.25Å; R263-Y364 PolarHBondContact NH2-OH 3.35Å; L333-Y364 HydrophobicContact CD1-CD2 4.39Å; L333-Y364 HydrophobicContact CD1-CG 4.25Å; W362-Y364 PolarHBondContact O-N 3.23Å
365	H	87.2	Confident	89	Confident	32 Å²	32	24.3 Å²	24.3	15%	0.148	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-111.9	9.9	178.9	-59.6	-76.1	0	0	0	112.1	R75 W362 R363 S367 F368 L369	R75-H365 PolarHBondContact NE-ND1 3.43Å; W362-H365 PolarHBondContact O-N 3.05Å; R363-H365 PolarHBondContact O-N 3.18Å; H365-S367 PolarHBondContact O-N 3.01Å; H365-F368 PolarHBondContact O-N 3.06Å; H365-F368 VanDerWaalsContact O-N 3.13Å; H365-L369 HydrophobicContact CB-CD1 4.13Å; H365-L369 HydrophobicContact CB-CG 4.09Å; H365-L369 VanDerWaalsContact O-CG 3.3Å; H365-L369 WeakPolarHBondContact O-CG 3.21Å; H365-L369 PolarHBondContact O-N 3.35Å
366	A	88.1	Confident	88.3	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-53.4	-50.4	-172.3	0	0	0	0	0	112.5	A198 A201 V328 W362 R363 F368 L369 G370	A198-A366 HydrophobicContact CB-CB 3.91Å; A201-A366 WeakPolarHBondContact CB-O 3.36Å; V328-A366 HydrophobicContact CB-CB 4.38Å; V328-A366 HydrophobicContact CG1-CB 4.04Å; W362-A366 HydrophobicContact CE3-CB 4.33Å; W362-A366 HydrophobicContact CZ3-CB 3.89Å; R363-A366 WeakPolarHBondContact O-CB 3.47Å; R363-A366 PolarHBondContact O-N 3.27Å; A366-F368 PolarHBondContact O-N 3.15Å; A366-L369 PolarHBondContact O-N 2.88Å; A366-G370 PolarHBondContact O-N 2.86Å
367	S	91.8	Very high	87.3	Confident	9 Å²	9	29 Å²	29	6%	0.063	15%	0.154	C	C	.	.	H	α-helix	trans	-60	-44.9	179	-43.3	0	0	0	0	112.2	Q194 L197 H365 G370 A371	Q194-S367 WeakPolarHBondContact O-CB 3.23Å; Q194-S367 PolarHBondContact O-OG 3.42Å; L197-S367 VanDerWaalsContact CB-O 3.3Å; L197-S367 WeakPolarHBondContact CB-O 3.46Å; H365-S367 PolarHBondContact O-N 3.01Å; S367-G370 PolarHBondContact O-N 2.69Å; S367-A371 PolarHBondContact O-N 3.42Å
368	F	91.4	Very high	86.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-43.9	176.5	-177	-101.3	0	0	0	113.1	V66 E68 R75 P86 H365 A366 G370 A371 K372	V66-F368 HydrophobicContact CB-CE2 4.21Å; V66-F368 HydrophobicContact CG1-CD2 3.91Å; V66-F368 HydrophobicContact CG1-CE2 3.77Å; E68-F368 HydrophobicContact CB-CD2 4.19Å; E68-F368 VanDerWaalsContact OE2-CA 3.32Å; E68-F368 WeakPolarHBondContact OE2-CA 3.48Å; E68-F368 WeakPolarHBondContact OE2-CB 3.21Å; E68-F368 PolarHBondContact OE2-N 3.03Å; R75-F368 HydrophobicContact CB-CB 4.3Å; R75-F368 HydrophobicContact CB-CD2 3.51Å; R75-F368 HydrophobicContact CB-CE2 3.98Å; R75-F368 HydrophobicContact CB-CG 3.98Å; P86-F368 HydrophobicContact CB-CD1 4.38Å; P86-F368 HydrophobicContact CB-CE1 3.9Å; P86-F368 HydrophobicContact CB-CE2 4.34Å; P86-F368 HydrophobicContact CB-CZ 3.87Å; P86-F368 HydrophobicContact CG-CD1 3.58Å; P86-F368 HydrophobicContact CG-CD2 4.4Å; P86-F368 HydrophobicContact CG-CE1 3.57Å; P86-F368 HydrophobicContact CG-CE2 4.4Å; P86-F368 HydrophobicContact CG-CG 4Å; P86-F368 HydrophobicContact CG-CZ 3.99Å; H365-F368 PolarHBondContact O-N 3.06Å; H365-F368 VanDerWaalsContact O-N 3.13Å; A366-F368 PolarHBondContact O-N 3.15Å; F368-G370 VanDerWaalsContact C-N 3.33Å; F368-A371 WeakPolarHBondContact O-CB 3.44Å; F368-A371 PolarHBondContact O-N 3.3Å; F368-K372 HydrophobicContact CD1-CD 4.47Å; F368-K372 HydrophobicContact CE1-CD 3.8Å; F368-K372 HydrophobicContact CE1-CG 4.25Å; F368-K372 HydrophobicContact CZ-CD 4.24Å; F368-K372 VanDerWaalsContact CZ-CE 3.44Å; F368-K372 HydrophobicContact CZ-CG 4.45Å; F368-K372 PolarHBondContact O-N 3.22Å
369	L	88.7	Confident	85.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.1	-40.4	178.9	-66.7	175.4	0	0	0	110.5	L83 A201 W362 H365 A366 A371 K372 I373	L83-L369 HydrophobicContact CD1-CD2 4.03Å; L83-L369 HydrophobicContact CD2-CB 4.43Å; L83-L369 HydrophobicContact CD2-CD2 3.99Å; L83-L369 HydrophobicContact CG-CD2 3.91Å; A201-L369 HydrophobicContact CB-CB 4.33Å; W362-L369 HydrophobicContact CB-CD1 4.44Å; W362-L369 HydrophobicContact CD2-CD1 4.17Å; W362-L369 HydrophobicContact CE3-CD1 3.72Å; W362-L369 HydrophobicContact CG-CD1 4.49Å; W362-L369 HydrophobicContact CZ3-CD1 4.38Å; H365-L369 HydrophobicContact CB-CD1 4.13Å; H365-L369 HydrophobicContact CB-CG 4.09Å; H365-L369 VanDerWaalsContact O-CG 3.3Å; H365-L369 WeakPolarHBondContact O-CG 3.21Å; H365-L369 PolarHBondContact O-N 3.35Å; A366-L369 PolarHBondContact O-N 2.88Å; L369-A371 VanDerWaalsContact C-N 3.34Å; L369-A371 PolarHBondContact O-N 3.48Å; L369-K372 WeakPolarHBondContact O-CB 3.26Å; L369-K372 PolarHBondContact O-N 3.4Å; L369-K372 VanDerWaalsContact O-N 3.16Å; L369-I373 WeakPolarHBondContact O-CG1 3.45Å; L369-I373 PolarHBondContact O-N 3.15Å
370	G	89.7	Confident	84.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.7	-43.9	172.6	0	0	0	0	0	112.7	L197 A366 S367 F368 K372 I373 V374	L197-G370 WeakPolarHBondContact O-CA 3.37Å; A366-G370 PolarHBondContact O-N 2.86Å; S367-G370 PolarHBondContact O-N 2.69Å; F368-G370 VanDerWaalsContact C-N 3.33Å; G370-K372 VanDerWaalsContact C-N 3.31Å; G370-K372 PolarHBondContact O-N 2.85Å; G370-I373 PolarHBondContact O-N 2.98Å; G370-I373 VanDerWaalsContact O-N 3.15Å; G370-V374 WeakPolarHBondContact O-CG2 3.46Å; G370-V374 PolarHBondContact O-N 2.97Å
371	A	92.3	Very high	84.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.4	-42	173.9	0	0	0	0	0	111.8	V66 L161 L197 S367 F368 L369 I373 V374 A375	V66-A371 HydrophobicContact CG1-CB 3.42Å; V66-A371 VanDerWaalsContact CG1-CB 3.42Å; L161-A371 HydrophobicContact CD1-CB 4.4Å; L161-A371 WeakPolarHBondContact CD1-O 3.33Å; L161-A371 HydrophobicContact CD2-CB 3.75Å; L197-A371 HydrophobicContact CD1-CB 3.77Å; L197-A371 HydrophobicContact CD2-CB 4.26Å; L197-A371 HydrophobicContact CG-CB 4.46Å; S367-A371 PolarHBondContact O-N 3.42Å; F368-A371 WeakPolarHBondContact O-CB 3.44Å; F368-A371 PolarHBondContact O-N 3.3Å; L369-A371 VanDerWaalsContact C-N 3.34Å; L369-A371 PolarHBondContact O-N 3.48Å; A371-I373 PolarHBondContact O-N 2.76Å; A371-V374 PolarHBondContact O-N 3.36Å; A371-A375 WeakPolarHBondContact O-CB 3.27Å; A371-A375 PolarHBondContact O-N 3.42Å
372	K	89.4	Confident	84.7	Confident	7 Å²	7	37 Å²	37	3%	0.03	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-40.3	174.1	-78.9	-168.2	169.2	178.3	0	112.7	V66 L78 L83 T84 L85 F368 L369 G370 A375 D376	V66-K372 HydrophobicContact CB-CG 4.48Å; V66-K372 HydrophobicContact CG2-CG 4.09Å; L78-K372 VanDerWaalsContact O-CE 3.29Å; L78-K372 WeakPolarHBondContact O-CE 3.45Å; L78-K372 PolarHBondContact O-NZ 3.49Å; L83-K372 HydrophobicContact CD1-CB 3.46Å; L83-K372 VanDerWaalsContact CD1-CB 3.46Å; L83-K372 HydrophobicContact CD1-CD 3.86Å; L83-K372 HydrophobicContact CD1-CG 4.3Å; T84-K372 PolarHBondContact O-NZ 3.31Å; T84-K372 PolarHBondContact OG1-NZ 3.28Å; L85-K372 PolarHBondContact O-NZ 3.49Å; F368-K372 HydrophobicContact CD1-CD 4.47Å; F368-K372 HydrophobicContact CE1-CD 3.8Å; F368-K372 HydrophobicContact CE1-CG 4.25Å; F368-K372 HydrophobicContact CZ-CD 4.24Å; F368-K372 VanDerWaalsContact CZ-CE 3.44Å; F368-K372 HydrophobicContact CZ-CG 4.45Å; F368-K372 PolarHBondContact O-N 3.22Å; L369-K372 WeakPolarHBondContact O-CB 3.26Å; L369-K372 PolarHBondContact O-N 3.4Å; L369-K372 VanDerWaalsContact O-N 3.16Å; G370-K372 VanDerWaalsContact C-N 3.31Å; G370-K372 PolarHBondContact O-N 2.85Å; K372-A375 PolarHBondContact O-N 2.96Å; K372-D376 VanDerWaalsContact O-CB 3.28Å; K372-D376 WeakPolarHBondContact O-CB 3.31Å; K372-D376 PolarHBondContact O-N 3.36Å
373	I	86.5	Confident	84.9	Confident	26 Å²	26	36.2 Å²	36.2	13%	0.133	18%	0.179	C	C	.	.	H	α-helix	trans	-64.1	-44.7	176.3	-66.8	162.2	0	0	0	110.9	L2 L5 I200 L369 G370 A371 A375 D376 T377	L2-I373 HydrophobicContact CD2-CG2 3.8Å; L5-I373 HydrophobicContact CD1-CD1 4.3Å; L5-I373 HydrophobicContact CD2-CD1 4.49Å; I200-I373 HydrophobicContact CG2-CB 4.38Å; I200-I373 HydrophobicContact CG2-CG2 3.97Å; L369-I373 WeakPolarHBondContact O-CG1 3.45Å; L369-I373 PolarHBondContact O-N 3.15Å; G370-I373 PolarHBondContact O-N 2.98Å; G370-I373 VanDerWaalsContact O-N 3.15Å; A371-I373 PolarHBondContact O-N 2.76Å; I373-A375 VanDerWaalsContact C-N 3.32Å; I373-A375 PolarHBondContact O-N 3.25Å; I373-D376 PolarHBondContact O-N 2.84Å; I373-T377 WeakPolarHBondContact O-CB 3.24Å; I373-T377 VanDerWaalsContact O-CG2 3.22Å; I373-T377 WeakPolarHBondContact O-CG2 3.25Å; I373-T377 PolarHBondContact O-N 3.43Å; I373-T377 VanDerWaalsContact O-N 3.11Å; I373-T377 PolarHBondContact O-OG1 3Å
374	V	87.6	Confident	85.2	Confident	2 Å²	2	36 Å²	36	1%	0.012	18%	0.179	C	C	.	.	H	α-helix	trans	-63.7	-40.1	176.1	173.7	0	0	0	0	111.1	L161 L197 I200 G370 A371 T377 L379 T380 I383	L161-V374 HydrophobicContact CD1-CB 4.05Å; L161-V374 HydrophobicContact CD1-CG1 3.86Å; L197-V374 HydrophobicContact CD2-CB 4.23Å; L197-V374 HydrophobicContact CD2-CG2 3.76Å; I200-V374 HydrophobicContact CD1-CG2 3.47Å; I200-V374 VanDerWaalsContact CD1-CG2 3.47Å; I200-V374 HydrophobicContact CG2-CG2 4.19Å; G370-V374 WeakPolarHBondContact O-CG2 3.46Å; G370-V374 PolarHBondContact O-N 2.97Å; A371-V374 PolarHBondContact O-N 3.36Å; V374-T377 PolarHBondContact O-N 3.06Å; V374-T377 VanDerWaalsContact O-O 3.13Å; V374-T377 PolarHBondContact O-OG1 3.45Å; V374-L379 HydrophobicContact CG1-CB 4.18Å; V374-T380 PolarHBondContact O-N 3.49Å; V374-T380 PolarHBondContact O-OG1 3.28Å; V374-I383 HydrophobicContact CG1-CD1 4.27Å
375	A	88.4	Confident	85.7	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-66.7	-38.8	177.9	0	0	0	0	0	113.4	I64 V66 V79 L161 A371 K372 I373 T377 T380	I64-A375 WeakPolarHBondContact CD1-O 3.43Å; I64-A375 HydrophobicContact CG2-CB 3.89Å; V66-A375 HydrophobicContact CG2-CB 3.9Å; V79-A375 HydrophobicContact CG2-CB 3.4Å; L161-A375 HydrophobicContact CD1-CB 4.06Å; A371-A375 WeakPolarHBondContact O-CB 3.27Å; A371-A375 PolarHBondContact O-N 3.42Å; K372-A375 PolarHBondContact O-N 2.96Å; I373-A375 VanDerWaalsContact C-N 3.32Å; I373-A375 PolarHBondContact O-N 3.25Å; A375-T377 VanDerWaalsContact C-N 3.32Å; A375-T380 WeakPolarHBondContact CA-OG1 3.38Å; A375-T380 PolarHBondContact N-OG1 3.37Å
376	D	81.9	Confident	86.1	Confident	83 Å²	83	35.4 Å²	35.4	44%	0.444	18%	0.181	S	C	.	.	H	α-helix	trans	-75.1	-22.9	178.3	-169	42.6	0	0	0	112.9	V79 K372 I373	V79-D376 HydrophobicContact CG1-CB 3.88Å; K372-D376 VanDerWaalsContact O-CB 3.28Å; K372-D376 WeakPolarHBondContact O-CB 3.31Å; K372-D376 PolarHBondContact O-N 3.36Å; I373-D376 PolarHBondContact O-N 2.84Å
377	T	77.6	Confident	86.3	Confident	44 Å²	44	40.5 Å²	40.5	27%	0.27	20%	0.204	S	C	.	.	S	Bend	trans	-91.6	163.7	177.2	59.2	0	0	0	0	112.5	I373 V374 A375 L379	I373-T377 WeakPolarHBondContact O-CB 3.24Å; I373-T377 VanDerWaalsContact O-CG2 3.22Å; I373-T377 WeakPolarHBondContact O-CG2 3.25Å; I373-T377 PolarHBondContact O-N 3.43Å; I373-T377 VanDerWaalsContact O-N 3.11Å; I373-T377 PolarHBondContact O-OG1 3Å; V374-T377 PolarHBondContact O-N 3.06Å; V374-T377 VanDerWaalsContact O-O 3.13Å; V374-T377 PolarHBondContact O-OG1 3.45Å; A375-T377 VanDerWaalsContact C-N 3.32Å; T377-L379 PolarHBondContact O-N 3.29Å; T377-L379 WeakPolarHBondContact OG1-CB 3.4Å; T377-L379 WeakPolarHBondContact OG1-CG 3.17Å
378	N	75.2	Confident	86.4	Confident	139 Å²	139	45.4 Å²	45.4	74%	0.743	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-0.3	172.1	-71.3	-26.1	0	0	0	113.9	T380 Q381	N378-T380 VanDerWaalsContact C-N 3.33Å; N378-Q381 PolarHBondContact O-N 2.66Å
379	L	75.3	Confident	86.4	Confident	54 Å²	54	47.8 Å²	47.8	28%	0.283	25%	0.251	S	S	.	.	H	α-helix	trans	-65.7	-37.3	178.2	-62.9	-179.1	0	0	0	111.4	V374 T377 Q381 K382 I404	V374-L379 HydrophobicContact CG1-CB 4.18Å; T377-L379 PolarHBondContact O-N 3.29Å; T377-L379 WeakPolarHBondContact OG1-CB 3.4Å; T377-L379 WeakPolarHBondContact OG1-CG 3.17Å; L379-Q381 VanDerWaalsContact C-N 3.25Å; L379-Q381 PolarHBondContact O-N 3.17Å; L379-K382 WeakPolarHBondContact O-CB 3.29Å; L379-K382 PolarHBondContact O-N 2.9Å; L379-I404 HydrophobicContact CB-CD1 4.36Å; L379-I404 HydrophobicContact CD1-CD1 4.18Å; L379-I404 HydrophobicContact CD2-CD1 3.81Å; L379-I404 HydrophobicContact CG-CD1 4.34Å
380	T	76.8	Confident	86.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.7	-35.6	178.8	-66.9	0	0	0	0	112.5	A190 V374 A375 N378 K382 I383 L384	A190-T380 HydrophobicContact CB-CG2 4.21Å; V374-T380 PolarHBondContact O-N 3.49Å; V374-T380 PolarHBondContact O-OG1 3.28Å; A375-T380 WeakPolarHBondContact CA-OG1 3.38Å; A375-T380 PolarHBondContact N-OG1 3.37Å; N378-T380 VanDerWaalsContact C-N 3.33Å; T380-K382 PolarHBondContact O-N 3.28Å; T380-I383 WeakPolarHBondContact O-CG1 3.3Å; T380-I383 PolarHBondContact O-N 2.9Å; T380-L384 HydrophobicContact CG2-CD1 4.33Å; T380-L384 WeakPolarHBondContact O-CB 3.43Å; T380-L384 PolarHBondContact O-N 3.28Å
381	Q	80.8	Confident	86.4	Confident	101 Å²	101	53.6 Å²	53.6	47%	0.472	28%	0.282	S	S	.	.	H	α-helix	trans	-66	-25.6	179.2	-60	-51.4	-47.4	0	0	112.9	N378 L379 I383	N378-Q381 PolarHBondContact O-N 2.66Å; L379-Q381 VanDerWaalsContact C-N 3.25Å; L379-Q381 PolarHBondContact O-N 3.17Å; Q381-I383 VanDerWaalsContact C-N 3.3Å
382	K	82.6	Confident	86.1	Confident	165 Å²	165	58.4 Å²	58.4	72%	0.717	31%	0.308	S	S	*	.	H	α-helix	trans	-74.4	-22.4	178	-63.3	-176.4	176.9	-177.4	0	113.2	L379 T380	L379-K382 WeakPolarHBondContact O-CB 3.29Å; L379-K382 PolarHBondContact O-N 2.9Å; T380-K382 PolarHBondContact O-N 3.28Å
383	I	84.5	Confident	85.9	Confident	33 Å²	33	59.2 Å²	59.2	17%	0.169	31%	0.314	C	S	.	.	S	Bend	trans	-117.4	6.9	-174.4	63.4	172.5	0	0	0	112.5	A190 E192 V374 T380 Q381 I385 V403	A190-I383 HydrophobicContact CB-CD1 3.86Å; A190-I383 HydrophobicContact CB-CG1 3.83Å; E192-I383 HydrophobicContact CG-CD1 4.1Å; E192-I383 WeakPolarHBondContact OE1-CD1 3.32Å; V374-I383 HydrophobicContact CG1-CD1 4.27Å; T380-I383 WeakPolarHBondContact O-CG1 3.3Å; T380-I383 PolarHBondContact O-N 2.9Å; Q381-I383 VanDerWaalsContact C-N 3.3Å; I383-I385 PolarHBondContact O-N 3.05Å; I383-V403 HydrophobicContact CB-CG2 4.31Å; I383-V403 HydrophobicContact CD1-CG1 3.95Å; I383-V403 HydrophobicContact CD1-CG2 4.14Å; I383-V403 HydrophobicContact CG2-CB 4.33Å; I383-V403 HydrophobicContact CG2-CG1 3.61Å; I383-V403 HydrophobicContact CG2-CG2 3.97Å
384	L	90.6	Very high	85.7	Confident	21 Å²	21	59 Å²	59	11%	0.11	31%	0.313	C	S	.	.			trans	-75.5	120.7	-176.4	-167.5	75.9	0	0	0	110.1	Q159 G188 T380 T386 N389	Q159-L384 HydrophobicContact CB-CD1 4.29Å; Q159-L384 HydrophobicContact CG-CD1 4.21Å; Q159-L384 HydrophobicContact CG-CD2 4.37Å; G188-L384 VanDerWaalsContact C-CD1 3.49Å; T380-L384 HydrophobicContact CG2-CD1 4.33Å; T380-L384 WeakPolarHBondContact O-CB 3.43Å; T380-L384 PolarHBondContact O-N 3.28Å; L384-T386 HydrophobicContact CD2-CG2 4.3Å; L384-N389 PolarHBondContact O-ND2 3.2Å
385	I	93.4	Very high	85.2	Confident	27 Å²	27	63.4 Å²	63.4	14%	0.138	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-97.1	127.6	172.2	-52.5	175.1	0	0	0	108.1	L177 L181 G188 V189 I383 N389 M390	L177-I385 HydrophobicContact CD1-CB 4.25Å; L177-I385 HydrophobicContact CD1-CD1 4.25Å; L177-I385 HydrophobicContact CD1-CG2 4.31Å; L177-I385 HydrophobicContact CD2-CD1 3.83Å; L177-I385 HydrophobicContact CD2-CG2 4.21Å; L181-I385 HydrophobicContact CD1-CG2 3.96Å; G188-I385 CarbonylContact C-O 3.46Å; G188-I385 WeakPolarHBondContact CA-O 3.43Å; V189-I385 PolarHBondContact N-O 3.01Å; V189-I385 WeakPolarHBondContact O-CB 3.24Å; V189-I385 PolarHBondContact O-N 2.61Å; I383-I385 PolarHBondContact O-N 3.05Å; I385-N389 WeakPolarHBondContact CA-OD1 3.37Å; I385-N389 WeakPolarHBondContact CG2-OD1 3.26Å; I385-M390 HydrophobicContact CG2-CB 4.23Å; I385-M390 HydrophobicContact CG2-CG 4.33Å
386	T	94.7	Very high	84.1	Confident	31 Å²	31	71.1 Å²	71.1	19%	0.19	38%	0.38	C	S	.	.			trans	-111.2	168.1	174.2	67.1	0	0	0	0	109.2	L384 S388 N389 M390	L384-T386 HydrophobicContact CD2-CG2 4.3Å; T386-S388 PolarHBondContact O-N 3.2Å; T386-S388 PolarHBondContact OG1-N 3.02Å; T386-S388 PolarHBondContact OG1-OG 3.01Å; T386-N389 PolarHBondContact N-OD1 3.32Å; T386-N389 PolarHBondContact O-N 3.23Å; T386-N389 PolarHBondContact O-OD1 3.13Å; T386-N389 VanDerWaalsContact O-OD1 3.05Å; T386-N389 PolarHBondContact OG1-OD1 3.03Å; T386-M390 WeakPolarHBondContact O-CB 3.34Å; T386-M390 PolarHBondContact O-N 3.4Å; T386-M390 VanDerWaalsContact O-N 3.12Å
387	Q	93.4	Very high	82.8	Confident	108 Å²	108	68.1 Å²	68.1	51%	0.505	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-56.5	-33.2	173.8	-71.7	-173.4	28.5	0	0	112.5	L181	L181-Q387 HydrophobicContact CB-CG 4.01Å; L181-Q387 PolarHBondContact O-NE2 3.16Å
388	S	93.3	Very high	81.1	Confident	111 Å²	111	75 Å²	75	78%	0.776	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-75.7	-26.2	-175.7	62	0	0	0	0	114.3	T386	T386-S388 PolarHBondContact O-N 3.2Å; T386-S388 PolarHBondContact OG1-N 3.02Å; T386-S388 PolarHBondContact OG1-OG 3.01Å
389	N	92.5	Very high	79.4	Confident	51 Å²	51	70.2 Å²	70.2	27%	0.273	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-110.3	8.8	179.3	72.7	8.2	0	0	0	112.6	L384 I385 T386 D391 D392 S393	L384-N389 PolarHBondContact O-ND2 3.2Å; I385-N389 WeakPolarHBondContact CA-OD1 3.37Å; I385-N389 WeakPolarHBondContact CG2-OD1 3.26Å; T386-N389 PolarHBondContact N-OD1 3.32Å; T386-N389 PolarHBondContact O-N 3.23Å; T386-N389 PolarHBondContact O-OD1 3.13Å; T386-N389 VanDerWaalsContact O-OD1 3.05Å; T386-N389 PolarHBondContact OG1-OD1 3.03Å; N389-D391 PolarHBondContact O-N 3.13Å; N389-D392 PolarHBondContact O-N 3.46Å; N389-S393 VanDerWaalsContact O-CB 3.31Å; N389-S393 WeakPolarHBondContact O-CB 3.45Å; N389-S393 PolarHBondContact O-N 3.38Å; N389-S393 PolarHBondContact O-OG 3.13Å; N389-S393 PolarHBondContact OD1-OG 3.37Å
390	M	89.3	Confident	77.5	Confident	10 Å²	10	69.8 Å²	69.8	5%	0.049	38%	0.375	C	S	.	.	H	α-helix	trans	-62.3	-45.9	-170.9	-173.5	-179.4	62.4	0	0	112	L177 R178 L181 I385 T386 S393 I394	L177-M390 HydrophobicContact CD2-CG 4.27Å; R178-M390 HydrophobicContact CG-CE 4.36Å; R178-M390 HydrophobicContact CG-SD 4.06Å; L181-M390 HydrophobicContact CD1-CB 4.42Å; L181-M390 HydrophobicContact CD1-CG 4.15Å; L181-M390 HydrophobicContact CD1-SD 3.93Å; I385-M390 HydrophobicContact CG2-CB 4.23Å; I385-M390 HydrophobicContact CG2-CG 4.33Å; T386-M390 WeakPolarHBondContact O-CB 3.34Å; T386-M390 PolarHBondContact O-N 3.4Å; T386-M390 VanDerWaalsContact O-N 3.12Å; M390-S393 PolarHBondContact O-N 3.2Å; M390-I394 HydrophobicContact CG-CD1 3.74Å; M390-I394 HydrophobicContact CG-CG1 4.4Å; M390-I394 WeakPolarHBondContact O-CB 3.35Å; M390-I394 WeakPolarHBondContact O-CG1 3.27Å; M390-I394 PolarHBondContact O-N 3.46Å; M390-I394 HydrophobicContact SD-CD1 4.48Å
391	D	88.2	Confident	75.9	Confident	111 Å²	111	71.1 Å²	71.1	59%	0.594	38%	0.382	S	S	*	.	H	α-helix	trans	-67.8	-40.7	-177.5	-67.3	-27.9	0	0	0	111.9	N389 S395	N389-D391 PolarHBondContact O-N 3.13Å; D391-S395 WeakPolarHBondContact O-CB 3.34Å; D391-S395 PolarHBondContact O-N 3.47Å; D391-S395 PolarHBondContact O-OG 3.06Å
392	D	86.7	Confident	73.3	Confident	101 Å²	101	70 Å²	70	54%	0.54	39%	0.386	S	S	.	.	H	α-helix	trans	-63.1	-46.4	172.6	-67.4	-24.4	0	0	0	111.3	N389 I394 S395 Q396	N389-D392 PolarHBondContact O-N 3.46Å; D392-I394 PolarHBondContact O-N 3.21Å; D392-S395 PolarHBondContact O-N 2.63Å; D392-S395 VanDerWaalsContact O-N 3.11Å; D392-Q396 WeakPolarHBondContact O-CB 3.39Å; D392-Q396 WeakPolarHBondContact O-CG 3.26Å; D392-Q396 PolarHBondContact O-N 3.04Å
393	S	84.2	Confident	70.7	Confident	25 Å²	25	63.1 Å²	63.1	18%	0.175	36%	0.357	C	S	.	.	H	α-helix	trans	-62	-44.4	179.3	-55.5	0	0	0	0	110.9	N389 M390 S395 S397	N389-S393 VanDerWaalsContact O-CB 3.31Å; N389-S393 WeakPolarHBondContact O-CB 3.45Å; N389-S393 PolarHBondContact O-N 3.38Å; N389-S393 PolarHBondContact O-OG 3.13Å; N389-S393 PolarHBondContact OD1-OG 3.37Å; M390-S393 PolarHBondContact O-N 3.2Å; S393-S395 VanDerWaalsContact C-N 3.28Å; S393-S395 PolarHBondContact O-N 3.25Å; S393-S397 WeakPolarHBondContact O-CB 3.41Å; S393-S397 PolarHBondContact O-N 3.32Å; S393-S397 PolarHBondContact O-OG 3.47Å
394	I	83.6	Confident	68.1	Low	20 Å²	20	67.2 Å²	67.2	10%	0.103	38%	0.378	C	S	.	.	H	α-helix	trans	-61.4	-41	176	-70.7	167.1	0	0	0	109.5	R170 I174 L177 M390 D392	R170-I394 PolarHBondContact NH2-O 2.78Å; I174-I394 HydrophobicContact CD1-CG2 3.84Å; I174-I394 HydrophobicContact CG1-CG1 4.36Å; I174-I394 HydrophobicContact CG1-CG2 4.33Å; I174-I394 HydrophobicContact CG2-CD1 3.89Å; L177-I394 HydrophobicContact CD2-CG1 4.33Å; M390-I394 HydrophobicContact CG-CD1 3.74Å; M390-I394 HydrophobicContact CG-CG1 4.4Å; M390-I394 WeakPolarHBondContact O-CB 3.35Å; M390-I394 WeakPolarHBondContact O-CG1 3.27Å; M390-I394 PolarHBondContact O-N 3.46Å; M390-I394 HydrophobicContact SD-CD1 4.48Å; D392-I394 PolarHBondContact O-N 3.21Å
395	S	75.4	Confident	67	Low	96 Å²	96	69.5 Å²	69.5	67%	0.671	39%	0.391	S	S	*	.	H	α-helix	trans	-71.7	-43.5	-177.6	-58.8	0	0	0	0	113.2	D391 D392 S393	D391-S395 WeakPolarHBondContact O-CB 3.34Å; D391-S395 PolarHBondContact O-N 3.47Å; D391-S395 PolarHBondContact O-OG 3.06Å; D392-S395 PolarHBondContact O-N 2.63Å; D392-S395 VanDerWaalsContact O-N 3.11Å; S393-S395 VanDerWaalsContact C-N 3.28Å; S393-S395 PolarHBondContact O-N 3.25Å
396	Q	66.5	Low	65.6	Low	162 Å²	162	71.7 Å²	71.7	76%	0.757	41%	0.405	S	S	*	.	H	α-helix	trans	-79.2	-34.5	-176.7	-70.1	-179	0.8	0	0	113	D392 F398	D392-Q396 WeakPolarHBondContact O-CB 3.39Å; D392-Q396 WeakPolarHBondContact O-CG 3.26Å; D392-Q396 PolarHBondContact O-N 3.04Å; Q396-F398 PolarHBondContact O-N 2.68Å; Q396-F398 VanDerWaalsContact O-N 3.12Å
397	S	54.2	Low	64	Low	21 Å²	21	74 Å²	74	15%	0.147	42%	0.417	C	S	.	.			trans	-69.6	114.8	175.6	59.1	0	0	0	0	108.4	R170 S393 L399	R170-S397 PolarHBondContact NH1-O 3.15Å; R170-S397 PolarHBondContact NH2-O 3.41Å; S393-S397 WeakPolarHBondContact O-CB 3.41Å; S393-S397 PolarHBondContact O-N 3.32Å; S393-S397 PolarHBondContact O-OG 3.47Å; S397-L399 PolarHBondContact O-N 3.14Å; S397-L399 WeakPolarHBondContact OG-CG 3.13Å
398	F	42.4	Very low	62.3	Low	188 Å²	188	72 Å²	72	83%	0.825	41%	0.411	S	S	*	.			trans	-57	92.1	139.9	-90.4	-94.4	0	0	0	105	Q396 G400	Q396-F398 PolarHBondContact O-N 2.68Å; Q396-F398 VanDerWaalsContact O-N 3.12Å; F398-G400 PolarHBondContact O-N 3.34Å
399	L	39.4	Very low	60.3	Low	38 Å²	38	69.6 Å²	69.6	20%	0.199	39%	0.389	C	S	.	.	S	Bend	trans	-64.6	57.5	172.8	-101.9	151.9	0	0	0	111	R170 V173 I174 S397	R170-L399 HydrophobicContact CB-CB 4.24Å; R170-L399 HydrophobicContact CG-CB 3.63Å; R170-L399 HydrophobicContact CG-CD1 4.11Å; R170-L399 HydrophobicContact CG-CG 4.46Å; V173-L399 HydrophobicContact CB-CD2 4Å; V173-L399 HydrophobicContact CG1-CD2 3.45Å; V173-L399 VanDerWaalsContact CG1-CD2 3.45Å; I174-L399 HydrophobicContact CD1-CD1 3.96Å; I174-L399 HydrophobicContact CG1-CD1 3.64Å; S397-L399 PolarHBondContact O-N 3.14Å; S397-L399 WeakPolarHBondContact OG-CG 3.13Å
400	G	35.6	Very low	58.2	Low	45 Å²	45	70.8 Å²	70.8	46%	0.464	40%	0.396	S	S	.	.	S	Bend	trans	-113.5	57.6	152.4	0	0	0	0	0	107.3	R193 F398	R193-G400 PolarHBondContact NH1-O 2.65Å; R193-G400 PolarHBondContact NH2-O 3.21Å; R193-G400 VanDerWaalsContact NH2-O 3.17Å; F398-G400 PolarHBondContact O-N 3.34Å
401	I	42	Very low	56	Low	28 Å²	28	75.1 Å²	75.1	14%	0.144	42%	0.421	C	S	.	.			trans	38.7	83.9	-179.6	-49.3	98.3	0	0	0	112.6	R193 V403	R193-I401 HydrophobicContact CB-CB 4.45Å; R193-I401 HydrophobicContact CB-CG2 3.86Å; R193-I401 HydrophobicContact CG-CB 3.7Å; R193-I401 HydrophobicContact CG-CD1 3.47Å; R193-I401 VanDerWaalsContact CG-CD1 3.47Å; R193-I401 HydrophobicContact CG-CG1 3.56Å; R193-I401 HydrophobicContact CG-CG2 3.66Å; R193-I401 VanDerWaalsContact CZ-O 3.29Å; R193-I401 PolarHBondContact NH2-O 2.7Å; I401-V403 PolarHBondContact O-N 2.79Å
402	S	27.9	Very low	53.5	Low	79 Å²	79	72.4 Å²	72.4	55%	0.552	41%	0.408	S	S	*	.			trans	-86.6	93.7	167.2	50.8	0	0	0	0	108.4
403	V	27.7	Very low	50.7	Low	19 Å²	19	70 Å²	70	12%	0.115	40%	0.397	C	S	.	.			trans	-145.5	120.6	160.2	-172	0	0	0	0	109.6	E192 N196 I383 I401	E192-V403 HydrophobicContact CG-CG2 4.3Å; E192-V403 WeakPolarHBondContact OE1-CB 3.45Å; E192-V403 WeakPolarHBondContact OE1-CG1 3.47Å; E192-V403 VanDerWaalsContact OE1-CG2 3.23Å; E192-V403 WeakPolarHBondContact OE1-CG2 2.84Å; E192-V403 VanDerWaalsContact OE2-CB 3.31Å; E192-V403 WeakPolarHBondContact OE2-CB 3.41Å; E192-V403 WeakPolarHBondContact OE2-CG2 3.39Å; N196-V403 PolarHBondContact ND2-O 3.48Å; I383-V403 HydrophobicContact CB-CG2 4.31Å; I383-V403 HydrophobicContact CD1-CG1 3.95Å; I383-V403 HydrophobicContact CD1-CG2 4.14Å; I383-V403 HydrophobicContact CG2-CB 4.33Å; I383-V403 HydrophobicContact CG2-CG1 3.61Å; I383-V403 HydrophobicContact CG2-CG2 3.97Å; I401-V403 PolarHBondContact O-N 2.79Å
404	I	29.6	Very low	47.7	Very low	119 Å²	119	74.1 Å²	74.1	61%	0.61	42%	0.417	S	S	*	.			trans	36.2	0	169.1	-54.4	167.7	0	0	0	117	G224 L379	G224-I404 WeakPolarHBondContact CA-OXT 3.39Å; L379-I404 HydrophobicContact CB-CD1 4.36Å; L379-I404 HydrophobicContact CD1-CD1 4.18Å; L379-I404 HydrophobicContact CD2-CD1 3.81Å; L379-I404 HydrophobicContact CG-CD1 4.34Å

Retrieved 404 of 404 residues in 722.7 ms (Link to these results)

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