A0A087XGF8_POEFO Loading...

Ectodysplasin A receptor

AlphaFold DB , UniProt , Accession A0A087XGF8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 522 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	46.8	Very low	53.9	Low	251 Å²	251	139 Å²	139	100%	1.236	69%	0.693	S	S	*	*				0	50.9	0	-69.5	157.9	76.6	0	0	112.8
2	S	49.4	Very low	54.6	Low	110 Å²	110	139.8 Å²	139.8	77%	0.769	69%	0.69	S	S	*	*			trans	-125.1	-10	-178.4	-154.9	0	0	0	0	115
3	Q	46.7	Very low	55.6	Low	183 Å²	183	137.5 Å²	137.5	86%	0.855	68%	0.681	S	S	*	*	S	Bend	trans	-88.4	-28.6	-173	-146.3	166.2	13.1	0	0	113.7	R5	Q3-R5 VanDerWaalsContact C-N 3.29Å; Q3-R5 PolarHBondContact O-N 3.49Å
4	S	51.1	Low	56.3	Low	72 Å²	72	132.8 Å²	132.8	50%	0.503	67%	0.668	S	S	.	*	H	α-helix	trans	-70.2	-20.8	179.9	175.8	0	0	0	0	114
5	R	50.2	Low	56.8	Low	200 Å²	200	131.7 Å²	131.7	76%	0.755	66%	0.664	S	S	*	*	H	α-helix	trans	-83.8	-23.6	-174.5	-144.7	173.3	-170	171.4	2.1	113.1	Q3 K9	Q3-R5 VanDerWaalsContact C-N 3.29Å; Q3-R5 PolarHBondContact O-N 3.49Å; R5-K9 WeakPolarHBondContact O-CG 3.42Å
6	G	52.4	Low	57.4	Low	36 Å²	36	128.9 Å²	128.9	37%	0.371	65%	0.65	S	S	.	*	H	α-helix	trans	-79.5	-40.3	176.6	0	0	0	0	0	113	K8 K9 F10	G6-K8 PolarHBondContact O-N 3.08Å; G6-K9 PolarHBondContact O-N 2.91Å; G6-F10 PolarHBondContact O-N 3.22Å
7	Q	55.3	Low	57.6	Low	147 Å²	147	127.5 Å²	127.5	69%	0.687	65%	0.645	S	S	*	*	H	α-helix	trans	-63.3	-41.5	-180	-129.2	173.9	-2.1	0	0	112.2	K9 F10 V11	Q7-K9 VanDerWaalsContact C-N 3.32Å; Q7-K9 PolarHBondContact O-N 2.91Å; Q7-F10 PolarHBondContact O-N 3.22Å; Q7-V11 VanDerWaalsContact O-CG2 3.31Å; Q7-V11 WeakPolarHBondContact O-CG2 3.43Å; Q7-V11 PolarHBondContact O-N 3.29Å
8	K	55.5	Low	57.8	Low	141 Å²	141	124.2 Å²	124.2	61%	0.613	63%	0.632	S	S	*	*	H	α-helix	trans	-65.3	-34.5	176.3	-66.7	-179	-177.9	-176.2	0	112.7	G6 F12	G6-K8 PolarHBondContact O-N 3.08Å; K8-F12 WeakPolarHBondContact O-CB 3.14Å; K8-F12 PolarHBondContact O-N 3.26Å
9	K	58.8	Low	57.8	Low	141 Å²	141	120.8 Å²	120.8	61%	0.613	62%	0.62	S	S	*	*	H	α-helix	trans	-72	-40.8	177.9	-73.1	179.7	178.3	-170.4	0	112	R5 G6 Q7 F12 L13	R5-K9 WeakPolarHBondContact O-CG 3.42Å; G6-K9 PolarHBondContact O-N 2.91Å; Q7-K9 VanDerWaalsContact C-N 3.32Å; Q7-K9 PolarHBondContact O-N 2.91Å; K9-F12 PolarHBondContact O-N 3.04Å; K9-L13 WeakPolarHBondContact O-CB 3.28Å; K9-L13 PolarHBondContact O-N 3.32Å
10	F	60	Low	57.6	Low	166 Å²	166	123.8 Å²	123.8	73%	0.728	62%	0.624	S	S	*	*	H	α-helix	trans	-66.2	-40.3	175.8	-95.9	-87.7	0	0	0	112.5	G6 Q7 L13 S14	G6-F10 PolarHBondContact O-N 3.22Å; Q7-F10 PolarHBondContact O-N 3.22Å; F10-L13 PolarHBondContact O-N 3.15Å; F10-S14 VanDerWaalsContact O-CB 3.24Å; F10-S14 WeakPolarHBondContact O-CB 3.19Å; F10-S14 PolarHBondContact O-N 2.78Å
11	V	66.3	Low	57.4	Low	82 Å²	82	124 Å²	124	50%	0.497	63%	0.626	S	S	.	*	H	α-helix	trans	-65.7	-41.3	174.6	173.7	0	0	0	0	111.2	Q7 S14 L15	Q7-V11 VanDerWaalsContact O-CG2 3.31Å; Q7-V11 WeakPolarHBondContact O-CG2 3.43Å; Q7-V11 PolarHBondContact O-N 3.29Å; V11-S14 PolarHBondContact O-N 3.04Å; V11-L15 HydrophobicContact CG1-CD1 3.88Å; V11-L15 WeakPolarHBondContact O-CB 3.39Å; V11-L15 WeakPolarHBondContact O-CD1 3.47Å; V11-L15 PolarHBondContact O-N 3.47Å
12	F	63.3	Low	57.4	Low	149 Å²	149	120 Å²	120	65%	0.654	60%	0.602	S	S	*	*	H	α-helix	trans	-64.7	-42.6	174.7	-106.6	-91.5	0	0	0	112.7	K8 K9 S14 L15 I16	K8-F12 WeakPolarHBondContact O-CB 3.14Å; K8-F12 PolarHBondContact O-N 3.26Å; K9-F12 PolarHBondContact O-N 3.04Å; F12-S14 VanDerWaalsContact C-N 3.31Å; F12-S14 PolarHBondContact O-N 2.87Å; F12-L15 PolarHBondContact O-N 2.95Å; F12-I16 WeakPolarHBondContact O-CB 3.2Å; F12-I16 WeakPolarHBondContact O-CD1 3.46Å; F12-I16 WeakPolarHBondContact O-CG1 3.12Å; F12-I16 PolarHBondContact O-N 2.87Å
13	L	66.4	Low	57.3	Low	110 Å²	110	120 Å²	120	58%	0.576	60%	0.597	S	S	*	*	H	α-helix	trans	-65.1	-38.5	177.3	-134.5	87.8	0	0	0	111.2	K9 F10 I16 L17	K9-L13 WeakPolarHBondContact O-CB 3.28Å; K9-L13 PolarHBondContact O-N 3.32Å; F10-L13 PolarHBondContact O-N 3.15Å; L13-I16 PolarHBondContact O-N 3.37Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 PolarHBondContact O-N 2.86Å
14	S	66.4	Low	57.3	Low	71 Å²	71	115.1 Å²	115.1	50%	0.497	58%	0.583	S	S	.	*	H	α-helix	trans	-69.9	-38.8	177.1	-163.3	0	0	0	0	111.7	F10 V11 F12 I16 L17 V18	F10-S14 VanDerWaalsContact O-CB 3.24Å; F10-S14 WeakPolarHBondContact O-CB 3.19Å; F10-S14 PolarHBondContact O-N 2.78Å; V11-S14 PolarHBondContact O-N 3.04Å; F12-S14 VanDerWaalsContact C-N 3.31Å; F12-S14 PolarHBondContact O-N 2.87Å; S14-I16 VanDerWaalsContact C-N 3.33Å; S14-I16 PolarHBondContact O-N 3.13Å; S14-L17 PolarHBondContact O-N 2.83Å; S14-V18 WeakPolarHBondContact O-CB 3.5Å; S14-V18 WeakPolarHBondContact O-CG2 3.49Å; S14-V18 PolarHBondContact O-N 2.98Å
15	L	63.7	Low	57	Low	116 Å²	116	115.7 Å²	115.7	61%	0.607	59%	0.592	S	S	*	*	H	α-helix	trans	-65.5	-33.4	170	-107.6	99.6	0	0	0	112.9	V11 F12 S19	V11-L15 HydrophobicContact CG1-CD1 3.88Å; V11-L15 WeakPolarHBondContact O-CB 3.39Å; V11-L15 WeakPolarHBondContact O-CD1 3.47Å; V11-L15 PolarHBondContact O-N 3.47Å; F12-L15 PolarHBondContact O-N 2.95Å; L15-S19 VanDerWaalsContact O-CB 3.23Å; L15-S19 WeakPolarHBondContact O-CB 2.92Å; L15-S19 PolarHBondContact O-N 2.8Å; L15-S19 PolarHBondContact O-OG 2.04Å
16	I	65.8	Low	56.9	Low	87 Å²	87	114.5 Å²	114.5	45%	0.446	60%	0.595	S	S	.	*	H	α-helix	trans	-71.9	-39.2	175.1	-68.9	167	0	0	0	110.3	F12 L13 S14 S19 R20	F12-I16 WeakPolarHBondContact O-CB 3.2Å; F12-I16 WeakPolarHBondContact O-CD1 3.46Å; F12-I16 WeakPolarHBondContact O-CG1 3.12Å; F12-I16 PolarHBondContact O-N 2.87Å; L13-I16 PolarHBondContact O-N 3.37Å; S14-I16 VanDerWaalsContact C-N 3.33Å; S14-I16 PolarHBondContact O-N 3.13Å; I16-S19 VanDerWaalsContact CA-OG 3.26Å; I16-S19 WeakPolarHBondContact CA-OG 3.42Å; I16-S19 PolarHBondContact O-N 3.36Å; I16-S19 PolarHBondContact O-OG 2.85Å; I16-S19 VanDerWaalsContact O-OG 3.05Å; I16-R20 HydrophobicContact CG2-CG 4.43Å; I16-R20 WeakPolarHBondContact O-CB 3.31Å; I16-R20 WeakPolarHBondContact O-CG 3.41Å; I16-R20 PolarHBondContact O-N 3.18Å
17	L	61.5	Low	56.9	Low	105 Å²	105	122.9 Å²	122.9	55%	0.55	62%	0.617	S	S	.	*	H	α-helix	trans	-68	-41.1	174.5	-104	129.5	0	0	0	112.4	L13 S14 R20 L21	L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 PolarHBondContact O-N 2.86Å; S14-L17 PolarHBondContact O-N 2.83Å; L17-R20 PolarHBondContact O-N 3.32Å; L17-L21 WeakPolarHBondContact O-CG 3.07Å; L17-L21 PolarHBondContact O-N 3.39Å
18	V	61.1	Low	57.2	Low	69 Å²	69	118.9 Å²	118.9	42%	0.418	61%	0.605	S	S	.	*	H	α-helix	trans	-66.6	-41.6	174.4	173.9	0	0	0	0	110.2	S14 R20 L21 F22	S14-V18 WeakPolarHBondContact O-CB 3.5Å; S14-V18 WeakPolarHBondContact O-CG2 3.49Å; S14-V18 PolarHBondContact O-N 2.98Å; V18-R20 VanDerWaalsContact C-N 3.32Å; V18-R20 PolarHBondContact O-N 2.02Å; V18-L21 PolarHBondContact O-N 3.32Å; V18-F22 HydrophobicContact CG1-CD2 3.64Å; V18-F22 HydrophobicContact CG1-CE2 3.68Å; V18-F22 VanDerWaalsContact O-CD2 3.25Å; V18-F22 WeakPolarHBondContact O-CD2 3.04Å; V18-F22 PolarHBondContact O-N 2.8Å
19	S	57.5	Low	58.3	Low	59 Å²	59	116.3 Å²	116.3	41%	0.413	61%	0.605	S	S	.	*	H	α-helix	trans	-68	-28.2	174.3	57.5	0	0	0	0	113.2	L15 I16 V23	L15-S19 VanDerWaalsContact O-CB 3.23Å; L15-S19 WeakPolarHBondContact O-CB 2.92Å; L15-S19 PolarHBondContact O-N 2.8Å; L15-S19 PolarHBondContact O-OG 2.04Å; I16-S19 VanDerWaalsContact CA-OG 3.26Å; I16-S19 WeakPolarHBondContact CA-OG 3.42Å; I16-S19 PolarHBondContact O-N 3.36Å; I16-S19 PolarHBondContact O-OG 2.85Å; I16-S19 VanDerWaalsContact O-OG 3.05Å; S19-V23 VanDerWaalsContact O-CB 3.29Å; S19-V23 WeakPolarHBondContact O-CB 3.13Å; S19-V23 WeakPolarHBondContact O-CG2 3.01Å; S19-V23 PolarHBondContact O-N 2.94Å; S19-V23 VanDerWaalsContact O-N 3.13Å
20	R	53.8	Low	59.7	Low	181 Å²	181	109.8 Å²	109.8	68%	0.683	58%	0.577	S	S	*	*	H	α-helix	trans	-72.2	-31.7	170.4	-70	-72.4	-174.9	-175.2	2.2	113.1	I16 L17 V18 S24	I16-R20 HydrophobicContact CG2-CG 4.43Å; I16-R20 WeakPolarHBondContact O-CB 3.31Å; I16-R20 WeakPolarHBondContact O-CG 3.41Å; I16-R20 PolarHBondContact O-N 3.18Å; L17-R20 PolarHBondContact O-N 3.32Å; V18-R20 VanDerWaalsContact C-N 3.32Å; V18-R20 PolarHBondContact O-N 2.02Å; R20-S24 PolarHBondContact O-OG 2.05Å; R20-S24 VanDerWaalsContact O-OG 3.12Å
21	L	53.8	Low	61	Low	127 Å²	127	103.4 Å²	103.4	67%	0.665	56%	0.558	S	S	*	*	H	α-helix	trans	-75	-29.7	172.8	-71.5	167.7	0	0	0	112.7	L17 V18	L17-L21 WeakPolarHBondContact O-CG 3.07Å; L17-L21 PolarHBondContact O-N 3.39Å; V18-L21 PolarHBondContact O-N 3.32Å
22	F	47.1	Very low	62.1	Low	169 Å²	169	104 Å²	104	74%	0.741	56%	0.555	S	S	*	*	H	α-helix	trans	-83.7	-10.3	173.8	-83.3	-77.3	0	0	0	114.2	V18	V18-F22 HydrophobicContact CG1-CD2 3.64Å; V18-F22 HydrophobicContact CG1-CE2 3.68Å; V18-F22 VanDerWaalsContact O-CD2 3.25Å; V18-F22 WeakPolarHBondContact O-CD2 3.04Å; V18-F22 PolarHBondContact O-N 2.8Å
23	V	46.1	Very low	63.4	Low	109 Å²	109	101.8 Å²	101.8	66%	0.661	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	3.9	178.7	168.4	0	0	0	0	112.7	S19	S19-V23 VanDerWaalsContact O-CB 3.29Å; S19-V23 WeakPolarHBondContact O-CB 3.13Å; S19-V23 WeakPolarHBondContact O-CG2 3.01Å; S19-V23 PolarHBondContact O-N 2.94Å; S19-V23 VanDerWaalsContact O-N 3.13Å
24	S	46.7	Very low	64.7	Low	80 Å²	80	100.2 Å²	100.2	56%	0.559	53%	0.533	S	S	*	.			trans	-112.3	24.4	176.1	31.5	0	0	0	0	113.8	R20 E26	R20-S24 PolarHBondContact O-OG 2.05Å; R20-S24 VanDerWaalsContact O-OG 3.12Å; S24-E26 PolarHBondContact O-N 2.74Å; S24-E26 VanDerWaalsContact O-N 3.17Å
25	A	45.4	Very low	65.9	Low	84 Å²	84	98.1 Å²	98.1	69%	0.694	52%	0.515	S	S	*	.			trans	-79.4	80.7	145.5	0	0	0	0	0	106	Y27	A25-Y27 VanDerWaalsContact C-N 3.29Å; A25-Y27 PolarHBondContact O-N 2.81Å
26	E	48.9	Very low	67.2	Low	176 Å²	176	95.7 Å²	95.7	82%	0.822	50%	0.5	S	S	*	.			trans	-49	107.7	158	-75.1	168.9	154.4	0	0	105.2	S24 S28	S24-E26 PolarHBondContact O-N 2.74Å; S24-E26 VanDerWaalsContact O-N 3.17Å; E26-S28 PolarHBondContact O-N 3.27Å
27	Y	52.3	Low	68.3	Low	212 Å²	212	93.2 Å²	93.2	83%	0.831	49%	0.487	S	S	*	.			trans	-68.3	83.2	175.3	-173.5	-96.2	0	0	0	105.3	A25 S29	A25-Y27 VanDerWaalsContact C-N 3.29Å; A25-Y27 PolarHBondContact O-N 2.81Å; Y27-S29 PolarHBondContact O-N 3.44Å
28	S	60.5	Low	69.5	Low	63 Å²	63	96.2 Å²	96.2	44%	0.441	50%	0.498	S	S	.	.			trans	-67.3	80.9	172.1	52.6	0	0	0	0	106.1	E26 C30	E26-S28 PolarHBondContact O-N 3.27Å; S28-C30 PolarHBondContact O-N 2.97Å
29	S	78.9	Confident	70.8	Confident	87 Å²	87	99.5 Å²	99.5	61%	0.608	52%	0.519	S	S	*	.			trans	-62.9	102.4	171.2	-176.6	0	0	0	0	106.3	Y27	Y27-S29 PolarHBondContact O-N 3.44Å
30	C	88.4	Confident	72.2	Confident	3 Å²	3	99.1 Å²	99.1	2%	0.02	52%	0.516	C	S	.	.			trans	-62.4	154.5	176.3	-56.4	0	0	0	0	110.3	S28 E34 C43	S28-C30 PolarHBondContact O-N 2.97Å; C30-E34 HydrophobicContact CB-CB 3.79Å; C30-C43 WeakPolarHBondContact CA-SG 3.29Å; C30-C43 HydrophobicContact CB-CB 3.71Å; C30-C43 WeakPolarHBondContact CB-SG 3.04Å; C30-C43 VanDerWaalsContact SG-CA 3.58Å; C30-C43 WeakPolarHBondContact SG-CB 3.07Å; C30-C43 CovalentContact SG-SG 2.04Å; C30-C43 PolarHBondContact SG-SG 3.37Å
31	G	87.8	Confident	73.8	Confident	32 Å²	32	96.5 Å²	96.5	33%	0.33	52%	0.516	S	S	.	.			trans	-64.8	174.5	179.6	0	0	0	0	0	114.1	Y33 E34 Y61	G31-Y33 PolarHBondContact O-N 3.05Å; G31-E34 PolarHBondContact N-OE2 2.9Å; G31-E34 PolarHBondContact O-N 2.91Å; G31-E34 VanDerWaalsContact O-N 3.11Å; G31-Y61 PolarHBondContact O-N 3.35Å
32	E	89.3	Confident	75.5	Confident	95 Å²	95	92.8 Å²	92.8	44%	0.444	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-31	179.4	177	176.8	161.1	0	0	113.3	G60 Y61	E32-G60 WeakPolarHBondContact O-CA 3.42Å; E32-Y61 HydrophobicContact CB-CE1 4.04Å; E32-Y61 HydrophobicContact CB-CE2 4.3Å; E32-Y61 HydrophobicContact CG-CE1 4.42Å; E32-Y61 HydrophobicContact CG-CE2 3.91Å; E32-Y61 WeakPolarHBondContact CG-OH 3.31Å
33	Y	90.8	Very high	77.7	Confident	103 Å²	103	86.8 Å²	86.8	40%	0.404	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	29.2	179.7	-53.2	-54.9	0	0	0	112.4	G31 C46 Y83	G31-Y33 PolarHBondContact O-N 3.05Å; Y33-C46 VanDerWaalsContact C-SG 3.54Å; Y33-C46 WeakPolarHBondContact O-CB 3.48Å; Y33-C46 PolarHBondContact O-N 3.12Å; Y33-C46 PolarHBondContact O-SG 2.72Å; Y33-Y83 AromaticContact CD1-CD1 3.93Å; Y33-Y83 HydrophobicContact CD1-CD1 3.93Å; Y33-Y83 AromaticContact CD1-CD2 3.24Å; Y33-Y83 HydrophobicContact CD1-CD2 3.24Å; Y33-Y83 HydrophobicContact CD1-CE1 4.16Å; Y33-Y83 AromaticContact CD1-CE2 3.5Å; Y33-Y83 HydrophobicContact CD1-CE2 3.5Å; Y33-Y83 AromaticContact CD1-CG 3.46Å; Y33-Y83 HydrophobicContact CD1-CG 3.46Å; Y33-Y83 VanDerWaalsContact CD1-CG 3.46Å; Y33-Y83 AromaticContact CD1-CZ 3.95Å; Y33-Y83 AromaticContact CD2-CD2 3.93Å; Y33-Y83 HydrophobicContact CD2-CD2 3.93Å; Y33-Y83 AromaticContact CD2-CE2 3.74Å; Y33-Y83 HydrophobicContact CD2-CE2 3.74Å; Y33-Y83 HydrophobicContact CE1-CD1 4.47Å; Y33-Y83 AromaticContact CE1-CD2 3.44Å; Y33-Y83 HydrophobicContact CE1-CD2 3.44Å; Y33-Y83 VanDerWaalsContact CE1-CD2 3.44Å; Y33-Y83 HydrophobicContact CE1-CE2 4.14Å; Y33-Y83 AromaticContact CE1-CG 3.63Å; Y33-Y83 HydrophobicContact CE1-CG 3.63Å; Y33-Y83 HydrophobicContact CE2-CD2 4.08Å; Y33-Y83 HydrophobicContact CE2-CE2 4.32Å; Y33-Y83 AromaticContact CG-CD2 3.53Å; Y33-Y83 HydrophobicContact CG-CD2 3.53Å; Y33-Y83 HydrophobicContact CG-CE1 4.42Å; Y33-Y83 AromaticContact CG-CE2 3.3Å; Y33-Y83 HydrophobicContact CG-CE2 3.3Å; Y33-Y83 HydrophobicContact CG-CG 4.17Å; Y33-Y83 AromaticContact CG-CZ 3.78Å; Y33-Y83 AromaticContact CZ-CD2 3.87Å
34	E	92.3	Very high	79.9	Confident	76 Å²	76	85 Å²	85	36%	0.355	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	144.4	-179.6	-62.1	179.2	152.6	0	0	111	C30 G31 C43 Q44 G60 Y61 G62	C30-E34 HydrophobicContact CB-CB 3.79Å; G31-E34 PolarHBondContact N-OE2 2.9Å; G31-E34 PolarHBondContact O-N 2.91Å; G31-E34 VanDerWaalsContact O-N 3.11Å; E34-C43 HydrophobicContact CB-CB 4.33Å; E34-Q44 CarbonylContact C-O 3.45Å; E34-Q44 WeakPolarHBondContact CA-O 3.46Å; E34-G60 CarbonylContact O-C 3.55Å; E34-G60 WeakPolarHBondContact O-CA 3.28Å; E34-Y61 PolarHBondContact O-N 3.24Å; E34-Y61 VanDerWaalsContact O-N 3.11Å; E34-G62 PolarHBondContact O-N 3.45Å
35	F	91.7	Very high	82.1	Confident	27 Å²	27	84.5 Å²	84.5	12%	0.118	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	152.6	174.7	71.7	-84	0	0	0	110.7	N37 C43 Q44 A45 K64	F35-N37 HydrophobicContact CE2-CB 4.09Å; F35-N37 PolarHBondContact O-N 3.46Å; F35-C43 WeakPolarHBondContact O-CA 3Å; F35-Q44 HydrophobicContact CD1-CB 4.37Å; F35-Q44 VanDerWaalsContact CD1-O 3.31Å; F35-Q44 WeakPolarHBondContact CD1-O 3.38Å; F35-Q44 HydrophobicContact CE1-CB 3.83Å; F35-Q44 HydrophobicContact CE2-CB 4.39Å; F35-Q44 HydrophobicContact CZ-CB 3.84Å; F35-Q44 PolarHBondContact N-O 2.85Å; F35-Q44 PolarHBondContact O-N 3.39Å; F35-A45 WeakPolarHBondContact CE1-O 3.43Å; F35-K64 HydrophobicContact CB-CB 3.58Å; F35-K64 HydrophobicContact CD1-CB 4.2Å; F35-K64 HydrophobicContact CD1-CD 4.03Å; F35-K64 HydrophobicContact CD2-CB 3.83Å; F35-K64 HydrophobicContact CD2-CD 4.14Å; F35-K64 HydrophobicContact CE1-CD 3.99Å; F35-K64 HydrophobicContact CE2-CD 4.1Å; F35-K64 HydrophobicContact CG-CB 3.6Å; F35-K64 HydrophobicContact CG-CD 4.12Å; F35-K64 HydrophobicContact CG-CG 4.4Å; F35-K64 HydrophobicContact CZ-CD 4.03Å
36	F	91.2	Very high	84.3	Confident	66 Å²	66	80.7 Å²	80.7	29%	0.289	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	114.8	-179.7	-173.5	-101.6	0	0	0	109.4	Q38 G62	F36-Q38 HydrophobicContact CD1-CG 4.14Å; F36-Q38 HydrophobicContact CE1-CG 4.22Å; F36-G62 WeakPolarHBondContact CB-O 3.45Å; F36-G62 PolarHBondContact N-O 2.98Å
37	N	89.7	Confident	86.3	Confident	34 Å²	34	75.1 Å²	75.1	18%	0.182	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	110.5	175.6	-173.8	-31.6	0	0	0	109.3	F35 T39 S40 N41 S42 Q44	F35-N37 HydrophobicContact CE2-CB 4.09Å; F35-N37 PolarHBondContact O-N 3.46Å; N37-T39 PolarHBondContact O-N 3.27Å; N37-T39 WeakPolarHBondContact OD1-CA 3.4Å; N37-T39 VanDerWaalsContact OD1-CB 3.28Å; N37-T39 WeakPolarHBondContact OD1-CB 3.33Å; N37-T39 PolarHBondContact OD1-N 3.1Å; N37-S40 WeakPolarHBondContact CB-OG 3.46Å; N37-S40 PolarHBondContact O-N 3.49Å; N37-S40 PolarHBondContact OD1-N 3.23Å; N37-N41 WeakPolarHBondContact O-CA 3.46Å; N37-N41 PolarHBondContact O-N 3.28Å; N37-S42 PolarHBondContact N-O 2.8Å; N37-S42 PolarHBondContact O-N 3.37Å; N37-Q44 HydrophobicContact CB-CG 3.95Å; N37-Q44 PolarHBondContact ND2-NE2 2.98Å; N37-Q44 VanDerWaalsContact ND2-NE2 3.13Å; N37-Q44 PolarHBondContact ND2-OE1 2.93Å
38	Q	85.5	Confident	88.3	Confident	168 Å²	168	70.6 Å²	70.6	79%	0.785	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-25.8	-179.8	-64.3	175.2	10.9	0	0	113	F36	F36-Q38 HydrophobicContact CD1-CG 4.14Å; F36-Q38 HydrophobicContact CE1-CG 4.22Å
39	T	88.8	Confident	89.9	Confident	139 Å²	139	67.9 Å²	67.9	85%	0.853	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-37.3	178.7	-49.1	0	0	0	0	112	N37	N37-T39 PolarHBondContact O-N 3.27Å; N37-T39 WeakPolarHBondContact OD1-CA 3.4Å; N37-T39 VanDerWaalsContact OD1-CB 3.28Å; N37-T39 WeakPolarHBondContact OD1-CB 3.33Å; N37-T39 PolarHBondContact OD1-N 3.1Å
40	S	86.8	Confident	90.7	Very high	51 Å²	51	69.7 Å²	69.7	36%	0.357	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-5.2	176.6	66.6	0	0	0	0	113.7	N37 S42 Q44	N37-S40 WeakPolarHBondContact CB-OG 3.46Å; N37-S40 PolarHBondContact O-N 3.49Å; N37-S40 PolarHBondContact OD1-N 3.23Å; S40-S42 PolarHBondContact O-N 2.73Å; S40-S42 PolarHBondContact OG-OG 3.17Å; S40-Q44 PolarHBondContact OG-NE2 3.23Å; S40-Q44 VanDerWaalsContact OG-NE2 3.11Å
41	N	87.3	Confident	91.1	Very high	126 Å²	126	72.2 Å²	72.2	67%	0.674	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	38.8	-174.5	-159.3	61.9	0	0	0	112.3	N37	N37-N41 WeakPolarHBondContact O-CA 3.46Å; N37-N41 PolarHBondContact O-N 3.28Å
42	S	91.1	Very high	91.5	Very high	49 Å²	49	71 Å²	71	34%	0.343	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	155.9	-173.5	75	0	0	0	0	111.2	N37 S40	N37-S42 PolarHBondContact N-O 2.8Å; N37-S42 PolarHBondContact O-N 3.37Å; S40-S42 PolarHBondContact O-N 2.73Å; S40-S42 PolarHBondContact OG-OG 3.17Å
43	C	92.9	Very high	91.8	Very high	43 Å²	43	69.4 Å²	69.4	29%	0.291	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	133	170.8	-60.9	0	0	0	0	110.1	C30 E34 F35	C30-C43 WeakPolarHBondContact CA-SG 3.29Å; C30-C43 HydrophobicContact CB-CB 3.71Å; C30-C43 WeakPolarHBondContact CB-SG 3.04Å; C30-C43 VanDerWaalsContact SG-CA 3.58Å; C30-C43 WeakPolarHBondContact SG-CB 3.07Å; C30-C43 CovalentContact SG-SG 2.04Å; C30-C43 PolarHBondContact SG-SG 3.37Å; E34-C43 HydrophobicContact CB-CB 4.33Å; F35-C43 WeakPolarHBondContact O-CA 3Å
44	Q	92.3	Very high	91.9	Very high	70 Å²	70	66.2 Å²	66.2	33%	0.327	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.4	176.8	-71.4	-173.2	-5.8	0	0	110	E34 F35 N37 S40	E34-Q44 CarbonylContact C-O 3.45Å; E34-Q44 WeakPolarHBondContact CA-O 3.46Å; F35-Q44 HydrophobicContact CD1-CB 4.37Å; F35-Q44 VanDerWaalsContact CD1-O 3.31Å; F35-Q44 WeakPolarHBondContact CD1-O 3.38Å; F35-Q44 HydrophobicContact CE1-CB 3.83Å; F35-Q44 HydrophobicContact CE2-CB 4.39Å; F35-Q44 HydrophobicContact CZ-CB 3.84Å; F35-Q44 PolarHBondContact N-O 2.85Å; F35-Q44 PolarHBondContact O-N 3.39Å; N37-Q44 HydrophobicContact CB-CG 3.95Å; N37-Q44 PolarHBondContact ND2-NE2 2.98Å; N37-Q44 VanDerWaalsContact ND2-NE2 3.13Å; N37-Q44 PolarHBondContact ND2-OE1 2.93Å; S40-Q44 PolarHBondContact OG-NE2 3.23Å; S40-Q44 VanDerWaalsContact OG-NE2 3.11Å
45	A	92.3	Very high	92	Very high	70 Å²	70	63.9 Å²	63.9	58%	0.579	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	138.1	177.5	0	0	0	0	0	111.4	F35	F35-A45 WeakPolarHBondContact CE1-O 3.43Å
46	C	92.1	Very high	91.9	Very high	4 Å²	4	67.6 Å²	67.6	3%	0.027	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-63.5	143.4	171.4	-71.7	0	0	0	0	110.7	Y33 Q48 C59 G60 Y83	Y33-C46 VanDerWaalsContact C-SG 3.54Å; Y33-C46 WeakPolarHBondContact O-CB 3.48Å; Y33-C46 PolarHBondContact O-N 3.12Å; Y33-C46 PolarHBondContact O-SG 2.72Å; C46-Q48 PolarHBondContact O-N 2.76Å; C46-C59 VanDerWaalsContact CA-SG 3.55Å; C46-C59 HydrophobicContact CB-CB 3.77Å; C46-C59 WeakPolarHBondContact CB-SG 3.16Å; C46-C59 WeakPolarHBondContact SG-CB 3.26Å; C46-C59 PolarHBondContact SG-O 3.24Å; C46-C59 VanDerWaalsContact SG-O 3.4Å; C46-C59 CovalentContact SG-SG 2.03Å; C46-C59 PolarHBondContact SG-SG 3.4Å; C46-G60 PolarHBondContact SG-N 3.36Å; C46-Y83 HydrophobicContact CB-CE1 3.77Å; C46-Y83 PolarHBondContact O-OH 3.42Å; C46-Y83 VanDerWaalsContact O-OH 3.1Å
47	P	91.5	Very high	91.8	Very high	60 Å²	60	67.4 Å²	67.4	39%	0.39	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-62	133.4	173.8	-14.5	26.4	0	0	0	110.4	F68	P47-F68 HydrophobicContact CB-CD1 4.42Å; P47-F68 HydrophobicContact CB-CE1 3.86Å; P47-F68 HydrophobicContact CG-CD1 4Å; P47-F68 HydrophobicContact CG-CE1 3.87Å; P47-F68 WeakPolarHBondContact O-CE1 3.18Å; P47-F68 WeakPolarHBondContact O-CZ 3.44Å
48	Q	93.3	Very high	91.8	Very high	117 Å²	117	72.1 Å²	72.1	55%	0.547	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-90.5	137.6	179.8	-69.3	179.5	23.7	0	0	110.8	C46 Y83	C46-Q48 PolarHBondContact O-N 2.76Å; Q48-Y83 HydrophobicContact CG-CE1 3.98Å; Q48-Y83 HydrophobicContact CG-CE2 4.09Å; Q48-Y83 WeakPolarHBondContact CG-OH 3.17Å
49	C	94.7	Very high	92	Very high	5 Å²	5	65 Å²	65	3%	0.034	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-79.9	150.3	175.2	-60	0	0	0	0	111.8	Q53 C70 G81 K82	C49-Q53 HydrophobicContact CB-CB 3.99Å; C49-C70 WeakPolarHBondContact CA-SG 3.2Å; C49-C70 HydrophobicContact CB-CB 3.71Å; C49-C70 WeakPolarHBondContact CB-SG 3.47Å; C49-C70 WeakPolarHBondContact SG-CB 3.06Å; C49-C70 CovalentContact SG-SG 2.05Å; C49-C70 PolarHBondContact SG-SG 2.68Å; C49-G81 CarbonylContact O-C 3.21Å; C49-G81 WeakPolarHBondContact O-CA 3.38Å; C49-K82 PolarHBondContact N-O 2.79Å; C49-K82 PolarHBondContact O-N 3.46Å
50	Q	95.9	Very high	92.1	Very high	126 Å²	126	58.9 Å²	58.9	59%	0.589	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-75.8	161.8	174.5	-64.2	-62	-23	0	0	110.6	G52 Q53 G81	Q50-G52 PolarHBondContact O-N 2.84Å; Q50-Q53 WeakPolarHBondContact O-CB 3.41Å; Q50-Q53 PolarHBondContact O-N 3.45Å; Q50-G81 WeakPolarHBondContact O-CA 3.37Å
51	P	96.4	Very high	92.3	Very high	56 Å²	56	64 Å²	64	36%	0.364	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	139.7	165.5	-26.4	36.1	0	0	0	111	Q53 E107	P51-Q53 VanDerWaalsContact C-N 3.26Å; P51-Q53 PolarHBondContact O-N 2.85Å; P51-E107 HydrophobicContact CB-CB 3.86Å; P51-E107 HydrophobicContact CB-CG 3.75Å
52	G	95	Very high	92.4	Very high	6 Å²	6	58.7 Å²	58.7	6%	0.062	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	10.7	-173.8	0	0	0	0	0	116	Q50 P72 C73 S79 A106	Q50-G52 PolarHBondContact O-N 2.84Å; G52-P72 CarbonylContact O-C 3.51Å; G52-P72 WeakPolarHBondContact O-CA 3.27Å; G52-C73 VanDerWaalsContact C-SG 3.6Å; G52-C73 PolarHBondContact O-N 3.39Å; G52-C73 PolarHBondContact O-SG 3.31Å; G52-S79 PolarHBondContact N-O 2.7Å; G52-A106 WeakPolarHBondContact CA-O 3.28Å
53	Q	95.8	Very high	92.2	Very high	61 Å²	61	63.1 Å²	63.1	29%	0.285	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	154	171.6	-59.3	177	-16.5	0	0	111.9	C49 Q50 P51 C70 I71 S79	C49-Q53 HydrophobicContact CB-CB 3.99Å; Q50-Q53 WeakPolarHBondContact O-CB 3.41Å; Q50-Q53 PolarHBondContact O-N 3.45Å; P51-Q53 VanDerWaalsContact C-N 3.26Å; P51-Q53 PolarHBondContact O-N 2.85Å; Q53-C70 HydrophobicContact CB-CB 4.17Å; Q53-I71 CarbonylContact C-O 3.38Å; Q53-I71 WeakPolarHBondContact CA-O 3.43Å; Q53-I71 WeakPolarHBondContact CB-O 3.36Å; Q53-S79 WeakPolarHBondContact O-CB 3.39Å; Q53-S79 PolarHBondContact O-OG 3.46Å
54	E	93.9	Very high	92.1	Very high	37 Å²	37	65.3 Å²	65.3	17%	0.173	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	150.2	171.9	61.8	-175.2	166.6	0	0	112	H56 C70 I71 C86	E54-H56 PolarHBondContact O-N 3.01Å; E54-C70 WeakPolarHBondContact O-CA 3.35Å; E54-I71 HydrophobicContact CG-CD1 4.16Å; E54-I71 HydrophobicContact CG-CG1 3.71Å; E54-I71 PolarHBondContact N-O 3.43Å; E54-I71 WeakPolarHBondContact O-CG1 3.05Å; E54-I71 PolarHBondContact O-N 3.19Å; E54-C86 HydrophobicContact CB-CB 4.4Å; E54-C86 VanDerWaalsContact CB-SG 3.53Å; E54-C86 HydrophobicContact CG-CB 4.34Å; E54-C86 VanDerWaalsContact CG-SG 3.52Å; E54-C86 VanDerWaalsContact OE2-CB 3.31Å; E54-C86 WeakPolarHBondContact OE2-CB 3.03Å; E54-C86 PolarHBondContact OE2-N 2.83Å
55	P	93.8	Very high	92	Very high	27 Å²	27	65.1 Å²	65.1	18%	0.175	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	119.9	171.1	27.2	-31.7	0	0	0	110.1	F68 E84	P55-F68 HydrophobicContact CB-CE2 3.75Å; P55-F68 HydrophobicContact CB-CZ 4.01Å; P55-E84 WeakPolarHBondContact CD-O 3.12Å
56	H	89.6	Confident	91.7	Very high	104 Å²	104	71 Å²	71	48%	0.481	36%	0.357	S	S	.	.	S	Bend	trans	-74.7	-28.5	-180	-179.2	-124.6	0	0	0	113	E54 A69 I71	E54-H56 PolarHBondContact O-N 3.01Å; H56-A69 WeakPolarHBondContact CB-O 3.06Å; H56-A69 PolarHBondContact N-O 3.03Å; H56-I71 HydrophobicContact CB-CD1 3.97Å; H56-I71 HydrophobicContact CB-CG1 4.07Å; H56-I71 HydrophobicContact CB-CG2 3.98Å
57	M	89.9	Confident	91.4	Very high	62 Å²	62	76.5 Å²	76.5	31%	0.305	39%	0.386	S	S	.	.	S	Bend	trans	-130	172.9	179.7	-60.9	-62.3	-173.8	0	0	111.2	D65 D67 F68	M57-D65 HydrophobicContact CB-CB 3.79Å; M57-D65 HydrophobicContact CG-CB 4.39Å; M57-D67 HydrophobicContact CE-CB 4.33Å; M57-D67 HydrophobicContact CG-CB 4.17Å; M57-D67 WeakPolarHBondContact CG-O 3.42Å; M57-F68 VanDerWaalsContact O-CD2 3.25Å; M57-F68 WeakPolarHBondContact O-CD2 3.09Å; M57-F68 WeakPolarHBondContact O-CE2 3.44Å
58	N	88.1	Confident	91.4	Very high	133 Å²	133	74.8 Å²	74.8	71%	0.711	37%	0.373	S	S	*	.			trans	-86.9	134.4	-176.1	-66.8	96.6	0	0	0	111.1	D65	N58-D65 PolarHBondContact N-OD2 3.41Å; N58-D65 PolarHBondContact O-N 2.86Å; N58-D65 VanDerWaalsContact O-N 3.17Å
59	C	90.8	Very high	91.3	Very high	19 Å²	19	71.4 Å²	71.4	13%	0.128	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	124.6	167.8	-176.3	0	0	0	0	108	C46 K64 F68	C46-C59 VanDerWaalsContact CA-SG 3.55Å; C46-C59 HydrophobicContact CB-CB 3.77Å; C46-C59 WeakPolarHBondContact CB-SG 3.16Å; C46-C59 WeakPolarHBondContact SG-CB 3.26Å; C46-C59 PolarHBondContact SG-O 3.24Å; C46-C59 VanDerWaalsContact SG-O 3.4Å; C46-C59 CovalentContact SG-SG 2.03Å; C46-C59 PolarHBondContact SG-SG 3.4Å; C59-K64 HydrophobicContact CB-CG 4.26Å; C59-F68 HydrophobicContact CB-CD2 3.43Å; C59-F68 VanDerWaalsContact CB-CD2 3.43Å; C59-F68 HydrophobicContact CB-CE2 3.44Å; C59-F68 VanDerWaalsContact CB-CE2 3.44Å; C59-F68 HydrophobicContact CB-CG 4.05Å; C59-F68 HydrophobicContact CB-CZ 4.08Å
60	G	91.5	Very high	91.4	Very high	10 Å²	10	73.1 Å²	73.1	10%	0.103	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.9	167.6	-175.9	0	0	0	0	0	113.1	E32 E34 C46 G62 M63	E32-G60 WeakPolarHBondContact O-CA 3.42Å; E34-G60 CarbonylContact O-C 3.55Å; E34-G60 WeakPolarHBondContact O-CA 3.28Å; C46-G60 PolarHBondContact SG-N 3.36Å; G60-G62 PolarHBondContact O-N 3.44Å; G60-G62 VanDerWaalsContact O-N 3.15Å; G60-M63 PolarHBondContact N-O 3.09Å; G60-M63 PolarHBondContact O-N 3.13Å
61	Y	90.6	Very high	91.3	Very high	158 Å²	158	69.9 Å²	69.9	62%	0.62	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	37.2	175.4	-56	-78.3	0	0	0	113.5	G31 E32 E34 M63	G31-Y61 PolarHBondContact O-N 3.35Å; E32-Y61 HydrophobicContact CB-CE1 4.04Å; E32-Y61 HydrophobicContact CB-CE2 4.3Å; E32-Y61 HydrophobicContact CG-CE1 4.42Å; E32-Y61 HydrophobicContact CG-CE2 3.91Å; E32-Y61 WeakPolarHBondContact CG-OH 3.31Å; E34-Y61 PolarHBondContact O-N 3.24Å; E34-Y61 VanDerWaalsContact O-N 3.11Å; Y61-M63 VanDerWaalsContact C-N 3.27Å; Y61-M63 PolarHBondContact O-N 3.44Å
62	G	89.1	Confident	91.3	Very high	16 Å²	16	71.9 Å²	71.9	17%	0.165	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	84	-2.9	178.1	0	0	0	0	0	114.4	E34 F36 G60	E34-G62 PolarHBondContact O-N 3.45Å; F36-G62 WeakPolarHBondContact CB-O 3.45Å; F36-G62 PolarHBondContact N-O 2.98Å; G60-G62 PolarHBondContact O-N 3.44Å; G60-G62 VanDerWaalsContact O-N 3.15Å
63	M	87.1	Confident	91.4	Very high	142 Å²	142	72.5 Å²	72.5	70%	0.7	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	143.4	-179.2	-58.4	-63.9	-72.2	0	0	110.7	G60 Y61	G60-M63 PolarHBondContact N-O 3.09Å; G60-M63 PolarHBondContact O-N 3.13Å; Y61-M63 VanDerWaalsContact C-N 3.27Å; Y61-M63 PolarHBondContact O-N 3.44Å
64	K	90.3	Very high	91.3	Very high	89 Å²	89	72.4 Å²	72.4	39%	0.387	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	124.7	171	175.5	-173.6	172.5	-151.3	0	108.2	F35 C59 F68	F35-K64 HydrophobicContact CB-CB 3.58Å; F35-K64 HydrophobicContact CD1-CB 4.2Å; F35-K64 HydrophobicContact CD1-CD 4.03Å; F35-K64 HydrophobicContact CD2-CB 3.83Å; F35-K64 HydrophobicContact CD2-CD 4.14Å; F35-K64 HydrophobicContact CE1-CD 3.99Å; F35-K64 HydrophobicContact CE2-CD 4.1Å; F35-K64 HydrophobicContact CG-CB 3.6Å; F35-K64 HydrophobicContact CG-CD 4.12Å; F35-K64 HydrophobicContact CG-CG 4.4Å; F35-K64 HydrophobicContact CZ-CD 4.03Å; C59-K64 HydrophobicContact CB-CG 4.26Å; K64-F68 HydrophobicContact CG-CB 4.19Å
65	D	89.4	Confident	91.2	Very high	66 Å²	66	80.2 Å²	80.2	35%	0.353	42%	0.424	S	S	.	.			trans	-67.5	141.1	172.2	-64.1	-36.5	0	0	0	110.5	M57 N58 D67 F68	M57-D65 HydrophobicContact CB-CB 3.79Å; M57-D65 HydrophobicContact CG-CB 4.39Å; N58-D65 PolarHBondContact N-OD2 3.41Å; N58-D65 PolarHBondContact O-N 2.86Å; N58-D65 VanDerWaalsContact O-N 3.17Å; D65-D67 PolarHBondContact O-N 3.02Å; D65-F68 VanDerWaalsContact O-CB 3.3Å; D65-F68 WeakPolarHBondContact O-CB 3.38Å; D65-F68 PolarHBondContact O-N 3.32Å; D65-F68 VanDerWaalsContact O-N 3.1Å
66	E	86.9	Confident	91.1	Very high	193 Å²	193	80.9 Å²	80.9	90%	0.902	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-35.9	-178.4	-64.3	-174.7	168.6	0	0	111.7	F68	E66-F68 VanDerWaalsContact C-N 3.26Å; E66-F68 PolarHBondContact O-N 2.75Å
67	D	86.3	Confident	91.3	Very high	120 Å²	120	78.7 Å²	78.7	64%	0.642	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	19.3	179.2	-62.2	-37.3	0	0	0	113.5	M57 D65 A69	M57-D67 HydrophobicContact CE-CB 4.33Å; M57-D67 HydrophobicContact CG-CB 4.17Å; M57-D67 WeakPolarHBondContact CG-O 3.42Å; D65-D67 PolarHBondContact O-N 3.02Å; D67-A69 PolarHBondContact O-N 2.79Å
68	F	90.7	Very high	91.6	Very high	24 Å²	24	77 Å²	77	11%	0.105	42%	0.416	C	S	.	.			trans	-61	110.9	173.9	-176.8	-87.5	0	0	0	110.8	P47 P55 M57 C59 K64 D65 E66	P47-F68 HydrophobicContact CB-CD1 4.42Å; P47-F68 HydrophobicContact CB-CE1 3.86Å; P47-F68 HydrophobicContact CG-CD1 4Å; P47-F68 HydrophobicContact CG-CE1 3.87Å; P47-F68 WeakPolarHBondContact O-CE1 3.18Å; P47-F68 WeakPolarHBondContact O-CZ 3.44Å; P55-F68 HydrophobicContact CB-CE2 3.75Å; P55-F68 HydrophobicContact CB-CZ 4.01Å; M57-F68 VanDerWaalsContact O-CD2 3.25Å; M57-F68 WeakPolarHBondContact O-CD2 3.09Å; M57-F68 WeakPolarHBondContact O-CE2 3.44Å; C59-F68 HydrophobicContact CB-CD2 3.43Å; C59-F68 VanDerWaalsContact CB-CD2 3.43Å; C59-F68 HydrophobicContact CB-CE2 3.44Å; C59-F68 VanDerWaalsContact CB-CE2 3.44Å; C59-F68 HydrophobicContact CB-CG 4.05Å; C59-F68 HydrophobicContact CB-CZ 4.08Å; K64-F68 HydrophobicContact CG-CB 4.19Å; D65-F68 VanDerWaalsContact O-CB 3.3Å; D65-F68 WeakPolarHBondContact O-CB 3.38Å; D65-F68 PolarHBondContact O-N 3.32Å; D65-F68 VanDerWaalsContact O-N 3.1Å; E66-F68 VanDerWaalsContact C-N 3.26Å; E66-F68 PolarHBondContact O-N 2.75Å
69	A	92.5	Very high	92	Very high	46 Å²	46	70.8 Å²	70.8	38%	0.38	38%	0.383	S	S	.	.			trans	-141	151.5	178.1	0	0	0	0	0	110.6	H56 D67	H56-A69 WeakPolarHBondContact CB-O 3.06Å; H56-A69 PolarHBondContact N-O 3.03Å; D67-A69 PolarHBondContact O-N 2.79Å
70	C	95.1	Very high	92.1	Very high	40 Å²	40	76.5 Å²	76.5	27%	0.27	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	120.8	171.3	-64.2	0	0	0	0	109.1	C49 Q53 E54	C49-C70 WeakPolarHBondContact CA-SG 3.2Å; C49-C70 HydrophobicContact CB-CB 3.71Å; C49-C70 WeakPolarHBondContact CB-SG 3.47Å; C49-C70 WeakPolarHBondContact SG-CB 3.06Å; C49-C70 CovalentContact SG-SG 2.05Å; C49-C70 PolarHBondContact SG-SG 2.68Å; Q53-C70 HydrophobicContact CB-CB 4.17Å; E54-C70 WeakPolarHBondContact O-CA 3.35Å
71	I	95	Very high	92	Very high	59 Å²	59	76 Å²	76	30%	0.303	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	145.8	-179	59.4	169.3	0	0	0	110.4	Q53 E54 H56	Q53-I71 CarbonylContact C-O 3.38Å; Q53-I71 WeakPolarHBondContact CA-O 3.43Å; Q53-I71 WeakPolarHBondContact CB-O 3.36Å; E54-I71 HydrophobicContact CG-CD1 4.16Å; E54-I71 HydrophobicContact CG-CG1 3.71Å; E54-I71 PolarHBondContact N-O 3.43Å; E54-I71 WeakPolarHBondContact O-CG1 3.05Å; E54-I71 PolarHBondContact O-N 3.19Å; H56-I71 HydrophobicContact CB-CD1 3.97Å; H56-I71 HydrophobicContact CB-CG1 4.07Å; H56-I71 HydrophobicContact CB-CG2 3.98Å
72	P	96.6	Very high	92.1	Very high	98 Å²	98	74.6 Å²	74.6	64%	0.636	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	146.1	-179.6	28	-34.4	0	0	0	112	G52	G52-P72 CarbonylContact O-C 3.51Å; G52-P72 WeakPolarHBondContact O-CA 3.27Å
73	C	96.1	Very high	92.1	Very high	19 Å²	19	76.4 Å²	76.4	13%	0.128	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-61.4	136.8	175.4	-66.7	0	0	0	0	111.7	G52 K77 C86	G52-C73 VanDerWaalsContact C-SG 3.6Å; G52-C73 PolarHBondContact O-N 3.39Å; G52-C73 PolarHBondContact O-SG 3.31Å; C73-K77 HydrophobicContact CB-CB 4.28Å; C73-C86 WeakPolarHBondContact CA-SG 3.34Å; C73-C86 HydrophobicContact CB-CB 3.79Å; C73-C86 WeakPolarHBondContact CB-SG 3.25Å; C73-C86 WeakPolarHBondContact SG-CB 3.36Å; C73-C86 CovalentContact SG-SG 2.03Å; C73-C86 PolarHBondContact SG-SG 2.83Å
74	A	94.7	Very high	92.3	Very high	58 Å²	58	73.1 Å²	73.1	48%	0.479	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-62.6	158	170.2	0	0	0	0	0	111.7	G76 K77	A74-G76 PolarHBondContact O-N 3.15Å; A74-K77 HydrophobicContact CB-CD 4.36Å; A74-K77 WeakPolarHBondContact O-CB 3.38Å; A74-K77 PolarHBondContact O-N 3.33Å; A74-K77 VanDerWaalsContact O-N 3.09Å
75	Q	91.6	Very high	92.4	Very high	201 Å²	201	73.7 Å²	73.7	94%	0.939	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	137.1	179	-68	179.3	2	0	0	112.1	K77	Q75-K77 VanDerWaalsContact C-N 3.29Å
76	G	90.4	Very high	92.7	Very high	42 Å²	42	71 Å²	71	43%	0.433	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	12.6	-176.6	0	0	0	0	0	114.5	A74 R88 H89	A74-G76 PolarHBondContact O-N 3.15Å; G76-R88 WeakPolarHBondContact O-CA 3.34Å; G76-H89 PolarHBondContact O-N 2.87Å; G76-H89 VanDerWaalsContact O-N 3.13Å
77	K	95.1	Very high	93.1	Very high	57 Å²	57	68.5 Å²	68.5	25%	0.248	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	159.9	172.2	-60.1	-176.5	176.2	-172.1	0	111.7	C73 A74 Q75 C86 R87 R88	C73-K77 HydrophobicContact CB-CB 4.28Å; A74-K77 HydrophobicContact CB-CD 4.36Å; A74-K77 WeakPolarHBondContact O-CB 3.38Å; A74-K77 PolarHBondContact O-N 3.33Å; A74-K77 VanDerWaalsContact O-N 3.09Å; Q75-K77 VanDerWaalsContact C-N 3.29Å; K77-C86 HydrophobicContact CB-CB 4.03Å; K77-C86 HydrophobicContact CD-CB 3.98Å; K77-R87 CarbonylContact C-O 3.58Å; K77-R87 WeakPolarHBondContact CA-O 3.26Å; K77-R87 VanDerWaalsContact CB-O 3.27Å; K77-R87 WeakPolarHBondContact CB-O 3.4Å; K77-R88 HydrophobicContact CG-CG 4.05Å
78	Y	95.6	Very high	93.5	Very high	28 Å²	28	72.1 Å²	72.1	11%	0.11	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	157.9	174.1	77.5	-76.3	0	0	0	113	C86 R87 H89 T105 A106 D109	Y78-C86 CarbonylContact O-C 3.53Å; Y78-C86 WeakPolarHBondContact O-CA 3.36Å; Y78-R87 WeakPolarHBondContact CD1-O 3.38Å; Y78-R87 HydrophobicContact CE1-CB 4.22Å; Y78-R87 PolarHBondContact N-O 3.2Å; Y78-R87 PolarHBondContact O-N 3.47Å; Y78-H89 AromaticContact CD1-CD2 3.43Å; Y78-H89 VanDerWaalsContact CD1-CD2 3.43Å; Y78-H89 WeakPolarHBondContact CD1-CD2 3.38Å; Y78-H89 AromaticContact CG-CD2 3.97Å; Y78-T105 WeakPolarHBondContact CB-O 3.23Å; Y78-A106 CarbonylContact C-O 3.36Å; Y78-A106 WeakPolarHBondContact CA-O 3.36Å; Y78-A106 WeakPolarHBondContact CB-O 3.45Å; Y78-D109 HydrophobicContact CD1-CB 4.18Å; Y78-D109 HydrophobicContact CD2-CB 4.36Å; Y78-D109 HydrophobicContact CE1-CB 3.56Å; Y78-D109 WeakPolarHBondContact CE1-OD1 3.26Å; Y78-D109 HydrophobicContact CE2-CB 3.8Å; Y78-D109 WeakPolarHBondContact OH-CB 3.28Å; Y78-D109 VanDerWaalsContact OH-CG 3.22Å; Y78-D109 PolarHBondContact OH-OD2 2.98Å
79	S	95.8	Very high	93.6	Very high	1 Å²	1	73 Å²	73	1%	0.007	37%	0.367	C	S	.	.			trans	-143.9	143.2	169.1	179.3	0	0	0	0	109.4	G52 Q53 G81 E84 A106	G52-S79 PolarHBondContact N-O 2.7Å; Q53-S79 WeakPolarHBondContact O-CB 3.39Å; Q53-S79 PolarHBondContact O-OG 3.46Å; S79-G81 PolarHBondContact O-N 3.18Å; S79-G81 PolarHBondContact OG-N 3.46Å; S79-E84 PolarHBondContact OG-O 3.12Å; S79-A106 PolarHBondContact N-O 2.9Å
80	K	93.4	Very high	93.4	Very high	139 Å²	139	74.4 Å²	74.4	60%	0.604	36%	0.364	S	S	*	.			trans	-78.1	2.7	169.5	-64.8	-175	177.2	-176.1	0	112.5
81	G	90.6	Very high	93.2	Very high	0 Å²	0	76.4 Å²	76.4	0%	0	37%	0.372	C	S	.	.	S	Bend	trans	80.7	-147.9	-178.4	0	0	0	0	0	112.5	C49 Q50 S79 Y83 E84	C49-G81 CarbonylContact O-C 3.21Å; C49-G81 WeakPolarHBondContact O-CA 3.38Å; Q50-G81 WeakPolarHBondContact O-CA 3.37Å; S79-G81 PolarHBondContact O-N 3.18Å; S79-G81 PolarHBondContact OG-N 3.46Å; G81-Y83 PolarHBondContact O-N 3.11Å; G81-Y83 VanDerWaalsContact O-N 3.11Å; G81-E84 WeakPolarHBondContact O-CB 3.42Å; G81-E84 PolarHBondContact O-N 3.49Å
82	K	90.9	Very high	93	Very high	129 Å²	129	73.7 Å²	73.7	56%	0.561	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	61.3	-104.8	-172.5	-53.9	175.6	-179	-179.4	0	110.8	C49	C49-K82 PolarHBondContact N-O 2.79Å; C49-K82 PolarHBondContact O-N 3.46Å
83	Y	90.1	Very high	92.7	Very high	53 Å²	53	73.7 Å²	73.7	21%	0.208	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	11.4	179.2	-49.4	-67.6	0	0	0	111.1	Y33 C46 Q48 G81	Y33-Y83 AromaticContact CD1-CD1 3.93Å; Y33-Y83 HydrophobicContact CD1-CD1 3.93Å; Y33-Y83 AromaticContact CD1-CD2 3.24Å; Y33-Y83 HydrophobicContact CD1-CD2 3.24Å; Y33-Y83 HydrophobicContact CD1-CE1 4.16Å; Y33-Y83 AromaticContact CD1-CE2 3.5Å; Y33-Y83 HydrophobicContact CD1-CE2 3.5Å; Y33-Y83 AromaticContact CD1-CG 3.46Å; Y33-Y83 HydrophobicContact CD1-CG 3.46Å; Y33-Y83 VanDerWaalsContact CD1-CG 3.46Å; Y33-Y83 AromaticContact CD1-CZ 3.95Å; Y33-Y83 AromaticContact CD2-CD2 3.93Å; Y33-Y83 HydrophobicContact CD2-CD2 3.93Å; Y33-Y83 AromaticContact CD2-CE2 3.74Å; Y33-Y83 HydrophobicContact CD2-CE2 3.74Å; Y33-Y83 HydrophobicContact CE1-CD1 4.47Å; Y33-Y83 AromaticContact CE1-CD2 3.44Å; Y33-Y83 HydrophobicContact CE1-CD2 3.44Å; Y33-Y83 VanDerWaalsContact CE1-CD2 3.44Å; Y33-Y83 HydrophobicContact CE1-CE2 4.14Å; Y33-Y83 AromaticContact CE1-CG 3.63Å; Y33-Y83 HydrophobicContact CE1-CG 3.63Å; Y33-Y83 HydrophobicContact CE2-CD2 4.08Å; Y33-Y83 HydrophobicContact CE2-CE2 4.32Å; Y33-Y83 AromaticContact CG-CD2 3.53Å; Y33-Y83 HydrophobicContact CG-CD2 3.53Å; Y33-Y83 HydrophobicContact CG-CE1 4.42Å; Y33-Y83 AromaticContact CG-CE2 3.3Å; Y33-Y83 HydrophobicContact CG-CE2 3.3Å; Y33-Y83 HydrophobicContact CG-CG 4.17Å; Y33-Y83 AromaticContact CG-CZ 3.78Å; Y33-Y83 AromaticContact CZ-CD2 3.87Å; C46-Y83 HydrophobicContact CB-CE1 3.77Å; C46-Y83 PolarHBondContact O-OH 3.42Å; C46-Y83 VanDerWaalsContact O-OH 3.1Å; Q48-Y83 HydrophobicContact CG-CE1 3.98Å; Q48-Y83 HydrophobicContact CG-CE2 4.09Å; Q48-Y83 WeakPolarHBondContact CG-OH 3.17Å; G81-Y83 PolarHBondContact O-N 3.11Å; G81-Y83 VanDerWaalsContact O-N 3.11Å
84	E	91	Very high	92.3	Very high	73 Å²	73	75.6 Å²	75.6	34%	0.341	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-79.2	137.7	177.2	-64.9	-172.9	-173	0	0	111.3	P55 S79 G81	P55-E84 WeakPolarHBondContact CD-O 3.12Å; S79-E84 PolarHBondContact OG-O 3.12Å; G81-E84 WeakPolarHBondContact O-CB 3.42Å; G81-E84 PolarHBondContact O-N 3.49Å
85	I	93	Very high	91.8	Very high	102 Å²	102	78 Å²	78	52%	0.523	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-80	154.7	170.6	61.9	170.5	0	0	0	111.2	R87	I85-R87 PolarHBondContact O-N 3.47Å
86	C	95.5	Very high	91.6	Very high	8 Å²	8	69 Å²	69	5%	0.054	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-69.5	118.4	179.6	-64.7	0	0	0	0	111.4	E54 C73 K77 Y78	E54-C86 HydrophobicContact CB-CB 4.4Å; E54-C86 VanDerWaalsContact CB-SG 3.53Å; E54-C86 HydrophobicContact CG-CB 4.34Å; E54-C86 VanDerWaalsContact CG-SG 3.52Å; E54-C86 VanDerWaalsContact OE2-CB 3.31Å; E54-C86 WeakPolarHBondContact OE2-CB 3.03Å; E54-C86 PolarHBondContact OE2-N 2.83Å; C73-C86 WeakPolarHBondContact CA-SG 3.34Å; C73-C86 HydrophobicContact CB-CB 3.79Å; C73-C86 WeakPolarHBondContact CB-SG 3.25Å; C73-C86 WeakPolarHBondContact SG-CB 3.36Å; C73-C86 CovalentContact SG-SG 2.03Å; C73-C86 PolarHBondContact SG-SG 2.83Å; K77-C86 HydrophobicContact CB-CB 4.03Å; K77-C86 HydrophobicContact CD-CB 3.98Å; Y78-C86 CarbonylContact O-C 3.53Å; Y78-C86 WeakPolarHBondContact O-CA 3.36Å
87	R	94.6	Very high	91.6	Very high	141 Å²	141	69.8 Å²	69.8	53%	0.532	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	151.2	179.3	-60.8	-177.6	-173.8	179.4	2.8	110.8	K77 Y78 I85	K77-R87 CarbonylContact C-O 3.58Å; K77-R87 WeakPolarHBondContact CA-O 3.26Å; K77-R87 VanDerWaalsContact CB-O 3.27Å; K77-R87 WeakPolarHBondContact CB-O 3.4Å; Y78-R87 WeakPolarHBondContact CD1-O 3.38Å; Y78-R87 HydrophobicContact CE1-CB 4.22Å; Y78-R87 PolarHBondContact N-O 3.2Å; Y78-R87 PolarHBondContact O-N 3.47Å; I85-R87 PolarHBondContact O-N 3.47Å
88	R	94.5	Very high	91.4	Very high	196 Å²	196	67.2 Å²	67.2	74%	0.74	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	146.9	174.4	-76.8	-166.9	173.2	89.5	0.1	111.3	G76 K77	G76-R88 WeakPolarHBondContact O-CA 3.34Å; K77-R88 HydrophobicContact CG-CG 4.05Å
89	H	92.6	Very high	91.1	Very high	44 Å²	44	68.4 Å²	68.4	20%	0.204	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-60.4	152.6	170.6	-62.9	137.2	0	0	0	111.7	G76 Y78 D91 G104 T105 S108 D109 A110	G76-H89 PolarHBondContact O-N 2.87Å; G76-H89 VanDerWaalsContact O-N 3.13Å; Y78-H89 AromaticContact CD1-CD2 3.43Å; Y78-H89 VanDerWaalsContact CD1-CD2 3.43Å; Y78-H89 WeakPolarHBondContact CD1-CD2 3.38Å; Y78-H89 AromaticContact CG-CD2 3.97Å; H89-D91 PolarHBondContact O-N 2.77Å; H89-G104 WeakPolarHBondContact NE2-CA 3.04Å; H89-T105 PolarHBondContact CE1-O 3.01Å; H89-T105 PolarHBondContact NE2-N 3.36Å; H89-T105 PolarHBondContact NE2-O 3.18Å; H89-S108 PolarHBondContact CD2-O 3.43Å; H89-S108 PolarHBondContact NE2-O 3.38Å; H89-D109 VanDerWaalsContact CA-OD1 3.25Å; H89-D109 WeakPolarHBondContact CA-OD1 3.22Å; H89-A110 HydrophobicContact CB-CB 4.13Å
90	K	90.1	Very high	90.9	Very high	74 Å²	74	72.5 Å²	72.5	32%	0.322	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-58.3	131.6	167.2	-70	-174.8	-145.7	-40.4	0	110.4	C92 Y96 D109	K90-C92 PolarHBondContact O-N 3.3Å; K90-Y96 HydrophobicContact CB-CD2 4.48Å; K90-Y96 HydrophobicContact CB-CE2 3.94Å; K90-Y96 HydrophobicContact CD-CE2 4.04Å; K90-Y96 HydrophobicContact CG-CE2 4.06Å; K90-D109 VanDerWaalsContact CE-OD2 3.28Å; K90-D109 WeakPolarHBondContact CE-OD2 3.25Å; K90-D109 WeakPolarHBondContact CG-OD2 3.35Å; K90-D109 PolarHBondContact N-OD1 2.03Å; K90-D109 IonicContact NZ-OD2 3.41Å; K90-D109 PolarHBondContact NZ-OD2 3.49Å
91	D	90.7	Very high	90.8	Very high	82 Å²	82	74.8 Å²	74.8	44%	0.439	35%	0.352	S	S	.	.			trans	-88	90.4	172.7	-166.3	-25.4	0	0	0	110.1	H89 D93 A94 L95 Y96	H89-D91 PolarHBondContact O-N 2.77Å; D91-D93 VanDerWaalsContact C-N 3.31Å; D91-D93 PolarHBondContact O-N 2.68Å; D91-D93 PolarHBondContact OD1-N 3.3Å; D91-A94 VanDerWaalsContact CG-CB 3.44Å; D91-A94 WeakPolarHBondContact OD1-CB 3.05Å; D91-A94 PolarHBondContact OD1-N 2.75Å; D91-A94 WeakPolarHBondContact OD2-CB 3.48Å; D91-L95 HydrophobicContact CB-CB 4.09Å; D91-L95 VanDerWaalsContact O-CB 3.26Å; D91-L95 WeakPolarHBondContact O-CB 3.39Å; D91-L95 PolarHBondContact O-N 2.93Å; D91-L95 VanDerWaalsContact O-N 3.12Å; D91-Y96 WeakPolarHBondContact O-CD2 3.22Å; D91-Y96 PolarHBondContact O-N 3.11Å
92	C	90.4	Very high	90.9	Very high	3 Å²	3	77.9 Å²	77.9	2%	0.02	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-36	-176.3	-61	0	0	0	0	112.9	K90 Y96 K97 A98 V100 C112	K90-C92 PolarHBondContact O-N 3.3Å; C92-Y96 CarbonylContact O-C 3.27Å; C92-Y96 WeakPolarHBondContact O-CB 3.36Å; C92-Y96 PolarHBondContact O-N 3.03Å; C92-K97 PolarHBondContact O-N 3.01Å; C92-A98 CarbonylContact C-O 3.39Å; C92-A98 VanDerWaalsContact C-O 3.27Å; C92-A98 PolarHBondContact O-N 3.48Å; C92-A98 VanDerWaalsContact O-O 3.07Å; C92-V100 HydrophobicContact CB-CG2 3.81Å; C92-C112 WeakPolarHBondContact CA-SG 3.09Å; C92-C112 HydrophobicContact CB-CB 3.79Å; C92-C112 WeakPolarHBondContact CB-SG 3.31Å; C92-C112 WeakPolarHBondContact SG-CA 3.4Å; C92-C112 WeakPolarHBondContact SG-CB 3.44Å; C92-C112 CovalentContact SG-SG 2.05Å; C92-C112 PolarHBondContact SG-SG 2.88Å
93	D	89.6	Confident	91	Very high	98 Å²	98	75 Å²	75	52%	0.524	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-55.4	-176.6	-171	0.1	0	0	0	111.4	D91 K97 L116	D91-D93 VanDerWaalsContact C-N 3.31Å; D91-D93 PolarHBondContact O-N 2.68Å; D91-D93 PolarHBondContact OD1-N 3.3Å; D93-K97 WeakPolarHBondContact O-CA 3.42Å; D93-K97 PolarHBondContact O-N 3.47Å; D93-K97 PolarHBondContact O-NZ 2.69Å; D93-L116 WeakPolarHBondContact OD1-CD1 3.48Å
94	A	87.7	Confident	91	Very high	59 Å²	59	73.6 Å²	73.6	49%	0.488	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-39.9	-173.3	0	0	0	0	0	112.4	D91 K97	D91-A94 VanDerWaalsContact CG-CB 3.44Å; D91-A94 WeakPolarHBondContact OD1-CB 3.05Å; D91-A94 PolarHBondContact OD1-N 2.75Å; D91-A94 WeakPolarHBondContact OD2-CB 3.48Å; A94-K97 PolarHBondContact O-NZ 3.18Å
95	L	85.3	Confident	91.2	Very high	107 Å²	107	73.3 Å²	73.3	56%	0.56	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-48.8	-176.4	-172.9	65.4	0	0	0	112.2	D91	D91-L95 HydrophobicContact CB-CB 4.09Å; D91-L95 VanDerWaalsContact O-CB 3.26Å; D91-L95 WeakPolarHBondContact O-CB 3.39Å; D91-L95 PolarHBondContact O-N 2.93Å; D91-L95 VanDerWaalsContact O-N 3.12Å
96	Y	86.8	Confident	91.3	Very high	12 Å²	12	70.7 Å²	70.7	5%	0.047	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-10	-172.8	-64	-72.2	0	0	0	114.6	K90 D91 C92 A98 M132 V133 C134	K90-Y96 HydrophobicContact CB-CD2 4.48Å; K90-Y96 HydrophobicContact CB-CE2 3.94Å; K90-Y96 HydrophobicContact CD-CE2 4.04Å; K90-Y96 HydrophobicContact CG-CE2 4.06Å; D91-Y96 WeakPolarHBondContact O-CD2 3.22Å; D91-Y96 PolarHBondContact O-N 3.11Å; C92-Y96 CarbonylContact O-C 3.27Å; C92-Y96 WeakPolarHBondContact O-CB 3.36Å; C92-Y96 PolarHBondContact O-N 3.03Å; Y96-A98 PolarHBondContact O-N 3.11Å; Y96-M132 WeakPolarHBondContact CD1-O 3.38Å; Y96-V133 HydrophobicContact CD1-CG2 3.81Å; Y96-V133 HydrophobicContact CE1-CG2 3.97Å; Y96-C134 WeakPolarHBondContact O-CB 3.27Å; Y96-C134 PolarHBondContact O-N 2.92Å; Y96-C134 PolarHBondContact O-SG 3.36Å; Y96-C134 VanDerWaalsContact O-SG 3.35Å
97	K	90.9	Very high	91.2	Very high	60 Å²	60	76 Å²	76	26%	0.261	39%	0.394	S	S	.	.			trans	51.2	41.2	-175.4	-64	-73.4	177.7	-73.8	0	111.9	C92 D93 A94 L116 Y119 C134	C92-K97 PolarHBondContact O-N 3.01Å; D93-K97 WeakPolarHBondContact O-CA 3.42Å; D93-K97 PolarHBondContact O-N 3.47Å; D93-K97 PolarHBondContact O-NZ 2.69Å; A94-K97 PolarHBondContact O-NZ 3.18Å; K97-L116 WeakPolarHBondContact O-CB 3.05Å; K97-L116 WeakPolarHBondContact O-CG 3.03Å; K97-L116 PolarHBondContact O-N 3.1Å; K97-Y119 HydrophobicContact CB-CD1 3.75Å; K97-Y119 HydrophobicContact CB-CD2 4.38Å; K97-Y119 HydrophobicContact CB-CE1 4.01Å; K97-Y119 HydrophobicContact CB-CG 3.98Å; K97-Y119 HydrophobicContact CD-CD1 4.42Å; K97-Y119 HydrophobicContact CD-CE1 3.8Å; K97-Y119 HydrophobicContact CD-CE2 4.16Å; K97-Y119 HydrophobicContact CG-CD1 3.95Å; K97-Y119 HydrophobicContact CG-CE1 3.69Å; K97-C134 HydrophobicContact CB-CB 3.96Å
98	A	89.4	Confident	91.1	Very high	2 Å²	2	71.7 Å²	71.7	2%	0.017	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	156.6	-174.6	0	0	0	0	0	111.4	C92 Y96 C112 P114	C92-A98 CarbonylContact C-O 3.39Å; C92-A98 VanDerWaalsContact C-O 3.27Å; C92-A98 PolarHBondContact O-N 3.48Å; C92-A98 VanDerWaalsContact O-O 3.07Å; Y96-A98 PolarHBondContact O-N 3.11Å; A98-C112 HydrophobicContact CB-CB 4.2Å; A98-P114 WeakPolarHBondContact CA-O 3.37Å
99	T	89.8	Confident	91.1	Very high	53 Å²	53	63.5 Å²	63.5	33%	0.325	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	150	173.5	53.1	0	0	0	0	110.9	R101 G113 P114 L116	T99-R101 PolarHBondContact O-N 3.37Å; T99-G113 PolarHBondContact O-N 3.44Å; T99-P114 PolarHBondContact N-O 3.36Å; T99-P114 WeakPolarHBondContact OG1-CD 3.41Å; T99-P114 PolarHBondContact OG1-O 2.98Å; T99-L116 HydrophobicContact CG2-CD2 3.84Å
100	V	92.3	Very high	91	Very high	87 Å²	87	61.8 Å²	61.8	53%	0.527	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	116.9	170.1	179.3	0	0	0	0	107.9	C92	C92-V100 HydrophobicContact CB-CG2 3.81Å
101	R	91.8	Very high	91.1	Very high	188 Å²	188	63.2 Å²	63.2	71%	0.709	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	-45.8	176.1	-179	-177.7	163.6	-174.2	-7.9	110.9	T99 E111	T99-R101 PolarHBondContact O-N 3.37Å; R101-E111 WeakPolarHBondContact CA-O 3.5Å; R101-E111 WeakPolarHBondContact CB-O 3.43Å; R101-E111 PolarHBondContact N-O 2.81Å
102	V	92.8	Very high	91.1	Very high	64 Å²	64	60.4 Å²	60.4	39%	0.388	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.8	174.6	-172.6	0	0	0	0	108	A110 E111	V102-A110 WeakPolarHBondContact O-CA 3.37Å; V102-E111 HydrophobicContact CB-CB 3.95Å; V102-E111 HydrophobicContact CB-CG 4.21Å; V102-E111 HydrophobicContact CG2-CB 4.16Å; V102-E111 HydrophobicContact CG2-CG 4.42Å; V102-E111 PolarHBondContact N-O 2.82Å; V102-E111 VanDerWaalsContact N-O 3.13Å; V102-E111 PolarHBondContact O-N 2.69Å
103	A	91.6	Very high	91	Very high	68 Å²	68	60.5 Å²	60.5	56%	0.562	35%	0.346	S	S	*	.			trans	-68.4	142	176.5	0	0	0	0	0	110.5
104	G	91.4	Very high	90.9	Very high	24 Å²	24	60.1 Å²	60.1	25%	0.247	35%	0.348	C	S	.	.			trans	-66.7	141.7	174.9	0	0	0	0	0	111.5	H89	H89-G104 WeakPolarHBondContact NE2-CA 3.04Å
105	T	94.5	Very high	91	Very high	68 Å²	68	58.3 Å²	58.3	42%	0.417	33%	0.332	S	S	.	.			trans	-116.7	176.6	175.6	69.2	0	0	0	0	109.6	Y78 H89 E107 S108	Y78-T105 WeakPolarHBondContact CB-O 3.23Å; H89-T105 PolarHBondContact CE1-O 3.01Å; H89-T105 PolarHBondContact NE2-N 3.36Å; H89-T105 PolarHBondContact NE2-O 3.18Å; T105-E107 PolarHBondContact O-N 3.25Å; T105-E107 VanDerWaalsContact O-N 3.17Å; T105-E107 PolarHBondContact OG1-N 2.97Å; T105-S108 PolarHBondContact N-O 3.24Å; T105-S108 PolarHBondContact OG1-N 3.12Å; T105-S108 VanDerWaalsContact OG1-N 3.1Å; T105-S108 PolarHBondContact OG1-OG 2.87Å
106	A	94	Very high	91.2	Very high	47 Å²	47	55.4 Å²	55.4	39%	0.388	32%	0.317	S	S	.	.	S	Bend	trans	-59.8	-25.4	172.9	0	0	0	0	0	112.1	G52 Y78 S79	G52-A106 WeakPolarHBondContact CA-O 3.28Å; Y78-A106 CarbonylContact C-O 3.36Å; Y78-A106 WeakPolarHBondContact CA-O 3.36Å; Y78-A106 WeakPolarHBondContact CB-O 3.45Å; S79-A106 PolarHBondContact N-O 2.9Å
107	E	94.6	Very high	91.3	Very high	120 Å²	120	60.7 Å²	60.7	56%	0.561	35%	0.353	S	S	*	.	S	Bend	trans	-99.8	-23.3	-171.9	-57.3	176.6	-174.1	0	0	112.7	P51 T105	P51-E107 HydrophobicContact CB-CB 3.86Å; P51-E107 HydrophobicContact CB-CG 3.75Å; T105-E107 PolarHBondContact O-N 3.25Å; T105-E107 VanDerWaalsContact O-N 3.17Å; T105-E107 PolarHBondContact OG1-N 2.97Å
108	S	92.1	Very high	90.9	Very high	49 Å²	49	59 Å²	59	34%	0.343	35%	0.352	S	S	.	.	S	Bend	trans	-135.3	148.6	-172.5	71.4	0	0	0	0	113.3	H89 T105	H89-S108 PolarHBondContact CD2-O 3.43Å; H89-S108 PolarHBondContact NE2-O 3.38Å; T105-S108 PolarHBondContact N-O 3.24Å; T105-S108 PolarHBondContact OG1-N 3.12Å; T105-S108 VanDerWaalsContact OG1-N 3.1Å; T105-S108 PolarHBondContact OG1-OG 2.87Å
109	D	93.9	Very high	90.8	Very high	25 Å²	25	62.6 Å²	62.6	13%	0.134	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-64.9	161.4	172.8	-150.1	-14.2	0	0	0	111.8	Y78 H89 K90	Y78-D109 HydrophobicContact CD1-CB 4.18Å; Y78-D109 HydrophobicContact CD2-CB 4.36Å; Y78-D109 HydrophobicContact CE1-CB 3.56Å; Y78-D109 WeakPolarHBondContact CE1-OD1 3.26Å; Y78-D109 HydrophobicContact CE2-CB 3.8Å; Y78-D109 WeakPolarHBondContact OH-CB 3.28Å; Y78-D109 VanDerWaalsContact OH-CG 3.22Å; Y78-D109 PolarHBondContact OH-OD2 2.98Å; H89-D109 VanDerWaalsContact CA-OD1 3.25Å; H89-D109 WeakPolarHBondContact CA-OD1 3.22Å; K90-D109 VanDerWaalsContact CE-OD2 3.28Å; K90-D109 WeakPolarHBondContact CE-OD2 3.25Å; K90-D109 WeakPolarHBondContact CG-OD2 3.35Å; K90-D109 PolarHBondContact N-OD1 2.03Å; K90-D109 IonicContact NZ-OD2 3.41Å; K90-D109 PolarHBondContact NZ-OD2 3.49Å
110	A	92	Very high	90.5	Very high	7 Å²	7	61.2 Å²	61.2	6%	0.058	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-72.8	138.8	165.5	0	0	0	0	0	110.4	H89 V102	H89-A110 HydrophobicContact CB-CB 4.13Å; V102-A110 WeakPolarHBondContact O-CA 3.37Å
111	E	91.4	Very high	90	Very high	105 Å²	105	59.7 Å²	59.7	49%	0.491	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122.9	174.2	-61.8	-172.4	-179.3	0	0	110.3	R101 V102	R101-E111 WeakPolarHBondContact CA-O 3.5Å; R101-E111 WeakPolarHBondContact CB-O 3.43Å; R101-E111 PolarHBondContact N-O 2.81Å; V102-E111 HydrophobicContact CB-CB 3.95Å; V102-E111 HydrophobicContact CB-CG 4.21Å; V102-E111 HydrophobicContact CG2-CB 4.16Å; V102-E111 HydrophobicContact CG2-CG 4.42Å; V102-E111 PolarHBondContact N-O 2.82Å; V102-E111 VanDerWaalsContact N-O 3.13Å; V102-E111 PolarHBondContact O-N 2.69Å
112	C	90.9	Very high	89.1	Confident	22 Å²	22	55.4 Å²	55.4	15%	0.149	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	137.8	177.4	-51	0	0	0	0	111.1	C92 A98	C92-C112 WeakPolarHBondContact CA-SG 3.09Å; C92-C112 HydrophobicContact CB-CB 3.79Å; C92-C112 WeakPolarHBondContact CB-SG 3.31Å; C92-C112 WeakPolarHBondContact SG-CA 3.4Å; C92-C112 WeakPolarHBondContact SG-CB 3.44Å; C92-C112 CovalentContact SG-SG 2.05Å; C92-C112 PolarHBondContact SG-SG 2.88Å; A98-C112 HydrophobicContact CB-CB 4.2Å
113	G	88.1	Confident	87.6	Confident	6 Å²	6	59.3 Å²	59.3	6%	0.062	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-152.9	177.1	0	0	0	0	0	112.5	T99	T99-G113 PolarHBondContact O-N 3.44Å
114	P	88.2	Confident	85.7	Confident	89 Å²	89	63.5 Å²	63.5	58%	0.578	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	159.1	178.1	27.9	-36.3	0	0	0	112.5	A98 T99	A98-P114 WeakPolarHBondContact CA-O 3.37Å; T99-P114 PolarHBondContact N-O 3.36Å; T99-P114 WeakPolarHBondContact OG1-CD 3.41Å; T99-P114 PolarHBondContact OG1-O 2.98Å
115	C	89.3	Confident	83.5	Confident	22 Å²	22	68.4 Å²	68.4	15%	0.149	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	148.7	175.2	-61.7	0	0	0	0	112.9	Y119 Y120 M121 C134	C115-Y119 WeakPolarHBondContact CB-O 3.46Å; C115-Y120 VanDerWaalsContact SG-C 3.58Å; C115-M121 WeakPolarHBondContact SG-CG 3.49Å; C115-C134 WeakPolarHBondContact CA-SG 3.47Å; C115-C134 HydrophobicContact CB-CB 3.67Å; C115-C134 WeakPolarHBondContact CB-SG 3.5Å; C115-C134 WeakPolarHBondContact SG-CB 3.26Å; C115-C134 CovalentContact SG-SG 2.02Å; C115-C134 PolarHBondContact SG-SG 2.96Å
116	L	89.7	Confident	81.1	Confident	45 Å²	45	69.8 Å²	69.8	24%	0.236	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-64.6	154.2	170.7	-67.7	171.8	0	0	0	110.7	D93 K97 T99 G118 Y119	D93-L116 WeakPolarHBondContact OD1-CD1 3.48Å; K97-L116 WeakPolarHBondContact O-CB 3.05Å; K97-L116 WeakPolarHBondContact O-CG 3.03Å; K97-L116 PolarHBondContact O-N 3.1Å; T99-L116 HydrophobicContact CG2-CD2 3.84Å; L116-G118 PolarHBondContact O-N 3.18Å; L116-Y119 HydrophobicContact CB-CD2 4.16Å; L116-Y119 WeakPolarHBondContact O-CB 3.49Å; L116-Y119 PolarHBondContact O-N 3.07Å
117	P	87.9	Confident	78.9	Confident	124 Å²	124	79.7 Å²	79.7	81%	0.805	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	131.4	176.1	-26	34.5	0	0	0	112.3	Y119	P117-Y119 VanDerWaalsContact C-N 3.34Å
118	G	83.5	Confident	76.6	Confident	25 Å²	25	78.4 Å²	78.4	26%	0.258	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	5.1	-176.1	0	0	0	0	0	114.6	L116 C137	L116-G118 PolarHBondContact O-N 3.18Å; G118-C137 VanDerWaalsContact O-CB 3.31Å; G118-C137 WeakPolarHBondContact O-CB 3.33Å; G118-C137 PolarHBondContact O-N 3.28Å; G118-C137 PolarHBondContact O-SG 2.8Å; G118-C137 VanDerWaalsContact O-SG 3.36Å
119	Y	86.2	Confident	74.6	Confident	77 Å²	77	80.1 Å²	80.1	30%	0.302	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	153.3	169.5	-61.4	-99.8	0	0	0	111.1	K97 C115 L116 P117 H135	K97-Y119 HydrophobicContact CB-CD1 3.75Å; K97-Y119 HydrophobicContact CB-CD2 4.38Å; K97-Y119 HydrophobicContact CB-CE1 4.01Å; K97-Y119 HydrophobicContact CB-CG 3.98Å; K97-Y119 HydrophobicContact CD-CD1 4.42Å; K97-Y119 HydrophobicContact CD-CE1 3.8Å; K97-Y119 HydrophobicContact CD-CE2 4.16Å; K97-Y119 HydrophobicContact CG-CD1 3.95Å; K97-Y119 HydrophobicContact CG-CE1 3.69Å; C115-Y119 WeakPolarHBondContact CB-O 3.46Å; L116-Y119 HydrophobicContact CB-CD2 4.16Å; L116-Y119 WeakPolarHBondContact O-CB 3.49Å; L116-Y119 PolarHBondContact O-N 3.07Å; P117-Y119 VanDerWaalsContact C-N 3.34Å; Y119-H135 CarbonylContact C-O 3.53Å; Y119-H135 WeakPolarHBondContact CA-O 3.42Å; Y119-H135 WeakPolarHBondContact CB-O 3.44Å
120	Y	84.1	Confident	72.5	Confident	24 Å²	24	87 Å²	87	9%	0.094	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	153.1	-177.9	76.2	-77.9	0	0	0	111.9	C115 L122 C134 H135 S136 A140 P141 T144 E146 C147	C115-Y120 VanDerWaalsContact SG-C 3.58Å; Y120-L122 HydrophobicContact CD2-CD1 4.16Å; Y120-L122 HydrophobicContact CE2-CD1 3.23Å; Y120-L122 HydrophobicContact CE2-CG 4.28Å; Y120-L122 WeakPolarHBondContact OH-CD1 3.38Å; Y120-C134 CarbonylContact O-C 3.48Å; Y120-C134 WeakPolarHBondContact O-CA 3.42Å; Y120-H135 HydrophobicContact CD1-CB 4.08Å; Y120-H135 WeakPolarHBondContact CD1-O 3.32Å; Y120-H135 HydrophobicContact CE1-CB 3.64Å; Y120-H135 PolarHBondContact N-O 3.2Å; Y120-H135 PolarHBondContact O-N 3.47Å; Y120-S136 WeakPolarHBondContact CE1-O 3.19Å; Y120-A140 HydrophobicContact CD1-CB 3.98Å; Y120-A140 HydrophobicContact CE1-CB 3.5Å; Y120-P141 WeakPolarHBondContact OH-CD 3.36Å; Y120-T144 HydrophobicContact CD2-CG2 3.81Å; Y120-T144 HydrophobicContact CE2-CG2 3.67Å; Y120-T144 HydrophobicContact CG-CG2 4.49Å; Y120-E146 WeakPolarHBondContact CA-OE2 3.25Å; Y120-E146 WeakPolarHBondContact CB-OE2 3.42Å; Y120-C147 VanDerWaalsContact CD1-SG 3.56Å
121	M	81.8	Confident	70.6	Confident	54 Å²	54	89.2 Å²	89.2	27%	0.266	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	139.8	173.2	-62.2	-166.3	-71.5	0	0	111	C115 M132 E146	C115-M121 WeakPolarHBondContact SG-CG 3.49Å; M121-M132 HydrophobicContact SD-CE 3.93Å; M121-M132 HydrophobicContact SD-SD 3.67Å; M121-M132 VanDerWaalsContact SD-SD 3.67Å; M121-E146 PolarHBondContact N-OE2 3.08Å
122	L	72.6	Confident	69.2	Low	98 Å²	98	88.2 Å²	88.2	51%	0.513	48%	0.477	S	S	.	.			trans	-85	107.8	165.5	-104.9	83.5	0	0	0	109.1	Y120 N124	Y120-L122 HydrophobicContact CD2-CD1 4.16Å; Y120-L122 HydrophobicContact CE2-CD1 3.23Å; Y120-L122 HydrophobicContact CE2-CG 4.28Å; Y120-L122 WeakPolarHBondContact OH-CD1 3.38Å; L122-N124 PolarHBondContact O-N 3.41Å
123	D	62.3	Low	68.7	Low	147 Å²	147	90.1 Å²	90.1	79%	0.786	49%	0.488	S	S	*	.			trans	-68.1	14.7	179.7	-78.8	-31.2	0	0	0	115.4
124	N	50.7	Low	68.6	Low	156 Å²	156	90.2 Å²	90.2	83%	0.834	49%	0.487	S	S	*	.			trans	-114.6	39.8	-160.6	-107.7	28.7	0	0	0	116.8	L122	L122-N124 PolarHBondContact O-N 3.41Å
125	K	45.7	Very low	68.6	Low	126 Å²	126	90 Å²	90	55%	0.548	48%	0.478	S	S	.	.	S	Bend	trans	-156.3	146.1	155.9	-151.3	163.4	-177.8	172.9	0	110.4	D404	K125-D404 IonicContact NZ-OD1 2.76Å; K125-D404 PolarHBondContact NZ-OD1 3.02Å
126	P	43.4	Very low	68.4	Low	97 Å²	97	90.6 Å²	90.6	63%	0.63	48%	0.483	S	S	*	.			trans	-47.9	146.5	177.4	16.1	-32.8	0	0	0	112.2	N128	P126-N128 VanDerWaalsContact O-CG 3.23Å; P126-N128 PolarHBondContact O-N 2.87Å; P126-N128 PolarHBondContact O-OD1 3.05Å
127	R	48.7	Very low	68.2	Low	256 Å²	256	89.8 Å²	89.8	97%	0.966	48%	0.481	S	S	*	.			trans	-58	66.5	-172.1	-151.6	177	-165	175.4	2.7	112.5
128	N	45.8	Very low	67.9	Low	92 Å²	92	91.6 Å²	91.6	49%	0.492	48%	0.478	S	S	.	.			trans	-72.2	146.6	170.4	-54.2	-13.5	0	0	0	107.5	P126 Y130 G131	P126-N128 VanDerWaalsContact O-CG 3.23Å; P126-N128 PolarHBondContact O-N 2.87Å; P126-N128 PolarHBondContact O-OD1 3.05Å; N128-Y130 PolarHBondContact O-N 3.05Å; N128-G131 PolarHBondContact O-N 3.46Å
129	A	51	Low	67.3	Low	85 Å²	85	97.4 Å²	97.4	70%	0.702	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-9.8	-176	0	0	0	0	0	115.4
130	Y	48.8	Very low	66.6	Low	169 Å²	169	94.9 Å²	94.9	66%	0.663	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	7	176.5	-68	-88.2	0	0	0	113.9	N128 M132	N128-Y130 PolarHBondContact O-N 3.05Å; Y130-M132 VanDerWaalsContact C-N 3.31Å; Y130-M132 PolarHBondContact O-N 2.9Å
131	G	52.8	Low	66	Low	55 Å²	55	96.9 Å²	96.9	57%	0.567	51%	0.514	S	S	*	.			trans	-81.5	10.8	-169.1	0	0	0	0	0	116.9	N128	N128-G131 PolarHBondContact O-N 3.46Å
132	M	62	Low	64.9	Low	84 Å²	84	99.8 Å²	99.8	41%	0.414	54%	0.54	S	S	.	.			trans	-108.5	45.7	-175.4	-69.6	-87.4	-66.6	0	0	111.9	Y96 M121 Y130	Y96-M132 WeakPolarHBondContact CD1-O 3.38Å; M121-M132 HydrophobicContact SD-CE 3.93Å; M121-M132 HydrophobicContact SD-SD 3.67Å; M121-M132 VanDerWaalsContact SD-SD 3.67Å; Y130-M132 VanDerWaalsContact C-N 3.31Å; Y130-M132 PolarHBondContact O-N 2.9Å
133	V	80.4	Confident	64.3	Low	62 Å²	62	101 Å²	101	38%	0.376	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-91.5	122.9	175.4	-176.6	0	0	0	0	109.3	Y96 H135	Y96-V133 HydrophobicContact CD1-CG2 3.81Å; Y96-V133 HydrophobicContact CE1-CG2 3.97Å; V133-H135 PolarHBondContact O-CD2 2.05Å
134	C	86.4	Confident	64.7	Low	8 Å²	8	95.1 Å²	95.1	5%	0.054	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.8	177.2	-61	0	0	0	0	111.6	Y96 K97 C115 Y120	Y96-C134 WeakPolarHBondContact O-CB 3.27Å; Y96-C134 PolarHBondContact O-N 2.92Å; Y96-C134 PolarHBondContact O-SG 3.36Å; Y96-C134 VanDerWaalsContact O-SG 3.35Å; K97-C134 HydrophobicContact CB-CB 3.96Å; C115-C134 WeakPolarHBondContact CA-SG 3.47Å; C115-C134 HydrophobicContact CB-CB 3.67Å; C115-C134 WeakPolarHBondContact CB-SG 3.5Å; C115-C134 WeakPolarHBondContact SG-CB 3.26Å; C115-C134 CovalentContact SG-SG 2.02Å; C115-C134 PolarHBondContact SG-SG 2.96Å; Y120-C134 CarbonylContact O-C 3.48Å; Y120-C134 WeakPolarHBondContact O-CA 3.42Å
135	H	86.6	Confident	65.6	Low	83 Å²	83	96.4 Å²	96.4	38%	0.384	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	149.4	-179.2	-65.9	-85.8	0	0	0	111.3	Y119 Y120 V133	Y119-H135 CarbonylContact C-O 3.53Å; Y119-H135 WeakPolarHBondContact CA-O 3.42Å; Y119-H135 WeakPolarHBondContact CB-O 3.44Å; Y120-H135 HydrophobicContact CD1-CB 4.08Å; Y120-H135 WeakPolarHBondContact CD1-O 3.32Å; Y120-H135 HydrophobicContact CE1-CB 3.64Å; Y120-H135 PolarHBondContact N-O 3.2Å; Y120-H135 PolarHBondContact O-N 3.47Å; V133-H135 PolarHBondContact O-CD2 2.05Å
136	S	85.8	Confident	66.6	Low	35 Å²	35	95.2 Å²	95.2	25%	0.245	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	144.3	-178.9	83.5	0	0	0	0	112.3	Y120 Q138	Y120-S136 WeakPolarHBondContact CE1-O 3.19Å; S136-Q138 PolarHBondContact O-N 3.39Å; S136-Q138 PolarHBondContact OG-OE1 3.1Å
137	C	85.3	Confident	68.1	Low	29 Å²	29	91.5 Å²	91.5	20%	0.196	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-69.5	-7.8	178.1	-73.9	0	0	0	0	114.5	G118 N139 A140 C147	G118-C137 VanDerWaalsContact O-CB 3.31Å; G118-C137 WeakPolarHBondContact O-CB 3.33Å; G118-C137 PolarHBondContact O-N 3.28Å; G118-C137 PolarHBondContact O-SG 2.8Å; G118-C137 VanDerWaalsContact O-SG 3.36Å; C137-N139 VanDerWaalsContact C-N 3.27Å; C137-N139 PolarHBondContact O-N 3.03Å; C137-A140 PolarHBondContact O-N 3.27Å; C137-C147 WeakPolarHBondContact CA-SG 3.33Å; C137-C147 HydrophobicContact CB-CB 3.54Å; C137-C147 WeakPolarHBondContact CB-SG 3.31Å; C137-C147 WeakPolarHBondContact SG-CA 3.45Å; C137-C147 WeakPolarHBondContact SG-CB 3.41Å; C137-C147 CovalentContact SG-SG 2.04Å; C137-C147 PolarHBondContact SG-SG 3.37Å
138	Q	82.3	Confident	68.7	Low	162 Å²	162	85 Å²	85	76%	0.757	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-62.7	-32.7	-177.8	-82.1	116.5	2.8	0	0	113.3	S136	S136-Q138 PolarHBondContact O-N 3.39Å; S136-Q138 PolarHBondContact OG-OE1 3.1Å
139	N	70.5	Confident	69.3	Low	147 Å²	147	87.9 Å²	87.9	79%	0.786	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-118.2	19.2	-178.8	-63.7	-29.1	0	0	0	111.8	C137	C137-N139 VanDerWaalsContact C-N 3.27Å; C137-N139 PolarHBondContact O-N 3.03Å
140	A	72.4	Confident	69.3	Low	23 Å²	23	88.5 Å²	88.5	19%	0.19	47%	0.47	C	S	.	.			trans	-69.6	139.9	-174.9	0	0	0	0	0	110.9	Y120 C137 T144 C147	Y120-A140 HydrophobicContact CD1-CB 3.98Å; Y120-A140 HydrophobicContact CE1-CB 3.5Å; C137-A140 PolarHBondContact O-N 3.27Å; A140-T144 HydrophobicContact CB-CG2 4.18Å; A140-T144 VanDerWaalsContact CB-OG1 3.28Å; A140-T144 WeakPolarHBondContact CB-OG1 3.1Å; A140-C147 HydrophobicContact CB-CB 4.07Å; A140-C147 VanDerWaalsContact CB-SG 3.59Å
141	P	70.3	Confident	69	Low	66 Å²	66	85.4 Å²	85.4	43%	0.429	47%	0.473	S	S	.	.			trans	-51.7	143.6	169.9	-26.1	34.2	0	0	0	111	Y120 N143 T144	Y120-P141 WeakPolarHBondContact OH-CD 3.36Å; P141-N143 WeakPolarHBondContact CB-OD1 3.48Å; P141-N143 PolarHBondContact O-N 3.17Å; P141-T144 HydrophobicContact CB-CG2 4.41Å; P141-T144 PolarHBondContact O-N 3.24Å; P141-T144 PolarHBondContact O-OG1 2.95Å
142	S	58.9	Low	68.5	Low	115 Å²	115	91 Å²	91	80%	0.804	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-6.4	-173.7	42.7	0	0	0	0	115.1
143	N	61.1	Low	67.5	Low	124 Å²	124	92.7 Å²	92.7	66%	0.663	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	11.2	177.8	66.5	-48	0	0	0	114.6	P141 K145	P141-N143 WeakPolarHBondContact CB-OD1 3.48Å; P141-N143 PolarHBondContact O-N 3.17Å; N143-K145 PolarHBondContact O-N 3.42Å
144	T	70.5	Confident	65.5	Low	24 Å²	24	99.3 Å²	99.3	15%	0.147	52%	0.523	C	S	.	.			trans	-83.5	103.6	178.4	48.9	0	0	0	0	111.7	Y120 A140 P141 E146 C147 M148	Y120-T144 HydrophobicContact CD2-CG2 3.81Å; Y120-T144 HydrophobicContact CE2-CG2 3.67Å; Y120-T144 HydrophobicContact CG-CG2 4.49Å; A140-T144 HydrophobicContact CB-CG2 4.18Å; A140-T144 VanDerWaalsContact CB-OG1 3.28Å; A140-T144 WeakPolarHBondContact CB-OG1 3.1Å; P141-T144 HydrophobicContact CB-CG2 4.41Å; P141-T144 PolarHBondContact O-N 3.24Å; P141-T144 PolarHBondContact O-OG1 2.95Å; T144-E146 PolarHBondContact O-N 3.48Å; T144-E146 VanDerWaalsContact O-N 3.15Å; T144-C147 PolarHBondContact O-N 2.87Å; T144-C147 WeakPolarHBondContact OG1-CB 3.46Å; T144-M148 WeakPolarHBondContact O-CG 3.2Å; T144-M148 PolarHBondContact O-N 2.86Å
145	K	69.1	Low	63.1	Low	182 Å²	182	107.9 Å²	107.9	79%	0.791	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-32.9	-174.3	-61.4	176.8	-176.2	173.4	0	113.5	N143 C147	N143-K145 PolarHBondContact O-N 3.42Å; K145-C147 VanDerWaalsContact C-N 3.31Å
146	E	67.3	Low	60.8	Low	101 Å²	101	112.9 Å²	112.9	47%	0.472	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.9	-26.7	-179.3	-65.2	168.5	-177.1	0	0	112.4	Y120 M121 T144	Y120-E146 WeakPolarHBondContact CA-OE2 3.25Å; Y120-E146 WeakPolarHBondContact CB-OE2 3.42Å; M121-E146 PolarHBondContact N-OE2 3.08Å; T144-E146 PolarHBondContact O-N 3.48Å; T144-E146 VanDerWaalsContact O-N 3.15Å
147	C	73.9	Confident	58.7	Low	19 Å²	19	116.4 Å²	116.4	13%	0.128	61%	0.605	C	S	.	*	T	Hydrogen-bonded Turn	trans	-97	-18.3	-177.8	-61.1	0	0	0	0	113.8	Y120 C137 A140 T144 K145 Q149	Y120-C147 VanDerWaalsContact CD1-SG 3.56Å; C137-C147 WeakPolarHBondContact CA-SG 3.33Å; C137-C147 HydrophobicContact CB-CB 3.54Å; C137-C147 WeakPolarHBondContact CB-SG 3.31Å; C137-C147 WeakPolarHBondContact SG-CA 3.45Å; C137-C147 WeakPolarHBondContact SG-CB 3.41Å; C137-C147 CovalentContact SG-SG 2.04Å; C137-C147 PolarHBondContact SG-SG 3.37Å; A140-C147 HydrophobicContact CB-CB 4.07Å; A140-C147 VanDerWaalsContact CB-SG 3.59Å; T144-C147 PolarHBondContact O-N 2.87Å; T144-C147 WeakPolarHBondContact OG1-CB 3.46Å; K145-C147 VanDerWaalsContact C-N 3.31Å; C147-Q149 PolarHBondContact O-N 2.94Å
148	M	61.6	Low	56.3	Low	121 Å²	121	120.8 Å²	120.8	60%	0.596	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-13.2	178.9	-67.4	-177.3	86.3	0	0	113.9	T144 S151	T144-M148 WeakPolarHBondContact O-CG 3.2Å; T144-M148 PolarHBondContact O-N 2.86Å; M148-S151 PolarHBondContact O-OG 3.34Å
149	Q	57.5	Low	54.3	Low	151 Å²	151	120.8 Å²	120.8	71%	0.706	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-10.4	-175.7	-69.5	-88.9	-20.6	0	0	114.2	C147	C147-Q149 PolarHBondContact O-N 2.94Å
150	I	52.6	Low	52.5	Low	99 Å²	99	120.9 Å²	120.9	51%	0.508	64%	0.637	S	S	.	*			trans	-93.3	-5.9	-176	-61.5	100	0	0	0	113	K152	I150-K152 PolarHBondContact O-N 2.93Å
151	S	42.3	Very low	51.1	Low	103 Å²	103	125.7 Å²	125.7	72%	0.72	67%	0.666	S	S	*	*			trans	-77.5	44.3	170.8	56.9	0	0	0	0	112.8	M148	M148-S151 PolarHBondContact O-OG 3.34Å
152	K	41.7	Very low	49.4	Very low	172 Å²	172	126.1 Å²	126.1	75%	0.748	68%	0.683	S	S	*	*			trans	-86.5	119.4	157.7	-76.3	-173.5	-179.9	177.6	0	107.5	I150 K154	I150-K152 PolarHBondContact O-N 2.93Å; K152-K154 PolarHBondContact O-N 3.34Å
153	P	40.5	Very low	48	Very low	120 Å²	120	126.6 Å²	126.6	78%	0.779	69%	0.686	S	S	*	*			trans	-55.7	129.3	173.7	-18.3	29.2	0	0	0	108.7	E155	P153-E155 PolarHBondContact O-N 2.98Å
154	K	38.6	Very low	47	Very low	202 Å²	202	126.4 Å²	126.4	88%	0.878	69%	0.69	S	S	*	*			trans	-55.9	103.6	169.2	-148.3	175.4	-172.4	177.4	0	107.2	K152 K156	K152-K154 PolarHBondContact O-N 3.34Å; K154-K156 PolarHBondContact O-N 3.28Å; K154-K156 VanDerWaalsContact O-N 3.08Å
155	E	37	Very low	45.3	Very low	187 Å²	187	131 Å²	131	87%	0.874	72%	0.718	S	S	*	*			trans	-57.6	113.1	176.2	-164.7	172.5	-175.8	0	0	107.7	P153	P153-E155 PolarHBondContact O-N 2.98Å
156	K	38.5	Very low	43.5	Very low	188 Å²	188	128.2 Å²	128.2	82%	0.817	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-72.2	131.9	175.9	-69.8	179.8	-179.8	178.3	0	107.7	K154	K154-K156 PolarHBondContact O-N 3.28Å; K154-K156 VanDerWaalsContact O-N 3.08Å
157	P	40.3	Very low	42.1	Very low	110 Å²	110	133.1 Å²	133.1	71%	0.714	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-64.6	150.1	170.1	26	-30.6	0	0	0	110.4	I159	P157-I159 PolarHBondContact O-N 3.27Å
158	P	36.1	Very low	40.6	Very low	121 Å²	121	137.4 Å²	137.4	79%	0.786	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-69.5	131.7	-167.2	27.7	-33.1	0	0	0	111.5
159	I	40.3	Very low	39.6	Very low	161 Å²	161	140.3 Å²	140.3	83%	0.826	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-75.9	118.5	169.8	-63.9	170.8	0	0	0	107.7	P157	P157-I159 PolarHBondContact O-N 3.27Å
160	N	32.8	Very low	38.2	Very low	149 Å²	149	144.1 Å²	144.1	80%	0.797	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-78.6	137.2	164.2	-88.6	-49.8	0	0	0	110.1
161	P	42.1	Very low	38	Very low	125 Å²	125	146.2 Å²	146.2	81%	0.812	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-86.6	117.5	177.9	33	-28.4	0	0	0	109.9
162	G	34.2	Very low	37.4	Very low	75 Å²	75	151.1 Å²	151.1	77%	0.773	80%	0.802	S	S	*	*			trans	154.3	84.3	167.3	0	0	0	0	0	114
163	S	29.2	Very low	36.9	Very low	125 Å²	125	151.1 Å²	151.1	87%	0.874	81%	0.805	S	S	*	*				-170.2	120.4	129.8	-155.8	0	0	0	0	109.9
164	T	40.4	Very low	36.5	Very low	120 Å²	120	149.8 Å²	149.8	74%	0.736	80%	0.798	S	S	*	*			trans	-74.7	150.8	178.7	-43	0	0	0	0	110.3
165	T	35.9	Very low	37.1	Very low	121 Å²	121	146.9 Å²	146.9	74%	0.742	80%	0.8	S	S	*	*			trans	106.8	131.3	149	74.2	0	0	0	0	118.9
166	V	30.3	Very low	37.8	Very low	123 Å²	123	140.7 Å²	140.7	75%	0.745	79%	0.786	S	S	*	*			trans	90.9	95	150.9	-161.9	0	0	0	0	117.8
167	F	38.6	Very low	38.2	Very low	204 Å²	204	139.9 Å²	139.9	90%	0.895	79%	0.786	S	S	*	*			trans	-58.1	142.5	143.9	-80.2	-88.6	0	0	0	109.7
168	P	41.8	Very low	38.7	Very low	109 Å²	109	136.7 Å²	136.7	71%	0.708	77%	0.773	S	S	*	*				-139.2	137.5	119.4	32.6	-17.9	0	0	0	113.3
169	H	40.9	Very low	39.8	Very low	182 Å²	182	138.8 Å²	138.8	84%	0.843	77%	0.772	S	S	*	*			trans	-70.4	120.7	156	-156	35.6	0	0	0	108
170	R	27.1	Very low	40.9	Very low	231 Å²	231	137.2 Å²	137.2	87%	0.872	76%	0.764	S	S	*	*			trans	-157.7	110.8	159.9	-99.3	-65.3	-173.7	166.6	1	110.7	K172	R170-K172 PolarHBondContact O-N 3.11Å
171	I	49.1	Very low	42.6	Very low	143 Å²	143	132.6 Å²	132.6	73%	0.733	75%	0.747	S	S	*	*			trans	-37.5	127.3	152.7	-62.7	158.5	0	0	0	109.8	E173	I171-E173 HydrophobicContact CG2-CG 4.47Å
172	K	30.4	Very low	44	Very low	205 Å²	205	130.3 Å²	130.3	89%	0.891	73%	0.731	S	S	*	*			trans	-145.3	88.3	159.4	-136.3	172.1	-174.7	-178.9	0	109.2	R170	R170-K172 PolarHBondContact O-N 3.11Å
173	E	30.8	Very low	46	Very low	173 Å²	173	129.3 Å²	129.3	81%	0.808	72%	0.715	S	S	*	*			trans	-60.5	129.6	160.9	-64.5	-176.3	159.4	0	0	108.7	I171	I171-E173 HydrophobicContact CG2-CG 4.47Å
174	S	33	Very low	48.5	Very low	92 Å²	92	128.2 Å²	128.2	64%	0.643	70%	0.699	S	S	*	*			trans	-80.3	126.8	171.1	51.8	0	0	0	0	109.9	G176	S174-G176 PolarHBondContact O-N 3.12Å; S174-G176 VanDerWaalsContact O-N 3.12Å
175	P	50.7	Low	50.6	Low	140 Å²	140	128.1 Å²	128.1	91%	0.909	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	95.3	175.6	33	-28.9	0	0	0	108.3
176	G	51.3	Low	53	Low	57 Å²	57	126.9 Å²	126.9	59%	0.588	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171	-21.9	179.1	0	0	0	0	0	114.1	S174 G178	S174-G176 PolarHBondContact O-N 3.12Å; S174-G176 VanDerWaalsContact O-N 3.12Å; G176-G178 VanDerWaalsContact C-N 3.35Å; G176-G178 PolarHBondContact O-N 3.35Å
177	Q	45.9	Very low	55.7	Low	172 Å²	172	123.1 Å²	123.1	80%	0.804	66%	0.662	S	S	*	*	S	Bend	trans	-91.3	13.6	-177.9	-152.9	101.5	-13.8	0	0	113.8
178	G	51.9	Low	58.2	Low	43 Å²	43	118.5 Å²	118.5	44%	0.443	65%	0.645	S	S	.	*	S	Bend	trans	-95.3	-31.9	179	0	0	0	0	0	113.7	G176 T182	G176-G178 VanDerWaalsContact C-N 3.35Å; G176-G178 PolarHBondContact O-N 3.35Å; G178-T182 PolarHBondContact O-N 3.46Å; G178-T182 PolarHBondContact O-OG1 2.98Å
179	H	58.6	Low	60.5	Low	165 Å²	165	115.7 Å²	115.7	76%	0.764	63%	0.628	S	S	*	*	H	α-helix	trans	-75.8	-31.7	-171.6	-79.9	-63.2	0	0	0	114	A183	H179-A183 WeakPolarHBondContact O-CB 3.49Å; H179-A183 PolarHBondContact O-N 3.14Å
180	L	63.9	Low	63	Low	127 Å²	127	110.3 Å²	110.3	67%	0.665	61%	0.608	S	S	*	*	H	α-helix	trans	-71.1	-43.4	179	-172.6	69.7	0	0	0	111.8	A183 L184	L180-A183 PolarHBondContact O-N 3.19Å; L180-L184 HydrophobicContact CG-CD1 4.22Å; L180-L184 WeakPolarHBondContact O-CB 3.37Å; L180-L184 VanDerWaalsContact O-CG 3.29Å; L180-L184 WeakPolarHBondContact O-CG 3.35Å; L180-L184 PolarHBondContact O-N 3.43Å
181	A	67.7	Low	66.2	Low	52 Å²	52	104.5 Å²	104.5	43%	0.43	59%	0.593	S	S	.	*	H	α-helix	trans	-64.2	-43.6	178.6	0	0	0	0	0	111.4	L184 I185	A181-L184 PolarHBondContact O-N 3.31Å; A181-I185 WeakPolarHBondContact O-CD1 3.17Å; A181-I185 WeakPolarHBondContact O-CG1 3.37Å; A181-I185 PolarHBondContact O-N 2.86Å
182	T	72.1	Confident	68.3	Low	78 Å²	78	104.2 Å²	104.2	48%	0.479	59%	0.587	S	S	.	*	H	α-helix	trans	-66.8	-38.6	175.5	-50.3	0	0	0	0	112.2	G178 I185 I186	G178-T182 PolarHBondContact O-N 3.46Å; G178-T182 PolarHBondContact O-OG1 2.98Å; T182-I185 PolarHBondContact O-N 3.03Å; T182-I186 HydrophobicContact CG2-CD1 3.96Å; T182-I186 WeakPolarHBondContact O-CB 3.42Å; T182-I186 VanDerWaalsContact O-CG1 3.24Å; T182-I186 WeakPolarHBondContact O-CG1 3.49Å; T182-I186 PolarHBondContact O-N 3.18Å
183	A	76.3	Confident	71.3	Confident	54 Å²	54	99.8 Å²	99.8	45%	0.446	57%	0.571	S	S	.	*	H	α-helix	trans	-64.4	-40.2	176.3	0	0	0	0	0	112.4	H179 L180 I186 A187	H179-A183 WeakPolarHBondContact O-CB 3.49Å; H179-A183 PolarHBondContact O-N 3.14Å; L180-A183 PolarHBondContact O-N 3.19Å; A183-I186 PolarHBondContact O-N 3.49Å; A183-A187 WeakPolarHBondContact O-CB 3.26Å; A183-A187 PolarHBondContact O-N 3.5Å
184	L	82.1	Confident	74.3	Confident	101 Å²	101	97.2 Å²	97.2	53%	0.529	56%	0.561	S	S	.	*	H	α-helix	trans	-68	-40.4	175.8	-70.5	173.5	0	0	0	111.9	L180 A181 I186 A187 M188	L180-L184 HydrophobicContact CG-CD1 4.22Å; L180-L184 WeakPolarHBondContact O-CB 3.37Å; L180-L184 VanDerWaalsContact O-CG 3.29Å; L180-L184 WeakPolarHBondContact O-CG 3.35Å; L180-L184 PolarHBondContact O-N 3.43Å; A181-L184 PolarHBondContact O-N 3.31Å; L184-I186 VanDerWaalsContact C-N 3.33Å; L184-I186 PolarHBondContact O-N 3.21Å; L184-A187 PolarHBondContact O-N 3.48Å; L184-M188 WeakPolarHBondContact O-CB 3.49Å; L184-M188 WeakPolarHBondContact O-CG 3.3Å; L184-M188 PolarHBondContact O-N 3Å
185	I	84.9	Confident	77.2	Confident	118 Å²	118	95.2 Å²	95.2	61%	0.605	55%	0.549	S	S	*	.	H	α-helix	trans	-62.9	-42.8	175.4	-67.8	163.2	0	0	0	110.5	A181 T182 S189	A181-I185 WeakPolarHBondContact O-CD1 3.17Å; A181-I185 WeakPolarHBondContact O-CG1 3.37Å; A181-I185 PolarHBondContact O-N 2.86Å; T182-I185 PolarHBondContact O-N 3.03Å; I185-S189 VanDerWaalsContact O-CB 3.25Å; I185-S189 WeakPolarHBondContact O-CB 3.23Å; I185-S189 PolarHBondContact O-N 3Å; I185-S189 PolarHBondContact O-OG 2.94Å
186	I	85	Confident	79.3	Confident	96 Å²	96	93.4 Å²	93.4	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-63.3	-49.4	176.3	-68	167	0	0	0	110	T182 A183 L184 M188 S189 T190	T182-I186 HydrophobicContact CG2-CD1 3.96Å; T182-I186 WeakPolarHBondContact O-CB 3.42Å; T182-I186 VanDerWaalsContact O-CG1 3.24Å; T182-I186 WeakPolarHBondContact O-CG1 3.49Å; T182-I186 PolarHBondContact O-N 3.18Å; A183-I186 PolarHBondContact O-N 3.49Å; L184-I186 VanDerWaalsContact C-N 3.33Å; L184-I186 PolarHBondContact O-N 3.21Å; I186-M188 PolarHBondContact O-N 3.31Å; I186-S189 WeakPolarHBondContact CA-OG 3.31Å; I186-S189 PolarHBondContact O-N 3.4Å; I186-S189 VanDerWaalsContact O-N 3.17Å; I186-S189 PolarHBondContact O-OG 2.97Å; I186-T190 HydrophobicContact CG2-CG2 4.31Å; I186-T190 WeakPolarHBondContact O-CG2 3.36Å; I186-T190 PolarHBondContact O-N 3.28Å; I186-T190 PolarHBondContact O-OG1 3.45Å
187	A	87.9	Confident	81.3	Confident	43 Å²	43	92.5 Å²	92.5	36%	0.355	52%	0.518	S	S	.	.	H	α-helix	trans	-59.9	-43.2	179.8	0	0	0	0	0	112.9	A183 L184 T190 I191	A183-A187 WeakPolarHBondContact O-CB 3.26Å; A183-A187 PolarHBondContact O-N 3.5Å; L184-A187 PolarHBondContact O-N 3.48Å; A187-T190 PolarHBondContact O-OG1 2.95Å; A187-I191 WeakPolarHBondContact O-CD1 3.48Å; A187-I191 VanDerWaalsContact O-CG1 3.24Å; A187-I191 WeakPolarHBondContact O-CG1 3.29Å; A187-I191 PolarHBondContact O-N 3.46Å
188	M	89.8	Confident	83.6	Confident	108 Å²	108	88.7 Å²	88.7	53%	0.532	50%	0.502	S	S	.	.	H	α-helix	trans	-66.8	-42.2	176	-65.3	-60.1	-75.6	0	0	110.7	L184 I186 T190 I191 F192	L184-M188 WeakPolarHBondContact O-CB 3.49Å; L184-M188 WeakPolarHBondContact O-CG 3.3Å; L184-M188 PolarHBondContact O-N 3Å; I186-M188 PolarHBondContact O-N 3.31Å; M188-T190 PolarHBondContact O-N 2.98Å; M188-I191 PolarHBondContact O-N 3.36Å; M188-F192 VanDerWaalsContact O-CD2 3.29Å; M188-F192 WeakPolarHBondContact O-CD2 3.48Å; M188-F192 PolarHBondContact O-N 3.34Å; M188-F192 VanDerWaalsContact O-N 3.07Å
189	S	92.1	Very high	85.6	Confident	50 Å²	50	91 Å²	91	35%	0.35	51%	0.508	S	S	.	.	H	α-helix	trans	-65	-36.6	179.8	71.7	0	0	0	0	113.4	I185 I186 F192 I193	I185-S189 VanDerWaalsContact O-CB 3.25Å; I185-S189 WeakPolarHBondContact O-CB 3.23Å; I185-S189 PolarHBondContact O-N 3Å; I185-S189 PolarHBondContact O-OG 2.94Å; I186-S189 WeakPolarHBondContact CA-OG 3.31Å; I186-S189 PolarHBondContact O-N 3.4Å; I186-S189 VanDerWaalsContact O-N 3.17Å; I186-S189 PolarHBondContact O-OG 2.97Å; S189-F192 PolarHBondContact O-N 2.95Å; S189-I193 WeakPolarHBondContact O-CD1 3.49Å; S189-I193 VanDerWaalsContact O-CG1 3.23Å; S189-I193 WeakPolarHBondContact O-CG1 3.43Å; S189-I193 PolarHBondContact O-N 2.94Å
190	T	93.4	Very high	87.2	Confident	69 Å²	69	87.8 Å²	87.8	42%	0.423	50%	0.496	S	S	.	.	H	α-helix	trans	-70.7	-37.7	177.7	55.3	0	0	0	0	111.6	I186 A187 M188 I193 M194	I186-T190 HydrophobicContact CG2-CG2 4.31Å; I186-T190 WeakPolarHBondContact O-CG2 3.36Å; I186-T190 PolarHBondContact O-N 3.28Å; I186-T190 PolarHBondContact O-OG1 3.45Å; A187-T190 PolarHBondContact O-OG1 2.95Å; M188-T190 PolarHBondContact O-N 2.98Å; T190-I193 PolarHBondContact O-N 3.48Å; T190-M194 WeakPolarHBondContact O-CB 2.98Å; T190-M194 VanDerWaalsContact O-CG 3.24Å; T190-M194 WeakPolarHBondContact O-CG 3.05Å; T190-M194 PolarHBondContact O-N 3.38Å
191	I	94.2	Very high	88.5	Confident	109 Å²	109	86.1 Å²	86.1	56%	0.559	49%	0.486	S	S	*	.	H	α-helix	trans	-61.4	-45.2	173.5	-66.6	165.2	0	0	0	110.5	A187 M188 M194 A195	A187-I191 WeakPolarHBondContact O-CD1 3.48Å; A187-I191 VanDerWaalsContact O-CG1 3.24Å; A187-I191 WeakPolarHBondContact O-CG1 3.29Å; A187-I191 PolarHBondContact O-N 3.46Å; M188-I191 PolarHBondContact O-N 3.36Å; I191-M194 PolarHBondContact O-N 3.01Å; I191-A195 WeakPolarHBondContact O-CB 3.25Å; I191-A195 PolarHBondContact O-N 3.37Å
192	F	92.6	Very high	89.6	Confident	137 Å²	137	87.9 Å²	87.9	60%	0.601	49%	0.488	S	S	*	.	H	α-helix	trans	-62.9	-43.1	177.4	-91.4	-79.1	0	0	0	112.6	M188 S189 A195 I196	M188-F192 VanDerWaalsContact O-CD2 3.29Å; M188-F192 WeakPolarHBondContact O-CD2 3.48Å; M188-F192 PolarHBondContact O-N 3.34Å; M188-F192 VanDerWaalsContact O-N 3.07Å; S189-F192 PolarHBondContact O-N 2.95Å; F192-A195 PolarHBondContact O-N 3.03Å; F192-I196 VanDerWaalsContact O-CG1 3.31Å; F192-I196 WeakPolarHBondContact O-CG1 3.37Å; F192-I196 PolarHBondContact O-N 2.94Å
193	I	93.8	Very high	90.1	Very high	112 Å²	112	88.9 Å²	88.9	57%	0.574	49%	0.488	S	S	*	.	H	α-helix	trans	-65.2	-41.9	177.8	-67.3	164.7	0	0	0	110.9	S189 T190 I196 A197	S189-I193 WeakPolarHBondContact O-CD1 3.49Å; S189-I193 VanDerWaalsContact O-CG1 3.23Å; S189-I193 WeakPolarHBondContact O-CG1 3.43Å; S189-I193 PolarHBondContact O-N 2.94Å; T190-I193 PolarHBondContact O-N 3.48Å; I193-I196 PolarHBondContact O-N 3.23Å; I193-A197 WeakPolarHBondContact O-CB 3.4Å; I193-A197 PolarHBondContact O-N 3.36Å
194	M	92.6	Very high	90.7	Very high	119 Å²	119	92 Å²	92	59%	0.586	49%	0.492	S	S	*	.	H	α-helix	trans	-65.2	-40.3	176.9	-72.5	-63.5	-69.8	0	0	112.1	T190 I191 A197 I198	T190-M194 WeakPolarHBondContact O-CB 2.98Å; T190-M194 VanDerWaalsContact O-CG 3.24Å; T190-M194 WeakPolarHBondContact O-CG 3.05Å; T190-M194 PolarHBondContact O-N 3.38Å; I191-M194 PolarHBondContact O-N 3.01Å; M194-A197 PolarHBondContact O-N 3.33Å; M194-I198 VanDerWaalsContact O-CG1 3.27Å; M194-I198 WeakPolarHBondContact O-CG1 3.07Å; M194-I198 PolarHBondContact O-N 3.04Å
195	A	94.3	Very high	90.6	Very high	49 Å²	49	94.7 Å²	94.7	41%	0.405	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-44.6	175.6	0	0	0	0	0	111.8	I191 F192 A197 I198 V199	I191-A195 WeakPolarHBondContact O-CB 3.25Å; I191-A195 PolarHBondContact O-N 3.37Å; F192-A195 PolarHBondContact O-N 3.03Å; A195-A197 PolarHBondContact O-N 3.31Å; A195-I198 PolarHBondContact O-N 3.01Å; A195-V199 WeakPolarHBondContact O-CG2 3.31Å; A195-V199 PolarHBondContact O-N 2.03Å
196	I	94.1	Very high	90.3	Very high	102 Å²	102	94.5 Å²	94.5	52%	0.523	50%	0.495	S	S	.	.	H	α-helix	trans	-62.1	-44.3	175.5	-66.4	166.2	0	0	0	110.4	F192 I193 I198 V199 L200	F192-I196 VanDerWaalsContact O-CG1 3.31Å; F192-I196 WeakPolarHBondContact O-CG1 3.37Å; F192-I196 PolarHBondContact O-N 2.94Å; I193-I196 PolarHBondContact O-N 3.23Å; I196-I198 PolarHBondContact O-N 2.79Å; I196-V199 PolarHBondContact O-N 2.84Å; I196-L200 HydrophobicContact CG2-CD1 4.07Å; I196-L200 HydrophobicContact CG2-CG 4.34Å; I196-L200 VanDerWaalsContact O-CG 3.31Å; I196-L200 WeakPolarHBondContact O-CG 3.17Å; I196-L200 PolarHBondContact O-N 3.39Å
197	A	93.8	Very high	89.8	Confident	39 Å²	39	96.2 Å²	96.2	32%	0.322	51%	0.505	S	S	.	.	H	α-helix	trans	-60.3	-42.9	177.4	0	0	0	0	0	112.2	I193 M194 A195 L200 I201	I193-A197 WeakPolarHBondContact O-CB 3.4Å; I193-A197 PolarHBondContact O-N 3.36Å; M194-A197 PolarHBondContact O-N 3.33Å; A195-A197 PolarHBondContact O-N 3.31Å; A197-L200 PolarHBondContact O-N 3.42Å; A197-I201 WeakPolarHBondContact O-CB 3.02Å; A197-I201 WeakPolarHBondContact O-CD1 3.28Å; A197-I201 WeakPolarHBondContact O-CG1 3.37Å; A197-I201 PolarHBondContact O-N 3.13Å
198	I	94.3	Very high	88.8	Confident	91 Å²	91	101.5 Å²	101.5	47%	0.467	52%	0.52	S	S	.	.	H	α-helix	trans	-62.9	-43.6	176.9	-68.8	164.8	0	0	0	110.9	M194 A195 I196 L200 I201 I202	M194-I198 VanDerWaalsContact O-CG1 3.27Å; M194-I198 WeakPolarHBondContact O-CG1 3.07Å; M194-I198 PolarHBondContact O-N 3.04Å; A195-I198 PolarHBondContact O-N 3.01Å; I196-I198 PolarHBondContact O-N 2.79Å; I198-L200 PolarHBondContact O-N 2.92Å; I198-I201 PolarHBondContact O-N 3.43Å; I198-I202 HydrophobicContact CG2-CD1 3.68Å; I198-I202 HydrophobicContact CG2-CG1 4.31Å; I198-I202 WeakPolarHBondContact O-CB 3.45Å; I198-I202 VanDerWaalsContact O-CG1 3.27Å; I198-I202 WeakPolarHBondContact O-CG1 3.45Å; I198-I202 PolarHBondContact O-N 3.11Å
199	V	94	Very high	87.2	Confident	92 Å²	92	99.5 Å²	99.5	56%	0.558	52%	0.52	S	S	*	.	H	α-helix	trans	-62.8	-42.7	176.8	172.7	0	0	0	0	111.3	A195 I196 I201 I202 M203	A195-V199 WeakPolarHBondContact O-CG2 3.31Å; A195-V199 PolarHBondContact O-N 2.03Å; I196-V199 PolarHBondContact O-N 2.84Å; V199-I201 VanDerWaalsContact C-N 3.34Å; V199-I201 PolarHBondContact O-N 3.49Å; V199-I202 PolarHBondContact O-N 3.11Å; V199-M203 VanDerWaalsContact O-CB 3.28Å; V199-M203 WeakPolarHBondContact O-CB 3.38Å; V199-M203 PolarHBondContact O-N 2.85Å
200	L	91.6	Very high	85.3	Confident	98 Å²	98	105.6 Å²	105.6	51%	0.513	54%	0.54	S	S	.	.	H	α-helix	trans	-64.7	-38.7	176.4	-68.1	178.1	0	0	0	112	I196 A197 I198 M203 F204	I196-L200 HydrophobicContact CG2-CD1 4.07Å; I196-L200 HydrophobicContact CG2-CG 4.34Å; I196-L200 VanDerWaalsContact O-CG 3.31Å; I196-L200 WeakPolarHBondContact O-CG 3.17Å; I196-L200 PolarHBondContact O-N 3.39Å; A197-L200 PolarHBondContact O-N 3.42Å; I198-L200 PolarHBondContact O-N 2.92Å; L200-M203 HydrophobicContact CD2-CE 3.84Å; L200-F204 WeakPolarHBondContact O-CB 3.39Å; L200-F204 PolarHBondContact O-N 3.17Å
201	I	92.4	Very high	83.4	Confident	91 Å²	91	107.5 Å²	107.5	47%	0.467	55%	0.554	S	S	.	*	H	α-helix	trans	-65.1	-48.2	175	-71	165.8	0	0	0	110.3	A197 I198 V199 M203 F204 Y205	A197-I201 WeakPolarHBondContact O-CB 3.02Å; A197-I201 WeakPolarHBondContact O-CD1 3.28Å; A197-I201 WeakPolarHBondContact O-CG1 3.37Å; A197-I201 PolarHBondContact O-N 3.13Å; I198-I201 PolarHBondContact O-N 3.43Å; V199-I201 VanDerWaalsContact C-N 3.34Å; V199-I201 PolarHBondContact O-N 3.49Å; I201-M203 VanDerWaalsContact C-N 3.35Å; I201-M203 PolarHBondContact O-N 3.46Å; I201-F204 WeakPolarHBondContact O-CB 3.35Å; I201-F204 PolarHBondContact O-N 3.4Å; I201-Y205 HydrophobicContact CG2-CD2 3.54Å; I201-Y205 HydrophobicContact CG2-CE2 3.43Å; I201-Y205 VanDerWaalsContact CG2-CE2 3.43Å; I201-Y205 WeakPolarHBondContact O-CD2 3.5Å; I201-Y205 PolarHBondContact O-N 2.81Å
202	I	89.9	Confident	81.2	Confident	90 Å²	90	105.8 Å²	105.8	46%	0.462	56%	0.564	S	S	.	*	H	α-helix	trans	-60.4	-45.2	177	-68.9	168.2	0	0	0	110.4	I198 V199 F204 Y205 I206	I198-I202 HydrophobicContact CG2-CD1 3.68Å; I198-I202 HydrophobicContact CG2-CG1 4.31Å; I198-I202 WeakPolarHBondContact O-CB 3.45Å; I198-I202 VanDerWaalsContact O-CG1 3.27Å; I198-I202 WeakPolarHBondContact O-CG1 3.45Å; I198-I202 PolarHBondContact O-N 3.11Å; V199-I202 PolarHBondContact O-N 3.11Å; I202-F204 VanDerWaalsContact C-N 3.32Å; I202-F204 PolarHBondContact O-N 2.93Å; I202-Y205 PolarHBondContact O-N 2.88Å; I202-Y205 VanDerWaalsContact O-N 3.16Å; I202-I206 HydrophobicContact CG2-CD1 3.7Å; I202-I206 HydrophobicContact CG2-CG1 4.33Å; I202-I206 VanDerWaalsContact O-CG1 3.27Å; I202-I206 WeakPolarHBondContact O-CG1 3.27Å; I202-I206 PolarHBondContact O-N 3.2Å
203	M	83.9	Confident	78.8	Confident	98 Å²	98	101.7 Å²	101.7	48%	0.483	56%	0.56	S	S	.	*	H	α-helix	trans	-61.4	-40.7	176.6	-172.2	163.5	67.9	0	0	111.5	V199 L200 I201 I206 L207	V199-M203 VanDerWaalsContact O-CB 3.28Å; V199-M203 WeakPolarHBondContact O-CB 3.38Å; V199-M203 PolarHBondContact O-N 2.85Å; L200-M203 HydrophobicContact CD2-CE 3.84Å; I201-M203 VanDerWaalsContact C-N 3.35Å; I201-M203 PolarHBondContact O-N 3.46Å; M203-I206 PolarHBondContact O-N 2.88Å; M203-L207 HydrophobicContact CG-CD1 4.04Å; M203-L207 WeakPolarHBondContact O-CB 3.41Å; M203-L207 WeakPolarHBondContact O-CG 3.4Å; M203-L207 PolarHBondContact O-N 2.91Å
204	F	87.1	Confident	76	Confident	119 Å²	119	106.1 Å²	106.1	52%	0.522	58%	0.578	S	S	.	*	H	α-helix	trans	-64.6	-40	173.7	-176.3	-101.3	0	0	0	112.3	L200 I201 I202 L207 K208	L200-F204 WeakPolarHBondContact O-CB 3.39Å; L200-F204 PolarHBondContact O-N 3.17Å; I201-F204 WeakPolarHBondContact O-CB 3.35Å; I201-F204 PolarHBondContact O-N 3.4Å; I202-F204 VanDerWaalsContact C-N 3.32Å; I202-F204 PolarHBondContact O-N 2.93Å; F204-L207 PolarHBondContact O-N 3.22Å; F204-K208 HydrophobicContact CE1-CD 3.92Å; F204-K208 HydrophobicContact CZ-CD 4.17Å; F204-K208 VanDerWaalsContact O-CB 3.24Å; F204-K208 WeakPolarHBondContact O-CB 3.3Å; F204-K208 PolarHBondContact O-N 3.06Å
205	Y	81.3	Confident	73.4	Confident	159 Å²	159	105 Å²	105	62%	0.624	59%	0.587	S	S	*	*	H	α-helix	trans	-66.5	-36.4	174.6	-84.3	-71.7	0	0	0	112.5	I201 I202 K208 A209	I201-Y205 HydrophobicContact CG2-CD2 3.54Å; I201-Y205 HydrophobicContact CG2-CE2 3.43Å; I201-Y205 VanDerWaalsContact CG2-CE2 3.43Å; I201-Y205 WeakPolarHBondContact O-CD2 3.5Å; I201-Y205 PolarHBondContact O-N 2.81Å; I202-Y205 PolarHBondContact O-N 2.88Å; I202-Y205 VanDerWaalsContact O-N 3.16Å; Y205-K208 PolarHBondContact O-N 3.49Å; Y205-A209 WeakPolarHBondContact O-CB 3.31Å; Y205-A209 PolarHBondContact O-N 2.88Å
206	I	79	Confident	70.5	Confident	113 Å²	113	108.9 Å²	108.9	58%	0.579	61%	0.61	S	S	*	*	H	α-helix	trans	-69.3	-39.6	174.2	-65.4	166	0	0	0	110.8	I202 M203 K208 A209	I202-I206 HydrophobicContact CG2-CD1 3.7Å; I202-I206 HydrophobicContact CG2-CG1 4.33Å; I202-I206 VanDerWaalsContact O-CG1 3.27Å; I202-I206 WeakPolarHBondContact O-CG1 3.27Å; I202-I206 PolarHBondContact O-N 3.2Å; M203-I206 PolarHBondContact O-N 2.88Å; I206-K208 VanDerWaalsContact C-N 3.34Å; I206-A209 CarbonylContact O-C 3.52Å; I206-A209 VanDerWaalsContact O-O 3.14Å
207	L	73.4	Confident	67.9	Low	132 Å²	132	110.3 Å²	110.3	69%	0.691	63%	0.627	S	S	*	*	H	α-helix	trans	-71	-29.7	177.1	-70.6	169.6	0	0	0	112.7	M203 F204	M203-L207 HydrophobicContact CG-CD1 4.04Å; M203-L207 WeakPolarHBondContact O-CB 3.41Å; M203-L207 WeakPolarHBondContact O-CG 3.4Å; M203-L207 PolarHBondContact O-N 2.91Å; F204-L207 PolarHBondContact O-N 3.22Å
208	K	68.2	Low	65	Low	155 Å²	155	114.2 Å²	114.2	67%	0.674	65%	0.652	S	S	*	*	H	α-helix	trans	-86.6	-26.9	176.6	-150.6	-180	-172.8	178.6	0	112.4	F204 Y205 I206 K210	F204-K208 HydrophobicContact CE1-CD 3.92Å; F204-K208 HydrophobicContact CZ-CD 4.17Å; F204-K208 VanDerWaalsContact O-CB 3.24Å; F204-K208 WeakPolarHBondContact O-CB 3.3Å; F204-K208 PolarHBondContact O-N 3.06Å; Y205-K208 PolarHBondContact O-N 3.49Å; I206-K208 VanDerWaalsContact C-N 3.34Å; K208-K210 PolarHBondContact O-N 3.21Å
209	A	54.9	Low	62.2	Low	66 Å²	66	113.4 Å²	113.4	55%	0.545	67%	0.666	S	S	.	*	S	Bend	trans	-75.4	69.2	164.4	0	0	0	0	0	109.1	Y205 I206 P211	Y205-A209 WeakPolarHBondContact O-CB 3.31Å; Y205-A209 PolarHBondContact O-N 2.88Å; I206-A209 CarbonylContact O-C 3.52Å; I206-A209 VanDerWaalsContact O-O 3.14Å; A209-P211 WeakPolarHBondContact O-CD 3.46Å
210	K	52.6	Low	59.1	Low	177 Å²	177	117.9 Å²	117.9	77%	0.77	68%	0.681	S	S	*	*			trans	-48.7	113.1	170.6	-175.4	166.6	-174	158.3	0	109.2	K208 G212	K208-K210 PolarHBondContact O-N 3.21Å; K210-G212 PolarHBondContact O-N 2.63Å
211	P	54.3	Low	56.2	Low	109 Å²	109	119.3 Å²	119.3	71%	0.708	69%	0.694	S	S	*	*			trans	-65.5	121.5	153.8	-3.8	22.3	0	0	0	104.5	A209 G213	A209-P211 WeakPolarHBondContact O-CD 3.46Å; P211-G213 PolarHBondContact O-N 3.09Å
212	G	46.3	Very low	53.1	Low	74 Å²	74	120.8 Å²	120.8	76%	0.763	71%	0.707	S	S	*	*			trans	-48.9	110.7	165.5	0	0	0	0	0	107.3	K210	K210-G212 PolarHBondContact O-N 2.63Å
213	G	43.9	Very low	50.3	Low	50 Å²	50	125.6 Å²	125.6	52%	0.515	72%	0.724	S	S	.	*			trans	-66.3	168	-165.6	0	0	0	0	0	112.3	P211	P211-G213 PolarHBondContact O-N 3.09Å
214	H	34.1	Very low	47.7	Very low	206 Å²	206	125 Å²	125	95%	0.954	74%	0.735	S	S	*	*			trans	-160.1	97.4	133.1	-94.4	87.4	0	0	0	107.3
215	A	37.7	Very low	45	Very low	96 Å²	96	125.2 Å²	125.2	79%	0.793	75%	0.746	S	S	*	*			trans	-135.1	110.4	154.3	0	0	0	0	0	106.7
216	C	33.9	Very low	42.6	Very low	130 Å²	130	126.1 Å²	126.1	88%	0.878	76%	0.756	S	S	*	*				159.5	135.2	115.9	-100.8	0	0	0	0	112.1
217	C	39.6	Very low	40.3	Very low	131 Å²	131	125.3 Å²	125.3	89%	0.885	77%	0.766	S	S	*	*			trans	-57.8	144.6	168.1	-56.5	0	0	0	0	112.3
218	S	33.1	Very low	38.2	Very low	121 Å²	121	127.6 Å²	127.6	85%	0.846	77%	0.773	S	S	*	*				-166.5	128.1	125.4	-144	0	0	0	0	110.4
219	G	35.5	Very low	36.1	Very low	74 Å²	74	126 Å²	126	76%	0.763	78%	0.777	S	S	*	*			trans	-79.6	127.4	169.1	0	0	0	0	0	110.5
220	Q	28.5	Very low	34.8	Very low	186 Å²	186	129.1 Å²	129.1	87%	0.869	78%	0.783	S	S	*	*			trans	-150	99.4	150.7	-119.7	179.6	-16.1	0	0	109.7
221	V	31	Very low	33.7	Very low	129 Å²	129	129.3 Å²	129.3	78%	0.782	78%	0.783	S	S	*	*				42.2	115	125.1	179.7	0	0	0	0	118.4
222	V	27.3	Very low	32.4	Very low	122 Å²	122	131.1 Å²	131.1	74%	0.739	78%	0.782	S	S	*	*			trans	91.4	109.2	141.6	171.4	0	0	0	0	119.7
223	K	30.8	Very low	31.7	Very low	191 Å²	191	133.4 Å²	133.4	83%	0.83	78%	0.777	S	S	*	*				129.1	130.9	116.6	-126.3	172.7	-178.1	176.7	0	116.2
224	A	29.2	Very low	31.1	Very low	84 Å²	84	136.9 Å²	136.9	69%	0.694	78%	0.784	S	S	*	*			trans	70	109.5	144.9	0	0	0	0	0	117.3
225	V	30.2	Very low	31	Very low	125 Å²	125	135 Å²	135	76%	0.758	77%	0.773	S	S	*	*				87.4	112.2	70.9	163.5	0	0	0	0	111.9
226	E	31.7	Very low	30.8	Very low	178 Å²	178	138.7 Å²	138.7	83%	0.832	77%	0.771	S	S	*	*			trans	72.6	119.9	142.2	-71.2	173	164.6	0	0	122.9
227	A	29.6	Very low	30.6	Very low	96 Å²	96	139.2 Å²	139.2	79%	0.793	77%	0.765	S	S	*	*				86.1	125.1	118.5	0	0	0	0	0	120.9
228	Q	29.1	Very low	30.2	Very low	179 Å²	179	139.5 Å²	139.5	84%	0.836	76%	0.763	S	S	*	*			trans	-40.3	145.8	159.8	-65.6	163.4	-21.1	0	0	114
229	T	24.9	Very low	30.5	Very low	123 Å²	123	138.9 Å²	138.9	76%	0.755	76%	0.755	S	S	*	*				-177.3	124.7	117.2	17	0	0	0	0	113.8
230	I	27.4	Very low	30.3	Very low	131 Å²	131	142 Å²	142	67%	0.672	76%	0.755	S	S	*	*				73	126.6	123.4	-67.5	175.5	0	0	0	121.9
231	K	29.1	Very low	30.3	Very low	181 Å²	181	139.8 Å²	139.8	79%	0.787	75%	0.749	S	S	*	*			trans	78.2	151.1	150.5	-77.4	168.8	-165.8	-172.5	0	119.2
232	Q	27.8	Very low	30.1	Very low	146 Å²	146	139.8 Å²	139.8	68%	0.682	75%	0.749	S	S	*	*			cis	-177.6	170.3	-14.2	-166.1	176.2	-61.5	0	0	106.3
233	D	31.4	Very low	30.4	Very low	123 Å²	123	139.6 Å²	139.6	66%	0.658	75%	0.748	S	S	*	*			trans	87.8	135.5	157.9	-85.8	-115.3	0	0	0	118.3
234	D	31.4	Very low	30.3	Very low	122 Å²	122	137 Å²	137	65%	0.652	74%	0.742	S	S	*	*			cis	-170.7	170	-8.7	-143	-84.4	0	0	0	112
235	K	32.8	Very low	30.3	Very low	166 Å²	166	142.7 Å²	142.7	72%	0.722	75%	0.751	S	S	*	*			trans	79.9	133.1	162	-100.5	171.8	173.4	153.5	0	120.3
236	K	31.8	Very low	30.4	Very low	175 Å²	175	141.9 Å²	141.9	76%	0.761	75%	0.751	S	S	*	*			cis	-163.9	155.3	17.9	-156.7	168.8	-174.4	-171.9	0	112.3
237	D	29.9	Very low	30.3	Very low	140 Å²	140	141.7 Å²	141.7	75%	0.749	75%	0.75	S	S	*	*			trans	-61.5	154.9	-167.6	-53.1	-86.6	0	0	0	120.8
238	V	31.8	Very low	30.3	Very low	138 Å²	138	145.4 Å²	145.4	84%	0.836	75%	0.748	S	S	*	*				172.4	144.2	103.2	161.1	0	0	0	0	110.7
239	P	39.3	Very low	30.4	Very low	107 Å²	107	142.5 Å²	142.5	70%	0.695	74%	0.739	S	S	*	*			trans	-111.2	163.8	-160.1	39.6	-26.8	0	0	0	115.4
240	D	30.7	Very low	30.7	Very low	141 Å²	141	145 Å²	145	75%	0.754	74%	0.742	S	S	*	*				-178.5	134.4	112.4	-116.6	-33.7	0	0	0	115.4
241	N	29.2	Very low	30.7	Very low	138 Å²	138	147.8 Å²	147.8	74%	0.738	75%	0.745	S	S	*	*			trans	25.6	129.9	154.6	-82.4	-43.6	0	0	0	123.8
242	V	27.5	Very low	30.6	Very low	130 Å²	130	145.4 Å²	145.4	79%	0.788	74%	0.741	S	S	*	*				177.1	114.8	98.5	158.4	0	0	0	0	111.6
243	V	32.2	Very low	30.6	Very low	117 Å²	117	147.3 Å²	147.3	71%	0.709	75%	0.747	S	S	*	*			trans	56.7	93.6	139.1	-169.5	0	0	0	0	121.4
244	I	29.1	Very low	30.5	Very low	138 Å²	138	148.1 Å²	148.1	71%	0.708	75%	0.751	S	S	*	*				14	125.4	122.4	-55.7	177	0	0	0	118.5
245	F	29.1	Very low	30.4	Very low	202 Å²	202	152.1 Å²	152.1	89%	0.886	76%	0.762	S	S	*	*				-159.7	128.2	107	-100.3	-75.9	0	0	0	111.3
246	S	32.1	Very low	30.3	Very low	109 Å²	109	149 Å²	149	76%	0.762	77%	0.768	S	S	*	*			trans	-103.6	176.3	173.4	-62.8	0	0	0	0	109.8
247	E	30	Very low	30.1	Very low	173 Å²	173	145 Å²	145	81%	0.808	77%	0.768	S	S	*	*			trans	108.4	97.8	156.8	-145	162.2	171.5	0	0	113.1
248	K	30.8	Very low	30.7	Very low	174 Å²	174	144 Å²	144	76%	0.757	77%	0.769	S	S	*	*				68.5	148.4	84.7	-83.5	177.8	150.5	120.9	0	111.5
249	D	30.5	Very low	30.9	Very low	119 Å²	119	146.8 Å²	146.8	64%	0.636	77%	0.772	S	S	*	*			cis	-159.5	159.3	7	-101.3	-41.7	0	0	0	104.6
250	E	30.2	Very low	30.3	Very low	174 Å²	174	151.7 Å²	151.7	81%	0.813	78%	0.783	S	S	*	*				150.1	99.8	123	-162	163.9	136	0	0	114.4
251	Y	27.3	Very low	30.3	Very low	190 Å²	190	151 Å²	151	75%	0.745	78%	0.784	S	S	*	*			trans	44.9	115	132.9	-72.3	-99.6	0	0	0	119.9
252	D	26.9	Very low	30.3	Very low	132 Å²	132	150.9 Å²	150.9	71%	0.706	79%	0.788	S	S	*	*				76.6	98.4	67.6	-163.9	14.4	0	0	0	113.1
253	K	29	Very low	30.3	Very low	186 Å²	186	154.1 Å²	154.1	81%	0.809	79%	0.791	S	S	*	*			trans	-164.1	100.3	148	-141.7	152.2	-178.2	-85	0	115.1
254	L	30	Very low	30.2	Very low	140 Å²	140	152.5 Å²	152.5	73%	0.733	79%	0.785	S	S	*	*				58.2	112.9	127.3	-58.7	170.8	0	0	0	122.1
255	K	29.3	Very low	30.2	Very low	205 Å²	205	153.4 Å²	153.4	89%	0.891	79%	0.786	S	S	*	*			trans	-43.8	145.4	142.5	-171.3	-177.5	-170	-179.8	0	115.3
256	A	30.1	Very low	30.4	Very low	101 Å²	101	151.2 Å²	151.2	84%	0.835	78%	0.784	S	S	*	*			trans	-165.4	151.7	145.8	0	0	0	0	0	112.9
257	A	28.1	Very low	30.3	Very low	92 Å²	92	154 Å²	154	76%	0.76	79%	0.79	S	S	*	*			trans	-98.6	-149.4	-174.4	0	0	0	0	0	112.9
258	P	40.8	Very low	30.2	Very low	119 Å²	119	150.7 Å²	150.7	77%	0.773	79%	0.792	S	S	*	*				-121.7	176.1	-80.6	34.1	-16	0	0	0	115.8
259	Q	36.7	Very low	30.2	Very low	195 Å²	195	147.3 Å²	147.3	91%	0.911	79%	0.791	S	S	*	*			trans	29.4	135.9	158.1	-72.1	-168	-20.1	0	0	123.9
260	K	26.3	Very low	30.3	Very low	210 Å²	210	147.4 Å²	147.4	91%	0.913	80%	0.801	S	S	*	*			trans	-161.4	133.3	137	-122.5	176.2	-175.7	178.1	0	115.1
261	T	30.1	Very low	30.6	Very low	128 Å²	128	147.3 Å²	147.3	79%	0.785	80%	0.8	S	S	*	*			trans	-83.3	149.1	165.3	39.6	0	0	0	0	113.2
262	V	29.4	Very low	30.7	Very low	135 Å²	135	144.9 Å²	144.9	82%	0.818	80%	0.8	S	S	*	*			trans	-165.7	116.2	149.7	172.7	0	0	0	0	107.7
263	K	28.7	Very low	31.2	Very low	198 Å²	198	147 Å²	147	86%	0.861	81%	0.806	S	S	*	*				54.9	146.1	105.4	-95	-177.3	175	-178.1	0	115.3
264	S	30	Very low	31.4	Very low	82 Å²	82	146.7 Å²	146.7	57%	0.573	81%	0.807	S	S	*	*			cis	-176.6	171.2	6.3	41.4	0	0	0	0	108.8
265	E	29.5	Very low	31.5	Very low	157 Å²	157	146.9 Å²	146.9	73%	0.734	81%	0.808	S	S	*	*			trans	81.7	101.5	152.2	-72.4	154.6	138.1	0	0	120.2
266	N	33.1	Very low	31.6	Very low	156 Å²	156	145 Å²	145	83%	0.834	81%	0.807	S	S	*	*				160	133.5	92.6	-86.7	-27	0	0	0	113.1
267	D	29.9	Very low	31.6	Very low	167 Å²	167	145.3 Å²	145.3	89%	0.893	80%	0.803	S	S	*	*			trans	-78	147.3	168.6	-73.1	-58.3	0	0	0	112.4
268	A	28	Very low	31.8	Very low	104 Å²	104	151.8 Å²	151.8	86%	0.86	81%	0.808	S	S	*	*			trans	-153	117	145.5	0	0	0	0	0	110
269	S	30.6	Very low	31.4	Very low	103 Å²	103	150.9 Å²	150.9	72%	0.72	80%	0.804	S	S	*	*			trans	-56.9	149.5	173.1	176	0	0	0	0	114.2
270	S	33.3	Very low	31.5	Very low	121 Å²	121	149.9 Å²	149.9	85%	0.846	80%	0.804	S	S	*	*			trans	-163	132.4	136.1	-177.1	0	0	0	0	112
271	E	35.2	Very low	31.5	Very low	173 Å²	173	146 Å²	146	81%	0.808	79%	0.793	S	S	*	*			trans	-74.8	152.1	-176.7	-58.4	150.7	170.3	0	0	112.4
272	N	30.4	Very low	31.6	Very low	138 Å²	138	145.7 Å²	145.7	74%	0.738	80%	0.796	S	S	*	*			trans	-161.7	92.7	148.2	178.6	12.8	0	0	0	110.5
273	E	36.2	Very low	31.8	Very low	178 Å²	178	146.3 Å²	146.3	83%	0.832	80%	0.795	S	S	*	*			trans	-83.2	115.6	157.9	-76.2	-90.4	142.4	0	0	108.6
274	Q	33.4	Very low	32.1	Very low	179 Å²	179	146.3 Å²	146.3	84%	0.836	80%	0.798	S	S	*	*			trans	-135.6	106.4	153.2	-82.3	-167.5	-10.1	0	0	111.2
275	L	33	Very low	32.2	Very low	143 Å²	143	150.6 Å²	150.6	75%	0.749	81%	0.809	S	S	*	*			trans	-35.7	141.8	157.5	-61.1	163.2	0	0	0	113.2
276	L	31.5	Very low	33.5	Very low	167 Å²	167	147.7 Å²	147.7	87%	0.874	80%	0.803	S	S	*	*			trans	-156.9	105.5	139.8	-102.4	163.8	0	0	0	110.7
277	S	29.9	Very low	33.8	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	80%	0.797	S	S	*	*			trans	-86.6	133.9	162.5	-34.4	0	0	0	0	109.5
278	R	32.8	Very low	33.7	Very low	227 Å²	227	142.4 Å²	142.4	86%	0.857	79%	0.789	S	S	*	*			trans	-170.3	101	158.2	-112.3	-180	162.3	133.2	-2.2	107.5
279	S	32.2	Very low	33.6	Very low	100 Å²	100	143.5 Å²	143.5	70%	0.699	78%	0.781	S	S	*	*				47.1	111.2	89.2	74.6	0	0	0	0	114.7
280	I	37.2	Very low	33.6	Very low	175 Å²	175	147.3 Å²	147.3	90%	0.897	78%	0.784	S	S	*	*			trans	-165.9	146.3	132.3	-146.4	72	0	0	0	111
281	D	26.8	Very low	33.2	Very low	129 Å²	129	150.3 Å²	150.3	69%	0.69	79%	0.785	S	S	*	*			trans	-91.9	156.8	-173	-151.3	-74.1	0	0	0	110.9
282	S	32.4	Very low	32.7	Very low	121 Å²	121	145.4 Å²	145.4	85%	0.846	78%	0.781	S	S	*	*			trans	170.7	133.9	140.3	-73.1	0	0	0	0	113.9
283	D	34.1	Very low	32.4	Very low	148 Å²	148	143.9 Å²	143.9	79%	0.791	78%	0.781	S	S	*	*			trans	-63.4	155.1	173.5	-62.4	-69.8	0	0	0	116.1
284	E	35	Very low	31.8	Very low	198 Å²	198	140.9 Å²	140.9	93%	0.925	77%	0.774	S	S	*	*				-178.6	143.9	126.6	-114.6	177.5	107	0	0	112.9
285	E	32.6	Very low	31.5	Very low	172 Å²	172	140.4 Å²	140.4	80%	0.804	77%	0.772	S	S	*	*			trans	-139.6	174.4	175.8	-117.7	-122.9	161.6	0	0	106.9
286	P	56.7	Low	31	Very low	96 Å²	96	138.5 Å²	138.5	62%	0.623	77%	0.771	S	S	*	*				-117.3	-156.1	-70.3	43.6	-25.7	0	0	0	109.1
287	P	38.9	Very low	30.7	Very low	109 Å²	109	135.1 Å²	135.1	71%	0.708	77%	0.767	S	S	*	*				-158.8	176.7	63.7	39.6	-15.2	0	0	0	119
288	S	28	Very low	30.5	Very low	103 Å²	103	135.4 Å²	135.4	72%	0.72	77%	0.769	S	S	*	*			trans	74.4	145.4	147.5	-81.1	0	0	0	0	119.4
289	D	26.2	Very low	30.4	Very low	127 Å²	127	130.4 Å²	130.4	68%	0.679	77%	0.766	S	S	*	*			cis	-177.8	159.7	-1.7	-121.5	-54.3	0	0	0	108.7
290	K	30.1	Very low	30.1	Very low	183 Å²	183	133 Å²	133	80%	0.796	77%	0.772	S	S	*	*			trans	72.6	153.4	157	-66.7	169	-176.1	179.8	0	120.1
291	Q	24.8	Very low	30.1	Very low	183 Å²	183	129.6 Å²	129.6	86%	0.855	76%	0.761	S	S	*	*			cis	178.1	128.6	-22.4	179.2	85	14	0	0	105.3
292	G	25	Very low	30	Very low	71 Å²	71	130.2 Å²	130.2	73%	0.732	77%	0.765	S	S	*	*			trans	88.2	162.1	151	0	0	0	0	0	118
293	S	23	Very low	29.6	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	77%	0.765	S	S	*	*			cis	177.8	126.5	-8.9	172.7	0	0	0	0	106.2
294	V	25.5	Very low	29.1	Very low	115 Å²	115	131.7 Å²	131.7	70%	0.697	77%	0.772	S	S	*	*			trans	67.6	139.3	139.1	-179.4	0	0	0	0	116.4
295	E	25.1	Very low	28.5	Very low	169 Å²	169	129.5 Å²	129.5	79%	0.79	77%	0.765	S	S	*	*			cis	-167.8	152.8	26.4	-137.8	146.5	-164.1	0	0	111.1
296	S	23.9	Very low	28.2	Very low	104 Å²	104	128.4 Å²	128.4	73%	0.727	77%	0.77	S	S	*	*			trans	34.9	127.8	142.2	68.6	0	0	0	0	123.3
297	A	24.9	Very low	26.6	Very low	96 Å²	96	130.4 Å²	130.4	79%	0.793	78%	0.776	S	S	*	*				172.7	118	104.8	0	0	0	0	0	111.7
298	S	25.5	Very low	26.1	Very low	113 Å²	113	133.7 Å²	133.7	79%	0.79	79%	0.786	S	S	*	*			trans	-73.5	150.3	151.7	47.5	0	0	0	0	109.1
299	P	30.4	Very low	25.8	Very low	121 Å²	121	131.1 Å²	131.1	79%	0.786	78%	0.776	S	S	*	*				-148.2	144.2	96.1	33	-13.7	0	0	0	115.2
300	N	26.9	Very low	25.9	Very low	155 Å²	155	132.9 Å²	132.9	83%	0.829	79%	0.785	S	S	*	*			trans	-85.4	159.8	150.3	-98.7	-38.7	0	0	0	107.8
301	P	37	Very low	25.8	Very low	103 Å²	103	133 Å²	133	67%	0.669	79%	0.786	S	S	*	*			cis	-154.7	175.3	48.1	36.5	-12.4	0	0	0	119.2
302	N	24.5	Very low	26.5	Very low	142 Å²	142	129.2 Å²	129.2	76%	0.759	78%	0.777	S	S	*	*			trans	94.9	107.8	151.2	-66.4	-50.3	0	0	0	121.8
303	L	23.9	Very low	26.7	Very low	163 Å²	163	132.8 Å²	132.8	85%	0.853	78%	0.78	S	S	*	*				56.9	110.7	118	-152.7	76.7	0	0	0	119.6
304	C	22.3	Very low	26.8	Very low	138 Å²	138	136 Å²	136	93%	0.932	79%	0.788	S	S	*	*			trans	-159.1	146.1	133.4	-119.5	0	0	0	0	112.4
305	L	22.9	Very low	26.9	Very low	152 Å²	152	134.7 Å²	134.7	80%	0.796	78%	0.783	S	S	*	*			trans	-107.4	129.8	-171.6	164.9	128.6	0	0	0	108.2
306	V	25.8	Very low	27.1	Very low	148 Å²	148	133.5 Å²	133.5	90%	0.897	78%	0.782	S	S	*	*			trans	-152	138.1	148.3	-174.7	0	0	0	0	110.2
307	D	24.1	Very low	27.2	Very low	139 Å²	139	136.7 Å²	136.7	74%	0.743	79%	0.79	S	S	*	*			trans	-98.1	145.2	-174.8	-163.7	-1.1	0	0	0	110.8
308	L	27.3	Very low	27.3	Very low	177 Å²	177	136.9 Å²	136.9	93%	0.927	79%	0.786	S	S	*	*			trans	-175.7	122.3	157.2	-139.9	71.7	0	0	0	107.2
309	G	23.4	Very low	27.5	Very low	49 Å²	49	139.9 Å²	139.9	51%	0.505	79%	0.792	S	S	.	*			cis	128.3	112	17.3	0	0	0	0	0	109.4
310	N	27.4	Very low	27.3	Very low	165 Å²	165	137 Å²	137	88%	0.882	78%	0.784	S	S	*	*			trans	79	139.5	159.9	-51.4	-39.5	0	0	0	117.7
311	K	27.4	Very low	27.3	Very low	184 Å²	184	137.7 Å²	137.7	80%	0.8	79%	0.786	S	S	*	*			cis	-164.8	153.7	20.3	-158.1	172	179.4	176.8	0	111.1
312	P	41.3	Very low	26.8	Very low	105 Å²	105	141 Å²	141	68%	0.682	80%	0.798	S	S	*	*			trans	-105.6	163.4	170.4	38.3	-29.4	0	0	0	112.7
313	D	27.9	Very low	26.9	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	80%	0.801	S	S	*	*			trans	-177.7	119.8	149.6	-90.4	-34.4	0	0	0	110.1
314	L	26.3	Very low	27.1	Very low	172 Å²	172	144.5 Å²	144.5	90%	0.901	80%	0.801	S	S	*	*				177.7	158.9	107.8	-139.8	75.3	0	0	0	112.1
315	S	27.1	Very low	27.2	Very low	87 Å²	87	141.3 Å²	141.3	61%	0.608	79%	0.792	S	S	*	*			trans	-105.2	156.4	-144.4	52	0	0	0	0	116.6
316	L	27.9	Very low	27.4	Very low	145 Å²	145	145.3 Å²	145.3	76%	0.759	80%	0.796	S	S	*	*			trans	59.3	127.4	135.4	-73.9	171.5	0	0	0	121.1
317	L	27	Very low	27.4	Very low	170 Å²	170	144.4 Å²	144.4	89%	0.89	79%	0.791	S	S	*	*				-156.4	119.5	104.1	-100.9	164.6	0	0	0	111.2
318	S	26.4	Very low	27.6	Very low	101 Å²	101	143.3 Å²	143.3	71%	0.706	79%	0.794	S	S	*	*			trans	-89.6	143.6	163.9	-58.8	0	0	0	0	109.7
319	L	29.9	Very low	27.6	Very low	175 Å²	175	142.6 Å²	142.6	92%	0.916	79%	0.791	S	S	*	*			trans	-138.3	104.4	153.6	-116.2	148.9	0	0	0	107.2
320	G	26.2	Very low	27.7	Very low	60 Å²	60	144 Å²	144	62%	0.619	81%	0.806	S	S	*	*			trans	-88.6	161	169.6	0	0	0	0	0	111.6
321	L	27.6	Very low	27.5	Very low	170 Å²	170	140.8 Å²	140.8	89%	0.89	80%	0.802	S	S	*	*			trans	-174.2	92.7	131.9	-100.3	165.5	0	0	0	108.9
322	L	26.6	Very low	27.9	Very low	172 Å²	172	137.4 Å²	137.4	90%	0.901	80%	0.799	S	S	*	*			trans	-92.5	125.1	149.3	-88.6	165.2	0	0	0	105.7
323	D	25.3	Very low	27.2	Very low	157 Å²	157	139.8 Å²	139.8	84%	0.84	80%	0.804	S	S	*	*			trans	-99.1	133	162.1	-164.8	22.3	0	0	0	109.5
324	R	28.9	Very low	27.1	Very low	222 Å²	222	139.5 Å²	139.5	84%	0.838	81%	0.808	S	S	*	*			trans	-112.7	116.7	-167.8	176.6	176.9	178.3	162.9	0.9	107.5
325	G	25.2	Very low	27.1	Very low	72 Å²	72	135.3 Å²	135.3	74%	0.742	80%	0.798	S	S	*	*			trans	-59.8	145.8	171.8	0	0	0	0	0	112.8
326	R	26.8	Very low	27	Very low	236 Å²	236	135.7 Å²	135.7	89%	0.891	81%	0.806	S	S	*	*			trans	-147.6	136.2	154.2	-146.1	173.1	-167.8	176.8	2.6	111.8
327	T	26.3	Very low	27	Very low	128 Å²	128	133.4 Å²	133.4	79%	0.785	80%	0.802	S	S	*	*			trans	-61.5	150.1	-175.5	50.9	0	0	0	0	116.4
328	S	26.6	Very low	27	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	80%	0.797	S	S	*	*				-164.6	158.7	128.1	-155.9	0	0	0	0	112.7
329	N	27.3	Very low	26.9	Very low	162 Å²	162	133.3 Å²	133.3	87%	0.866	79%	0.793	S	S	*	*			trans	-80.7	160.6	-158.4	-58.9	-52	0	0	0	116.8
330	G	25.7	Very low	26.9	Very low	78 Å²	78	131.8 Å²	131.8	80%	0.804	78%	0.784	S	S	*	*			trans	148.4	107.7	151.7	0	0	0	0	0	116.4
331	A	24.1	Very low	26.9	Very low	97 Å²	97	134.7 Å²	134.7	80%	0.802	79%	0.785	S	S	*	*			trans	-72.1	171.2	159	0	0	0	0	0	110.1
332	P	36.5	Very low	26.8	Very low	114 Å²	114	133 Å²	133	74%	0.74	78%	0.776	S	S	*	*			cis	-143.9	163.7	25.6	38.1	-15.2	0	0	0	119.3
333	I	25.6	Very low	26.8	Very low	155 Å²	155	132.9 Å²	132.9	80%	0.795	77%	0.77	S	S	*	*			trans	21.4	123.7	136.2	-44.2	173.4	0	0	0	120.9
334	V	26.6	Very low	26.8	Very low	140 Å²	140	129.8 Å²	129.8	85%	0.848	76%	0.761	S	S	*	*			trans	-166.7	110.1	130.7	-175.1	0	0	0	0	106.2
335	A	25.2	Very low	27.4	Very low	84 Å²	84	124.9 Å²	124.9	69%	0.694	76%	0.758	S	S	*	*				78.3	134.4	69.2	0	0	0	0	0	117.2
336	A	26	Very low	27.5	Very low	94 Å²	94	128 Å²	128	78%	0.777	76%	0.758	S	S	*	*			trans	82.5	125.3	168.8	0	0	0	0	0	116.7
337	S	26.7	Very low	27.6	Very low	97 Å²	97	124.7 Å²	124.7	68%	0.678	75%	0.752	S	S	*	*				-172.5	138.4	55.5	-70.7	0	0	0	0	113.9
338	H	27.9	Very low	27.8	Very low	169 Å²	169	124.5 Å²	124.5	78%	0.782	75%	0.745	S	S	*	*			trans	60.5	146.4	135.2	-69.6	-62.7	0	0	0	122.5
339	T	24.6	Very low	27.8	Very low	101 Å²	101	125.8 Å²	125.8	62%	0.62	74%	0.743	S	S	*	*			cis	176.9	153.9	-33.6	13.1	0	0	0	0	108.4
340	I	29.6	Very low	27.7	Very low	143 Å²	143	123.1 Å²	123.1	73%	0.733	74%	0.737	S	S	*	*			trans	77	138.2	144	-68	162.2	0	0	0	117.2
341	N	25.1	Very low	27.8	Very low	121 Å²	121	124.9 Å²	124.9	65%	0.647	73%	0.732	S	S	*	*			cis	-158.9	142.5	10.6	-121.5	-2.1	0	0	0	108.5
342	I	26.5	Very low	28.1	Very low	134 Å²	134	126.6 Å²	126.6	69%	0.687	73%	0.727	S	S	*	*				63.7	130.5	81.5	-60.1	-171.8	0	0	0	113.2
343	Q	25.6	Very low	27.8	Very low	169 Å²	169	129.5 Å²	129.5	79%	0.79	73%	0.731	S	S	*	*			cis	-162.9	150.1	33.5	-172	80.7	0.1	0	0	111.6
344	S	25.8	Very low	28.1	Very low	92 Å²	92	129.9 Å²	129.9	64%	0.643	73%	0.733	S	S	*	*			trans	-17.3	176.1	152	-107.9	0	0	0	0	121.8
345	P	41.6	Very low	28.1	Very low	120 Å²	120	128 Å²	128	78%	0.779	73%	0.731	S	S	*	*			cis	-146.4	174.5	32	34.6	-9.3	0	0	0	120
346	N	27.5	Very low	28.3	Very low	137 Å²	137	129.4 Å²	129.4	73%	0.733	74%	0.737	S	S	*	*			trans	-47	149.6	177.6	-55.3	-40.3	0	0	0	118.6
347	H	29.4	Very low	28.4	Very low	167 Å²	167	130.1 Å²	130.1	77%	0.773	74%	0.736	S	S	*	*				178.9	133	116.2	-116.6	-119.4	0	0	0	115.5
348	I	29.1	Very low	29	Very low	123 Å²	123	132.5 Å²	132.5	63%	0.631	74%	0.741	S	S	*	*			trans	72.9	120.8	139.9	-71	179.9	0	0	0	123.7
349	N	27	Very low	29.1	Very low	144 Å²	144	133.3 Å²	133.3	77%	0.77	75%	0.745	S	S	*	*			trans	40.9	123.5	142.3	-57.2	-13.1	0	0	0	120.8
350	S	25.8	Very low	29.7	Very low	106 Å²	106	136 Å²	136	74%	0.741	75%	0.754	S	S	*	*				159.5	126.5	89.1	-157.8	0	0	0	0	111.8
351	V	28.2	Very low	29.7	Very low	116 Å²	116	134.6 Å²	134.6	70%	0.703	76%	0.757	S	S	*	*			trans	83.7	121.9	138.5	169.3	0	0	0	0	120.8
352	N	29.9	Very low	30	Very low	132 Å²	132	133.9 Å²	133.9	71%	0.706	76%	0.761	S	S	*	*			trans	96.7	97.9	148.5	-69.2	-9.8	0	0	0	122.4
353	H	29.4	Very low	30.3	Very low	175 Å²	175	136.2 Å²	136.2	81%	0.81	77%	0.771	S	S	*	*				64.6	117.8	115.5	-82.2	-78.2	0	0	0	121.7
354	I	32.4	Very low	31	Very low	164 Å²	164	136 Å²	136	84%	0.841	78%	0.776	S	S	*	*			trans	-43.1	131.8	157.3	-62	156.2	0	0	0	112.5
355	A	27.2	Very low	31	Very low	99 Å²	99	134.8 Å²	134.8	82%	0.818	78%	0.777	S	S	*	*			trans	-150.4	122.4	148.1	0	0	0	0	0	111.1
356	S	29.7	Very low	31.3	Very low	115 Å²	115	137 Å²	137	80%	0.804	78%	0.78	S	S	*	*			trans	-68.9	143.2	162	-175.8	0	0	0	0	109.9
357	S	27.7	Very low	31.5	Very low	109 Å²	109	137 Å²	137	76%	0.762	78%	0.781	S	S	*	*			trans	-166.1	128.7	144.7	-160.7	0	0	0	0	112.5
358	N	39	Very low	32.3	Very low	147 Å²	147	136.1 Å²	136.1	79%	0.786	78%	0.781	S	S	*	*			trans	-55.7	151.6	154.6	-66	-49.9	0	0	0	110.5
359	H	30.3	Very low	32.9	Very low	185 Å²	185	137.1 Å²	137.1	86%	0.856	79%	0.788	S	S	*	*			trans	-160.9	129.1	139	-120	-79.1	0	0	0	113.3
360	I	36.9	Very low	33.6	Very low	159 Å²	159	138.1 Å²	138.1	82%	0.815	79%	0.786	S	S	*	*			trans	-70.7	137.8	164	-69.2	160.3	0	0	0	108.3
361	S	30.2	Very low	34.7	Very low	113 Å²	113	137.2 Å²	137.2	79%	0.79	78%	0.776	S	S	*	*			trans	-121.3	109.2	164.3	49.4	0	0	0	0	110.8
362	S	31.8	Very low	36	Very low	106 Å²	106	136.7 Å²	136.7	74%	0.741	78%	0.775	S	S	*	*			trans	-73.8	132.8	159	177.9	0	0	0	0	108.5
363	M	31.3	Very low	37.3	Very low	183 Å²	183	133 Å²	133	90%	0.901	77%	0.768	S	S	*	*			trans	-136.4	115	159.5	-81.7	-147.1	157.6	0	0	110.2
364	N	39.9	Very low	38.6	Very low	165 Å²	165	130.5 Å²	130.5	88%	0.882	76%	0.758	S	S	*	*			trans	-67.4	122.1	158.7	-93.1	-17.2	0	0	0	108.7
365	G	27.6	Very low	39.9	Very low	65 Å²	65	126.8 Å²	126.8	67%	0.67	74%	0.74	S	S	*	*			trans	-134.2	103.9	168.3	0	0	0	0	0	109	N367	G365-N367 PolarHBondContact O-N 3.38Å
366	I	46	Very low	41.7	Very low	166 Å²	166	127.9 Å²	127.9	85%	0.851	73%	0.728	S	S	*	*			trans	-70	105.1	168.9	-62.3	170.9	0	0	0	106.8
367	N	33.7	Very low	44.1	Very low	139 Å²	139	126.1 Å²	126.1	74%	0.743	72%	0.716	S	S	*	*			trans	-135.7	103.4	162	69	-8.3	0	0	0	111.4	G365 N369	G365-N367 PolarHBondContact O-N 3.38Å; N367-N369 PolarHBondContact O-N 3.4Å
368	N	45.4	Very low	46.6	Very low	147 Å²	147	127.8 Å²	127.8	79%	0.786	71%	0.705	S	S	*	*			trans	-68.7	99.9	167.1	-70.4	-42.4	0	0	0	108.3
369	N	41.8	Very low	48.6	Very low	144 Å²	144	126.7 Å²	126.7	77%	0.77	69%	0.69	S	S	*	*			trans	-166.8	85.1	158.6	-84.5	-24.5	0	0	0	110	N367 T371	N367-N369 PolarHBondContact O-N 3.4Å; N369-T371 PolarHBondContact O-N 2.89Å; N369-T371 VanDerWaalsContact O-N 3.1Å
370	K	40.8	Very low	51.1	Low	165 Å²	165	125.3 Å²	125.3	72%	0.717	68%	0.682	S	S	*	*			trans	-74.6	95.8	-178	-167.9	170.2	-176.5	171.7	0	110.5	L375	K370-L375 HydrophobicContact CD-CD1 4.2Å; K370-L375 HydrophobicContact CG-CD1 3.82Å; K370-L375 HydrophobicContact CG-CG 4.44Å
371	T	49.4	Very low	53.5	Low	87 Å²	87	124.1 Å²	124.1	53%	0.534	67%	0.67	S	S	.	*			trans	-81.3	145.4	172.7	35.2	0	0	0	0	111.9	N369 G373 M374	N369-T371 PolarHBondContact O-N 2.89Å; N369-T371 VanDerWaalsContact O-N 3.1Å; T371-G373 PolarHBondContact O-N 3.13Å; T371-G373 VanDerWaalsContact O-N 3.14Å; T371-M374 PolarHBondContact O-N 2.92Å
372	P	55.4	Low	56.1	Low	105 Å²	105	119 Å²	119	68%	0.682	63%	0.634	S	S	*	*	H	α-helix	trans	-59.6	-25	-178.2	-24.7	33.6	0	0	0	115.2
373	G	58	Low	58.6	Low	55 Å²	55	117.4 Å²	117.4	57%	0.567	62%	0.617	S	S	*	*	H	α-helix	trans	-72.3	-31.9	179.5	0	0	0	0	0	114.4	T371 S377	T371-G373 PolarHBondContact O-N 3.13Å; T371-G373 VanDerWaalsContact O-N 3.14Å; G373-S377 PolarHBondContact O-N 3.3Å; G373-S377 VanDerWaalsContact O-N 3.08Å
374	M	56.5	Low	61.2	Low	123 Å²	123	114 Å²	114	61%	0.606	60%	0.599	S	S	*	*	H	α-helix	trans	-75.4	-31.9	-178.2	-162.7	171.3	74.3	0	0	112.3	T371 S377 R378	T371-M374 PolarHBondContact O-N 2.92Å; M374-S377 PolarHBondContact O-N 3.47Å; M374-R378 PolarHBondContact O-N 3.26Å
375	L	60	Low	63.5	Low	85 Å²	85	107.5 Å²	107.5	45%	0.445	56%	0.564	S	S	.	*	H	α-helix	trans	-65.8	-41.8	172.8	-84.3	143.9	0	0	0	112.4	K370 S377 R378 R379	K370-L375 HydrophobicContact CD-CD1 4.2Å; K370-L375 HydrophobicContact CG-CD1 3.82Å; K370-L375 HydrophobicContact CG-CG 4.44Å; L375-S377 VanDerWaalsContact C-N 3.34Å; L375-R378 PolarHBondContact O-N 3.31Å; L375-R379 WeakPolarHBondContact O-CB 3.35Å; L375-R379 PolarHBondContact O-N 3.44Å
376	Q	65.3	Low	66.2	Low	123 Å²	123	107.1 Å²	107.1	58%	0.575	54%	0.543	S	S	*	.	H	α-helix	trans	-67.2	-38	175.8	-67	-66.6	-11.3	0	0	111.1	R379 K380	Q376-R379 PolarHBondContact O-N 2.78Å; Q376-K380 WeakPolarHBondContact O-CB 3.36Å; Q376-K380 PolarHBondContact O-N 3.16Å
377	S	78.1	Confident	68.1	Low	78 Å²	78	101.4 Å²	101.4	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-45.6	172.9	-172	0	0	0	0	112.3	G373 M374 L375 K380 K381	G373-S377 PolarHBondContact O-N 3.3Å; G373-S377 VanDerWaalsContact O-N 3.08Å; M374-S377 PolarHBondContact O-N 3.47Å; L375-S377 VanDerWaalsContact C-N 3.34Å; S377-K380 PolarHBondContact O-N 3.43Å; S377-K381 PolarHBondContact O-N 3.09Å
378	R	80.9	Confident	70.6	Confident	143 Å²	143	100.8 Å²	100.8	54%	0.54	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-45.3	175.6	-173.8	177.4	175.4	-165.2	-3.8	111.8	M374 L375 K380 K381 I382 E478	M374-R378 PolarHBondContact O-N 3.26Å; L375-R378 PolarHBondContact O-N 3.31Å; R378-K380 VanDerWaalsContact C-N 3.33Å; R378-K380 PolarHBondContact O-N 3.3Å; R378-K381 WeakPolarHBondContact O-CB 3.29Å; R378-K381 PolarHBondContact O-N 3.11Å; R378-I382 HydrophobicContact CG-CD1 4.08Å; R378-I382 WeakPolarHBondContact O-CG1 3.39Å; R378-I382 PolarHBondContact O-N 3.45Å; R378-E478 IonicContact CZ-OE2 2.63Å; R378-E478 IonicContact NE-OE2 3.78Å; R378-E478 PolarHBondContact NE-OE2 3.39Å; R378-E478 IonicContact NH2-OE2 2.79Å; R378-E478 PolarHBondContact NH2-OE2 2.7Å
379	R	81.2	Confident	72.6	Confident	124 Å²	124	93.8 Å²	93.8	47%	0.468	47%	0.47	S	S	.	.	H	α-helix	trans	-60.4	-42.2	177.2	-174.6	174.2	-175.5	176.8	3.5	111.9	L375 Q376 K381 I382 L383 L474	L375-R379 WeakPolarHBondContact O-CB 3.35Å; L375-R379 PolarHBondContact O-N 3.44Å; Q376-R379 PolarHBondContact O-N 2.78Å; R379-K381 VanDerWaalsContact C-N 3.35Å; R379-K381 PolarHBondContact O-N 3.21Å; R379-I382 PolarHBondContact O-N 2.92Å; R379-L383 HydrophobicContact CG-CD1 4.36Å; R379-L383 WeakPolarHBondContact O-CG 3.48Å; R379-L383 PolarHBondContact O-N 2.72Å; R379-L474 HydrophobicContact CG-CD1 3.92Å
380	K	82.5	Confident	74.7	Confident	157 Å²	157	87.9 Å²	87.9	68%	0.683	44%	0.44	S	S	*	.	H	α-helix	trans	-60.8	-43.2	175.3	-173.7	180	177.6	-176.5	0	111.7	Q376 S377 R378 L383 E384	Q376-K380 WeakPolarHBondContact O-CB 3.36Å; Q376-K380 PolarHBondContact O-N 3.16Å; S377-K380 PolarHBondContact O-N 3.43Å; R378-K380 VanDerWaalsContact C-N 3.33Å; R378-K380 PolarHBondContact O-N 3.3Å; K380-L383 PolarHBondContact O-N 3.15Å; K380-E384 PolarHBondContact O-N 2.9Å
381	K	86.9	Confident	76.7	Confident	133 Å²	133	86 Å²	86	58%	0.578	44%	0.438	S	S	*	.	H	α-helix	trans	-63.5	-40	177.3	-168.5	178.8	-178.8	-175.6	0	112.6	S377 R378 R379 E384 L385	S377-K381 PolarHBondContact O-N 3.09Å; R378-K381 WeakPolarHBondContact O-CB 3.29Å; R378-K381 PolarHBondContact O-N 3.11Å; R379-K381 VanDerWaalsContact C-N 3.35Å; R379-K381 PolarHBondContact O-N 3.21Å; K381-E384 PolarHBondContact O-N 3.34Å; K381-L385 PolarHBondContact O-N 3.36Å
382	I	86.6	Confident	78.3	Confident	5 Å²	5	85.2 Å²	85.2	3%	0.026	43%	0.433	C	S	.	.	H	α-helix	trans	-65.1	-40.9	176.4	-65	168.9	0	0	0	110.9	R378 R379 E384 L385 Y386 L474 V477 E478	R378-I382 HydrophobicContact CG-CD1 4.08Å; R378-I382 WeakPolarHBondContact O-CG1 3.39Å; R378-I382 PolarHBondContact O-N 3.45Å; R379-I382 PolarHBondContact O-N 2.92Å; I382-E384 VanDerWaalsContact C-N 3.32Å; I382-E384 PolarHBondContact O-N 2.9Å; I382-L385 PolarHBondContact O-N 3.06Å; I382-Y386 WeakPolarHBondContact O-CB 3.37Å; I382-Y386 PolarHBondContact O-N 3.32Å; I382-L474 HydrophobicContact CD1-CB 4.14Å; I382-L474 HydrophobicContact CG2-CD2 4.37Å; I382-V477 HydrophobicContact CG2-CB 4.32Å; I382-V477 HydrophobicContact CG2-CG1 3.87Å; I382-E478 HydrophobicContact CD1-CB 4.14Å; I382-E478 HydrophobicContact CD1-CG 4.47Å; I382-E478 HydrophobicContact CG1-CB 4.01Å; I382-E478 HydrophobicContact CG1-CG 4.11Å; I382-E478 HydrophobicContact CG2-CB 4.36Å
383	L	84.3	Confident	79.6	Confident	73 Å²	73	80.3 Å²	80.3	38%	0.382	40%	0.401	S	S	.	.	H	α-helix	trans	-66.9	-32.6	176.5	-70.6	169.8	0	0	0	112.7	R379 K380 Y386 A387	R379-L383 HydrophobicContact CG-CD1 4.36Å; R379-L383 WeakPolarHBondContact O-CG 3.48Å; R379-L383 PolarHBondContact O-N 2.72Å; K380-L383 PolarHBondContact O-N 3.15Å; L383-Y386 WeakPolarHBondContact O-CB 3.31Å; L383-A387 PolarHBondContact O-N 3.16Å
384	E	85.5	Confident	80.5	Confident	111 Å²	111	85.5 Å²	85.5	52%	0.519	41%	0.41	S	S	.	.	H	α-helix	trans	-67.8	-41.9	173	-165.2	-170.5	150.3	0	0	111.8	K380 K381 I382 A387 R388	K380-E384 PolarHBondContact O-N 2.9Å; K381-E384 PolarHBondContact O-N 3.34Å; I382-E384 VanDerWaalsContact C-N 3.32Å; I382-E384 PolarHBondContact O-N 2.9Å; E384-A387 PolarHBondContact O-N 3.1Å; E384-R388 PolarHBondContact O-N 3.07Å; E384-R388 IonicContact OE1-NH2 3.99Å; E384-R388 PolarHBondContact OE1-NH2 2.89Å
385	L	86.7	Confident	81.2	Confident	30 Å²	30	82.9 Å²	82.9	16%	0.157	42%	0.415	C	S	.	.	H	α-helix	trans	-62.1	-42.8	173.2	-76.2	166	0	0	0	111.7	K381 I382 R388 T389 C481 V482 L485	K381-L385 PolarHBondContact O-N 3.36Å; I382-L385 PolarHBondContact O-N 3.06Å; L385-R388 PolarHBondContact O-N 3.47Å; L385-T389 WeakPolarHBondContact O-CB 3.19Å; L385-T389 PolarHBondContact O-N 3.3Å; L385-T389 PolarHBondContact O-OG1 3.41Å; L385-C481 HydrophobicContact CB-CB 4.03Å; L385-V482 HydrophobicContact CD1-CG2 4.38Å; L385-L485 HydrophobicContact CD2-CD1 3.74Å
386	Y	86.1	Confident	82.2	Confident	56 Å²	56	82.2 Å²	82.2	22%	0.22	41%	0.411	C	S	.	.	H	α-helix	trans	-55.7	-52.4	173.3	163.4	-96.7	0	0	0	111.4	I382 L383 R388 T389 C390 L465 T466	I382-Y386 WeakPolarHBondContact O-CB 3.37Å; I382-Y386 PolarHBondContact O-N 3.32Å; L383-Y386 WeakPolarHBondContact O-CB 3.31Å; Y386-R388 VanDerWaalsContact C-N 3.31Å; Y386-R388 PolarHBondContact O-N 2.91Å; Y386-T389 PolarHBondContact O-N 3.03Å; Y386-T389 VanDerWaalsContact O-N 3.15Å; Y386-C390 WeakPolarHBondContact CE2-SG 3.33Å; Y386-C390 VanDerWaalsContact CZ-SG 3.52Å; Y386-C390 PolarHBondContact O-N 3.19Å; Y386-C390 PolarHBondContact O-SG 2.97Å; Y386-L465 HydrophobicContact CD2-CB 3.68Å; Y386-L465 HydrophobicContact CD2-CD1 4.13Å; Y386-L465 HydrophobicContact CD2-CG 4.44Å; Y386-L465 HydrophobicContact CE2-CB 3.52Å; Y386-L465 HydrophobicContact CE2-CD1 4.42Å; Y386-T466 PolarHBondContact OH-OG1 2.93Å
387	A	85.7	Confident	83	Confident	47 Å²	47	77.5 Å²	77.5	39%	0.388	39%	0.392	S	S	.	.	H	α-helix	trans	-60.4	-40.7	-179.4	0	0	0	0	0	112.2	L383 E384 N391	L383-A387 PolarHBondContact O-N 3.16Å; E384-A387 PolarHBondContact O-N 3.1Å; A387-N391 VanDerWaalsContact O-CG 3.25Å; A387-N391 PolarHBondContact O-N 3.44Å; A387-N391 PolarHBondContact O-ND2 3.43Å
388	R	85.9	Confident	83.2	Confident	126 Å²	126	73.8 Å²	73.8	48%	0.475	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-40.9	176.5	-167.7	-178.2	-59.9	176.3	3.3	112.1	E384 L385 Y386 N391 V392 L485	E384-R388 PolarHBondContact O-N 3.07Å; E384-R388 IonicContact OE1-NH2 3.99Å; E384-R388 PolarHBondContact OE1-NH2 2.89Å; L385-R388 PolarHBondContact O-N 3.47Å; Y386-R388 VanDerWaalsContact C-N 3.31Å; Y386-R388 PolarHBondContact O-N 2.91Å; R388-N391 PolarHBondContact O-N 2.89Å; R388-V392 WeakPolarHBondContact O-CG2 3.24Å; R388-V392 PolarHBondContact O-N 2.94Å; R388-L485 HydrophobicContact CB-CD1 4.34Å; R388-L485 HydrophobicContact CB-CD2 4.48Å; R388-L485 HydrophobicContact CG-CD1 4.34Å; R388-L485 HydrophobicContact CG-CD2 3.92Å
389	T	86.1	Confident	83.1	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-65.8	-46.8	179.1	-54.2	0	0	0	0	110.6	L385 Y386 N391 V392 T393 L465 C481 V484	L385-T389 WeakPolarHBondContact O-CB 3.19Å; L385-T389 PolarHBondContact O-N 3.3Å; L385-T389 PolarHBondContact O-OG1 3.41Å; Y386-T389 PolarHBondContact O-N 3.03Å; Y386-T389 VanDerWaalsContact O-N 3.15Å; T389-N391 PolarHBondContact O-N 2.76Å; T389-V392 PolarHBondContact O-N 3.41Å; T389-T393 HydrophobicContact CG2-CG2 4.1Å; T389-T393 PolarHBondContact O-N 3.01Å; T389-T393 PolarHBondContact O-OG1 2.87Å; T389-L465 HydrophobicContact CG2-CD1 3.93Å; T389-C481 VanDerWaalsContact OG1-CB 3.29Å; T389-C481 WeakPolarHBondContact OG1-CB 3.24Å; T389-V484 HydrophobicContact CG2-CB 3.95Å; T389-V484 HydrophobicContact CG2-CG1 3.7Å; T389-V484 HydrophobicContact CG2-CG2 4.47Å
390	C	85.7	Confident	83.1	Confident	20 Å²	20	69.4 Å²	69.4	14%	0.135	36%	0.362	C	S	.	.	H	α-helix	trans	-57.7	-35.2	178.2	-68.9	0	0	0	0	113.2	Y386 V392 E394 P462	Y386-C390 WeakPolarHBondContact CE2-SG 3.33Å; Y386-C390 VanDerWaalsContact CZ-SG 3.52Å; Y386-C390 PolarHBondContact O-N 3.19Å; Y386-C390 PolarHBondContact O-SG 2.97Å; C390-V392 VanDerWaalsContact C-N 3.32Å; C390-V392 PolarHBondContact O-N 3.38Å; C390-E394 PolarHBondContact O-N 3.34Å; C390-P462 HydrophobicContact CB-CB 4.4Å; C390-P462 HydrophobicContact CB-CG 4.29Å
391	N	83.3	Confident	83.2	Confident	126 Å²	126	62.7 Å²	62.7	67%	0.674	33%	0.333	S	S	*	.	H	α-helix	trans	-68.8	-27.9	176.5	-67.5	-18.9	0	0	0	113.4	A387 R388 T389	A387-N391 VanDerWaalsContact O-CG 3.25Å; A387-N391 PolarHBondContact O-N 3.44Å; A387-N391 PolarHBondContact O-ND2 3.43Å; R388-N391 PolarHBondContact O-N 2.89Å; T389-N391 PolarHBondContact O-N 2.76Å
392	V	83.7	Confident	83	Confident	70 Å²	70	59.1 Å²	59.1	42%	0.424	32%	0.324	S	S	.	.	H	α-helix	trans	-91.5	-27.5	-178.9	179.6	0	0	0	0	111.4	R388 T389 C390 L485	R388-V392 WeakPolarHBondContact O-CG2 3.24Å; R388-V392 PolarHBondContact O-N 2.94Å; T389-V392 PolarHBondContact O-N 3.41Å; C390-V392 VanDerWaalsContact C-N 3.32Å; C390-V392 PolarHBondContact O-N 3.38Å; V392-L485 HydrophobicContact CG2-CD2 4.42Å
393	T	81.9	Confident	82.8	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.012	34%	0.344	C	S	.	.	S	Bend	trans	-103.5	17.1	-177	63.8	0	0	0	0	114	T389 G395 L396 I461 V484	T389-T393 HydrophobicContact CG2-CG2 4.1Å; T389-T393 PolarHBondContact O-N 3.01Å; T389-T393 PolarHBondContact O-OG1 2.87Å; T393-G395 PolarHBondContact O-N 3.1Å; T393-L396 HydrophobicContact CG2-CD1 4.34Å; T393-L396 PolarHBondContact O-N 3.29Å; T393-L396 VanDerWaalsContact O-N 3.14Å; T393-I461 HydrophobicContact CG2-CD1 4.11Å; T393-I461 HydrophobicContact CG2-CG2 4.19Å; T393-V484 HydrophobicContact CG2-CG1 3.47Å; T393-V484 VanDerWaalsContact CG2-CG1 3.47Å
394	E	77.9	Confident	82.7	Confident	163 Å²	163	65 Å²	65	76%	0.762	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	120.7	179.8	-168.3	174.7	-169.9	0	0	110	C390 L396	C390-E394 PolarHBondContact O-N 3.34Å; E394-L396 VanDerWaalsContact C-N 3.35Å
395	G	71.8	Confident	82.7	Confident	69 Å²	69	60 Å²	60	71%	0.711	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	1.6	-178.9	0	0	0	0	0	116	T393	T393-G395 PolarHBondContact O-N 3.1Å
396	L	79.4	Confident	82.7	Confident	70 Å²	70	59.1 Å²	59.1	37%	0.366	32%	0.324	S	S	.	.			trans	-88.2	139.5	175.2	-58.2	-176.4	0	0	0	111.3	T393 E394 E400 S460 I461	T393-L396 HydrophobicContact CG2-CD1 4.34Å; T393-L396 PolarHBondContact O-N 3.29Å; T393-L396 VanDerWaalsContact O-N 3.14Å; E394-L396 VanDerWaalsContact C-N 3.35Å; L396-E400 VanDerWaalsContact CA-OE2 3.28Å; L396-E400 WeakPolarHBondContact CA-OE2 2.91Å; L396-E400 VanDerWaalsContact CB-OE2 3.23Å; L396-E400 WeakPolarHBondContact CB-OE2 3.28Å; L396-E400 WeakPolarHBondContact CD2-OE2 3.41Å; L396-S460 WeakPolarHBondContact O-CA 3.5Å; L396-I461 HydrophobicContact CB-CD1 3.75Å; L396-I461 PolarHBondContact O-N 2.87Å
397	S	83.3	Confident	82.7	Confident	24 Å²	24	59.3 Å²	59.3	17%	0.168	33%	0.327	C	S	.	.			trans	-82.6	151.2	176.4	69.7	0	0	0	0	111.9	T399 E400 S455	S397-T399 PolarHBondContact O-N 3Å; S397-T399 VanDerWaalsContact O-N 3.11Å; S397-T399 PolarHBondContact OG-OG1 2.87Å; S397-E400 WeakPolarHBondContact CB-OE1 3.46Å; S397-E400 PolarHBondContact N-OE1 3.02Å; S397-E400 PolarHBondContact N-OE2 2.84Å; S397-E400 WeakPolarHBondContact O-CB 3.28Å; S397-E400 PolarHBondContact O-N 3.21Å; S397-E400 VanDerWaalsContact OG-CD 3.25Å; S397-E400 WeakPolarHBondContact OG-CG 3.38Å; S397-E400 PolarHBondContact OG-OE1 3.33Å; S397-S455 WeakPolarHBondContact CB-OG 3.31Å; S397-S455 PolarHBondContact OG-OG 2.89Å
398	P	80.9	Confident	82.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-54.1	-31	178.9	-30	35.3	0	0	0	114.9	E400 L401 L406 V454 Y459 L464	P398-E400 VanDerWaalsContact C-N 3.28Å; P398-E400 PolarHBondContact O-N 3.13Å; P398-L401 WeakPolarHBondContact O-CB 3.2Å; P398-L401 PolarHBondContact O-N 3.17Å; P398-L406 WeakPolarHBondContact O-CD1 3.33Å; P398-L406 WeakPolarHBondContact O-CD2 3.21Å; P398-V454 HydrophobicContact CG-CG1 4.22Å; P398-Y459 WeakPolarHBondContact CD-O 3.05Å; P398-L464 HydrophobicContact CB-CD2 4.08Å; P398-L464 HydrophobicContact CG-CB 4.48Å; P398-L464 HydrophobicContact CG-CD2 4.21Å
399	T	79.5	Confident	82.7	Confident	68 Å²	68	55.5 Å²	55.5	42%	0.417	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-76.5	-11.1	178.9	46.5	0	0	0	0	114.1	S397 L401 E452 S455	S397-T399 PolarHBondContact O-N 3Å; S397-T399 VanDerWaalsContact O-N 3.11Å; S397-T399 PolarHBondContact OG-OG1 2.87Å; T399-L401 PolarHBondContact O-N 3.27Å; T399-E452 HydrophobicContact CG2-CB 4.5Å; T399-S455 WeakPolarHBondContact OG1-CB 3.41Å; T399-S455 PolarHBondContact OG1-OG 3.02Å
400	E	82.3	Confident	82.8	Confident	108 Å²	108	56 Å²	56	51%	0.505	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-77	-10.4	172.4	-71.4	159.3	-142.5	0	0	112.4	L396 S397 P398	L396-E400 VanDerWaalsContact CA-OE2 3.28Å; L396-E400 WeakPolarHBondContact CA-OE2 2.91Å; L396-E400 VanDerWaalsContact CB-OE2 3.23Å; L396-E400 WeakPolarHBondContact CB-OE2 3.28Å; L396-E400 WeakPolarHBondContact CD2-OE2 3.41Å; S397-E400 WeakPolarHBondContact CB-OE1 3.46Å; S397-E400 PolarHBondContact N-OE1 3.02Å; S397-E400 PolarHBondContact N-OE2 2.84Å; S397-E400 WeakPolarHBondContact O-CB 3.28Å; S397-E400 PolarHBondContact O-N 3.21Å; S397-E400 VanDerWaalsContact OG-CD 3.25Å; S397-E400 WeakPolarHBondContact OG-CG 3.38Å; S397-E400 PolarHBondContact OG-OE1 3.33Å; P398-E400 VanDerWaalsContact C-N 3.28Å; P398-E400 PolarHBondContact O-N 3.13Å
401	L	84.1	Confident	82.7	Confident	15 Å²	15	62.5 Å²	62.5	8%	0.079	33%	0.331	C	S	.	.	S	Bend	trans	-72.3	148	172.6	-65.2	-176.9	0	0	0	111.6	P398 T399 F403 L406 I461 L480 V484	P398-L401 WeakPolarHBondContact O-CB 3.2Å; P398-L401 PolarHBondContact O-N 3.17Å; T399-L401 PolarHBondContact O-N 3.27Å; L401-F403 PolarHBondContact O-N 3.43Å; L401-L406 HydrophobicContact CB-CD1 4.32Å; L401-L406 HydrophobicContact CB-CD2 4.15Å; L401-L406 HydrophobicContact CB-CG 4.01Å; L401-L406 HydrophobicContact CD1-CD2 4.17Å; L401-I461 HydrophobicContact CD1-CD1 4.02Å; L401-I461 HydrophobicContact CD1-CG1 4.24Å; L401-I461 HydrophobicContact CD2-CD1 3.58Å; L401-I461 HydrophobicContact CG-CD1 3.62Å; L401-I461 HydrophobicContact CG-CG1 4.28Å; L401-L480 HydrophobicContact CD1-CD1 4.11Å; L401-L480 HydrophobicContact CD1-CD2 4.34Å; L401-L480 HydrophobicContact CD1-CG 4.31Å; L401-V484 HydrophobicContact CD1-CG2 4.07Å; L401-V484 HydrophobicContact CD2-CG2 3.5Å; L401-V484 VanDerWaalsContact CD2-CG2 3.5Å; L401-V484 HydrophobicContact CG-CG2 4.44Å
402	P	82.6	Confident	82.7	Confident	59 Å²	59	57.5 Å²	57.5	38%	0.383	30%	0.304	S	S	.	.			trans	-54.9	139	174.7	-21.4	29.9	0	0	0	111.6	D404 C405 L406 T487	P402-D404 VanDerWaalsContact C-N 3.25Å; P402-D404 PolarHBondContact O-N 2.99Å; P402-C405 HydrophobicContact CB-CB 4.45Å; P402-C405 VanDerWaalsContact O-CB 3.26Å; P402-C405 WeakPolarHBondContact O-CB 3.47Å; P402-C405 PolarHBondContact O-N 3.31Å; P402-L406 PolarHBondContact O-N 3.11Å; P402-T487 HydrophobicContact CG-CG2 4Å
403	F	82.2	Confident	82.7	Confident	100 Å²	100	54.2 Å²	54.2	44%	0.439	28%	0.284	S	S	.	.	H	α-helix	trans	-51.8	-43.6	-179.4	178.3	-90.8	0	0	0	112.8	L401 C405 L406 E407 L448	L401-F403 PolarHBondContact O-N 3.43Å; F403-C405 PolarHBondContact O-N 2.93Å; F403-L406 PolarHBondContact O-N 3.4Å; F403-E407 HydrophobicContact CD1-CB 4.42Å; F403-E407 HydrophobicContact CE1-CB 4.1Å; F403-E407 HydrophobicContact CE1-CG 4.4Å; F403-E407 WeakPolarHBondContact CE1-OE2 3.42Å; F403-E407 WeakPolarHBondContact O-CB 3.05Å; F403-E407 PolarHBondContact O-N 3.47Å; F403-L448 HydrophobicContact CE2-CD2 3.67Å; F403-L448 HydrophobicContact CZ-CD2 4.19Å
404	D	81.5	Confident	82.7	Confident	100 Å²	100	55.5 Å²	55.5	54%	0.535	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-29.2	-177.8	-56.4	-33.7	0	0	0	112	K125 P402 K408	K125-D404 IonicContact NZ-OD1 2.76Å; K125-D404 PolarHBondContact NZ-OD1 3.02Å; P402-D404 VanDerWaalsContact C-N 3.25Å; P402-D404 PolarHBondContact O-N 2.99Å; D404-K408 VanDerWaalsContact O-CB 3.25Å; D404-K408 WeakPolarHBondContact O-CB 3.43Å; D404-K408 PolarHBondContact O-N 3.28Å; D404-K408 VanDerWaalsContact O-N 3.12Å
405	C	86.1	Confident	82.1	Confident	8 Å²	8	51.1 Å²	51.1	5%	0.054	28%	0.281	C	S	.	.	H	α-helix	trans	-71.3	-47	175.1	-178.9	0	0	0	0	111.2	P402 F403 K408 A409 L480 D483	P402-C405 HydrophobicContact CB-CB 4.45Å; P402-C405 VanDerWaalsContact O-CB 3.26Å; P402-C405 WeakPolarHBondContact O-CB 3.47Å; P402-C405 PolarHBondContact O-N 3.31Å; F403-C405 PolarHBondContact O-N 2.93Å; C405-K408 PolarHBondContact O-N 3.36Å; C405-A409 WeakPolarHBondContact O-CB 3.49Å; C405-A409 PolarHBondContact O-N 2.91Å; C405-L480 WeakPolarHBondContact SG-CD1 3.46Å; C405-D483 HydrophobicContact CB-CB 4.22Å; C405-D483 WeakPolarHBondContact SG-CB 3.19Å
406	L	86.2	Confident	81.5	Confident	10 Å²	10	52.9 Å²	52.9	5%	0.052	28%	0.282	C	S	.	.	H	α-helix	trans	-66.6	-39.9	177.1	-67.4	174	0	0	0	112.1	P398 L401 P402 F403 A409 S410 L448 F451	P398-L406 WeakPolarHBondContact O-CD1 3.33Å; P398-L406 WeakPolarHBondContact O-CD2 3.21Å; L401-L406 HydrophobicContact CB-CD1 4.32Å; L401-L406 HydrophobicContact CB-CD2 4.15Å; L401-L406 HydrophobicContact CB-CG 4.01Å; L401-L406 HydrophobicContact CD1-CD2 4.17Å; P402-L406 PolarHBondContact O-N 3.11Å; F403-L406 PolarHBondContact O-N 3.4Å; L406-A409 PolarHBondContact O-N 3.15Å; L406-S410 VanDerWaalsContact O-CB 3.28Å; L406-S410 WeakPolarHBondContact O-CB 3.47Å; L406-S410 PolarHBondContact O-N 3.3Å; L406-L448 HydrophobicContact CB-CD1 3.78Å; L406-F451 HydrophobicContact CB-CD2 4.2Å; L406-F451 HydrophobicContact CD2-CB 4.37Å; L406-F451 HydrophobicContact CD2-CD2 3.86Å; L406-F451 HydrophobicContact CD2-CE2 4.37Å; L406-F451 HydrophobicContact CD2-CG 4.16Å; L406-F451 WeakPolarHBondContact O-CE2 3.02Å
407	E	86.3	Confident	80.4	Confident	60 Å²	60	55.8 Å²	55.8	28%	0.28	29%	0.289	S	S	.	.	H	α-helix	trans	-62.4	-45.3	176.5	-174.3	-178.9	-168.3	0	0	110.8	F403 S410 R411	F403-E407 HydrophobicContact CD1-CB 4.42Å; F403-E407 HydrophobicContact CE1-CB 4.1Å; F403-E407 HydrophobicContact CE1-CG 4.4Å; F403-E407 WeakPolarHBondContact CE1-OE2 3.42Å; F403-E407 WeakPolarHBondContact O-CB 3.05Å; F403-E407 PolarHBondContact O-N 3.47Å; E407-S410 WeakPolarHBondContact O-CB 3.22Å; E407-S410 PolarHBondContact O-N 2.04Å; E407-R411 WeakPolarHBondContact O-CG 3.46Å; E407-R411 PolarHBondContact O-N 2.91Å; E407-R411 IonicContact OE1-CZ 3.41Å; E407-R411 IonicContact OE1-NE 2.94Å; E407-R411 IonicContact OE1-NH2 3.49Å; E407-R411 PolarHBondContact OE1-NH2 3.04Å
408	K	85.8	Confident	78.9	Confident	89 Å²	89	56.9 Å²	56.9	39%	0.387	30%	0.297	S	S	.	.	H	α-helix	trans	-61.4	-45.6	175.7	-177.8	179	168.8	-153.7	0	111.7	D404 C405 S410 R411 M412 S479 D483	D404-K408 VanDerWaalsContact O-CB 3.25Å; D404-K408 WeakPolarHBondContact O-CB 3.43Å; D404-K408 PolarHBondContact O-N 3.28Å; D404-K408 VanDerWaalsContact O-N 3.12Å; C405-K408 PolarHBondContact O-N 3.36Å; K408-S410 PolarHBondContact O-N 2.96Å; K408-R411 PolarHBondContact O-N 3.1Å; K408-M412 WeakPolarHBondContact O-CG 3.2Å; K408-M412 PolarHBondContact O-N 3.47Å; K408-S479 WeakPolarHBondContact CE-OG 3.4Å; K408-S479 PolarHBondContact NZ-OG 3.29Å; K408-D483 IonicContact NZ-OD1 3.7Å; K408-D483 PolarHBondContact NZ-OD1 3.49Å; K408-D483 IonicContact NZ-OD2 3.16Å; K408-D483 PolarHBondContact NZ-OD2 2.92Å
409	A	86.3	Confident	77.1	Confident	4 Å²	4	61.9 Å²	61.9	3%	0.033	33%	0.331	C	S	.	.	H	α-helix	trans	-62.6	-41.8	175.6	0	0	0	0	0	112.2	C405 L406 M412 L413 F451 L480	C405-A409 WeakPolarHBondContact O-CB 3.49Å; C405-A409 PolarHBondContact O-N 2.91Å; L406-A409 PolarHBondContact O-N 3.15Å; A409-M412 PolarHBondContact O-N 3.09Å; A409-L413 WeakPolarHBondContact O-CB 3.49Å; A409-L413 VanDerWaalsContact O-CG 3.27Å; A409-L413 WeakPolarHBondContact O-CG 3.42Å; A409-L413 PolarHBondContact O-N 3.18Å; A409-F451 HydrophobicContact CB-CE2 4.12Å; A409-F451 HydrophobicContact CB-CZ 4.05Å; A409-L480 HydrophobicContact CB-CD1 3.94Å
410	S	88	Confident	75.7	Confident	12 Å²	12	68.3 Å²	68.3	8%	0.084	36%	0.357	C	S	.	.	H	α-helix	trans	-59.9	-45.9	175.5	178.7	0	0	0	0	111.4	L406 E407 K408 M412 L413 S414 G447 L448	L406-S410 VanDerWaalsContact O-CB 3.28Å; L406-S410 WeakPolarHBondContact O-CB 3.47Å; L406-S410 PolarHBondContact O-N 3.3Å; E407-S410 WeakPolarHBondContact O-CB 3.22Å; E407-S410 PolarHBondContact O-N 2.04Å; K408-S410 PolarHBondContact O-N 2.96Å; S410-M412 PolarHBondContact O-N 3.01Å; S410-L413 CarbonylContact O-C 3.52Å; S410-L413 PolarHBondContact O-N 3.02Å; S410-S414 PolarHBondContact O-N 3.27Å; S410-G447 WeakPolarHBondContact OG-CA 3.39Å; S410-G447 PolarHBondContact OG-N 3.36Å; S410-L448 PolarHBondContact OG-N 2.9Å
411	R	84.6	Confident	73.9	Confident	155 Å²	155	67.9 Å²	67.9	59%	0.585	37%	0.372	S	S	*	.	H	α-helix	trans	-62.3	-43.1	176	-72	179.6	-171.3	-164.5	5.2	112.1	E407 K408 L413 S414 Y417	E407-R411 WeakPolarHBondContact O-CG 3.46Å; E407-R411 PolarHBondContact O-N 2.91Å; E407-R411 IonicContact OE1-CZ 3.41Å; E407-R411 IonicContact OE1-NE 2.94Å; E407-R411 IonicContact OE1-NH2 3.49Å; E407-R411 PolarHBondContact OE1-NH2 3.04Å; K408-R411 PolarHBondContact O-N 3.1Å; R411-L413 VanDerWaalsContact C-N 3.26Å; R411-L413 PolarHBondContact O-N 2.61Å; R411-S414 WeakPolarHBondContact O-CB 3.37Å; R411-S414 PolarHBondContact O-N 3.26Å; R411-S414 VanDerWaalsContact O-N 3.13Å; R411-Y417 WeakPolarHBondContact O-CB 3.36Å
412	M	82.8	Confident	72.4	Confident	21 Å²	21	70.1 Å²	70.1	10%	0.103	39%	0.392	C	S	.	.	H	α-helix	trans	-61.6	-35.8	175.9	-70.5	-179.3	71.4	0	0	112	K408 A409 S410 S414 Y417 R473 D475	K408-M412 WeakPolarHBondContact O-CG 3.2Å; K408-M412 PolarHBondContact O-N 3.47Å; A409-M412 PolarHBondContact O-N 3.09Å; S410-M412 PolarHBondContact O-N 3.01Å; M412-S414 VanDerWaalsContact C-N 3.3Å; M412-Y417 HydrophobicContact CB-CD1 4.47Å; M412-Y417 HydrophobicContact CB-CE1 4.46Å; M412-Y417 HydrophobicContact CG-CE1 4.3Å; M412-Y417 WeakPolarHBondContact O-CD1 3.46Å; M412-R473 PolarHBondContact O-NH1 2.88Å; M412-R473 PolarHBondContact O-NH2 2.94Å; M412-D475 VanDerWaalsContact CE-C 3.49Å; M412-D475 HydrophobicContact CE-CB 3.93Å; M412-D475 WeakPolarHBondContact CE-O 3.49Å
413	L	84	Confident	71	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.005	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-3.7	178.5	-64.2	167.9	0	0	0	113.6	A409 S410 R411 T426 W427 L430 F451 L468 I471 R473 A476	A409-L413 WeakPolarHBondContact O-CB 3.49Å; A409-L413 VanDerWaalsContact O-CG 3.27Å; A409-L413 WeakPolarHBondContact O-CG 3.42Å; A409-L413 PolarHBondContact O-N 3.18Å; S410-L413 CarbonylContact O-C 3.52Å; S410-L413 PolarHBondContact O-N 3.02Å; R411-L413 VanDerWaalsContact C-N 3.26Å; R411-L413 PolarHBondContact O-N 2.61Å; L413-T426 CarbonylContact O-C 3.57Å; L413-T426 VanDerWaalsContact O-CA 3.3Å; L413-T426 WeakPolarHBondContact O-CA 3.49Å; L413-W427 HydrophobicContact CB-CB 3.92Å; L413-W427 PolarHBondContact O-N 3.18Å; L413-L430 HydrophobicContact CD1-CD2 3.81Å; L413-F451 HydrophobicContact CD1-CE1 4.23Å; L413-F451 HydrophobicContact CD1-CZ 3.78Å; L413-L468 HydrophobicContact CD1-CD2 3.99Å; L413-L468 HydrophobicContact CD2-CD2 3.84Å; L413-I471 HydrophobicContact CD2-CD1 4.34Å; L413-R473 HydrophobicContact CD2-CB 4.34Å; L413-R473 HydrophobicContact CD2-CG 4.07Å; L413-A476 HydrophobicContact CD2-CB 4.15Å; L413-A476 HydrophobicContact CG-CB 4.47Å
414	S	82.1	Confident	70.4	Confident	30 Å²	30	72.2 Å²	72.2	21%	0.21	41%	0.412	C	S	.	.	S	Bend	trans	-68.7	149.3	176.4	-172.9	0	0	0	0	111.8	S410 R411 M412 S416 Y417	S410-S414 PolarHBondContact O-N 3.27Å; R411-S414 WeakPolarHBondContact O-CB 3.37Å; R411-S414 PolarHBondContact O-N 3.26Å; R411-S414 VanDerWaalsContact O-N 3.13Å; M412-S414 VanDerWaalsContact C-N 3.3Å; S414-S416 PolarHBondContact O-N 2.97Å; S414-S416 PolarHBondContact OG-N 3.15Å; S414-S416 PolarHBondContact OG-OG 3.28Å; S414-Y417 PolarHBondContact O-N 2.77Å
415	S	65.4	Low	70.4	Confident	71 Å²	71	70.8 Å²	70.8	50%	0.497	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-61.7	-28.2	173.2	49.2	0	0	0	0	112.6	Y417	S415-Y417 VanDerWaalsContact C-N 3.3Å; S415-Y417 PolarHBondContact O-N 3.03Å
416	S	58	Low	70.4	Confident	106 Å²	106	71.3 Å²	71.3	74%	0.741	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-75.7	-11.4	179.6	50.4	0	0	0	0	114.6	S414 S418	S414-S416 PolarHBondContact O-N 2.97Å; S414-S416 PolarHBondContact OG-N 3.15Å; S414-S416 PolarHBondContact OG-OG 3.28Å; S416-S418 VanDerWaalsContact C-N 3.35Å
417	Y	55.8	Low	70.5	Confident	130 Å²	130	71.2 Å²	71.2	51%	0.51	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-86.3	-9.2	177.4	-168.7	-102.7	0	0	0	112.8	R411 M412 S414 S415 S419	R411-Y417 WeakPolarHBondContact O-CB 3.36Å; M412-Y417 HydrophobicContact CB-CD1 4.47Å; M412-Y417 HydrophobicContact CB-CE1 4.46Å; M412-Y417 HydrophobicContact CG-CE1 4.3Å; M412-Y417 WeakPolarHBondContact O-CD1 3.46Å; S414-Y417 PolarHBondContact O-N 2.77Å; S415-Y417 VanDerWaalsContact C-N 3.3Å; S415-Y417 PolarHBondContact O-N 3.03Å; Y417-S419 PolarHBondContact O-N 3.25Å; Y417-S419 VanDerWaalsContact O-N 3.16Å
418	S	53.5	Low	70.6	Confident	48 Å²	48	73 Å²	73	34%	0.336	41%	0.407	S	S	.	.			trans	-84.9	90.3	-178.1	-146.5	0	0	0	0	110	S416 E420 A422 V424	S416-S418 VanDerWaalsContact C-N 3.35Å; S418-E420 PolarHBondContact O-N 3.19Å; S418-E420 VanDerWaalsContact O-N 3.1Å; S418-A422 PolarHBondContact OG-O 3.29Å; S418-V424 WeakPolarHBondContact OG-CB 3.35Å; S418-V424 WeakPolarHBondContact OG-CG2 3.36Å
419	S	42.8	Very low	70.7	Confident	104 Å²	104	72.6 Å²	72.6	73%	0.727	41%	0.407	S	S	*	.			trans	-70.7	101.2	170	44.8	0	0	0	0	110.5	Y417 A421	Y417-S419 PolarHBondContact O-N 3.25Å; Y417-S419 VanDerWaalsContact O-N 3.16Å; S419-A421 VanDerWaalsContact C-N 3.29Å; S419-A421 PolarHBondContact O-N 3.48Å
420	E	48.5	Very low	70.8	Confident	203 Å²	203	72.4 Å²	72.4	95%	0.949	41%	0.405	S	S	*	.	S	Bend	trans	49.8	-2.8	148.5	-80.9	167.4	151.4	0	0	122.6	S418	S418-E420 PolarHBondContact O-N 3.19Å; S418-E420 VanDerWaalsContact O-N 3.1Å
421	A	45.2	Very low	70.8	Confident	100 Å²	100	71.9 Å²	71.9	83%	0.826	40%	0.401	S	S	*	.	S	Bend	trans	-136.8	0.8	-175.9	0	0	0	0	0	116.7	S419	S419-A421 VanDerWaalsContact C-N 3.29Å; S419-A421 PolarHBondContact O-N 3.48Å
422	A	52.2	Low	71.1	Confident	61 Å²	61	68 Å²	68	50%	0.504	39%	0.39	S	S	.	.			trans	-144.7	132.6	173.8	0	0	0	0	0	110.6	S418 V424	S418-A422 PolarHBondContact OG-O 3.29Å; A422-V424 HydrophobicContact CB-CG2 3.76Å; A422-V424 PolarHBondContact O-N 2.94Å
423	V	54.7	Low	71.4	Confident	155 Å²	155	68.2 Å²	68.2	94%	0.939	39%	0.393	S	S	*	.			trans	-70.6	82.8	167.4	-179.3	0	0	0	0	107
424	V	69.1	Low	71.6	Confident	49 Å²	49	68.8 Å²	68.8	30%	0.297	40%	0.396	S	S	.	.			trans	-81.6	131	-177.2	-177.8	0	0	0	0	109.2	S418 A422 T426 R473	S418-V424 WeakPolarHBondContact OG-CB 3.35Å; S418-V424 WeakPolarHBondContact OG-CG2 3.36Å; A422-V424 HydrophobicContact CB-CG2 3.76Å; A422-V424 PolarHBondContact O-N 2.94Å; V424-T426 PolarHBondContact O-N 3.27Å; V424-R473 VanDerWaalsContact CG1-NH1 3.28Å
425	K	80.6	Confident	71.9	Confident	69 Å²	69	70.3 Å²	70.3	30%	0.3	42%	0.416	S	S	.	.			trans	-62.3	123.5	177.2	-58.1	-162.6	-166	84.5	0	109.7	H429 I471 E472 R473	K425-H429 HydrophobicContact CB-CB 3.92Å; K425-H429 HydrophobicContact CD-CB 4.47Å; K425-I471 HydrophobicContact CB-CB 4.16Å; K425-I471 HydrophobicContact CD-CB 3.89Å; K425-I471 HydrophobicContact CD-CG2 4.36Å; K425-I471 WeakPolarHBondContact CD-O 3.49Å; K425-I471 PolarHBondContact NZ-O 3.18Å; K425-I471 VanDerWaalsContact NZ-O 3.11Å; K425-E472 IonicContact NZ-OE2 2.96Å; K425-E472 PolarHBondContact NZ-OE2 2.87Å; K425-R473 WeakPolarHBondContact O-CD 3.42Å; K425-R473 PolarHBondContact O-NH1 3.32Å
426	T	86.1	Confident	72.9	Confident	20 Å²	20	68 Å²	68	12%	0.123	40%	0.398	C	S	.	.			trans	-84.9	174.9	-178.4	58.5	0	0	0	0	112.2	L413 V424 R428 H429 L430	L413-T426 CarbonylContact O-C 3.57Å; L413-T426 VanDerWaalsContact O-CA 3.3Å; L413-T426 WeakPolarHBondContact O-CA 3.49Å; V424-T426 PolarHBondContact O-N 3.27Å; T426-R428 PolarHBondContact O-N 3.02Å; T426-R428 VanDerWaalsContact O-N 3.1Å; T426-H429 PolarHBondContact N-ND1 2.86Å; T426-H429 VanDerWaalsContact N-ND1 3.19Å; T426-H429 WeakPolarHBondContact O-CB 3.45Å; T426-H429 PolarHBondContact O-N 3Å; T426-H429 PolarHBondContact OG1-ND1 2.92Å; T426-L430 PolarHBondContact O-N 3.07Å
427	W	87.9	Confident	74.3	Confident	7 Å²	7	69.5 Å²	69.5	3%	0.027	39%	0.391	C	S	.	.	H	α-helix	trans	-54.4	-27	172.1	64.9	-100.1	0	0	0	113.1	L413 H429 L430 A431 I441 M444 L450	L413-W427 HydrophobicContact CB-CB 3.92Å; L413-W427 PolarHBondContact O-N 3.18Å; W427-H429 PolarHBondContact O-N 3.02Å; W427-L430 WeakPolarHBondContact O-CB 3.4Å; W427-L430 PolarHBondContact O-N 3.49Å; W427-A431 PolarHBondContact O-N 3.3Å; W427-I441 HydrophobicContact CH2-CG2 4.4Å; W427-I441 HydrophobicContact CZ3-CG2 3.94Å; W427-M444 HydrophobicContact CH2-CB 3.85Å; W427-M444 VanDerWaalsContact CH2-O 3.27Å; W427-M444 WeakPolarHBondContact CH2-O 3.43Å; W427-M444 HydrophobicContact CZ3-CB 3.8Å; W427-M444 HydrophobicContact CZ3-SD 4.44Å; W427-L450 HydrophobicContact CB-CD2 4.25Å; W427-L450 HydrophobicContact CE3-CD2 4.49Å; W427-L450 VanDerWaalsContact O-CD2 3.28Å; W427-L450 WeakPolarHBondContact O-CD2 3.38Å
428	R	88.1	Confident	75.6	Confident	98 Å²	98	71.9 Å²	71.9	37%	0.37	40%	0.399	S	S	.	.	H	α-helix	trans	-64.3	-40	175.3	-63.9	-173.3	-179.1	94.3	1.4	112.4	T426 L430 A431 E432 I441	T426-R428 PolarHBondContact O-N 3.02Å; T426-R428 VanDerWaalsContact O-N 3.1Å; R428-L430 VanDerWaalsContact C-N 3.31Å; R428-A431 WeakPolarHBondContact O-CB 3.34Å; R428-A431 PolarHBondContact O-N 3.44Å; R428-E432 WeakPolarHBondContact O-CG 3.5Å; R428-E432 PolarHBondContact O-N 2.76Å; R428-I441 HydrophobicContact CB-CG2 4.05Å; R428-I441 HydrophobicContact CG-CG2 3.87Å
429	H	88.6	Confident	77	Confident	81 Å²	81	75 Å²	75	38%	0.375	41%	0.412	S	S	.	.	H	α-helix	trans	-70.4	-32.1	175.5	-60.5	86	0	0	0	111.5	K425 T426 W427 S433	K425-H429 HydrophobicContact CB-CB 3.92Å; K425-H429 HydrophobicContact CD-CB 4.47Å; T426-H429 PolarHBondContact N-ND1 2.86Å; T426-H429 VanDerWaalsContact N-ND1 3.19Å; T426-H429 WeakPolarHBondContact O-CB 3.45Å; T426-H429 PolarHBondContact O-N 3Å; T426-H429 PolarHBondContact OG1-ND1 2.92Å; W427-H429 PolarHBondContact O-N 3.02Å; H429-S433 PolarHBondContact O-N 2.89Å; H429-S433 VanDerWaalsContact O-N 3.15Å
430	L	89.3	Confident	78.9	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-64	-44.8	171	-176.6	61.4	0	0	0	110.5	L413 T426 W427 R428 E432 S433 F434 L450 F451 L464 R467 L468 I471	L413-L430 HydrophobicContact CD1-CD2 3.81Å; T426-L430 PolarHBondContact O-N 3.07Å; W427-L430 WeakPolarHBondContact O-CB 3.4Å; W427-L430 PolarHBondContact O-N 3.49Å; R428-L430 VanDerWaalsContact C-N 3.31Å; L430-E432 PolarHBondContact O-N 3.24Å; L430-S433 WeakPolarHBondContact O-CB 3.46Å; L430-S433 PolarHBondContact O-N 2.94Å; L430-S433 VanDerWaalsContact O-N 3.09Å; L430-S433 PolarHBondContact O-OG 3.35Å; L430-F434 HydrophobicContact CD1-CD2 4.49Å; L430-F434 HydrophobicContact CD1-CE2 3.9Å; L430-F434 HydrophobicContact CG-CD2 4.36Å; L430-F434 HydrophobicContact CG-CE2 3.94Å; L430-F434 VanDerWaalsContact O-CD2 3.22Å; L430-F434 WeakPolarHBondContact O-CD2 3.42Å; L430-F434 PolarHBondContact O-N 3.07Å; L430-L450 HydrophobicContact CB-CD2 4.08Å; L430-L450 HydrophobicContact CD2-CD2 3.97Å; L430-L450 HydrophobicContact CG-CD2 4.05Å; L430-F451 HydrophobicContact CD2-CE1 4.14Å; L430-L464 HydrophobicContact CD2-CD1 3.94Å; L430-R467 HydrophobicContact CD1-CB 3.68Å; L430-L468 HydrophobicContact CD1-CD2 4Å; L430-L468 HydrophobicContact CD1-CG 4.13Å; L430-L468 HydrophobicContact CD2-CD2 3.73Å; L430-L468 HydrophobicContact CD2-CG 4.31Å; L430-L468 HydrophobicContact CG-CD2 4.47Å; L430-I471 HydrophobicContact CB-CD1 3.97Å; L430-I471 HydrophobicContact CD1-CD1 4.09Å
431	A	88.4	Confident	80.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.1	-44.8	177.3	0	0	0	0	0	112.4	W427 R428 S433 F434 G435 L436 I441 L450	W427-A431 PolarHBondContact O-N 3.3Å; R428-A431 WeakPolarHBondContact O-CB 3.34Å; R428-A431 PolarHBondContact O-N 3.44Å; A431-S433 PolarHBondContact O-N 3.49Å; A431-F434 WeakPolarHBondContact O-CB 3.4Å; A431-F434 PolarHBondContact O-N 3.44Å; A431-G435 PolarHBondContact O-N 3.37Å; A431-L436 HydrophobicContact CB-CB 4.38Å; A431-L436 HydrophobicContact CB-CD1 3.8Å; A431-L436 WeakPolarHBondContact O-CB 3.29Å; A431-L436 PolarHBondContact O-N 2.76Å; A431-I441 HydrophobicContact CB-CD1 3.74Å; A431-I441 HydrophobicContact CB-CG1 3.68Å; A431-L450 HydrophobicContact CB-CD1 3.51Å; A431-L450 HydrophobicContact CB-CD2 3.96Å; A431-L450 HydrophobicContact CB-CG 4.36Å
432	E	89.8	Confident	82.3	Confident	73 Å²	73	62 Å²	62	34%	0.341	34%	0.341	S	S	.	.	H	α-helix	trans	-58.4	-36.1	174	-71.7	171.5	-173.2	0	0	112.1	R428 L430 F434 G435 R438 I441	R428-E432 WeakPolarHBondContact O-CG 3.5Å; R428-E432 PolarHBondContact O-N 2.76Å; L430-E432 PolarHBondContact O-N 3.24Å; E432-F434 PolarHBondContact O-N 3.02Å; E432-G435 WeakPolarHBondContact O-CA 3.38Å; E432-G435 PolarHBondContact O-N 3Å; E432-R438 IonicContact OE1-CZ 3.63Å; E432-R438 IonicContact OE1-NE 3.52Å; E432-R438 IonicContact OE1-NH1 2.76Å; E432-R438 PolarHBondContact OE1-NH1 3.34Å; E432-R438 IonicContact OE1-NH2 2.78Å; E432-I441 HydrophobicContact CG-CD1 3.66Å
433	S	88.9	Confident	83.7	Confident	26 Å²	26	61.9 Å²	61.9	18%	0.182	35%	0.346	C	S	.	.	H	α-helix	trans	-67.7	-20.5	177.6	81.9	0	0	0	0	113.9	H429 L430 A431 G435 R467	H429-S433 PolarHBondContact O-N 2.89Å; H429-S433 VanDerWaalsContact O-N 3.15Å; L430-S433 WeakPolarHBondContact O-CB 3.46Å; L430-S433 PolarHBondContact O-N 2.94Å; L430-S433 VanDerWaalsContact O-N 3.09Å; L430-S433 PolarHBondContact O-OG 3.35Å; A431-S433 PolarHBondContact O-N 3.49Å; S433-G435 VanDerWaalsContact C-N 3.31Å; S433-R467 PolarHBondContact O-NE 3.17Å; S433-R467 PolarHBondContact O-NH1 3.12Å; S433-R467 WeakPolarHBondContact OG-CB 3.45Å
434	F	88.3	Confident	85.2	Confident	14 Å²	14	55.5 Å²	55.5	6%	0.061	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-1.3	169.7	-73.3	-75.6	0	0	0	113.1	L430 A431 E432 L436 V454 Y459 L464 R467	L430-F434 HydrophobicContact CD1-CD2 4.49Å; L430-F434 HydrophobicContact CD1-CE2 3.9Å; L430-F434 HydrophobicContact CG-CD2 4.36Å; L430-F434 HydrophobicContact CG-CE2 3.94Å; L430-F434 VanDerWaalsContact O-CD2 3.22Å; L430-F434 WeakPolarHBondContact O-CD2 3.42Å; L430-F434 PolarHBondContact O-N 3.07Å; A431-F434 WeakPolarHBondContact O-CB 3.4Å; A431-F434 PolarHBondContact O-N 3.44Å; E432-F434 PolarHBondContact O-N 3.02Å; F434-L436 VanDerWaalsContact C-N 3.34Å; F434-L436 HydrophobicContact CB-CD1 4.14Å; F434-V454 HydrophobicContact CD1-CG1 4.24Å; F434-V454 HydrophobicContact CD1-CG2 4.29Å; F434-V454 HydrophobicContact CD2-CG2 3.7Å; F434-V454 HydrophobicContact CE1-CG1 3.67Å; F434-V454 HydrophobicContact CE1-CG2 4.35Å; F434-V454 HydrophobicContact CE2-CG1 4.1Å; F434-V454 HydrophobicContact CE2-CG2 3.76Å; F434-V454 HydrophobicContact CG-CG2 3.96Å; F434-V454 HydrophobicContact CZ-CG1 3.56Å; F434-V454 HydrophobicContact CZ-CG2 4.06Å; F434-Y459 HydrophobicContact CB-CE2 4.5Å; F434-Y459 HydrophobicContact CD1-CD1 4.03Å; F434-Y459 AromaticContact CD1-CD2 3.77Å; F434-Y459 HydrophobicContact CD1-CD2 3.77Å; F434-Y459 HydrophobicContact CD1-CE1 4.07Å; F434-Y459 AromaticContact CD1-CE2 3.8Å; F434-Y459 HydrophobicContact CD1-CE2 3.8Å; F434-Y459 AromaticContact CD1-CG 3.89Å; F434-Y459 HydrophobicContact CD1-CG 3.89Å; F434-Y459 AromaticContact CD1-CZ 3.97Å; F434-Y459 HydrophobicContact CE1-CD1 4.02Å; F434-Y459 HydrophobicContact CE1-CD2 4.05Å; F434-Y459 HydrophobicContact CE1-CE1 4.48Å; F434-Y459 AromaticContact CE1-CG 3.79Å; F434-Y459 HydrophobicContact CE1-CG 3.79Å; F434-L464 HydrophobicContact CE2-CD1 3.96Å; F434-L464 HydrophobicContact CZ-CB 4.31Å; F434-L464 HydrophobicContact CZ-CD1 3.86Å; F434-R467 HydrophobicContact CD1-CG 4.2Å; F434-R467 HydrophobicContact CE1-CG 3.83Å; F434-R467 HydrophobicContact CE2-CB 4.17Å; F434-R467 HydrophobicContact CE2-CG 4.18Å; F434-R467 HydrophobicContact CZ-CB 4.1Å; F434-R467 HydrophobicContact CZ-CG 3.85Å
435	G	87.8	Confident	85.7	Confident	62 Å²	62	57.2 Å²	57.2	64%	0.639	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	16.5	-178.6	0	0	0	0	0	114.1	A431 E432 S433	A431-G435 PolarHBondContact O-N 3.37Å; E432-G435 WeakPolarHBondContact O-CA 3.38Å; E432-G435 PolarHBondContact O-N 3Å; S433-G435 VanDerWaalsContact C-N 3.31Å
436	L	87.5	Confident	86	Confident	21 Å²	21	56.7 Å²	56.7	11%	0.11	32%	0.321	C	S	.	.			trans	-65.7	138.2	172.8	-73.3	147.7	0	0	0	109.7	A431 F434 E440 I441 M444 L450 R453	A431-L436 HydrophobicContact CB-CB 4.38Å; A431-L436 HydrophobicContact CB-CD1 3.8Å; A431-L436 WeakPolarHBondContact O-CB 3.29Å; A431-L436 PolarHBondContact O-N 2.76Å; F434-L436 VanDerWaalsContact C-N 3.34Å; F434-L436 HydrophobicContact CB-CD1 4.14Å; L436-E440 HydrophobicContact CD2-CB 4.28Å; L436-E440 WeakPolarHBondContact CD2-OE2 3.24Å; L436-I441 HydrophobicContact CB-CD1 4.1Å; L436-I441 HydrophobicContact CB-CG1 3.9Å; L436-I441 WeakPolarHBondContact O-CD1 3.32Å; L436-M444 HydrophobicContact CD1-CE 4.37Å; L436-M444 HydrophobicContact CD2-CE 4.03Å; L436-L450 HydrophobicContact CD1-CD1 3.42Å; L436-L450 VanDerWaalsContact CD1-CD1 3.42Å; L436-R453 HydrophobicContact CD2-CG 3.97Å
437	K	87.5	Confident	85.9	Confident	139 Å²	139	55.7 Å²	55.7	60%	0.604	32%	0.315	S	S	*	.			trans	-77.4	159.5	179.9	-59.9	-179.7	-179.5	173.5	0	111.3	D439 E440 I441	K437-D439 VanDerWaalsContact C-N 3.25Å; K437-D439 WeakPolarHBondContact CB-OD1 3.38Å; K437-D439 PolarHBondContact O-N 3.49Å; K437-E440 PolarHBondContact N-OE2 3.05Å; K437-E440 PolarHBondContact O-N 3.32Å; K437-E440 VanDerWaalsContact O-N 3.13Å; K437-I441 VanDerWaalsContact O-CG1 3.28Å; K437-I441 WeakPolarHBondContact O-CG1 3.25Å; K437-I441 PolarHBondContact O-N 3.31Å
438	R	82.4	Confident	85.9	Confident	179 Å²	179	57.6 Å²	57.6	68%	0.675	33%	0.325	S	S	*	.	H	α-helix	trans	-58.7	-34.6	-179	-75.7	-67.4	-143.6	-171.7	-4	113.3	E432 G442	E432-R438 IonicContact OE1-CZ 3.63Å; E432-R438 IonicContact OE1-NE 3.52Å; E432-R438 IonicContact OE1-NH1 2.76Å; E432-R438 PolarHBondContact OE1-NH1 3.34Å; E432-R438 IonicContact OE1-NH2 2.78Å; R438-G442 PolarHBondContact O-N 3.46Å
439	D	82.9	Confident	86	Confident	113 Å²	113	55.9 Å²	55.9	60%	0.604	32%	0.321	S	S	*	.	H	α-helix	trans	-65.7	-43.4	175.1	51	-57.5	0	0	0	112.2	K437 G442 G443	K437-D439 VanDerWaalsContact C-N 3.25Å; K437-D439 WeakPolarHBondContact CB-OD1 3.38Å; K437-D439 PolarHBondContact O-N 3.49Å; D439-G442 PolarHBondContact O-N 3.03Å; D439-G443 PolarHBondContact O-N 3Å
440	E	83.1	Confident	86.1	Confident	64 Å²	64	52 Å²	52	30%	0.299	30%	0.304	S	S	.	.	H	α-helix	trans	-66.6	-40.1	175.7	-63.6	-177.6	118.1	0	0	111.5	L436 K437 G443 R453	L436-E440 HydrophobicContact CD2-CB 4.28Å; L436-E440 WeakPolarHBondContact CD2-OE2 3.24Å; K437-E440 PolarHBondContact N-OE2 3.05Å; K437-E440 PolarHBondContact O-N 3.32Å; K437-E440 VanDerWaalsContact O-N 3.13Å; E440-G443 PolarHBondContact O-N 3.19Å; E440-R453 IonicContact OE1-CZ 3.31Å; E440-R453 IonicContact OE1-NE 3.52Å; E440-R453 IonicContact OE1-NH2 3.47Å; E440-R453 PolarHBondContact OE1-NH2 3.43Å
441	I	84.2	Confident	86.2	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-69.1	-37.3	178.3	-62.5	169.3	0	0	0	111.1	W427 R428 A431 E432 L436 K437 G443 M444	W427-I441 HydrophobicContact CH2-CG2 4.4Å; W427-I441 HydrophobicContact CZ3-CG2 3.94Å; R428-I441 HydrophobicContact CB-CG2 4.05Å; R428-I441 HydrophobicContact CG-CG2 3.87Å; A431-I441 HydrophobicContact CB-CD1 3.74Å; A431-I441 HydrophobicContact CB-CG1 3.68Å; E432-I441 HydrophobicContact CG-CD1 3.66Å; L436-I441 HydrophobicContact CB-CD1 4.1Å; L436-I441 HydrophobicContact CB-CG1 3.9Å; L436-I441 WeakPolarHBondContact O-CD1 3.32Å; K437-I441 VanDerWaalsContact O-CG1 3.28Å; K437-I441 WeakPolarHBondContact O-CG1 3.25Å; K437-I441 PolarHBondContact O-N 3.31Å; I441-G443 PolarHBondContact O-N 3.04Å; I441-M444 PolarHBondContact O-N 3.43Å
442	G	81.3	Confident	86.2	Confident	66 Å²	66	57.9 Å²	57.9	68%	0.68	33%	0.331	S	S	*	.	H	α-helix	trans	-65	-27.2	176.4	0	0	0	0	0	113.2	R438 D439 M444	R438-G442 PolarHBondContact O-N 3.46Å; D439-G442 PolarHBondContact O-N 3.03Å; G442-M444 VanDerWaalsContact C-N 3.34Å
443	G	82.1	Confident	86	Confident	60 Å²	60	58.8 Å²	58.8	62%	0.619	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-12.4	174	0	0	0	0	0	115	D439 E440 I441	D439-G443 PolarHBondContact O-N 3Å; E440-G443 PolarHBondContact O-N 3.19Å; I441-G443 PolarHBondContact O-N 3.04Å
444	M	84.9	Confident	86.1	Confident	20 Å²	20	57.7 Å²	57.7	10%	0.099	32%	0.323	C	S	.	.			trans	-91.1	133.8	180	-62.9	176.9	-158.2	0	0	111.2	W427 L436 I441 G442 Q449 L450 R453	W427-M444 HydrophobicContact CH2-CB 3.85Å; W427-M444 VanDerWaalsContact CH2-O 3.27Å; W427-M444 WeakPolarHBondContact CH2-O 3.43Å; W427-M444 HydrophobicContact CZ3-CB 3.8Å; W427-M444 HydrophobicContact CZ3-SD 4.44Å; L436-M444 HydrophobicContact CD1-CE 4.37Å; L436-M444 HydrophobicContact CD2-CE 4.03Å; I441-M444 PolarHBondContact O-N 3.43Å; G442-M444 VanDerWaalsContact C-N 3.34Å; M444-Q449 HydrophobicContact CB-CB 4.36Å; M444-Q449 HydrophobicContact CG-CB 4.27Å; M444-L450 HydrophobicContact SD-CB 4.02Å; M444-L450 HydrophobicContact SD-CD1 4.2Å; M444-R453 HydrophobicContact CE-CB 4.1Å; M444-R453 HydrophobicContact CE-CG 3.87Å
445	S	81.1	Confident	86.1	Confident	86 Å²	86	57.8 Å²	57.8	60%	0.601	33%	0.326	S	S	*	.			trans	-88.7	-27.1	177.6	58.3	0	0	0	0	113.8	Q449	S445-Q449 PolarHBondContact OG-NE2 2.91Å
446	D	85.1	Confident	86	Confident	57 Å²	57	60 Å²	60	31%	0.305	33%	0.327	S	S	.	.	S	Bend	trans	-149.5	174.7	-175.6	64.3	21.4	0	0	0	113	L448 Q449	D446-L448 PolarHBondContact O-N 3.36Å; D446-L448 WeakPolarHBondContact OD1-CA 3.48Å; D446-L448 WeakPolarHBondContact OD1-CB 3.39Å; D446-L448 PolarHBondContact OD1-N 3.48Å; D446-Q449 PolarHBondContact OD1-N 3.17Å
447	G	85.7	Confident	85.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-70.2	-12.8	175.3	0	0	0	0	0	113.9	S410 L450 F451	S410-G447 WeakPolarHBondContact OG-CA 3.39Å; S410-G447 PolarHBondContact OG-N 3.36Å; G447-L450 WeakPolarHBondContact O-CB 3.48Å; G447-L450 PolarHBondContact O-N 3.36Å; G447-F451 WeakPolarHBondContact O-CD2 3.39Å; G447-F451 WeakPolarHBondContact O-CE2 3.4Å; G447-F451 VanDerWaalsContact O-CG 3.25Å; G447-F451 WeakPolarHBondContact O-CG 3.24Å; G447-F451 PolarHBondContact O-N 3.41Å; G447-F451 VanDerWaalsContact O-N 3.12Å
448	L	87.5	Confident	85.7	Confident	46 Å²	46	58.1 Å²	58.1	24%	0.241	35%	0.347	C	S	.	.	H	α-helix	trans	-76.7	-42.7	-179.2	-169.2	68.7	0	0	0	110.5	F403 L406 S410 D446 L450 F451 E452	F403-L448 HydrophobicContact CE2-CD2 3.67Å; F403-L448 HydrophobicContact CZ-CD2 4.19Å; L406-L448 HydrophobicContact CB-CD1 3.78Å; S410-L448 PolarHBondContact OG-N 2.9Å; D446-L448 PolarHBondContact O-N 3.36Å; D446-L448 WeakPolarHBondContact OD1-CA 3.48Å; D446-L448 WeakPolarHBondContact OD1-CB 3.39Å; D446-L448 PolarHBondContact OD1-N 3.48Å; L448-L450 PolarHBondContact O-N 3.43Å; L448-F451 HydrophobicContact CD1-CD2 4.38Å; L448-F451 PolarHBondContact O-N 3.23Å; L448-F451 VanDerWaalsContact O-N 3.11Å; L448-E452 PolarHBondContact O-N 2.92Å; L448-E452 VanDerWaalsContact O-N 3.08Å
449	Q	89.8	Confident	86	Confident	63 Å²	63	53.4 Å²	53.4	29%	0.294	33%	0.33	S	S	.	.	H	α-helix	trans	-60.5	-34.4	170.7	-69.7	-178.6	20.7	0	0	111.9	M444 S445 D446 E452 R453	M444-Q449 HydrophobicContact CB-CB 4.36Å; M444-Q449 HydrophobicContact CG-CB 4.27Å; S445-Q449 PolarHBondContact OG-NE2 2.91Å; D446-Q449 PolarHBondContact OD1-N 3.17Å; Q449-E452 PolarHBondContact O-N 2.76Å; Q449-R453 WeakPolarHBondContact O-CB 3.46Å; Q449-R453 PolarHBondContact O-N 2.84Å
450	L	91.3	Very high	86.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-47.2	172.5	174.4	63.2	0	0	0	111.6	W427 L430 A431 L436 M444 G447 L448 E452 R453 V454	W427-L450 HydrophobicContact CB-CD2 4.25Å; W427-L450 HydrophobicContact CE3-CD2 4.49Å; W427-L450 VanDerWaalsContact O-CD2 3.28Å; W427-L450 WeakPolarHBondContact O-CD2 3.38Å; L430-L450 HydrophobicContact CB-CD2 4.08Å; L430-L450 HydrophobicContact CD2-CD2 3.97Å; L430-L450 HydrophobicContact CG-CD2 4.05Å; A431-L450 HydrophobicContact CB-CD1 3.51Å; A431-L450 HydrophobicContact CB-CD2 3.96Å; A431-L450 HydrophobicContact CB-CG 4.36Å; L436-L450 HydrophobicContact CD1-CD1 3.42Å; L436-L450 VanDerWaalsContact CD1-CD1 3.42Å; M444-L450 HydrophobicContact SD-CB 4.02Å; M444-L450 HydrophobicContact SD-CD1 4.2Å; G447-L450 WeakPolarHBondContact O-CB 3.48Å; G447-L450 PolarHBondContact O-N 3.36Å; L448-L450 PolarHBondContact O-N 3.43Å; L450-E452 VanDerWaalsContact C-N 3.31Å; L450-E452 PolarHBondContact O-N 3.17Å; L450-R453 PolarHBondContact O-N 3.28Å; L450-V454 HydrophobicContact CD1-CG2 3.76Å; L450-V454 HydrophobicContact CG-CG2 4.21Å; L450-V454 WeakPolarHBondContact O-CB 3.39Å; L450-V454 WeakPolarHBondContact O-CG2 3.41Å; L450-V454 PolarHBondContact O-N 3.07Å
451	F	91.1	Very high	86.5	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.009	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-38.2	179.6	-59.6	-40	0	0	0	112.4	L406 A409 L413 L430 G447 L448 S455 L464	L406-F451 HydrophobicContact CB-CD2 4.2Å; L406-F451 HydrophobicContact CD2-CB 4.37Å; L406-F451 HydrophobicContact CD2-CD2 3.86Å; L406-F451 HydrophobicContact CD2-CE2 4.37Å; L406-F451 HydrophobicContact CD2-CG 4.16Å; L406-F451 WeakPolarHBondContact O-CE2 3.02Å; A409-F451 HydrophobicContact CB-CE2 4.12Å; A409-F451 HydrophobicContact CB-CZ 4.05Å; L413-F451 HydrophobicContact CD1-CE1 4.23Å; L413-F451 HydrophobicContact CD1-CZ 3.78Å; L430-F451 HydrophobicContact CD2-CE1 4.14Å; G447-F451 WeakPolarHBondContact O-CD2 3.39Å; G447-F451 WeakPolarHBondContact O-CE2 3.4Å; G447-F451 VanDerWaalsContact O-CG 3.25Å; G447-F451 WeakPolarHBondContact O-CG 3.24Å; G447-F451 PolarHBondContact O-N 3.41Å; G447-F451 VanDerWaalsContact O-N 3.12Å; L448-F451 HydrophobicContact CD1-CD2 4.38Å; L448-F451 PolarHBondContact O-N 3.23Å; L448-F451 VanDerWaalsContact O-N 3.11Å; F451-S455 VanDerWaalsContact O-CB 3.31Å; F451-S455 WeakPolarHBondContact O-CB 3.23Å; F451-S455 PolarHBondContact O-N 3.49Å; F451-L464 HydrophobicContact CD1-CD1 4.11Å; F451-L464 HydrophobicContact CD1-CD2 4.03Å; F451-L464 HydrophobicContact CE1-CD1 3.94Å; F451-L464 HydrophobicContact CE1-CD2 4.11Å
452	E	87.9	Confident	86.7	Confident	121 Å²	121	47 Å²	47	57%	0.565	30%	0.301	S	S	*	.	H	α-helix	trans	-64.4	-44.4	173.8	-173	178.6	-174.8	0	0	111.9	T399 L448 Q449 L450 S455 T456	T399-E452 HydrophobicContact CG2-CB 4.5Å; L448-E452 PolarHBondContact O-N 2.92Å; L448-E452 VanDerWaalsContact O-N 3.08Å; Q449-E452 PolarHBondContact O-N 2.76Å; L450-E452 VanDerWaalsContact C-N 3.31Å; L450-E452 PolarHBondContact O-N 3.17Å; E452-S455 PolarHBondContact O-N 3.27Å; E452-T456 WeakPolarHBondContact O-CB 3.36Å; E452-T456 PolarHBondContact O-N 2.72Å; E452-T456 PolarHBondContact O-OG1 3.47Å
453	R	86.6	Confident	87.1	Confident	92 Å²	92	47 Å²	47	35%	0.347	29%	0.285	S	S	.	.	H	α-helix	trans	-66.9	-37.3	178.8	-174.6	64.2	176.9	76.9	5.4	112.7	L436 E440 M444 Q449 L450 A457	L436-R453 HydrophobicContact CD2-CG 3.97Å; E440-R453 IonicContact OE1-CZ 3.31Å; E440-R453 IonicContact OE1-NE 3.52Å; E440-R453 IonicContact OE1-NH2 3.47Å; E440-R453 PolarHBondContact OE1-NH2 3.43Å; M444-R453 HydrophobicContact CE-CB 4.1Å; M444-R453 HydrophobicContact CE-CG 3.87Å; Q449-R453 WeakPolarHBondContact O-CB 3.46Å; Q449-R453 PolarHBondContact O-N 2.84Å; L450-R453 PolarHBondContact O-N 3.28Å; R453-A457 WeakPolarHBondContact O-CB 3.37Å; R453-A457 PolarHBondContact O-N 3.49Å
454	V	90	Very high	87.5	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-67.9	-41.9	175.3	167.7	0	0	0	0	110.4	P398 F434 L450 A457 G458 Y459	P398-V454 HydrophobicContact CG-CG1 4.22Å; F434-V454 HydrophobicContact CD1-CG1 4.24Å; F434-V454 HydrophobicContact CD1-CG2 4.29Å; F434-V454 HydrophobicContact CD2-CG2 3.7Å; F434-V454 HydrophobicContact CE1-CG1 3.67Å; F434-V454 HydrophobicContact CE1-CG2 4.35Å; F434-V454 HydrophobicContact CE2-CG1 4.1Å; F434-V454 HydrophobicContact CE2-CG2 3.76Å; F434-V454 HydrophobicContact CG-CG2 3.96Å; F434-V454 HydrophobicContact CZ-CG1 3.56Å; F434-V454 HydrophobicContact CZ-CG2 4.06Å; L450-V454 HydrophobicContact CD1-CG2 3.76Å; L450-V454 HydrophobicContact CG-CG2 4.21Å; L450-V454 WeakPolarHBondContact O-CB 3.39Å; L450-V454 WeakPolarHBondContact O-CG2 3.41Å; L450-V454 PolarHBondContact O-N 3.07Å; V454-A457 PolarHBondContact O-N 3.26Å; V454-G458 PolarHBondContact O-N 3.04Å; V454-Y459 HydrophobicContact CB-CD2 4.47Å; V454-Y459 HydrophobicContact CG1-CD2 3.89Å; V454-Y459 HydrophobicContact CG1-CG 4.05Å; V454-Y459 WeakPolarHBondContact O-CD2 3.29Å; V454-Y459 PolarHBondContact O-N 2.63Å
455	S	88.1	Confident	87.7	Confident	17 Å²	17	43.3 Å²	43.3	12%	0.119	25%	0.251	C	S	.	.	H	α-helix	trans	-62.8	-45.3	173.5	-176.3	0	0	0	0	112.1	S397 T399 F451 E452 A457 G458	S397-S455 WeakPolarHBondContact CB-OG 3.31Å; S397-S455 PolarHBondContact OG-OG 2.89Å; T399-S455 WeakPolarHBondContact OG1-CB 3.41Å; T399-S455 PolarHBondContact OG1-OG 3.02Å; F451-S455 VanDerWaalsContact O-CB 3.31Å; F451-S455 WeakPolarHBondContact O-CB 3.23Å; F451-S455 PolarHBondContact O-N 3.49Å; E452-S455 PolarHBondContact O-N 3.27Å; S455-A457 PolarHBondContact O-N 2.96Å; S455-G458 PolarHBondContact O-N 3.11Å
456	T	86	Confident	88.1	Confident	109 Å²	109	41.5 Å²	41.5	67%	0.669	24%	0.237	S	C	*	.	H	α-helix	trans	-62.9	-30.2	176.7	-55	0	0	0	0	112.3	E452 G458	E452-T456 WeakPolarHBondContact O-CB 3.36Å; E452-T456 PolarHBondContact O-N 2.72Å; E452-T456 PolarHBondContact O-OG1 3.47Å; T456-G458 PolarHBondContact O-N 2.87Å
457	A	84.4	Confident	88.3	Confident	52 Å²	52	42.7 Å²	42.7	43%	0.43	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-1.5	174.6	0	0	0	0	0	113.6	R453 V454 S455 Y459	R453-A457 WeakPolarHBondContact O-CB 3.37Å; R453-A457 PolarHBondContact O-N 3.49Å; V454-A457 PolarHBondContact O-N 3.26Å; S455-A457 PolarHBondContact O-N 2.96Å; A457-Y459 HydrophobicContact CB-CD2 3.73Å; A457-Y459 HydrophobicContact CB-CE2 3.72Å
458	G	83.9	Confident	88.5	Confident	68 Å²	68	42.8 Å²	42.8	70%	0.701	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.7	15.4	176.5	0	0	0	0	0	114.7	V454 S455 T456	V454-G458 PolarHBondContact O-N 3.04Å; S455-G458 PolarHBondContact O-N 3.11Å; T456-G458 PolarHBondContact O-N 2.87Å
459	Y	88.2	Confident	88.5	Confident	80 Å²	80	42.5 Å²	42.5	31%	0.314	24%	0.238	S	C	.	.			trans	-76	143.5	172.8	-67	-71.7	0	0	0	110.8	P398 F434 V454 A457 D463	P398-Y459 WeakPolarHBondContact CD-O 3.05Å; F434-Y459 HydrophobicContact CB-CE2 4.5Å; F434-Y459 HydrophobicContact CD1-CD1 4.03Å; F434-Y459 AromaticContact CD1-CD2 3.77Å; F434-Y459 HydrophobicContact CD1-CD2 3.77Å; F434-Y459 HydrophobicContact CD1-CE1 4.07Å; F434-Y459 AromaticContact CD1-CE2 3.8Å; F434-Y459 HydrophobicContact CD1-CE2 3.8Å; F434-Y459 AromaticContact CD1-CG 3.89Å; F434-Y459 HydrophobicContact CD1-CG 3.89Å; F434-Y459 AromaticContact CD1-CZ 3.97Å; F434-Y459 HydrophobicContact CE1-CD1 4.02Å; F434-Y459 HydrophobicContact CE1-CD2 4.05Å; F434-Y459 HydrophobicContact CE1-CE1 4.48Å; F434-Y459 AromaticContact CE1-CG 3.79Å; F434-Y459 HydrophobicContact CE1-CG 3.79Å; V454-Y459 HydrophobicContact CB-CD2 4.47Å; V454-Y459 HydrophobicContact CG1-CD2 3.89Å; V454-Y459 HydrophobicContact CG1-CG 4.05Å; V454-Y459 WeakPolarHBondContact O-CD2 3.29Å; V454-Y459 PolarHBondContact O-N 2.63Å; A457-Y459 HydrophobicContact CB-CD2 3.73Å; A457-Y459 HydrophobicContact CB-CE2 3.72Å; Y459-D463 HydrophobicContact CD1-CB 4.19Å
460	S	89.9	Confident	88.4	Confident	23 Å²	23	44.5 Å²	44.5	16%	0.161	25%	0.247	C	C	.	.			trans	-91.4	166.6	179.7	70	0	0	0	0	112.5	L396 P462 D463 L464	L396-S460 WeakPolarHBondContact O-CA 3.5Å; S460-P462 WeakPolarHBondContact OG-CD 3.38Å; S460-D463 WeakPolarHBondContact CB-OD2 3.47Å; S460-D463 PolarHBondContact N-OD2 3.41Å; S460-D463 WeakPolarHBondContact O-CB 3.1Å; S460-D463 PolarHBondContact O-N 2.92Å; S460-D463 VanDerWaalsContact O-N 3.09Å; S460-D463 VanDerWaalsContact OG-CG 3.25Å; S460-D463 PolarHBondContact OG-N 2.95Å; S460-D463 PolarHBondContact OG-OD2 3.14Å; S460-L464 PolarHBondContact O-N 3.08Å
461	I	88.5	Confident	88.1	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-56.4	-43.1	172.2	-66	167.5	0	0	0	112.2	T393 L396 L401 D463 L464 L465	T393-I461 HydrophobicContact CG2-CD1 4.11Å; T393-I461 HydrophobicContact CG2-CG2 4.19Å; L396-I461 HydrophobicContact CB-CD1 3.75Å; L396-I461 PolarHBondContact O-N 2.87Å; L401-I461 HydrophobicContact CD1-CD1 4.02Å; L401-I461 HydrophobicContact CD1-CG1 4.24Å; L401-I461 HydrophobicContact CD2-CD1 3.58Å; L401-I461 HydrophobicContact CG-CD1 3.62Å; L401-I461 HydrophobicContact CG-CG1 4.28Å; I461-D463 VanDerWaalsContact C-N 3.3Å; I461-D463 PolarHBondContact O-N 3.45Å; I461-L464 WeakPolarHBondContact O-CB 3.27Å; I461-L464 PolarHBondContact O-N 3.1Å; I461-L465 HydrophobicContact CG2-CD1 4.06Å; I461-L465 HydrophobicContact CG2-CG 4.37Å; I461-L465 WeakPolarHBondContact O-CG 3.18Å; I461-L465 PolarHBondContact O-N 2.98Å
462	P	87.8	Confident	87.8	Confident	23 Å²	23	51.6 Å²	51.6	15%	0.149	28%	0.281	C	S	.	.	H	α-helix	trans	-56.1	-38.7	171.2	-29	34.9	0	0	0	114.4	C390 S460 L465 T466	C390-P462 HydrophobicContact CB-CB 4.4Å; C390-P462 HydrophobicContact CB-CG 4.29Å; S460-P462 WeakPolarHBondContact OG-CD 3.38Å; P462-L465 PolarHBondContact O-N 3.26Å; P462-T466 WeakPolarHBondContact O-CB 3.41Å; P462-T466 PolarHBondContact O-N 2.92Å; P462-T466 PolarHBondContact O-OG1 3.38Å
463	D	89.1	Confident	87.6	Confident	67 Å²	67	46.3 Å²	46.3	36%	0.358	26%	0.255	S	S	.	.	H	α-helix	trans	-65	-43.8	176.6	-62	-52.6	0	0	0	110.7	Y459 S460 I461 T466 R467	Y459-D463 HydrophobicContact CD1-CB 4.19Å; S460-D463 WeakPolarHBondContact CB-OD2 3.47Å; S460-D463 PolarHBondContact N-OD2 3.41Å; S460-D463 WeakPolarHBondContact O-CB 3.1Å; S460-D463 PolarHBondContact O-N 2.92Å; S460-D463 VanDerWaalsContact O-N 3.09Å; S460-D463 VanDerWaalsContact OG-CG 3.25Å; S460-D463 PolarHBondContact OG-N 2.95Å; S460-D463 PolarHBondContact OG-OD2 3.14Å; I461-D463 VanDerWaalsContact C-N 3.3Å; I461-D463 PolarHBondContact O-N 3.45Å; D463-T466 WeakPolarHBondContact O-CB 3.27Å; D463-T466 PolarHBondContact O-N 3.42Å; D463-R467 WeakPolarHBondContact O-CG 3.25Å; D463-R467 PolarHBondContact O-N 3.26Å
464	L	89.9	Confident	87.6	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-48.8	175.4	176.9	63.4	0	0	0	112.6	P398 L430 F434 F451 S460 I461 T466 R467 L468 L480	P398-L464 HydrophobicContact CB-CD2 4.08Å; P398-L464 HydrophobicContact CG-CB 4.48Å; P398-L464 HydrophobicContact CG-CD2 4.21Å; L430-L464 HydrophobicContact CD2-CD1 3.94Å; F434-L464 HydrophobicContact CE2-CD1 3.96Å; F434-L464 HydrophobicContact CZ-CB 4.31Å; F434-L464 HydrophobicContact CZ-CD1 3.86Å; F451-L464 HydrophobicContact CD1-CD1 4.11Å; F451-L464 HydrophobicContact CD1-CD2 4.03Å; F451-L464 HydrophobicContact CE1-CD1 3.94Å; F451-L464 HydrophobicContact CE1-CD2 4.11Å; S460-L464 PolarHBondContact O-N 3.08Å; I461-L464 WeakPolarHBondContact O-CB 3.27Å; I461-L464 PolarHBondContact O-N 3.1Å; L464-T466 VanDerWaalsContact C-N 3.31Å; L464-T466 PolarHBondContact O-N 3.06Å; L464-R467 PolarHBondContact O-N 3.01Å; L464-L468 HydrophobicContact CD1-CD1 4.4Å; L464-L468 HydrophobicContact CD1-CG 4.46Å; L464-L468 HydrophobicContact CG-CD1 4.16Å; L464-L468 WeakPolarHBondContact O-CB 3.39Å; L464-L468 VanDerWaalsContact O-CG 3.31Å; L464-L468 WeakPolarHBondContact O-CG 3.26Å; L464-L468 PolarHBondContact O-N 3.02Å; L464-L480 HydrophobicContact CD2-CD2 4.27Å
465	L	89.1	Confident	87.4	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-39.5	176.9	-72.9	173	0	0	0	111.7	Y386 T389 I461 P462 R467 L468 V469 V477 L480	Y386-L465 HydrophobicContact CD2-CB 3.68Å; Y386-L465 HydrophobicContact CD2-CD1 4.13Å; Y386-L465 HydrophobicContact CD2-CG 4.44Å; Y386-L465 HydrophobicContact CE2-CB 3.52Å; Y386-L465 HydrophobicContact CE2-CD1 4.42Å; T389-L465 HydrophobicContact CG2-CD1 3.93Å; I461-L465 HydrophobicContact CG2-CD1 4.06Å; I461-L465 HydrophobicContact CG2-CG 4.37Å; I461-L465 WeakPolarHBondContact O-CG 3.18Å; I461-L465 PolarHBondContact O-N 2.98Å; P462-L465 PolarHBondContact O-N 3.26Å; L465-R467 PolarHBondContact O-N 3.42Å; L465-L468 HydrophobicContact CD2-CD1 4.44Å; L465-L468 WeakPolarHBondContact O-CB 3.48Å; L465-L468 PolarHBondContact O-N 3.33Å; L465-V469 WeakPolarHBondContact O-CG2 3.48Å; L465-V469 PolarHBondContact O-N 2.93Å; L465-V477 HydrophobicContact CD2-CG1 4.25Å; L465-L480 HydrophobicContact CD2-CB 4.22Å; L465-L480 HydrophobicContact CD2-CD2 3.65Å; L465-L480 HydrophobicContact CD2-CG 4.43Å; L465-L480 HydrophobicContact CG-CD2 4.24Å
466	T	89.9	Confident	87.3	Confident	48 Å²	48	45.3 Å²	45.3	29%	0.294	26%	0.255	S	S	.	.	H	α-helix	trans	-60.2	-46.8	176.1	-62	0	0	0	0	111.1	Y386 P462 D463 L464 V469 Q470	Y386-T466 PolarHBondContact OH-OG1 2.93Å; P462-T466 WeakPolarHBondContact O-CB 3.41Å; P462-T466 PolarHBondContact O-N 2.92Å; P462-T466 PolarHBondContact O-OG1 3.38Å; D463-T466 WeakPolarHBondContact O-CB 3.27Å; D463-T466 PolarHBondContact O-N 3.42Å; L464-T466 VanDerWaalsContact C-N 3.31Å; L464-T466 PolarHBondContact O-N 3.06Å; T466-V469 PolarHBondContact O-N 3.3Å; T466-Q470 WeakPolarHBondContact O-CG 3.31Å; T466-Q470 PolarHBondContact O-N 3.38Å
467	R	90.1	Very high	87.4	Confident	82 Å²	82	40.1 Å²	40.1	31%	0.309	22%	0.224	S	C	.	.	H	α-helix	trans	-65.8	-37.1	177.1	-66.7	-50.7	-177.7	173.9	5.5	112.3	L430 S433 F434 D463 L464 L465 V469 Q470 I471	L430-R467 HydrophobicContact CD1-CB 3.68Å; S433-R467 PolarHBondContact O-NE 3.17Å; S433-R467 PolarHBondContact O-NH1 3.12Å; S433-R467 WeakPolarHBondContact OG-CB 3.45Å; F434-R467 HydrophobicContact CD1-CG 4.2Å; F434-R467 HydrophobicContact CE1-CG 3.83Å; F434-R467 HydrophobicContact CE2-CB 4.17Å; F434-R467 HydrophobicContact CE2-CG 4.18Å; F434-R467 HydrophobicContact CZ-CB 4.1Å; F434-R467 HydrophobicContact CZ-CG 3.85Å; D463-R467 WeakPolarHBondContact O-CG 3.25Å; D463-R467 PolarHBondContact O-N 3.26Å; L464-R467 PolarHBondContact O-N 3.01Å; L465-R467 PolarHBondContact O-N 3.42Å; R467-V469 PolarHBondContact O-N 2.95Å; R467-Q470 WeakPolarHBondContact O-CB 3.28Å; R467-Q470 PolarHBondContact O-N 3.06Å; R467-I471 WeakPolarHBondContact O-CG1 3.23Å; R467-I471 PolarHBondContact O-N 3.41Å
468	L	89.3	Confident	87.7	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-62.2	-39.7	173.2	-74.7	170.4	0	0	0	112.8	L413 L430 L464 L465 I471 E472 R473 A476 V477 L480	L413-L468 HydrophobicContact CD1-CD2 3.99Å; L413-L468 HydrophobicContact CD2-CD2 3.84Å; L430-L468 HydrophobicContact CD1-CD2 4Å; L430-L468 HydrophobicContact CD1-CG 4.13Å; L430-L468 HydrophobicContact CD2-CD2 3.73Å; L430-L468 HydrophobicContact CD2-CG 4.31Å; L430-L468 HydrophobicContact CG-CD2 4.47Å; L464-L468 HydrophobicContact CD1-CD1 4.4Å; L464-L468 HydrophobicContact CD1-CG 4.46Å; L464-L468 HydrophobicContact CG-CD1 4.16Å; L464-L468 WeakPolarHBondContact O-CB 3.39Å; L464-L468 VanDerWaalsContact O-CG 3.31Å; L464-L468 WeakPolarHBondContact O-CG 3.26Å; L464-L468 PolarHBondContact O-N 3.02Å; L465-L468 HydrophobicContact CD2-CD1 4.44Å; L465-L468 WeakPolarHBondContact O-CB 3.48Å; L465-L468 PolarHBondContact O-N 3.33Å; L468-I471 HydrophobicContact CD2-CD1 4.04Å; L468-I471 WeakPolarHBondContact O-CG1 3.44Å; L468-I471 PolarHBondContact O-N 3.13Å; L468-E472 PolarHBondContact O-N 3.5Å; L468-R473 HydrophobicContact CD2-CB 4.46Å; L468-R473 PolarHBondContact O-N 3.27Å; L468-R473 VanDerWaalsContact O-N 3.07Å; L468-A476 HydrophobicContact CD2-CB 4.31Å; L468-V477 HydrophobicContact CB-CG2 3.49Å; L468-V477 VanDerWaalsContact CB-CG2 3.49Å; L468-L480 HydrophobicContact CD1-CD2 4.44Å
469	V	88.1	Confident	87.9	Confident	40 Å²	40	37.4 Å²	37.4	24%	0.242	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-40.1	173.1	174	0	0	0	0	110.9	L465 T466 R467 I471 E472 L474 V477	L465-V469 WeakPolarHBondContact O-CG2 3.48Å; L465-V469 PolarHBondContact O-N 2.93Å; T466-V469 PolarHBondContact O-N 3.3Å; R467-V469 PolarHBondContact O-N 2.95Å; V469-I471 PolarHBondContact O-N 2.92Å; V469-E472 WeakPolarHBondContact O-CA 3.46Å; V469-E472 PolarHBondContact O-N 2.97Å; V469-L474 HydrophobicContact CG1-CD2 4.49Å; V469-L474 HydrophobicContact CG2-CD2 4.42Å; V469-V477 HydrophobicContact CG2-CG1 4.22Å; V469-V477 HydrophobicContact CG2-CG2 3.81Å
470	Q	86.3	Confident	87.9	Confident	105 Å²	105	33.8 Å²	33.8	49%	0.491	17%	0.172	S	C	.	.	H	α-helix	trans	-63.4	-37.9	177.9	-72.9	174.1	3.7	0	0	112.8	T466 R467 E472	T466-Q470 WeakPolarHBondContact O-CG 3.31Å; T466-Q470 PolarHBondContact O-N 3.38Å; R467-Q470 WeakPolarHBondContact O-CB 3.28Å; R467-Q470 PolarHBondContact O-N 3.06Å; Q470-E472 PolarHBondContact O-N 3.39Å
471	I	85.9	Confident	87.8	Confident	12 Å²	12	32.7 Å²	32.7	6%	0.062	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	4.7	175.4	65.5	165.3	0	0	0	113.1	L413 K425 L430 R467 L468 V469 R473	L413-I471 HydrophobicContact CD2-CD1 4.34Å; K425-I471 HydrophobicContact CB-CB 4.16Å; K425-I471 HydrophobicContact CD-CB 3.89Å; K425-I471 HydrophobicContact CD-CG2 4.36Å; K425-I471 WeakPolarHBondContact CD-O 3.49Å; K425-I471 PolarHBondContact NZ-O 3.18Å; K425-I471 VanDerWaalsContact NZ-O 3.11Å; L430-I471 HydrophobicContact CB-CD1 3.97Å; L430-I471 HydrophobicContact CD1-CD1 4.09Å; R467-I471 WeakPolarHBondContact O-CG1 3.23Å; R467-I471 PolarHBondContact O-N 3.41Å; L468-I471 HydrophobicContact CD2-CD1 4.04Å; L468-I471 WeakPolarHBondContact O-CG1 3.44Å; L468-I471 PolarHBondContact O-N 3.13Å; V469-I471 PolarHBondContact O-N 2.92Å; I471-R473 HydrophobicContact CD1-CB 3.94Å; I471-R473 HydrophobicContact CD1-CG 3.43Å; I471-R473 VanDerWaalsContact CD1-CG 3.43Å; I471-R473 HydrophobicContact CG1-CB 3.9Å; I471-R473 HydrophobicContact CG1-CG 3.66Å; I471-R473 PolarHBondContact O-N 2.84Å
472	E	85.3	Confident	87.8	Confident	140 Å²	140	36.2 Å²	36.2	65%	0.654	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	22.1	-179.7	-55.9	173.4	131.4	0	0	114	K425 L468 V469 Q470 L474	K425-E472 IonicContact NZ-OE2 2.96Å; K425-E472 PolarHBondContact NZ-OE2 2.87Å; L468-E472 PolarHBondContact O-N 3.5Å; V469-E472 WeakPolarHBondContact O-CA 3.46Å; V469-E472 PolarHBondContact O-N 2.97Å; Q470-E472 PolarHBondContact O-N 3.39Å; E472-L474 PolarHBondContact O-N 2.85Å; E472-L474 VanDerWaalsContact O-N 3.07Å
473	R	84.1	Confident	87.8	Confident	9 Å²	9	37 Å²	37	3%	0.034	19%	0.188	C	C	.	.			trans	-86.5	59.5	176.4	-69	-59.2	-55	-95.8	2.9	111.8	M412 L413 V424 K425 L468 I471 D475 A476 V477	M412-R473 PolarHBondContact O-NH1 2.88Å; M412-R473 PolarHBondContact O-NH2 2.94Å; L413-R473 HydrophobicContact CD2-CB 4.34Å; L413-R473 HydrophobicContact CD2-CG 4.07Å; V424-R473 VanDerWaalsContact CG1-NH1 3.28Å; K425-R473 WeakPolarHBondContact O-CD 3.42Å; K425-R473 PolarHBondContact O-NH1 3.32Å; L468-R473 HydrophobicContact CD2-CB 4.46Å; L468-R473 PolarHBondContact O-N 3.27Å; L468-R473 VanDerWaalsContact O-N 3.07Å; I471-R473 HydrophobicContact CD1-CB 3.94Å; I471-R473 HydrophobicContact CD1-CG 3.43Å; I471-R473 VanDerWaalsContact CD1-CG 3.43Å; I471-R473 HydrophobicContact CG1-CB 3.9Å; I471-R473 HydrophobicContact CG1-CG 3.66Å; I471-R473 PolarHBondContact O-N 2.84Å; R473-D475 VanDerWaalsContact C-OD1 3.24Å; R473-D475 WeakPolarHBondContact CA-OD1 3.15Å; R473-D475 IonicContact CZ-OD1 2.68Å; R473-D475 IonicContact CZ-OD2 2.87Å; R473-D475 IonicContact NE-OD1 3.75Å; R473-D475 PolarHBondContact NE-OD1 3.48Å; R473-D475 IonicContact NE-OD2 3.57Å; R473-D475 PolarHBondContact NE-OD2 3.44Å; R473-D475 IonicContact NH2-OD1 3.02Å; R473-D475 IonicContact NH2-OD2 3.77Å; R473-D475 PolarHBondContact NH2-OD2 2.84Å; R473-D475 PolarHBondContact O-N 3.27Å; R473-A476 HydrophobicContact CB-CB 4.2Å; R473-A476 PolarHBondContact O-N 3.3Å; R473-A476 VanDerWaalsContact O-N 3.16Å; R473-V477 WeakPolarHBondContact O-CG2 3.48Å; R473-V477 PolarHBondContact O-N 2.85Å; R473-V477 VanDerWaalsContact O-N 3.11Å
474	L	85.8	Confident	87.7	Confident	37 Å²	37	34.1 Å²	34.1	19%	0.194	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-24.8	-178.9	-64.3	177.2	0	0	0	113	R379 I382 V469 E472 E478	R379-L474 HydrophobicContact CG-CD1 3.92Å; I382-L474 HydrophobicContact CD1-CB 4.14Å; I382-L474 HydrophobicContact CG2-CD2 4.37Å; V469-L474 HydrophobicContact CG1-CD2 4.49Å; V469-L474 HydrophobicContact CG2-CD2 4.42Å; E472-L474 PolarHBondContact O-N 2.85Å; E472-L474 VanDerWaalsContact O-N 3.07Å; L474-E478 VanDerWaalsContact O-CB 3.31Å; L474-E478 WeakPolarHBondContact O-CB 3.37Å; L474-E478 PolarHBondContact O-N 2.87Å
475	D	85.3	Confident	87.4	Confident	52 Å²	52	35.2 Å²	35.2	28%	0.278	18%	0.179	S	C	.	.	H	α-helix	trans	-64.8	-45.9	173.2	60.8	-39.6	0	0	0	112	M412 R473 E478 S479	M412-D475 VanDerWaalsContact CE-C 3.49Å; M412-D475 HydrophobicContact CE-CB 3.93Å; M412-D475 WeakPolarHBondContact CE-O 3.49Å; R473-D475 VanDerWaalsContact C-OD1 3.24Å; R473-D475 WeakPolarHBondContact CA-OD1 3.15Å; R473-D475 IonicContact CZ-OD1 2.68Å; R473-D475 IonicContact CZ-OD2 2.87Å; R473-D475 IonicContact NE-OD1 3.75Å; R473-D475 PolarHBondContact NE-OD1 3.48Å; R473-D475 IonicContact NE-OD2 3.57Å; R473-D475 PolarHBondContact NE-OD2 3.44Å; R473-D475 IonicContact NH2-OD1 3.02Å; R473-D475 IonicContact NH2-OD2 3.77Å; R473-D475 PolarHBondContact NH2-OD2 2.84Å; R473-D475 PolarHBondContact O-N 3.27Å; D475-E478 PolarHBondContact O-N 3.05Å; D475-S479 PolarHBondContact O-N 2.85Å
476	A	87.3	Confident	86.8	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-68.4	-39	176	0	0	0	0	0	111.3	L413 L468 R473 S479 L480	L413-A476 HydrophobicContact CD2-CB 4.15Å; L413-A476 HydrophobicContact CG-CB 4.47Å; L468-A476 HydrophobicContact CD2-CB 4.31Å; R473-A476 HydrophobicContact CB-CB 4.2Å; R473-A476 PolarHBondContact O-N 3.3Å; R473-A476 VanDerWaalsContact O-N 3.16Å; A476-S479 PolarHBondContact O-N 3.47Å; A476-L480 WeakPolarHBondContact O-CB 3.49Å; A476-L480 PolarHBondContact O-N 3.5Å
477	V	88.4	Confident	85.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-48.4	173.9	174.9	0	0	0	0	111	I382 L465 L468 V469 R473 L480 C481	I382-V477 HydrophobicContact CG2-CB 4.32Å; I382-V477 HydrophobicContact CG2-CG1 3.87Å; L465-V477 HydrophobicContact CD2-CG1 4.25Å; L468-V477 HydrophobicContact CB-CG2 3.49Å; L468-V477 VanDerWaalsContact CB-CG2 3.49Å; V469-V477 HydrophobicContact CG2-CG1 4.22Å; V469-V477 HydrophobicContact CG2-CG2 3.81Å; R473-V477 WeakPolarHBondContact O-CG2 3.48Å; R473-V477 PolarHBondContact O-N 2.85Å; R473-V477 VanDerWaalsContact O-N 3.11Å; V477-L480 PolarHBondContact O-N 3.42Å; V477-C481 WeakPolarHBondContact O-CB 3.27Å; V477-C481 PolarHBondContact O-N 3.33Å; V477-C481 PolarHBondContact O-SG 3.41Å
478	E	88.7	Confident	83.9	Confident	47 Å²	47	35.4 Å²	35.4	22%	0.22	20%	0.198	C	C	.	.	H	α-helix	trans	-59.4	-48.2	179	-176	172.5	-153.7	0	0	111.1	R378 I382 L474 D475 C481 V482	R378-E478 IonicContact CZ-OE2 2.63Å; R378-E478 IonicContact NE-OE2 3.78Å; R378-E478 PolarHBondContact NE-OE2 3.39Å; R378-E478 IonicContact NH2-OE2 2.79Å; R378-E478 PolarHBondContact NH2-OE2 2.7Å; I382-E478 HydrophobicContact CD1-CB 4.14Å; I382-E478 HydrophobicContact CD1-CG 4.47Å; I382-E478 HydrophobicContact CG1-CB 4.01Å; I382-E478 HydrophobicContact CG1-CG 4.11Å; I382-E478 HydrophobicContact CG2-CB 4.36Å; L474-E478 VanDerWaalsContact O-CB 3.31Å; L474-E478 WeakPolarHBondContact O-CB 3.37Å; L474-E478 PolarHBondContact O-N 2.87Å; D475-E478 PolarHBondContact O-N 3.05Å; E478-C481 PolarHBondContact O-N 2.84Å; E478-V482 WeakPolarHBondContact O-CB 3.18Å; E478-V482 VanDerWaalsContact O-CG2 3.26Å; E478-V482 WeakPolarHBondContact O-CG2 3.2Å; E478-V482 PolarHBondContact O-N 2.75Å
479	S	88.6	Confident	82.1	Confident	17 Å²	17	42.1 Å²	42.1	12%	0.119	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-48.1	178.1	-173	0	0	0	0	112.1	K408 D475 A476 V482 D483	K408-S479 WeakPolarHBondContact CE-OG 3.4Å; K408-S479 PolarHBondContact NZ-OG 3.29Å; D475-S479 PolarHBondContact O-N 2.85Å; A476-S479 PolarHBondContact O-N 3.47Å; S479-V482 PolarHBondContact O-N 3.2Å; S479-D483 WeakPolarHBondContact O-CB 3.44Å; S479-D483 PolarHBondContact O-N 3.46Å; S479-D483 VanDerWaalsContact O-OD2 3.14Å; S479-D483 PolarHBondContact OG-OD2 3.48Å
480	L	88.3	Confident	80.1	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-44.3	-178.1	-158.6	77.8	0	0	0	110.9	L401 C405 A409 L464 L465 L468 A476 V477 V482 D483 V484	L401-L480 HydrophobicContact CD1-CD1 4.11Å; L401-L480 HydrophobicContact CD1-CD2 4.34Å; L401-L480 HydrophobicContact CD1-CG 4.31Å; C405-L480 WeakPolarHBondContact SG-CD1 3.46Å; A409-L480 HydrophobicContact CB-CD1 3.94Å; L464-L480 HydrophobicContact CD2-CD2 4.27Å; L465-L480 HydrophobicContact CD2-CB 4.22Å; L465-L480 HydrophobicContact CD2-CD2 3.65Å; L465-L480 HydrophobicContact CD2-CG 4.43Å; L465-L480 HydrophobicContact CG-CD2 4.24Å; L468-L480 HydrophobicContact CD1-CD2 4.44Å; A476-L480 WeakPolarHBondContact O-CB 3.49Å; A476-L480 PolarHBondContact O-N 3.5Å; V477-L480 PolarHBondContact O-N 3.42Å; L480-V482 PolarHBondContact O-N 2.89Å; L480-D483 PolarHBondContact O-N 2.88Å; L480-V484 WeakPolarHBondContact O-CB 3.42Å; L480-V484 WeakPolarHBondContact O-CG2 3.33Å; L480-V484 PolarHBondContact O-N 3.4Å
481	C	89	Confident	78	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-40.6	178.7	-65.9	0	0	0	0	112.3	L385 T389 V477 E478 L485	L385-C481 HydrophobicContact CB-CB 4.03Å; T389-C481 VanDerWaalsContact OG1-CB 3.29Å; T389-C481 WeakPolarHBondContact OG1-CB 3.24Å; V477-C481 WeakPolarHBondContact O-CB 3.27Å; V477-C481 PolarHBondContact O-N 3.33Å; V477-C481 PolarHBondContact O-SG 3.41Å; E478-C481 PolarHBondContact O-N 2.84Å; C481-L485 VanDerWaalsContact O-CB 3.31Å; C481-L485 WeakPolarHBondContact O-CB 3.46Å; C481-L485 VanDerWaalsContact O-CG 3.23Å; C481-L485 WeakPolarHBondContact O-CG 3.5Å; C481-L485 PolarHBondContact O-N 3.43Å
482	V	88.6	Confident	75.9	Confident	74 Å²	74	47.8 Å²	47.8	45%	0.448	28%	0.278	S	S	.	.	H	α-helix	trans	-66	-44.6	177.9	169.6	0	0	0	0	111.1	L385 E478 S479 L480 G486	L385-V482 HydrophobicContact CD1-CG2 4.38Å; E478-V482 WeakPolarHBondContact O-CB 3.18Å; E478-V482 VanDerWaalsContact O-CG2 3.26Å; E478-V482 WeakPolarHBondContact O-CG2 3.2Å; E478-V482 PolarHBondContact O-N 2.75Å; S479-V482 PolarHBondContact O-N 3.2Å; L480-V482 PolarHBondContact O-N 2.89Å; V482-G486 PolarHBondContact O-N 3.16Å
483	D	87.1	Confident	73.8	Confident	40 Å²	40	47.3 Å²	47.3	21%	0.214	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-40.7	-179.3	-65.4	-26.6	0	0	0	110.6	C405 K408 S479 L480 T487	C405-D483 HydrophobicContact CB-CB 4.22Å; C405-D483 WeakPolarHBondContact SG-CB 3.19Å; K408-D483 IonicContact NZ-OD1 3.7Å; K408-D483 PolarHBondContact NZ-OD1 3.49Å; K408-D483 IonicContact NZ-OD2 3.16Å; K408-D483 PolarHBondContact NZ-OD2 2.92Å; S479-D483 WeakPolarHBondContact O-CB 3.44Å; S479-D483 PolarHBondContact O-N 3.46Å; S479-D483 VanDerWaalsContact O-OD2 3.14Å; S479-D483 PolarHBondContact OG-OD2 3.48Å; L480-D483 PolarHBondContact O-N 2.88Å; D483-T487 WeakPolarHBondContact O-CG2 3.09Å; D483-T487 PolarHBondContact O-N 3.34Å; D483-T487 VanDerWaalsContact O-N 3.1Å; D483-T487 PolarHBondContact O-OG1 2.79Å
484	V	86.3	Confident	71.6	Confident	6 Å²	6	51 Å²	51	4%	0.036	32%	0.316	C	S	.	.	H	α-helix	trans	-66.6	-49.6	176.3	174.5	0	0	0	0	112.3	T389 T393 L401 L480 G486 T487 S488	T389-V484 HydrophobicContact CG2-CB 3.95Å; T389-V484 HydrophobicContact CG2-CG1 3.7Å; T389-V484 HydrophobicContact CG2-CG2 4.47Å; T393-V484 HydrophobicContact CG2-CG1 3.47Å; T393-V484 VanDerWaalsContact CG2-CG1 3.47Å; L401-V484 HydrophobicContact CD1-CG2 4.07Å; L401-V484 HydrophobicContact CD2-CG2 3.5Å; L401-V484 VanDerWaalsContact CD2-CG2 3.5Å; L401-V484 HydrophobicContact CG-CG2 4.44Å; L480-V484 WeakPolarHBondContact O-CB 3.42Å; L480-V484 WeakPolarHBondContact O-CG2 3.33Å; L480-V484 PolarHBondContact O-N 3.4Å; V484-G486 VanDerWaalsContact C-N 3.29Å; V484-G486 PolarHBondContact O-N 3.33Å; V484-T487 PolarHBondContact O-N 2.89Å; V484-T487 PolarHBondContact O-OG1 3.5Å; V484-S488 PolarHBondContact O-N 2.87Å
485	L	84.9	Confident	69.1	Low	24 Å²	24	52.1 Å²	52.1	13%	0.126	34%	0.338	C	S	.	.	H	α-helix	trans	-66	-35	179.5	-68.6	170.8	0	0	0	111.8	L385 R388 V392 C481 T487 S488 E489	L385-L485 HydrophobicContact CD2-CD1 3.74Å; R388-L485 HydrophobicContact CB-CD1 4.34Å; R388-L485 HydrophobicContact CB-CD2 4.48Å; R388-L485 HydrophobicContact CG-CD1 4.34Å; R388-L485 HydrophobicContact CG-CD2 3.92Å; V392-L485 HydrophobicContact CG2-CD2 4.42Å; C481-L485 VanDerWaalsContact O-CB 3.31Å; C481-L485 WeakPolarHBondContact O-CB 3.46Å; C481-L485 VanDerWaalsContact O-CG 3.23Å; C481-L485 WeakPolarHBondContact O-CG 3.5Å; C481-L485 PolarHBondContact O-N 3.43Å; L485-T487 VanDerWaalsContact C-N 3.33Å; L485-T487 PolarHBondContact O-N 2.9Å; L485-S488 PolarHBondContact O-N 3.37Å; L485-E489 PolarHBondContact O-N 3.06Å
486	G	76	Confident	66.8	Low	34 Å²	34	60.8 Å²	60.8	35%	0.351	37%	0.366	S	S	.	.	H	α-helix	trans	-62.1	-37.8	173.4	0	0	0	0	0	112.7	V482 V484 V490	V482-G486 PolarHBondContact O-N 3.16Å; V484-G486 VanDerWaalsContact C-N 3.29Å; V484-G486 PolarHBondContact O-N 3.33Å; G486-V490 WeakPolarHBondContact O-CG2 3.31Å; G486-V490 PolarHBondContact O-N 3.05Å
487	T	62.2	Low	64	Low	59 Å²	59	69.4 Å²	69.4	36%	0.362	41%	0.406	S	S	.	.	H	α-helix	trans	-70	-34.9	172.6	58.6	0	0	0	0	112.9	P402 D483 V484 L485 V490 V491	P402-T487 HydrophobicContact CG-CG2 4Å; D483-T487 WeakPolarHBondContact O-CG2 3.09Å; D483-T487 PolarHBondContact O-N 3.34Å; D483-T487 VanDerWaalsContact O-N 3.1Å; D483-T487 PolarHBondContact O-OG1 2.79Å; V484-T487 PolarHBondContact O-N 2.89Å; V484-T487 PolarHBondContact O-OG1 3.5Å; L485-T487 VanDerWaalsContact C-N 3.33Å; L485-T487 PolarHBondContact O-N 2.9Å; T487-V490 PolarHBondContact O-N 3.39Å; T487-V491 WeakPolarHBondContact O-CG2 3.1Å; T487-V491 PolarHBondContact O-N 2.86Å; T487-V491 VanDerWaalsContact O-N 3.15Å
488	S	57	Low	61.2	Low	42 Å²	42	74.2 Å²	74.2	29%	0.294	44%	0.44	S	S	.	.	H	α-helix	trans	-69.9	-32	178.5	-170.2	0	0	0	0	113.3	V484 L485 V491 A492	V484-S488 PolarHBondContact O-N 2.87Å; L485-S488 PolarHBondContact O-N 3.37Å; S488-V491 PolarHBondContact O-N 3.41Å; S488-A492 VanDerWaalsContact O-CB 3.26Å; S488-A492 WeakPolarHBondContact O-CB 3.24Å; S488-A492 PolarHBondContact O-N 2.92Å
489	E	50.8	Low	59	Low	142 Å²	142	78.6 Å²	78.6	66%	0.664	46%	0.464	S	S	*	.	H	α-helix	trans	-70.8	-35.1	174.8	-77.6	-175.2	160.5	0	0	112	L485 V491 A492 V493	L485-E489 PolarHBondContact O-N 3.06Å; E489-V491 VanDerWaalsContact C-N 3.32Å; E489-V491 PolarHBondContact O-N 3.04Å; E489-A492 PolarHBondContact O-N 2.87Å; E489-V493 WeakPolarHBondContact O-CG2 3.36Å; E489-V493 PolarHBondContact O-N 3.29Å; E489-V493 VanDerWaalsContact O-N 3.11Å
490	V	47.3	Very low	56.2	Low	110 Å²	110	84.5 Å²	84.5	67%	0.667	49%	0.494	S	S	*	.	H	α-helix	trans	-67.6	-34.1	174.4	179.5	0	0	0	0	111.2	G486 T487	G486-V490 WeakPolarHBondContact O-CG2 3.31Å; G486-V490 PolarHBondContact O-N 3.05Å; T487-V490 PolarHBondContact O-N 3.39Å
491	V	42.3	Very low	53.7	Low	100 Å²	100	89.9 Å²	89.9	61%	0.606	53%	0.532	S	S	*	.	H	α-helix	trans	-76.7	-34	174	178.1	0	0	0	0	111.9	T487 S488 E489 V493 A494 G495	T487-V491 WeakPolarHBondContact O-CG2 3.1Å; T487-V491 PolarHBondContact O-N 2.86Å; T487-V491 VanDerWaalsContact O-N 3.15Å; S488-V491 PolarHBondContact O-N 3.41Å; E489-V491 VanDerWaalsContact C-N 3.32Å; E489-V491 PolarHBondContact O-N 3.04Å; V491-V493 PolarHBondContact O-N 3.2Å; V491-A494 PolarHBondContact O-N 3.45Å; V491-G495 PolarHBondContact O-N 3.42Å
492	A	40.5	Very low	50.9	Low	66 Å²	66	99.7 Å²	99.7	55%	0.545	58%	0.575	S	S	.	*	H	α-helix	trans	-70.3	-27.7	178.2	0	0	0	0	0	113.5	S488 E489 A494 G495	S488-A492 VanDerWaalsContact O-CB 3.26Å; S488-A492 WeakPolarHBondContact O-CB 3.24Å; S488-A492 PolarHBondContact O-N 2.92Å; E489-A492 PolarHBondContact O-N 2.87Å; A492-A494 VanDerWaalsContact C-N 3.33Å; A492-G495 PolarHBondContact O-N 3.43Å
493	V	40.7	Very low	48	Very low	131 Å²	131	104.1 Å²	104.1	79%	0.794	59%	0.59	S	S	*	*	H	α-helix	trans	-73.5	-25.8	172	176.5	0	0	0	0	111.7	E489 V491	E489-V493 WeakPolarHBondContact O-CG2 3.36Å; E489-V493 PolarHBondContact O-N 3.29Å; E489-V493 VanDerWaalsContact O-N 3.11Å; V491-V493 PolarHBondContact O-N 3.2Å
494	A	39.4	Very low	45.4	Very low	85 Å²	85	106 Å²	106	70%	0.702	61%	0.607	S	S	*	*	H	α-helix	trans	-87	-14.9	173.4	0	0	0	0	0	113.8	V491 A492 R496	V491-A494 PolarHBondContact O-N 3.45Å; A492-A494 VanDerWaalsContact C-N 3.33Å; A494-R496 PolarHBondContact O-N 3.34Å
495	G	33.6	Very low	43.1	Very low	62 Å²	62	114.1 Å²	114.1	64%	0.639	64%	0.644	S	S	*	*	S	Bend	trans	-86.9	7.8	-171.9	0	0	0	0	0	116.9	V491 A492	V491-G495 PolarHBondContact O-N 3.42Å; A492-G495 PolarHBondContact O-N 3.43Å
496	R	36	Very low	40.3	Very low	234 Å²	234	121 Å²	121	88%	0.883	68%	0.68	S	S	*	*			trans	-113.5	58.5	176.1	-103.3	-172.8	178.2	-177.6	1.1	112.2	A494	A494-R496 PolarHBondContact O-N 3.34Å
497	Q	28.7	Very low	38.1	Very low	181 Å²	181	125.6 Å²	125.6	85%	0.846	70%	0.701	S	S	*	*			trans	-148.8	119.9	153.3	-109.3	165.7	18.3	0	0	111
498	S	30.4	Very low	36.4	Very low	102 Å²	102	128.5 Å²	128.5	71%	0.713	72%	0.722	S	S	*	*			trans	-64.4	136.8	177.9	173	0	0	0	0	111.7
499	I	40.8	Very low	35.2	Very low	139 Å²	139	132.4 Å²	132.4	71%	0.713	75%	0.747	S	S	*	*	S	Bend	trans	39.5	94.7	143	-47.3	167.6	0	0	0	115.8
500	N	31.1	Very low	34.3	Very low	140 Å²	140	131 Å²	131	75%	0.749	75%	0.753	S	S	*	*			trans	154.8	133.3	131.3	-83	-35.6	0	0	0	111.7
501	S	35.8	Very low	33.4	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	76%	0.763	S	S	*	*			trans	54.6	98.5	157	-157.1	0	0	0	0	117.5
502	F	28.5	Very low	32.6	Very low	206 Å²	206	136.3 Å²	136.3	90%	0.904	78%	0.777	S	S	*	*			trans	-98.7	106.8	170.3	-73.6	-75.2	0	0	0	111.4
503	H	29.4	Very low	32	Very low	168 Å²	168	139.4 Å²	139.4	78%	0.778	79%	0.789	S	S	*	*			trans	-112.5	114.6	156.6	-174.7	-96.8	0	0	0	107.9
504	S	31.9	Very low	31.4	Very low	80 Å²	80	139 Å²	139	56%	0.559	79%	0.792	S	S	*	*			trans	65.7	136.9	148.7	-63.4	0	0	0	0	122.2
505	Q	37.2	Very low	31.2	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	80%	0.797	S	S	*	*			trans	83.9	117.2	149.8	-69.8	171.9	21.3	0	0	119.7
506	L	27.7	Very low	30.8	Very low	170 Å²	170	143.9 Å²	143.9	89%	0.89	81%	0.809	S	S	*	*			trans	-173.7	95.4	147.5	-92.4	139.1	0	0	0	106.4
507	V	29.5	Very low	30.6	Very low	129 Å²	129	141.7 Å²	141.7	78%	0.782	81%	0.808	S	S	*	*				53.7	107.9	83	-175.3	0	0	0	0	113.2
508	C	26.2	Very low	30.4	Very low	120 Å²	120	144.8 Å²	144.8	81%	0.811	81%	0.812	S	S	*	*			trans	-71.5	151.7	169.6	-55.5	0	0	0	0	111.9
509	P	31.7	Very low	30.1	Very low	124 Å²	124	146.3 Å²	146.3	81%	0.805	82%	0.821	S	S	*	*			trans	-111.9	112.4	147.6	31.3	-19.7	0	0	0	110.4
510	S	31.7	Very low	29.3	Very low	114 Å²	114	144 Å²	144	80%	0.797	82%	0.823	S	S	*	*			trans	-74	136.6	159.5	52.2	0	0	0	0	110.1
511	Q	28.6	Very low	29	Very low	186 Å²	186	143 Å²	143	87%	0.869	83%	0.827	S	S	*	*			trans	-127.7	94.6	157.8	-84.5	-178	-1.5	0	0	109.9
512	C	24.6	Very low	28.6	Very low	134 Å²	134	147.8 Å²	147.8	91%	0.905	85%	0.851	S	S	*	*			trans	-105.7	123.7	149.4	-72.1	0	0	0	0	107.2
513	T	28.5	Very low	28.6	Very low	131 Å²	131	144.9 Å²	144.9	80%	0.804	85%	0.848	S	S	*	*			trans	-122.6	117.3	170.4	8.5	0	0	0	0	109
514	S	27.5	Very low	28.6	Very low	122 Å²	122	143.7 Å²	143.7	85%	0.853	85%	0.852	S	S	*	*			trans	-160.2	154.1	130.9	-86.2	0	0	0	0	110.8
515	P	35	Very low	28.4	Very low	124 Å²	124	147.2 Å²	147.2	81%	0.805	87%	0.868	S	S	*	*			trans	-106.3	148.1	-155.7	36.9	-26.5	0	0	0	112.5
516	S	25.6	Very low	27.9	Very low	127 Å²	127	145.6 Å²	145.6	89%	0.888	87%	0.871	S	S	*	*			trans	-155.3	133	147.5	-164	0	0	0	0	111
517	Q	32.4	Very low	27.9	Very low	187 Å²	187	144.1 Å²	144.1	87%	0.874	87%	0.87	S	S	*	*			trans	-79.2	130.1	-175.5	-68.8	170.1	-41.6	0	0	111.7
518	R	25.4	Very low	27.8	Very low	247 Å²	247	145.1 Å²	145.1	93%	0.932	88%	0.876	S	S	*	*				161.5	112.6	124	-97.3	179.5	172.6	165.5	-1.6	110.3
519	C	23	Very low	27.9	Very low	133 Å²	133	146.9 Å²	146.9	90%	0.899	88%	0.881	S	S	*	*			trans	-97.2	138.9	151	-68.3	0	0	0	0	108
520	A	25.1	Very low	27.6	Very low	91 Å²	91	148.6 Å²	148.6	75%	0.752	89%	0.887	S	S	*	*				162.7	130.1	123.2	0	0	0	0	0	112.3
521	S	24	Very low	27.3	Very low	120 Å²	120	151.5 Å²	151.5	84%	0.839	89%	0.894	S	S	*	*			trans	67.8	119	158.3	-54	0	0	0	0	115.6
522	V	28.2	Very low	27.2	Very low	216 Å²	216	148.4 Å²	148.4	100%	1.309	90%	0.896	S	S	*	*			cis	-151	0	41.5	166.4	0	0	0	0	109

Retrieved 522 of 522 residues in 103.8 ms (Link to these results)

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