A0A077ZJP0_TRITR Loading...

Integrase catalytic domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZJP0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 501 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	49.2	Very low	67.5	Low	214 Å²	214	108 Å²	108	100%	1.054	64%	0.644	S	S	*	*				0	136.4	0	-84.8	173.7	167	0	0	109.1
2	K	52.3	Low	68.1	Low	176 Å²	176	111.8 Å²	111.8	77%	0.765	65%	0.646	S	S	*	*			trans	-70.3	143.3	170.2	-72.7	178.8	176.8	177.8	0	108.7	A4 G5	K2-A4 PolarHBondContact O-N 3.03Å; K2-G5 PolarHBondContact O-N 3.36Å; K2-G5 VanDerWaalsContact O-N 3.16Å
3	P	59.1	Low	68.8	Low	110 Å²	110	113.8 Å²	113.8	71%	0.714	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-55.1	-23.4	-178.3	-24.6	32	0	0	0	114.5	G5	P3-G5 PolarHBondContact O-N 3.28Å
4	A	63.2	Low	69.3	Low	104 Å²	104	109.5 Å²	109.5	86%	0.86	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-71.6	-4.4	-179.5	0	0	0	0	0	115.6	K2	K2-A4 PolarHBondContact O-N 3.03Å
5	G	66.4	Low	69.8	Low	65 Å²	65	103.5 Å²	103.5	67%	0.67	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-97.5	-1	179.6	0	0	0	0	0	115.3	K2 P3 G7	K2-G5 PolarHBondContact O-N 3.36Å; K2-G5 VanDerWaalsContact O-N 3.16Å; P3-G5 PolarHBondContact O-N 3.28Å; G5-G7 PolarHBondContact O-N 2.83Å
6	L	71.8	Confident	70.5	Confident	38 Å²	38	100.1 Å²	100.1	20%	0.199	57%	0.571	C	S	.	*			trans	-93.2	101.9	-176.2	-55.2	176.2	0	0	0	109	H10 F12 Y13	L6-H10 HydrophobicContact CB-CB 4.11Å; L6-H10 HydrophobicContact CD2-CB 4.44Å; L6-H10 VanDerWaalsContact CD2-CD2 3.46Å; L6-H10 WeakPolarHBondContact CD2-CD2 3.46Å; L6-H10 VanDerWaalsContact CD2-CE1 3.46Å; L6-H10 WeakPolarHBondContact CD2-CE1 3.45Å; L6-H10 WeakPolarHBondContact CD2-NE2 3.45Å; L6-F12 HydrophobicContact CD1-CB 4.46Å; L6-F12 HydrophobicContact CD1-CD1 4.23Å; L6-F12 HydrophobicContact CD1-CG 4.39Å; L6-Y13 HydrophobicContact CB-CD2 4.42Å; L6-Y13 HydrophobicContact CB-CE2 3.61Å; L6-Y13 HydrophobicContact CD1-CE2 4.33Å
7	G	77	Confident	71	Confident	37 Å²	37	100.8 Å²	100.8	38%	0.381	57%	0.573	S	S	.	*			trans	-61.4	164.5	172.7	0	0	0	0	0	112.3	G5 N9 H10	G5-G7 PolarHBondContact O-N 2.83Å; G7-N9 PolarHBondContact O-N 3.3Å; G7-H10 VanDerWaalsContact O-CB 3.27Å; G7-H10 WeakPolarHBondContact O-CB 3.41Å; G7-H10 PolarHBondContact O-N 2.85Å
8	P	74.9	Confident	71.8	Confident	114 Å²	114	99.4 Å²	99.4	74%	0.74	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-22.9	-175.5	21.9	-32.5	0	0	0	114.2
9	N	72.8	Confident	72.1	Confident	140 Å²	140	98.3 Å²	98.3	75%	0.749	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	15.9	178.2	-61.9	-11.4	0	0	0	113.1	G7	G7-N9 PolarHBondContact O-N 3.3Å
10	H	79.6	Confident	72.5	Confident	71 Å²	71	99.8 Å²	99.8	33%	0.329	56%	0.558	S	S	.	*			trans	-67	138.9	178.7	-166.6	-84.7	0	0	0	110	L6 G7 F12 Y13 T14	L6-H10 HydrophobicContact CB-CB 4.11Å; L6-H10 HydrophobicContact CD2-CB 4.44Å; L6-H10 VanDerWaalsContact CD2-CD2 3.46Å; L6-H10 WeakPolarHBondContact CD2-CD2 3.46Å; L6-H10 VanDerWaalsContact CD2-CE1 3.46Å; L6-H10 WeakPolarHBondContact CD2-CE1 3.45Å; L6-H10 WeakPolarHBondContact CD2-NE2 3.45Å; G7-H10 VanDerWaalsContact O-CB 3.27Å; G7-H10 WeakPolarHBondContact O-CB 3.41Å; G7-H10 PolarHBondContact O-N 2.85Å; H10-F12 VanDerWaalsContact ND1-CB 3.34Å; H10-F12 WeakPolarHBondContact ND1-CB 3.32Å; H10-F12 PolarHBondContact ND1-N 2.69Å; H10-F12 VanDerWaalsContact ND1-N 3.16Å; H10-F12 PolarHBondContact O-N 3.15Å; H10-Y13 HydrophobicContact CB-CD2 4.19Å; H10-Y13 PolarHBondContact O-N 3.1Å; H10-T14 PolarHBondContact O-N 3.03Å; H10-T14 VanDerWaalsContact O-N 3.11Å; H10-T14 PolarHBondContact O-OG1 2.74Å
11	L	76.4	Confident	73	Confident	119 Å²	119	102 Å²	102	62%	0.623	56%	0.558	S	S	*	*	H	α-helix	trans	-48.5	-23.8	177.4	-105.9	140.1	0	0	0	114.5	G15 P16	L11-G15 WeakPolarHBondContact O-CA 3.39Å; L11-G15 PolarHBondContact O-N 3.46Å; L11-P16 HydrophobicContact CD2-CB 4.35Å
12	F	75.2	Confident	74.8	Confident	153 Å²	153	98.6 Å²	98.6	67%	0.671	54%	0.539	S	S	*	.	H	α-helix	trans	-68.2	-34.4	174.9	-174.1	-95.1	0	0	0	112.8	L6 H10	L6-F12 HydrophobicContact CD1-CB 4.46Å; L6-F12 HydrophobicContact CD1-CD1 4.23Å; L6-F12 HydrophobicContact CD1-CG 4.39Å; H10-F12 VanDerWaalsContact ND1-CB 3.34Å; H10-F12 WeakPolarHBondContact ND1-CB 3.32Å; H10-F12 PolarHBondContact ND1-N 2.69Å; H10-F12 VanDerWaalsContact ND1-N 3.16Å; H10-F12 PolarHBondContact O-N 3.15Å
13	Y	76.2	Confident	76.2	Confident	138 Å²	138	97.2 Å²	97.2	54%	0.541	54%	0.535	S	S	.	.	H	α-helix	trans	-93.9	-36.8	178.5	-63.6	-62.7	0	0	0	112.8	L6 H10	L6-Y13 HydrophobicContact CB-CD2 4.42Å; L6-Y13 HydrophobicContact CB-CE2 3.61Å; L6-Y13 HydrophobicContact CD1-CE2 4.33Å; H10-Y13 HydrophobicContact CB-CD2 4.19Å; H10-Y13 PolarHBondContact O-N 3.1Å
14	T	76.6	Confident	77.3	Confident	54 Å²	54	96.3 Å²	96.3	33%	0.331	53%	0.532	S	S	.	.	H	α-helix	trans	-90.8	-18.3	-176.3	57.3	0	0	0	0	113.3	H10	H10-T14 PolarHBondContact O-N 3.03Å; H10-T14 VanDerWaalsContact O-N 3.11Å; H10-T14 PolarHBondContact O-OG1 2.74Å
15	G	76.8	Confident	78.2	Confident	19 Å²	19	96.7 Å²	96.7	20%	0.196	52%	0.519	C	S	.	.			trans	64.9	176.4	-167.5	0	0	0	0	0	112.3	L11	L11-G15 WeakPolarHBondContact O-CA 3.39Å; L11-G15 PolarHBondContact O-N 3.46Å
16	P	80.6	Confident	79.2	Confident	49 Å²	49	98.6 Å²	98.6	32%	0.318	51%	0.505	S	S	.	.			trans	-69	140.5	170	26.9	-34.4	0	0	0	111.6	L11 F18 L19	L11-P16 HydrophobicContact CD2-CB 4.35Å; P16-F18 HydrophobicContact CB-CD1 3.77Å; P16-F18 HydrophobicContact CB-CE1 3.68Å; P16-F18 HydrophobicContact CG-CD1 3.97Å; P16-F18 HydrophobicContact CG-CE1 3.45Å; P16-F18 VanDerWaalsContact CG-CE1 3.45Å; P16-F18 HydrophobicContact CG-CZ 4.14Å; P16-F18 PolarHBondContact O-N 3.13Å; P16-L19 HydrophobicContact CG-CD1 3.84Å; P16-L19 HydrophobicContact CG-CG 4.12Å; P16-L19 PolarHBondContact O-N 3.49Å
17	D	79.8	Confident	79.6	Confident	113 Å²	113	100.9 Å²	100.9	60%	0.604	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-51.5	-30	-172.1	-69.7	-14.5	0	0	0	115.1	L19 L20	D17-L19 VanDerWaalsContact C-N 3.28Å; D17-L19 PolarHBondContact O-N 2.99Å; D17-L20 PolarHBondContact O-N 2.96Å
18	F	84.1	Confident	79.5	Confident	75 Å²	75	104.4 Å²	104.4	33%	0.329	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-67.2	-28.5	-178.7	78.7	-93.9	0	0	0	112.7	P16 L20 R21 W26 P27	P16-F18 HydrophobicContact CB-CD1 3.77Å; P16-F18 HydrophobicContact CB-CE1 3.68Å; P16-F18 HydrophobicContact CG-CD1 3.97Å; P16-F18 HydrophobicContact CG-CE1 3.45Å; P16-F18 VanDerWaalsContact CG-CE1 3.45Å; P16-F18 HydrophobicContact CG-CZ 4.14Å; P16-F18 PolarHBondContact O-N 3.13Å; F18-L20 PolarHBondContact O-N 2.68Å; F18-R21 WeakPolarHBondContact O-CB 3.46Å; F18-R21 PolarHBondContact O-N 3.27Å; F18-R21 VanDerWaalsContact O-N 3.11Å; F18-W26 HydrophobicContact CD2-CB 4.19Å; F18-W26 HydrophobicContact CD2-CD2 4.29Å; F18-W26 AromaticContact CD2-CG 3.97Å; F18-W26 HydrophobicContact CD2-CG 3.97Å; F18-W26 HydrophobicContact CE2-CD2 4.39Å; F18-W26 HydrophobicContact CE2-CG 4.43Å; F18-W26 PolarHBondContact O-NE1 3.28Å; F18-W26 VanDerWaalsContact O-NE1 3.08Å; F18-P27 HydrophobicContact CD1-CG 4.46Å; F18-P27 HydrophobicContact CD2-CG 4.11Å; F18-P27 HydrophobicContact CE2-CG 4.28Å; F18-P27 HydrophobicContact CG-CG 4.19Å
19	L	78.5	Confident	79	Confident	79 Å²	79	106.5 Å²	106.5	41%	0.414	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-70.5	-22.1	177.6	-70.7	178	0	0	0	112.6	P16 D17 R21 W26	P16-L19 HydrophobicContact CG-CD1 3.84Å; P16-L19 HydrophobicContact CG-CG 4.12Å; P16-L19 PolarHBondContact O-N 3.49Å; D17-L19 VanDerWaalsContact C-N 3.28Å; D17-L19 PolarHBondContact O-N 2.99Å; L19-R21 VanDerWaalsContact C-N 3.28Å; L19-W26 HydrophobicContact CD2-CD2 4.37Å; L19-W26 HydrophobicContact CD2-CE3 4.28Å; L19-W26 HydrophobicContact CD2-CH2 3.62Å; L19-W26 HydrophobicContact CD2-CZ2 3.71Å; L19-W26 HydrophobicContact CD2-CZ3 3.92Å
20	L	79.6	Confident	78.5	Confident	128 Å²	128	105.1 Å²	105.1	67%	0.67	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-81.7	-9	173.9	-59.6	174.6	0	0	0	112.3	D17 F18	D17-L20 PolarHBondContact O-N 2.96Å; F18-L20 PolarHBondContact O-N 2.68Å
21	R	84	Confident	77.4	Confident	147 Å²	147	110.2 Å²	110.2	56%	0.555	57%	0.568	S	S	*	*	S	Bend	trans	-93.4	160.2	177.7	-58.8	-178.9	-173.9	-169.3	0.6	110.8	F18 L19 L25 W26	F18-R21 WeakPolarHBondContact O-CB 3.46Å; F18-R21 PolarHBondContact O-N 3.27Å; F18-R21 VanDerWaalsContact O-N 3.11Å; L19-R21 VanDerWaalsContact C-N 3.28Å; R21-L25 HydrophobicContact CB-CB 4.2Å; R21-L25 HydrophobicContact CB-CD1 4.3Å; R21-W26 PolarHBondContact O-NE1 3.47Å
22	H	85.3	Confident	76.2	Confident	141 Å²	141	111.2 Å²	111.2	65%	0.653	58%	0.579	S	S	*	*			trans	-55.5	142.2	174.5	-171.8	-96.3	0	0	0	110.9	S24 L25	H22-S24 PolarHBondContact ND1-N 3.39Å; H22-S24 PolarHBondContact ND1-OG 3.11Å; H22-S24 PolarHBondContact O-N 3.39Å; H22-L25 WeakPolarHBondContact O-CB 3.34Å; H22-L25 PolarHBondContact O-N 3.08Å
23	Q	82.3	Confident	75	Confident	147 Å²	147	109 Å²	109	69%	0.687	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-55.4	-25.8	-171.6	-167.7	176.3	4.7	0	0	114	L25 W26	Q23-L25 PolarHBondContact O-N 2.93Å; Q23-W26 HydrophobicContact CG-CD2 4.23Å; Q23-W26 HydrophobicContact CG-CE3 4.35Å; Q23-W26 WeakPolarHBondContact O-CB 3.21Å; Q23-W26 PolarHBondContact O-N 2.97Å
24	S	82.9	Confident	73.8	Confident	92 Å²	92	110.3 Å²	110.3	64%	0.643	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-68	-15.7	175	62.1	0	0	0	0	114.6	H22	H22-S24 PolarHBondContact ND1-N 3.39Å; H22-S24 PolarHBondContact ND1-OG 3.11Å; H22-S24 PolarHBondContact O-N 3.39Å
25	L	81.2	Confident	72.3	Confident	112 Å²	112	113.1 Å²	113.1	59%	0.586	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-103.7	5.2	178.8	-63.2	171.9	0	0	0	112.1	R21 H22 Q23	R21-L25 HydrophobicContact CB-CB 4.2Å; R21-L25 HydrophobicContact CB-CD1 4.3Å; H22-L25 WeakPolarHBondContact O-CB 3.34Å; H22-L25 PolarHBondContact O-N 3.08Å; Q23-L25 PolarHBondContact O-N 2.93Å
26	W	86.7	Confident	71	Confident	104 Å²	104	118.6 Å²	118.6	39%	0.394	63%	0.632	S	S	.	*	S	Bend	trans	-72	140.2	175.5	-68.5	15.7	0	0	0	108.9	F18 L19 R21 Q23 S28	F18-W26 HydrophobicContact CD2-CB 4.19Å; F18-W26 HydrophobicContact CD2-CD2 4.29Å; F18-W26 AromaticContact CD2-CG 3.97Å; F18-W26 HydrophobicContact CD2-CG 3.97Å; F18-W26 HydrophobicContact CE2-CD2 4.39Å; F18-W26 HydrophobicContact CE2-CG 4.43Å; F18-W26 PolarHBondContact O-NE1 3.28Å; F18-W26 VanDerWaalsContact O-NE1 3.08Å; L19-W26 HydrophobicContact CD2-CD2 4.37Å; L19-W26 HydrophobicContact CD2-CE3 4.28Å; L19-W26 HydrophobicContact CD2-CH2 3.62Å; L19-W26 HydrophobicContact CD2-CZ2 3.71Å; L19-W26 HydrophobicContact CD2-CZ3 3.92Å; R21-W26 PolarHBondContact O-NE1 3.47Å; Q23-W26 HydrophobicContact CG-CD2 4.23Å; Q23-W26 HydrophobicContact CG-CE3 4.35Å; Q23-W26 WeakPolarHBondContact O-CB 3.21Å; Q23-W26 PolarHBondContact O-N 2.97Å; W26-S28 PolarHBondContact O-N 3.24Å
27	P	81.3	Confident	69.6	Low	86 Å²	86	122.9 Å²	122.9	56%	0.558	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-59.7	133.9	174.7	25.3	-31.1	0	0	0	109.3	F18	F18-P27 HydrophobicContact CD1-CG 4.46Å; F18-P27 HydrophobicContact CD2-CG 4.11Å; F18-P27 HydrophobicContact CE2-CG 4.28Å; F18-P27 HydrophobicContact CG-CG 4.19Å
28	S	74.2	Confident	68.4	Low	111 Å²	111	122.7 Å²	122.7	78%	0.776	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-61.1	137.5	170.1	36	0	0	0	0	109.2	W26	W26-S28 PolarHBondContact O-N 3.24Å
29	L	65.6	Low	67.1	Low	159 Å²	159	128.2 Å²	128.2	83%	0.832	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-53.2	130.4	169.9	-102.7	99	0	0	0	107.5	E31	L29-E31 PolarHBondContact O-N 3.46Å
30	P	62.1	Low	66	Low	110 Å²	110	131.5 Å²	131.5	71%	0.714	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-55.8	134.5	169.6	22.5	-29.1	0	0	0	107.6	V32	P30-V32 PolarHBondContact O-N 2.79Å
31	E	56.4	Low	65.1	Low	179 Å²	179	129.2 Å²	129.2	84%	0.836	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-50.1	133.5	168.9	-73.9	-175.3	160.6	0	0	107.4	L29 V33	L29-E31 PolarHBondContact O-N 3.46Å; E31-V33 PolarHBondContact O-N 3.16Å
32	V	51.8	Low	64	Low	139 Å²	139	127.8 Å²	127.8	84%	0.842	69%	0.691	S	S	*	*			trans	-58.4	94	177.9	178.9	0	0	0	0	107	P30 Q34	P30-V32 PolarHBondContact O-N 2.79Å; V32-Q34 PolarHBondContact O-N 2.87Å; V32-Q34 VanDerWaalsContact O-N 3.13Å
33	V	49.7	Very low	62.9	Low	107 Å²	107	129.2 Å²	129.2	65%	0.648	70%	0.698	S	S	*	*			trans	-60.4	120.1	169.2	-173.3	0	0	0	0	104	E31 L36	E31-V33 PolarHBondContact O-N 3.16Å; V33-L36 HydrophobicContact CG1-CD1 3.75Å
34	Q	50.1	Low	61.6	Low	166 Å²	166	125.9 Å²	125.9	78%	0.776	68%	0.684	S	S	*	*			trans	-43.2	140.2	171.8	-66.8	-176.4	15.4	0	0	108.3	V32 L36	V32-Q34 PolarHBondContact O-N 2.87Å; V32-Q34 VanDerWaalsContact O-N 3.13Å; Q34-L36 PolarHBondContact O-N 2.96Å
35	P	45.7	Very low	60.3	Low	113 Å²	113	130.9 Å²	130.9	73%	0.734	69%	0.69	S	S	*	*			trans	-56.9	106.5	-173.8	23.6	-30.8	0	0	0	107.8	N37	P35-N37 PolarHBondContact O-N 3.47Å
36	L	49.7	Very low	59	Low	133 Å²	133	130.1 Å²	130.1	70%	0.696	70%	0.7	S	S	*	*			trans	-54.1	140	161.5	-88.1	116.9	0	0	0	105.5	V33 Q34 L38	V33-L36 HydrophobicContact CG1-CD1 3.75Å; Q34-L36 PolarHBondContact O-N 2.96Å; L36-L38 VanDerWaalsContact C-N 3.27Å; L36-L38 WeakPolarHBondContact O-CG 3.46Å; L36-L38 PolarHBondContact O-N 3.34Å
37	N	49.9	Very low	57.3	Low	140 Å²	140	131.2 Å²	131.2	75%	0.749	72%	0.719	S	S	*	*			trans	-56	92.5	178	-77.4	-32.4	0	0	0	109.6	P35 F39	P35-N37 PolarHBondContact O-N 3.47Å; N37-F39 PolarHBondContact O-N 2.77Å
38	L	55.7	Low	55.6	Low	108 Å²	108	134.2 Å²	134.2	57%	0.565	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	16.2	-178.5	-76.2	150.8	0	0	0	112.3	L36 I44	L36-L38 VanDerWaalsContact C-N 3.27Å; L36-L38 WeakPolarHBondContact O-CG 3.46Å; L36-L38 PolarHBondContact O-N 3.34Å; L38-I44 HydrophobicContact CD2-CD1 3.22Å
39	F	56	Low	54.6	Low	191 Å²	191	138.1 Å²	138.1	84%	0.838	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-13.6	-176.7	-74.7	-76.2	0	0	0	113.6	N37	N37-F39 PolarHBondContact O-N 2.77Å
40	D	55.3	Low	54	Low	149 Å²	149	138.6 Å²	138.6	80%	0.797	73%	0.729	S	S	*	*	S	Bend	trans	-116.5	11.5	-173	-68.4	-35.5	0	0	0	114.8	P42	D40-P42 WeakPolarHBondContact O-CD 3.27Å
41	D	61.8	Low	53.5	Low	79 Å²	79	134.8 Å²	134.8	42%	0.422	71%	0.71	S	S	.	*			trans	-95	112.3	176.5	-166.7	-24.8	0	0	0	111.4	E43 I44	D41-E43 PolarHBondContact O-N 3.06Å; D41-E43 VanDerWaalsContact O-N 3.15Å; D41-E43 PolarHBondContact OD1-N 2.95Å; D41-I44 HydrophobicContact CB-CB 4.27Å; D41-I44 HydrophobicContact CB-CD1 3.63Å; D41-I44 HydrophobicContact CB-CG1 3.74Å; D41-I44 PolarHBondContact O-N 3.11Å; D41-I44 VanDerWaalsContact O-N 3.1Å
42	P	61.3	Low	53.6	Low	117 Å²	117	131.3 Å²	131.3	76%	0.76	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-8	-178.3	27.5	-33.8	0	0	0	114.6	D40	D40-P42 WeakPolarHBondContact O-CD 3.27Å
43	E	60.4	Low	53.7	Low	171 Å²	171	130.8 Å²	130.8	80%	0.799	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-4.7	173.1	-66.7	-170.1	167.4	0	0	113.4	D41 Y45	D41-E43 PolarHBondContact O-N 3.06Å; D41-E43 VanDerWaalsContact O-N 3.15Å; D41-E43 PolarHBondContact OD1-N 2.95Å; E43-Y45 PolarHBondContact O-N 3.08Å
44	I	55.1	Low	54	Low	78 Å²	78	132.3 Å²	132.3	40%	0.4	70%	0.701	S	S	.	*			trans	-101.1	89.4	-178.6	-55	-176.1	0	0	0	109.9	L38 D41 A46	L38-I44 HydrophobicContact CD2-CD1 3.22Å; D41-I44 HydrophobicContact CB-CB 4.27Å; D41-I44 HydrophobicContact CB-CD1 3.63Å; D41-I44 HydrophobicContact CB-CG1 3.74Å; D41-I44 PolarHBondContact O-N 3.11Å; D41-I44 VanDerWaalsContact O-N 3.1Å; I44-A46 PolarHBondContact O-N 3.23Å
45	Y	56.6	Low	54.4	Low	197 Å²	197	132.5 Å²	132.5	77%	0.773	70%	0.702	S	S	*	*			trans	-68.9	128.3	165.5	-63.2	-86.6	0	0	0	108.8	E43 T47	E43-Y45 PolarHBondContact O-N 3.08Å; Y45-T47 VanDerWaalsContact C-N 3.31Å; Y45-T47 PolarHBondContact O-N 2.86Å
46	A	53.3	Low	55.4	Low	96 Å²	96	134.9 Å²	134.9	79%	0.793	71%	0.708	S	S	*	*			trans	-57.9	96.8	167.5	0	0	0	0	0	108.6	I44 D48	I44-A46 PolarHBondContact O-N 3.23Å; A46-D48 PolarHBondContact O-N 3.16Å; A46-D48 VanDerWaalsContact O-N 3.08Å
47	T	51.1	Low	56.5	Low	127 Å²	127	133.6 Å²	133.6	78%	0.779	71%	0.706	S	S	*	*			trans	-71.5	102.8	170	48.1	0	0	0	0	106.7	Y45 W49	Y45-T47 VanDerWaalsContact C-N 3.31Å; Y45-T47 PolarHBondContact O-N 2.86Å; T47-W49 VanDerWaalsContact C-N 3.33Å; T47-W49 PolarHBondContact O-N 2.98Å
48	D	46.3	Very low	58.2	Low	148 Å²	148	129 Å²	129	79%	0.791	68%	0.681	S	S	*	*			trans	-55.7	102.8	164.7	-80.9	-31.6	0	0	0	107.5	A46 I50	A46-D48 PolarHBondContact O-N 3.16Å; A46-D48 VanDerWaalsContact O-N 3.08Å; D48-I50 PolarHBondContact O-N 3.39Å
49	W	52.6	Low	59.8	Low	194 Å²	194	128.9 Å²	128.9	74%	0.735	69%	0.687	S	S	*	*			trans	-66.3	102.4	173.5	179.9	86	0	0	0	107.8	T47 G51 I53	T47-W49 VanDerWaalsContact C-N 3.33Å; T47-W49 PolarHBondContact O-N 2.98Å; W49-G51 WeakPolarHBondContact CZ3-O 3.46Å; W49-G51 PolarHBondContact O-N 2.96Å; W49-I53 HydrophobicContact CH2-CD1 4.22Å; W49-I53 HydrophobicContact CH2-CG1 3.73Å; W49-I53 HydrophobicContact CZ3-CD1 4.36Å; W49-I53 HydrophobicContact CZ3-CG1 4.21Å
50	I	52.6	Low	61.4	Low	169 Å²	169	121.3 Å²	121.3	87%	0.867	66%	0.655	S	S	*	*			trans	-92.2	82.2	167.6	-54.8	174.8	0	0	0	106.9	D48	D48-I50 PolarHBondContact O-N 3.39Å
51	G	52.4	Low	63.1	Low	29 Å²	29	116.4 Å²	116.4	30%	0.299	63%	0.627	S	S	.	*			trans	-106.5	130.3	169.4	0	0	0	0	0	111.2	W49 I53	W49-G51 WeakPolarHBondContact CZ3-O 3.46Å; W49-G51 PolarHBondContact O-N 2.96Å; G51-I53 PolarHBondContact O-N 3.31Å
52	S	57.4	Low	64.5	Low	107 Å²	107	114.8 Å²	114.8	75%	0.748	62%	0.624	S	S	*	*			trans	-79	104.6	167.1	-179.2	0	0	0	0	108.4	N54	S52-N54 PolarHBondContact O-N 3.15Å; S52-N54 VanDerWaalsContact O-N 3.15Å
53	I	55.2	Low	66	Low	127 Å²	127	110.2 Å²	110.2	65%	0.651	59%	0.593	S	S	*	*			trans	-75.3	99.9	165.4	-50.6	170.8	0	0	0	105.8	W49 G51 E55	W49-I53 HydrophobicContact CH2-CD1 4.22Å; W49-I53 HydrophobicContact CH2-CG1 3.73Å; W49-I53 HydrophobicContact CZ3-CD1 4.36Å; W49-I53 HydrophobicContact CZ3-CG1 4.21Å; G51-I53 PolarHBondContact O-N 3.31Å; I53-E55 VanDerWaalsContact C-N 3.25Å; I53-E55 PolarHBondContact O-N 2.98Å
54	N	55.3	Low	67.6	Low	140 Å²	140	102.1 Å²	102.1	75%	0.749	56%	0.556	S	S	*	*			trans	-68.8	96.2	160.5	-81.7	-18.9	0	0	0	105.9	S52 D56	S52-N54 PolarHBondContact O-N 3.15Å; S52-N54 VanDerWaalsContact O-N 3.15Å; N54-D56 PolarHBondContact O-N 3.04Å
55	E	58.8	Low	69.4	Low	170 Å²	170	102 Å²	102	79%	0.794	56%	0.561	S	S	*	*			trans	-54.7	115.8	163.6	-78.1	-173.2	156.8	0	0	106.7	I53 V57	I53-E55 VanDerWaalsContact C-N 3.25Å; I53-E55 PolarHBondContact O-N 2.98Å; E55-V57 PolarHBondContact O-N 2.96Å
56	D	67.8	Low	71.2	Confident	163 Å²	163	100.3 Å²	100.3	87%	0.872	56%	0.558	S	S	*	*			trans	-53.5	109.5	175.6	-93.2	-30.3	0	0	0	107.9	N54 D58	N54-D56 PolarHBondContact O-N 3.04Å; D56-D58 PolarHBondContact O-N 3.41Å; D56-D58 VanDerWaalsContact O-N 3.1Å
57	V	72.6	Confident	73.1	Confident	105 Å²	105	97.3 Å²	97.3	64%	0.636	53%	0.527	S	S	*	.			trans	-59.2	122.2	178.1	179.8	0	0	0	0	106.7	E55 P59 A62	E55-V57 PolarHBondContact O-N 2.96Å; V57-P59 WeakPolarHBondContact O-CD 3.43Å; V57-P59 VanDerWaalsContact O-N 3.09Å; V57-A62 HydrophobicContact CG1-CB 4.04Å
58	D	85.5	Confident	75	Confident	44 Å²	44	95.7 Å²	95.7	24%	0.235	52%	0.52	C	S	.	.			trans	-45.7	120.2	178.5	-170.8	-44.9	0	0	0	110.3	D56 I60 E61 A62 K115	D56-D58 PolarHBondContact O-N 3.41Å; D56-D58 VanDerWaalsContact O-N 3.1Å; D58-I60 PolarHBondContact O-N 3.09Å; D58-I60 WeakPolarHBondContact OD1-CB 3.19Å; D58-I60 PolarHBondContact OD1-N 2.92Å; D58-E61 HydrophobicContact CB-CB 3.9Å; D58-E61 WeakPolarHBondContact O-CA 3.49Å; D58-E61 WeakPolarHBondContact O-CB 3.46Å; D58-E61 PolarHBondContact O-N 3.01Å; D58-A62 PolarHBondContact O-N 3.4Å; D58-K115 VanDerWaalsContact CG-CE 3.49Å; D58-K115 IonicContact OD1-NZ 3.86Å; D58-K115 WeakPolarHBondContact OD2-CE 3.48Å; D58-K115 IonicContact OD2-NZ 2.59Å; D58-K115 PolarHBondContact OD2-NZ 2.94Å
59	P	88.7	Confident	77.3	Confident	105 Å²	105	97 Å²	97	68%	0.682	52%	0.515	S	S	*	.	H	α-helix	trans	-56.6	-30.6	-173.9	-26.8	33.3	0	0	0	113.1	V57 L63	V57-P59 WeakPolarHBondContact O-CD 3.43Å; V57-P59 VanDerWaalsContact O-N 3.09Å; P59-L63 WeakPolarHBondContact O-CB 3.3Å; P59-L63 PolarHBondContact O-N 3.49Å
60	I	90.2	Very high	79.3	Confident	33 Å²	33	88.4 Å²	88.4	17%	0.169	48%	0.483	C	S	.	.	H	α-helix	trans	-73.4	-39.6	177.5	-59.8	177.3	0	0	0	110.4	D58 L63 L64 L112 K115	D58-I60 PolarHBondContact O-N 3.09Å; D58-I60 WeakPolarHBondContact OD1-CB 3.19Å; D58-I60 PolarHBondContact OD1-N 2.92Å; I60-L63 WeakPolarHBondContact O-CB 3.38Å; I60-L63 PolarHBondContact O-N 3.24Å; I60-L64 HydrophobicContact CG2-CD1 4.25Å; I60-L64 WeakPolarHBondContact O-CG 3.47Å; I60-L64 PolarHBondContact O-N 3.23Å; I60-L112 HydrophobicContact CG2-CD2 3.67Å; I60-K115 HydrophobicContact CB-CG 4.38Å; I60-K115 HydrophobicContact CD1-CD 4.27Å; I60-K115 HydrophobicContact CD1-CG 4.11Å; I60-K115 HydrophobicContact CG2-CG 4.11Å
61	E	90.1	Very high	81.3	Confident	46 Å²	46	84.1 Å²	84.1	22%	0.215	47%	0.465	C	S	.	.	H	α-helix	trans	-67.9	-41.5	176.2	-170.3	58.1	-155.8	0	0	111	D58 L63 L64 C65 H178	D58-E61 HydrophobicContact CB-CB 3.9Å; D58-E61 WeakPolarHBondContact O-CA 3.49Å; D58-E61 WeakPolarHBondContact O-CB 3.46Å; D58-E61 PolarHBondContact O-N 3.01Å; E61-L63 VanDerWaalsContact C-N 3.28Å; E61-L63 PolarHBondContact O-N 2.71Å; E61-L64 PolarHBondContact O-N 2.97Å; E61-C65 WeakPolarHBondContact O-CB 3.24Å; E61-C65 PolarHBondContact O-N 3.22Å; E61-C65 PolarHBondContact O-SG 3.32Å; E61-C65 VanDerWaalsContact O-SG 3.36Å; E61-H178 IonicContact OE2-CE1 3.97Å; E61-H178 IonicContact OE2-NE2 3.76Å
62	A	91.2	Very high	83.4	Confident	44 Å²	44	89.5 Å²	89.5	36%	0.364	48%	0.476	S	S	.	.	H	α-helix	trans	-57.6	-42.6	172.1	0	0	0	0	0	111.2	V57 D58 C65 K66	V57-A62 HydrophobicContact CG1-CB 4.04Å; D58-A62 PolarHBondContact O-N 3.4Å; A62-C65 PolarHBondContact O-N 3.29Å; A62-K66 VanDerWaalsContact O-CB 3.23Å; A62-K66 WeakPolarHBondContact O-CB 3.3Å; A62-K66 PolarHBondContact O-N 2.88Å
63	L	93.2	Very high	85.2	Confident	21 Å²	21	84.4 Å²	84.4	11%	0.11	44%	0.44	C	S	.	.	H	α-helix	trans	-63.2	-44.8	176.3	-177.9	69.4	0	0	0	112.4	P59 I60 E61 C65 K66 F67 V73 I76 M77	P59-L63 WeakPolarHBondContact O-CB 3.3Å; P59-L63 PolarHBondContact O-N 3.49Å; I60-L63 WeakPolarHBondContact O-CB 3.38Å; I60-L63 PolarHBondContact O-N 3.24Å; E61-L63 VanDerWaalsContact C-N 3.28Å; E61-L63 PolarHBondContact O-N 2.71Å; L63-C65 VanDerWaalsContact C-N 3.34Å; L63-K66 PolarHBondContact O-N 3.1Å; L63-F67 HydrophobicContact CD1-CD2 3.85Å; L63-F67 HydrophobicContact CD1-CE2 3.64Å; L63-V73 HydrophobicContact CD2-CG1 4.05Å; L63-V73 HydrophobicContact CG-CG1 4.17Å; L63-I76 HydrophobicContact CD1-CB 4.25Å; L63-I76 HydrophobicContact CD1-CD1 4.02Å; L63-I76 HydrophobicContact CD1-CG2 3.71Å; L63-I76 HydrophobicContact CD2-CB 4.39Å; L63-I76 HydrophobicContact CD2-CG2 3.99Å; L63-M77 HydrophobicContact CD2-CG 3.74Å; L63-M77 HydrophobicContact CD2-SD 3.48Å; L63-M77 WeakPolarHBondContact CD2-SD 3.33Å
64	L	94.3	Very high	87.2	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.005	41%	0.414	C	S	.	.	H	α-helix	trans	-64.2	-38	178	-77	167.3	0	0	0	112.2	I60 E61 V73 L112 R179 L180 L183	I60-L64 HydrophobicContact CG2-CD1 4.25Å; I60-L64 WeakPolarHBondContact O-CG 3.47Å; I60-L64 PolarHBondContact O-N 3.23Å; E61-L64 PolarHBondContact O-N 2.97Å; L64-V73 HydrophobicContact CD2-CG1 3.89Å; L64-V73 HydrophobicContact CG-CG1 4.49Å; L64-L112 HydrophobicContact CD2-CD2 4.38Å; L64-L112 HydrophobicContact CG-CD2 4.47Å; L64-R179 HydrophobicContact CB-CB 4.13Å; L64-R179 HydrophobicContact CB-CG 3.78Å; L64-R179 VanDerWaalsContact O-CG 3.28Å; L64-R179 WeakPolarHBondContact O-CG 3.19Å; L64-R179 PolarHBondContact O-NE 3.47Å; L64-L180 HydrophobicContact CD1-CB 4.37Å; L64-L180 HydrophobicContact CD2-CB 4.13Å; L64-L180 HydrophobicContact CD2-CD1 4.08Å; L64-L183 HydrophobicContact CD2-CD1 3.79Å
65	C	92.6	Very high	89.1	Confident	75 Å²	75	79.6 Å²	79.6	51%	0.507	41%	0.405	S	S	.	.	H	α-helix	trans	-74.6	-33	178.1	-71.7	0	0	0	0	112.5	E61 A62 L63 F67	E61-C65 WeakPolarHBondContact O-CB 3.24Å; E61-C65 PolarHBondContact O-N 3.22Å; E61-C65 PolarHBondContact O-SG 3.32Å; E61-C65 VanDerWaalsContact O-SG 3.36Å; A62-C65 PolarHBondContact O-N 3.29Å; L63-C65 VanDerWaalsContact C-N 3.34Å; C65-F67 VanDerWaalsContact C-N 3.34Å; C65-F67 PolarHBondContact O-N 3.19Å
66	K	93.3	Very high	90.8	Very high	163 Å²	163	73.8 Å²	73.8	71%	0.709	38%	0.379	S	S	*	.	H	α-helix	trans	-68.3	-29	-177.5	-174.8	171.1	-176.1	173.2	0	113.9	A62 L63	A62-K66 VanDerWaalsContact O-CB 3.23Å; A62-K66 WeakPolarHBondContact O-CB 3.3Å; A62-K66 PolarHBondContact O-N 2.88Å; L63-K66 PolarHBondContact O-N 3.1Å
67	F	93.4	Very high	92.1	Very high	32 Å²	32	67 Å²	67	14%	0.14	34%	0.342	C	S	.	.			trans	-117.7	151.3	-174.2	-63.2	-67.5	0	0	0	113.1	L63 C65 R72 V73 I76 R179	L63-F67 HydrophobicContact CD1-CD2 3.85Å; L63-F67 HydrophobicContact CD1-CE2 3.64Å; C65-F67 VanDerWaalsContact C-N 3.34Å; C65-F67 PolarHBondContact O-N 3.19Å; F67-R72 HydrophobicContact CD1-CG 4.35Å; F67-R72 HydrophobicContact CG-CG 4.48Å; F67-V73 HydrophobicContact CB-CG2 3.76Å; F67-V73 HydrophobicContact CD2-CG2 4.36Å; F67-V73 HydrophobicContact CG-CG2 4.49Å; F67-I76 HydrophobicContact CD2-CD1 3.92Å; F67-I76 HydrophobicContact CE2-CD1 3.33Å; F67-I76 HydrophobicContact CZ-CD1 3.75Å; F67-R179 PolarHBondContact O-NH2 2.88Å
68	S	91.8	Very high	93.2	Very high	93 Å²	93	62.1 Å²	62.1	65%	0.65	31%	0.312	S	S	*	.	S	Bend	trans	-103.8	-10.6	178.9	56.3	0	0	0	0	113.8	L183	S68-L183 WeakPolarHBondContact O-CD2 3.45Å
69	R	94.2	Very high	93.6	Very high	177 Å²	177	65 Å²	65	67%	0.668	32%	0.321	S	S	*	.			trans	-108.5	121.4	179.7	-66.7	-174	-178.7	177.7	0.5	110.3	T71 R72 V73	R69-T71 PolarHBondContact O-N 3.32Å; R69-R72 HydrophobicContact CB-CB 4.13Å; R69-R72 PolarHBondContact O-N 3.37Å; R69-V73 PolarHBondContact O-N 2.88Å
70	L	95.7	Very high	93.8	Very high	13 Å²	13	63.9 Å²	63.9	7%	0.068	31%	0.309	C	S	.	.	H	α-helix	trans	-57.8	-47	178.8	179.7	60.9	0	0	0	111.7	R72 V73 I74 L180 L183 I184 D187	L70-R72 PolarHBondContact O-N 3.33Å; L70-V73 PolarHBondContact O-N 3.26Å; L70-I74 HydrophobicContact CD1-CD1 4.04Å; L70-I74 HydrophobicContact CD1-CG1 4.22Å; L70-I74 HydrophobicContact CD2-CD1 4.36Å; L70-I74 HydrophobicContact CG-CD1 3.77Å; L70-I74 HydrophobicContact CG-CG1 4.37Å; L70-I74 WeakPolarHBondContact O-CG1 3.46Å; L70-I74 PolarHBondContact O-N 3.3Å; L70-L180 HydrophobicContact CD1-CD1 3.81Å; L70-L183 HydrophobicContact CB-CB 4.21Å; L70-L183 HydrophobicContact CD1-CB 4.12Å; L70-I184 HydrophobicContact CD1-CG1 4.4Å; L70-I184 HydrophobicContact CD2-CB 4.45Å; L70-I184 HydrophobicContact CD2-CG1 3.67Å; L70-D187 HydrophobicContact CB-CB 4.1Å; L70-D187 HydrophobicContact CD2-CB 4.14Å
71	T	94.6	Very high	93.8	Very high	79 Å²	79	64.8 Å²	64.8	49%	0.485	31%	0.313	S	S	.	.	H	α-helix	trans	-57.4	-34.6	179.3	53.2	0	0	0	0	113.3	R69 R75	R69-T71 PolarHBondContact O-N 3.32Å; T71-R75 WeakPolarHBondContact O-CG 3.28Å; T71-R75 PolarHBondContact O-N 3Å; T71-R75 VanDerWaalsContact O-N 3.11Å
72	R	95.1	Very high	93.8	Very high	142 Å²	142	64.2 Å²	64.2	54%	0.536	31%	0.31	S	S	.	.	H	α-helix	trans	-69.3	-42.5	176.2	-174.3	172.1	-177.1	167.8	1.9	111.5	F67 R69 L70 R75 I76	F67-R72 HydrophobicContact CD1-CG 4.35Å; F67-R72 HydrophobicContact CG-CG 4.48Å; R69-R72 HydrophobicContact CB-CB 4.13Å; R69-R72 PolarHBondContact O-N 3.37Å; L70-R72 PolarHBondContact O-N 3.33Å; R72-R75 PolarHBondContact O-N 3.26Å; R72-I76 HydrophobicContact CG-CD1 4.04Å; R72-I76 VanDerWaalsContact O-CG1 3.29Å; R72-I76 WeakPolarHBondContact O-CG1 3.36Å; R72-I76 PolarHBondContact O-N 3.33Å; R72-I76 VanDerWaalsContact O-N 3.08Å
73	V	96.3	Very high	93.7	Very high	0 Å²	0	69 Å²	69	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-46.3	177.1	177.2	0	0	0	0	110.7	L63 L64 F67 R69 L70 R75 I76 M77 L112 L183	L63-V73 HydrophobicContact CD2-CG1 4.05Å; L63-V73 HydrophobicContact CG-CG1 4.17Å; L64-V73 HydrophobicContact CD2-CG1 3.89Å; L64-V73 HydrophobicContact CG-CG1 4.49Å; F67-V73 HydrophobicContact CB-CG2 3.76Å; F67-V73 HydrophobicContact CD2-CG2 4.36Å; F67-V73 HydrophobicContact CG-CG2 4.49Å; R69-V73 PolarHBondContact O-N 2.88Å; L70-V73 PolarHBondContact O-N 3.26Å; V73-R75 PolarHBondContact O-N 3.04Å; V73-I76 PolarHBondContact O-N 2.91Å; V73-M77 PolarHBondContact O-N 2.77Å; V73-L112 HydrophobicContact CG1-CD1 3.91Å; V73-L112 HydrophobicContact CG1-CD2 4.25Å; V73-L183 HydrophobicContact CG2-CD1 4.18Å
74	I	96.4	Very high	93.5	Very high	21 Å²	21	70.3 Å²	70.3	11%	0.108	33%	0.333	C	S	.	.	H	α-helix	trans	-59.9	-46.8	179.5	-65.6	169.4	0	0	0	110.8	L70 I76 M77 A78 I105 A108 F109 L112	L70-I74 HydrophobicContact CD1-CD1 4.04Å; L70-I74 HydrophobicContact CD1-CG1 4.22Å; L70-I74 HydrophobicContact CD2-CD1 4.36Å; L70-I74 HydrophobicContact CG-CD1 3.77Å; L70-I74 HydrophobicContact CG-CG1 4.37Å; L70-I74 WeakPolarHBondContact O-CG1 3.46Å; L70-I74 PolarHBondContact O-N 3.3Å; I74-I76 PolarHBondContact O-N 3.09Å; I74-M77 PolarHBondContact O-N 2.89Å; I74-A78 WeakPolarHBondContact O-CB 3.28Å; I74-A78 PolarHBondContact O-N 2.78Å; I74-I105 HydrophobicContact CG2-CB 4.46Å; I74-I105 HydrophobicContact CG2-CG2 3.8Å; I74-I105 WeakPolarHBondContact CG2-O 3.35Å; I74-A108 HydrophobicContact CG2-CB 4.18Å; I74-F109 HydrophobicContact CD1-CB 4.41Å; I74-F109 HydrophobicContact CD1-CD2 3.67Å; I74-F109 HydrophobicContact CD1-CE2 4.41Å; I74-F109 HydrophobicContact CD1-CG 4.41Å; I74-F109 HydrophobicContact CG1-CD2 4.12Å; I74-L112 HydrophobicContact CG1-CD1 4.06Å
75	R	95.2	Very high	93.2	Very high	145 Å²	145	73 Å²	73	55%	0.547	35%	0.351	S	S	.	.	H	α-helix	trans	-61.4	-41.8	177.8	-73.9	-179.9	123.7	157.9	0.7	112.7	T71 R72 V73 A78 Y79 L100	T71-R75 WeakPolarHBondContact O-CG 3.28Å; T71-R75 PolarHBondContact O-N 3Å; T71-R75 VanDerWaalsContact O-N 3.11Å; R72-R75 PolarHBondContact O-N 3.26Å; V73-R75 PolarHBondContact O-N 3.04Å; R75-A78 PolarHBondContact O-N 3.46Å; R75-Y79 WeakPolarHBondContact O-CD2 3.29Å; R75-Y79 PolarHBondContact O-N 3.48Å; R75-L100 HydrophobicContact CB-CD1 3.98Å; R75-L100 HydrophobicContact CG-CD1 3.93Å
76	I	95.1	Very high	92.8	Very high	48 Å²	48	71.3 Å²	71.3	25%	0.246	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-44.8	176.3	-67	166.2	0	0	0	110.2	L63 F67 R72 V73 I74 A78 Y79 L80	L63-I76 HydrophobicContact CD1-CB 4.25Å; L63-I76 HydrophobicContact CD1-CD1 4.02Å; L63-I76 HydrophobicContact CD1-CG2 3.71Å; L63-I76 HydrophobicContact CD2-CB 4.39Å; L63-I76 HydrophobicContact CD2-CG2 3.99Å; F67-I76 HydrophobicContact CD2-CD1 3.92Å; F67-I76 HydrophobicContact CE2-CD1 3.33Å; F67-I76 HydrophobicContact CZ-CD1 3.75Å; R72-I76 HydrophobicContact CG-CD1 4.04Å; R72-I76 VanDerWaalsContact O-CG1 3.29Å; R72-I76 WeakPolarHBondContact O-CG1 3.36Å; R72-I76 PolarHBondContact O-N 3.33Å; R72-I76 VanDerWaalsContact O-N 3.08Å; V73-I76 PolarHBondContact O-N 2.91Å; I74-I76 PolarHBondContact O-N 3.09Å; I76-A78 VanDerWaalsContact C-N 3.31Å; I76-A78 PolarHBondContact O-N 3.08Å; I76-Y79 PolarHBondContact O-N 3.44Å; I76-L80 HydrophobicContact CG2-CD1 3.93Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CB 3.38Å; I76-L80 VanDerWaalsContact O-CG 3.32Å; I76-L80 WeakPolarHBondContact O-CG 3.48Å; I76-L80 PolarHBondContact O-N 3.4Å
77	M	95.3	Very high	92.5	Very high	21 Å²	21	67 Å²	67	10%	0.103	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-36.3	176.2	-83.3	-38.5	-49.9	0	0	113.2	L63 V73 I74 L80 N81 A108 L112	L63-M77 HydrophobicContact CD2-CG 3.74Å; L63-M77 HydrophobicContact CD2-SD 3.48Å; L63-M77 WeakPolarHBondContact CD2-SD 3.33Å; V73-M77 PolarHBondContact O-N 2.77Å; I74-M77 PolarHBondContact O-N 2.89Å; M77-L80 HydrophobicContact CE-CB 4.04Å; M77-L80 HydrophobicContact CE-CD1 4.11Å; M77-L80 PolarHBondContact O-N 3.21Å; M77-L80 HydrophobicContact SD-CD1 3.78Å; M77-N81 WeakPolarHBondContact O-CB 3.31Å; M77-N81 PolarHBondContact O-N 2.98Å; M77-A108 HydrophobicContact CB-CB 3.87Å; M77-L112 HydrophobicContact CG-CD1 4.34Å; M77-L112 HydrophobicContact CG-CD2 3.74Å; M77-L112 HydrophobicContact CG-CG 4.08Å
78	A	94.8	Very high	92.1	Very high	1 Å²	1	75.2 Å²	75.2	1%	0.008	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-47.5	176.2	0	0	0	0	0	111.1	I74 R75 I76 L80 N81 R82 L100 E104 A108	I74-A78 WeakPolarHBondContact O-CB 3.28Å; I74-A78 PolarHBondContact O-N 2.78Å; R75-A78 PolarHBondContact O-N 3.46Å; I76-A78 VanDerWaalsContact C-N 3.31Å; I76-A78 PolarHBondContact O-N 3.08Å; A78-L80 PolarHBondContact O-N 2.73Å; A78-N81 PolarHBondContact O-N 2.96Å; A78-R82 WeakPolarHBondContact O-CB 2.7Å; A78-R82 PolarHBondContact O-N 2.59Å; A78-L100 HydrophobicContact CB-CD1 3.82Å; A78-L100 HydrophobicContact CB-CD2 3.67Å; A78-L100 HydrophobicContact CB-CG 4.36Å; A78-E104 HydrophobicContact CB-CB 4.37Å; A78-A108 HydrophobicContact CB-CB 3.76Å
79	Y	93.9	Very high	91.6	Very high	105 Å²	105	76.5 Å²	76.5	41%	0.412	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-40.4	174.8	-76.3	-60.1	0	0	0	113.1	R75 I76 N81 R82 F83 L100	R75-Y79 WeakPolarHBondContact O-CD2 3.29Å; R75-Y79 PolarHBondContact O-N 3.48Å; I76-Y79 PolarHBondContact O-N 3.44Å; Y79-N81 VanDerWaalsContact C-N 3.34Å; Y79-R82 PolarHBondContact O-N 2.98Å; Y79-F83 WeakPolarHBondContact O-CB 3.49Å; Y79-F83 PolarHBondContact O-N 2.9Å; Y79-L100 HydrophobicContact CD1-CD2 3.87Å; Y79-L100 HydrophobicContact CD1-CG 4.29Å; Y79-L100 HydrophobicContact CD2-CD1 3.92Å; Y79-L100 HydrophobicContact CD2-CG 4.47Å; Y79-L100 HydrophobicContact CE1-CD1 4.29Å; Y79-L100 HydrophobicContact CE1-CD2 3.85Å; Y79-L100 HydrophobicContact CE1-CG 3.84Å; Y79-L100 HydrophobicContact CE2-CD1 3.58Å; Y79-L100 HydrophobicContact CE2-CG 4.03Å; Y79-L100 HydrophobicContact CG-CD1 4.4Å; Y79-L100 HydrophobicContact CG-CD2 4.23Å
80	L	92.4	Very high	90.4	Very high	82 Å²	82	80.5 Å²	80.5	43%	0.429	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-39.9	175.8	-72.9	172.5	0	0	0	111.7	I76 M77 A78 F83 C84	I76-L80 HydrophobicContact CG2-CD1 3.93Å; I76-L80 HydrophobicContact CG2-CG 4.33Å; I76-L80 WeakPolarHBondContact O-CB 3.38Å; I76-L80 VanDerWaalsContact O-CG 3.32Å; I76-L80 WeakPolarHBondContact O-CG 3.48Å; I76-L80 PolarHBondContact O-N 3.4Å; M77-L80 HydrophobicContact CE-CB 4.04Å; M77-L80 HydrophobicContact CE-CD1 4.11Å; M77-L80 PolarHBondContact O-N 3.21Å; M77-L80 HydrophobicContact SD-CD1 3.78Å; A78-L80 PolarHBondContact O-N 2.73Å; L80-F83 PolarHBondContact O-N 2.89Å; L80-C84 WeakPolarHBondContact O-CB 3.38Å; L80-C84 PolarHBondContact O-N 3.23Å; L80-C84 PolarHBondContact O-SG 2.99Å
81	N	90.8	Very high	88.8	Confident	51 Å²	51	87.8 Å²	87.8	27%	0.273	40%	0.402	S	S	.	.	H	α-helix	trans	-69.7	-40.3	178.4	-164.8	24.9	0	0	0	111.7	M77 A78 Y79 C84 S85 I111	M77-N81 WeakPolarHBondContact O-CB 3.31Å; M77-N81 PolarHBondContact O-N 2.98Å; A78-N81 PolarHBondContact O-N 2.96Å; Y79-N81 VanDerWaalsContact C-N 3.34Å; N81-C84 PolarHBondContact O-N 3.02Å; N81-S85 WeakPolarHBondContact O-CB 3.49Å; N81-S85 PolarHBondContact O-N 3.17Å; N81-S85 PolarHBondContact O-OG 2.8Å; N81-I111 HydrophobicContact CB-CD1 4.48Å
82	R	89.7	Confident	87.2	Confident	35 Å²	35	93.9 Å²	93.9	13%	0.132	42%	0.421	C	S	.	.	H	α-helix	trans	-58.8	-48.4	171.8	-175.1	-169.7	-70.1	-167.4	-16.5	111.3	A78 Y79 C84 S85 N86 H97 E99 E104	A78-R82 WeakPolarHBondContact O-CB 2.7Å; A78-R82 PolarHBondContact O-N 2.59Å; Y79-R82 PolarHBondContact O-N 2.98Å; R82-C84 PolarHBondContact O-N 3.05Å; R82-S85 PolarHBondContact O-N 3.22Å; R82-N86 WeakPolarHBondContact O-CB 3.38Å; R82-N86 PolarHBondContact O-N 2.86Å; R82-H97 PolarHBondContact NH1-O 3.01Å; R82-E99 PolarHBondContact NH2-O 3.3Å; R82-E104 IonicContact CZ-OE1 3.8Å; R82-E104 IonicContact CZ-OE2 2.87Å; R82-E104 IonicContact NE-OE1 3.66Å; R82-E104 PolarHBondContact NE-OE1 3.48Å; R82-E104 IonicContact NE-OE2 3.93Å; R82-E104 IonicContact NH2-OE1 3.59Å; R82-E104 PolarHBondContact NH2-OE1 2.85Å; R82-E104 IonicContact NH2-OE2 2.83Å; R82-E104 PolarHBondContact NH2-OE2 3.05Å
83	F	89.4	Confident	85.4	Confident	143 Å²	143	91 Å²	91	63%	0.627	42%	0.423	S	S	*	.	H	α-helix	trans	-57.6	-49	176.8	175.8	-97.8	0	0	0	111.5	Y79 L80 S85 N86 A87	Y79-F83 WeakPolarHBondContact O-CB 3.49Å; Y79-F83 PolarHBondContact O-N 2.9Å; L80-F83 PolarHBondContact O-N 2.89Å; F83-S85 VanDerWaalsContact C-N 3.29Å; F83-S85 PolarHBondContact O-N 2.97Å; F83-N86 PolarHBondContact O-N 3.18Å; F83-A87 VanDerWaalsContact O-CB 3.3Å; F83-A87 WeakPolarHBondContact O-CB 3.5Å; F83-A87 PolarHBondContact O-N 2.89Å
84	C	89.3	Confident	83.7	Confident	50 Å²	50	96.6 Å²	96.6	34%	0.338	45%	0.452	S	S	.	.	H	α-helix	trans	-58.5	-41	176.4	-70.2	0	0	0	0	112.4	L80 N81 R82 R88	L80-C84 WeakPolarHBondContact O-CB 3.38Å; L80-C84 PolarHBondContact O-N 3.23Å; L80-C84 PolarHBondContact O-SG 2.99Å; N81-C84 PolarHBondContact O-N 3.02Å; R82-C84 PolarHBondContact O-N 3.05Å; C84-R88 VanDerWaalsContact O-CG 3.24Å; C84-R88 WeakPolarHBondContact O-CG 3.48Å; C84-R88 PolarHBondContact O-N 3.36Å
85	S	86.9	Confident	82	Confident	56 Å²	56	100.6 Å²	100.6	39%	0.392	47%	0.471	S	S	.	.	H	α-helix	trans	-67.3	-44.1	-179.4	-59.9	0	0	0	0	111.3	N81 R82 F83 R88 R89	N81-S85 WeakPolarHBondContact O-CB 3.49Å; N81-S85 PolarHBondContact O-N 3.17Å; N81-S85 PolarHBondContact O-OG 2.8Å; R82-S85 PolarHBondContact O-N 3.22Å; F83-S85 VanDerWaalsContact C-N 3.29Å; F83-S85 PolarHBondContact O-N 2.97Å; S85-R88 PolarHBondContact O-N 3.46Å; S85-R89 PolarHBondContact O-N 3.45Å
86	N	85.4	Confident	80.4	Confident	41 Å²	41	103.3 Å²	103.3	22%	0.219	48%	0.482	C	S	.	.	H	α-helix	trans	-66.4	-41.3	176.6	-72.5	-12.1	0	0	0	112.1	R82 F83 R88 R89 L94	R82-N86 WeakPolarHBondContact O-CB 3.38Å; R82-N86 PolarHBondContact O-N 2.86Å; F83-N86 PolarHBondContact O-N 3.18Å; N86-R88 PolarHBondContact O-N 3.35Å; N86-R89 PolarHBondContact O-N 2.9Å; N86-L94 HydrophobicContact CB-CD2 4.04Å
87	A	85.8	Confident	79.2	Confident	72 Å²	72	107.1 Å²	107.1	60%	0.595	50%	0.499	S	S	*	.	H	α-helix	trans	-65.9	-25.6	178.4	0	0	0	0	0	113.3	F83	F83-A87 VanDerWaalsContact O-CB 3.3Å; F83-A87 WeakPolarHBondContact O-CB 3.5Å; F83-A87 PolarHBondContact O-N 2.89Å
88	R	85.8	Confident	78.3	Confident	205 Å²	205	109.7 Å²	109.7	77%	0.774	52%	0.524	S	S	*	.	H	α-helix	trans	-86.4	-17.2	177.4	-69.8	175.9	-157.3	-152.8	5.8	113.7	C84 S85 N86	C84-R88 VanDerWaalsContact O-CG 3.24Å; C84-R88 WeakPolarHBondContact O-CG 3.48Å; C84-R88 PolarHBondContact O-N 3.36Å; S85-R88 PolarHBondContact O-N 3.46Å; N86-R88 PolarHBondContact O-N 3.35Å
89	R	80.8	Confident	77.8	Confident	119 Å²	119	117.4 Å²	117.4	45%	0.449	56%	0.559	S	S	.	*			trans	-73.4	128	178.7	-79.8	-176.7	178.6	-175.9	3.2	109.7	S85 N86 E95	S85-R89 PolarHBondContact O-N 3.45Å; N86-R89 PolarHBondContact O-N 2.9Å; R89-E95 IonicContact CZ-OE1 3.51Å; R89-E95 IonicContact NH1-OE1 2.82Å; R89-E95 PolarHBondContact NH1-OE1 2.89Å; R89-E95 IonicContact NH2-OE1 3.18Å; R89-E95 PolarHBondContact NH2-OE1 3.18Å
90	R	69.1	Low	77.6	Confident	262 Å²	262	113.4 Å²	113.4	99%	0.989	55%	0.545	S	S	*	.	S	Bend	trans	-75.2	-21.9	175.2	-85.2	-177.7	170.9	170.5	-3	113.6
91	Q	63.7	Low	77.5	Confident	165 Å²	165	113 Å²	113	77%	0.771	54%	0.544	S	S	*	.	S	Bend	trans	-102.9	135.6	-178.3	-111.1	166	-19.4	0	0	111.3	S93	Q91-S93 PolarHBondContact O-N 3.33Å
92	K	59.5	Low	77.6	Confident	207 Å²	207	115.7 Å²	115.7	90%	0.9	56%	0.561	S	S	*	*			trans	-68.4	7	-173.2	-83.8	-175.4	177.1	178.7	0	116	L94	K92-L94 PolarHBondContact O-N 2.81Å
93	S	57.7	Low	77.7	Confident	82 Å²	82	118.1 Å²	118.1	57%	0.573	58%	0.58	S	S	*	*			trans	-74.6	80.8	174.4	61.4	0	0	0	0	109.6	Q91 E95	Q91-S93 PolarHBondContact O-N 3.33Å; S93-E95 PolarHBondContact O-N 2.82Å
94	L	60.5	Low	77.9	Confident	117 Å²	117	112.8 Å²	112.8	61%	0.613	56%	0.557	S	S	*	*			trans	-68.1	115.9	170.7	-75.6	158.3	0	0	0	108	N86 K92 Y96	N86-L94 HydrophobicContact CB-CD2 4.04Å; K92-L94 PolarHBondContact O-N 2.81Å; L94-Y96 PolarHBondContact O-N 3.48Å
95	E	59.9	Low	78.2	Confident	106 Å²	106	113 Å²	113	50%	0.495	56%	0.555	S	S	.	*			trans	-71	82.5	159.8	-77.6	162.5	-132.6	0	0	107.1	R89 S93 H97	R89-E95 IonicContact CZ-OE1 3.51Å; R89-E95 IonicContact NH1-OE1 2.82Å; R89-E95 PolarHBondContact NH1-OE1 2.89Å; R89-E95 IonicContact NH2-OE1 3.18Å; R89-E95 PolarHBondContact NH2-OE1 3.18Å; S93-E95 PolarHBondContact O-N 2.82Å; E95-H97 PolarHBondContact O-N 3.36Å
96	Y	61.9	Low	78.6	Confident	202 Å²	202	114.6 Å²	114.6	79%	0.792	56%	0.559	S	S	*	*			trans	-89.1	81.3	173.4	-165.1	-92.9	0	0	0	109.2	L94	L94-Y96 PolarHBondContact O-N 3.48Å
97	H	70.4	Confident	79	Confident	127 Å²	127	116.7 Å²	116.7	59%	0.588	57%	0.57	S	S	*	*			trans	-96.1	125.3	164.6	-65.5	-69.2	0	0	0	108.7	R82 E95 E99	R82-H97 PolarHBondContact NH1-O 3.01Å; E95-H97 PolarHBondContact O-N 3.36Å; H97-E99 PolarHBondContact O-N 3.14Å
98	A	76	Confident	79.5	Confident	76 Å²	76	113.3 Å²	113.3	63%	0.628	54%	0.542	S	S	*	.	S	Bend	trans	-61.2	-34.7	-177.4	0	0	0	0	0	112.2
99	E	85.9	Confident	80	Confident	162 Å²	162	105.2 Å²	105.2	76%	0.757	51%	0.512	S	S	*	.	S	Bend	trans	-93.2	149	-177.7	-58.6	-170.7	160.9	0	0	111.4	R82 H97	R82-E99 PolarHBondContact NH2-O 3.3Å; H97-E99 PolarHBondContact O-N 3.14Å
100	L	88.6	Confident	80.7	Confident	22 Å²	22	100.2 Å²	100.2	12%	0.115	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-78.3	133.2	172.1	-72.1	167.9	0	0	0	109.3	R75 A78 Y79 E104 I105	R75-L100 HydrophobicContact CB-CD1 3.98Å; R75-L100 HydrophobicContact CG-CD1 3.93Å; A78-L100 HydrophobicContact CB-CD1 3.82Å; A78-L100 HydrophobicContact CB-CD2 3.67Å; A78-L100 HydrophobicContact CB-CG 4.36Å; Y79-L100 HydrophobicContact CD1-CD2 3.87Å; Y79-L100 HydrophobicContact CD1-CG 4.29Å; Y79-L100 HydrophobicContact CD2-CD1 3.92Å; Y79-L100 HydrophobicContact CD2-CG 4.47Å; Y79-L100 HydrophobicContact CE1-CD1 4.29Å; Y79-L100 HydrophobicContact CE1-CD2 3.85Å; Y79-L100 HydrophobicContact CE1-CG 3.84Å; Y79-L100 HydrophobicContact CE2-CD1 3.58Å; Y79-L100 HydrophobicContact CE2-CG 4.03Å; Y79-L100 HydrophobicContact CG-CD1 4.4Å; Y79-L100 HydrophobicContact CG-CD2 4.23Å; L100-E104 HydrophobicContact CD2-CB 4.39Å; L100-I105 HydrophobicContact CB-CD1 4.36Å; L100-I105 HydrophobicContact CB-CG1 4.26Å
101	D	90	Very high	82	Confident	74 Å²	74	90 Å²	90	40%	0.396	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-80.3	166.2	172.3	77.5	46.9	0	0	0	111.6	T103 E104 I105	D101-T103 VanDerWaalsContact C-N 3.29Å; D101-T103 PolarHBondContact O-N 3.27Å; D101-T103 VanDerWaalsContact OD1-CA 3.22Å; D101-T103 WeakPolarHBondContact OD1-CA 3.47Å; D101-T103 VanDerWaalsContact OD1-CB 3.3Å; D101-T103 WeakPolarHBondContact OD1-CB 3.36Å; D101-T103 PolarHBondContact OD1-N 2.86Å; D101-T103 PolarHBondContact OD1-OG1 3.05Å; D101-T103 PolarHBondContact OD2-OG1 3.36Å; D101-E104 PolarHBondContact N-OE2 2.92Å; D101-E104 PolarHBondContact O-N 2.89Å; D101-E104 PolarHBondContact OD1-N 3.42Å; D101-I105 WeakPolarHBondContact O-CG1 3.32Å; D101-I105 PolarHBondContact O-N 2.9Å
102	V	92.6	Very high	83.6	Confident	107 Å²	107	82.1 Å²	82.1	65%	0.648	42%	0.423	S	S	*	.	H	α-helix	trans	-63.7	-36.8	-179.6	179.6	0	0	0	0	111.3	E104 I105 D106	V102-E104 PolarHBondContact O-N 2.96Å; V102-I105 PolarHBondContact O-N 3.12Å; V102-D106 WeakPolarHBondContact O-CB 3.5Å; V102-D106 PolarHBondContact O-N 3.09Å
103	T	92.9	Very high	85.4	Confident	86 Å²	86	72.4 Å²	72.4	53%	0.528	38%	0.38	S	S	.	.	H	α-helix	trans	-68.1	-35.6	-179.2	75.2	0	0	0	0	112	D101 D106 N107	D101-T103 VanDerWaalsContact C-N 3.29Å; D101-T103 PolarHBondContact O-N 3.27Å; D101-T103 VanDerWaalsContact OD1-CA 3.22Å; D101-T103 WeakPolarHBondContact OD1-CA 3.47Å; D101-T103 VanDerWaalsContact OD1-CB 3.3Å; D101-T103 WeakPolarHBondContact OD1-CB 3.36Å; D101-T103 PolarHBondContact OD1-N 2.86Å; D101-T103 PolarHBondContact OD1-OG1 3.05Å; D101-T103 PolarHBondContact OD2-OG1 3.36Å; T103-D106 PolarHBondContact O-N 3Å; T103-N107 WeakPolarHBondContact O-CB 3.5Å; T103-N107 PolarHBondContact O-N 3.33Å; T103-N107 PolarHBondContact O-ND2 2.91Å
104	E	93.8	Very high	87.2	Confident	31 Å²	31	72.9 Å²	72.9	15%	0.145	37%	0.37	C	S	.	.	H	α-helix	trans	-67.7	-40.8	174.7	-71.6	179.3	106.9	0	0	111.3	A78 R82 L100 D101 V102 A108	A78-E104 HydrophobicContact CB-CB 4.37Å; R82-E104 IonicContact CZ-OE1 3.8Å; R82-E104 IonicContact CZ-OE2 2.87Å; R82-E104 IonicContact NE-OE1 3.66Å; R82-E104 PolarHBondContact NE-OE1 3.48Å; R82-E104 IonicContact NE-OE2 3.93Å; R82-E104 IonicContact NH2-OE1 3.59Å; R82-E104 PolarHBondContact NH2-OE1 2.85Å; R82-E104 IonicContact NH2-OE2 2.83Å; R82-E104 PolarHBondContact NH2-OE2 3.05Å; L100-E104 HydrophobicContact CD2-CB 4.39Å; D101-E104 PolarHBondContact N-OE2 2.92Å; D101-E104 PolarHBondContact O-N 2.89Å; D101-E104 PolarHBondContact OD1-N 3.42Å; V102-E104 PolarHBondContact O-N 2.96Å; E104-A108 WeakPolarHBondContact O-CB 3.47Å; E104-A108 PolarHBondContact O-N 2.88Å
105	I	95.3	Very high	88.8	Confident	55 Å²	55	70.4 Å²	70.4	28%	0.282	35%	0.354	S	S	.	.	H	α-helix	trans	-62.8	-47.4	174.6	-72.1	174.1	0	0	0	110.3	I74 L100 D101 V102 A108 F109	I74-I105 HydrophobicContact CG2-CB 4.46Å; I74-I105 HydrophobicContact CG2-CG2 3.8Å; I74-I105 WeakPolarHBondContact CG2-O 3.35Å; L100-I105 HydrophobicContact CB-CD1 4.36Å; L100-I105 HydrophobicContact CB-CG1 4.26Å; D101-I105 WeakPolarHBondContact O-CG1 3.32Å; D101-I105 PolarHBondContact O-N 2.9Å; V102-I105 PolarHBondContact O-N 3.12Å; I105-A108 PolarHBondContact O-N 3.42Å; I105-F109 PolarHBondContact O-N 3.37Å
106	D	94.3	Very high	90.6	Very high	89 Å²	89	65.4 Å²	65.4	48%	0.476	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-46.5	178.6	-78.5	-16.6	0	0	0	111.2	V102 T103 A108 F109 V110	V102-D106 WeakPolarHBondContact O-CB 3.5Å; V102-D106 PolarHBondContact O-N 3.09Å; T103-D106 PolarHBondContact O-N 3Å; D106-A108 VanDerWaalsContact C-N 3.3Å; D106-A108 PolarHBondContact O-N 3.23Å; D106-F109 PolarHBondContact O-N 2.96Å; D106-F109 VanDerWaalsContact O-N 3.13Å; D106-V110 VanDerWaalsContact O-CG2 3.26Å; D106-V110 WeakPolarHBondContact O-CG2 3.35Å; D106-V110 PolarHBondContact O-N 3.48Å
107	N	95.2	Very high	92.2	Very high	85 Å²	85	55.9 Å²	55.9	46%	0.455	29%	0.293	S	S	.	.	H	α-helix	trans	-59.7	-41.7	176.7	-75.8	-33.4	0	0	0	111.7	T103 V110 I111	T103-N107 WeakPolarHBondContact O-CB 3.5Å; T103-N107 PolarHBondContact O-N 3.33Å; T103-N107 PolarHBondContact O-ND2 2.91Å; N107-V110 PolarHBondContact O-N 3.32Å; N107-I111 VanDerWaalsContact O-CG1 3.28Å; N107-I111 WeakPolarHBondContact O-CG1 3.35Å; N107-I111 PolarHBondContact O-N 2.89Å
108	A	96	Very high	93.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.3	-42.6	175.3	0	0	0	0	0	111.9	I74 M77 A78 E104 I105 D106 I111 L112	I74-A108 HydrophobicContact CG2-CB 4.18Å; M77-A108 HydrophobicContact CB-CB 3.87Å; A78-A108 HydrophobicContact CB-CB 3.76Å; E104-A108 WeakPolarHBondContact O-CB 3.47Å; E104-A108 PolarHBondContact O-N 2.88Å; I105-A108 PolarHBondContact O-N 3.42Å; D106-A108 VanDerWaalsContact C-N 3.3Å; D106-A108 PolarHBondContact O-N 3.23Å; A108-I111 PolarHBondContact O-N 3.43Å; A108-L112 WeakPolarHBondContact O-CG 3.24Å; A108-L112 PolarHBondContact O-N 3.38Å
109	F	95.7	Very high	94.2	Very high	35 Å²	35	52.4 Å²	52.4	15%	0.154	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-43.3	175.7	-175.8	-107.8	0	0	0	112.1	I74 I105 D106 I111 L112 V113 I184 Y208	I74-F109 HydrophobicContact CD1-CB 4.41Å; I74-F109 HydrophobicContact CD1-CD2 3.67Å; I74-F109 HydrophobicContact CD1-CE2 4.41Å; I74-F109 HydrophobicContact CD1-CG 4.41Å; I74-F109 HydrophobicContact CG1-CD2 4.12Å; I105-F109 PolarHBondContact O-N 3.37Å; D106-F109 PolarHBondContact O-N 2.96Å; D106-F109 VanDerWaalsContact O-N 3.13Å; F109-I111 VanDerWaalsContact C-N 3.31Å; F109-I111 PolarHBondContact O-N 3.22Å; F109-L112 WeakPolarHBondContact O-CB 3.45Å; F109-L112 PolarHBondContact O-N 2.95Å; F109-L112 VanDerWaalsContact O-N 3.15Å; F109-V113 HydrophobicContact CD1-CG2 4.1Å; F109-V113 HydrophobicContact CE1-CG2 3.66Å; F109-V113 HydrophobicContact CE2-CG2 4.2Å; F109-V113 HydrophobicContact CZ-CG2 3.71Å; F109-V113 WeakPolarHBondContact O-CG2 3.37Å; F109-V113 PolarHBondContact O-N 3.18Å; F109-I184 HydrophobicContact CE2-CD1 4.07Å; F109-I184 HydrophobicContact CE2-CG1 4.48Å; F109-I184 HydrophobicContact CZ-CD1 3.99Å; F109-Y208 HydrophobicContact CE1-CE1 4.04Å; F109-Y208 WeakPolarHBondContact CE1-OH 3.32Å; F109-Y208 AromaticContact CZ-CE1 3.85Å; F109-Y208 HydrophobicContact CZ-CE1 3.85Å; F109-Y208 AromaticContact CZ-CZ 3.85Å; F109-Y208 WeakPolarHBondContact CZ-OH 3.27Å
110	V	96.2	Very high	94.6	Very high	14 Å²	14	47 Å²	47	9%	0.085	25%	0.249	C	C	.	.	H	α-helix	trans	-57.9	-42.6	175.4	168.2	0	0	0	0	111.3	D106 N107 L112 V113 R114 R150 I152	D106-V110 VanDerWaalsContact O-CG2 3.26Å; D106-V110 WeakPolarHBondContact O-CG2 3.35Å; D106-V110 PolarHBondContact O-N 3.48Å; N107-V110 PolarHBondContact O-N 3.32Å; V110-L112 PolarHBondContact O-N 3.36Å; V110-V113 PolarHBondContact O-N 3.15Å; V110-R114 HydrophobicContact CG1-CG 4.28Å; V110-R114 WeakPolarHBondContact O-CB 3.45Å; V110-R114 VanDerWaalsContact O-CG 3.28Å; V110-R114 WeakPolarHBondContact O-CG 3.38Å; V110-R114 PolarHBondContact O-N 3.38Å; V110-R150 HydrophobicContact CG1-CB 4.23Å; V110-I152 HydrophobicContact CB-CD1 4.22Å; V110-I152 HydrophobicContact CG1-CD1 3.82Å; V110-I152 HydrophobicContact CG1-CG1 4.14Å; V110-I152 HydrophobicContact CG2-CD1 3.87Å
111	I	95.7	Very high	95	Very high	48 Å²	48	46.7 Å²	46.7	25%	0.246	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-46.7	176.2	-70.6	163.9	0	0	0	110.8	N81 N107 A108 F109 R114 K115	N81-I111 HydrophobicContact CB-CD1 4.48Å; N107-I111 VanDerWaalsContact O-CG1 3.28Å; N107-I111 WeakPolarHBondContact O-CG1 3.35Å; N107-I111 PolarHBondContact O-N 2.89Å; A108-I111 PolarHBondContact O-N 3.43Å; F109-I111 VanDerWaalsContact C-N 3.31Å; F109-I111 PolarHBondContact O-N 3.22Å; I111-R114 PolarHBondContact O-N 3.38Å; I111-K115 WeakPolarHBondContact O-CB 3.38Å; I111-K115 PolarHBondContact O-N 2.98Å
112	L	97	Very high	95.2	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.8	-44.9	178.8	-67.9	170	0	0	0	111.7	I60 L64 V73 I74 M77 A108 F109 V110 K115 A116 L180	I60-L112 HydrophobicContact CG2-CD2 3.67Å; L64-L112 HydrophobicContact CD2-CD2 4.38Å; L64-L112 HydrophobicContact CG-CD2 4.47Å; V73-L112 HydrophobicContact CG1-CD1 3.91Å; V73-L112 HydrophobicContact CG1-CD2 4.25Å; I74-L112 HydrophobicContact CG1-CD1 4.06Å; M77-L112 HydrophobicContact CG-CD1 4.34Å; M77-L112 HydrophobicContact CG-CD2 3.74Å; M77-L112 HydrophobicContact CG-CG 4.08Å; A108-L112 WeakPolarHBondContact O-CG 3.24Å; A108-L112 PolarHBondContact O-N 3.38Å; F109-L112 WeakPolarHBondContact O-CB 3.45Å; F109-L112 PolarHBondContact O-N 2.95Å; F109-L112 VanDerWaalsContact O-N 3.15Å; V110-L112 PolarHBondContact O-N 3.36Å; L112-K115 PolarHBondContact O-N 3.29Å; L112-A116 PolarHBondContact O-N 3.4Å; L112-L180 HydrophobicContact CB-CD1 4.24Å; L112-L180 HydrophobicContact CB-CD2 4.04Å
113	V	97	Very high	95.3	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-48.5	177.9	171.5	0	0	0	0	110.9	F109 V110 K115 A116 Q117 I152 V172 L180	F109-V113 HydrophobicContact CD1-CG2 4.1Å; F109-V113 HydrophobicContact CE1-CG2 3.66Å; F109-V113 HydrophobicContact CE2-CG2 4.2Å; F109-V113 HydrophobicContact CZ-CG2 3.71Å; F109-V113 WeakPolarHBondContact O-CG2 3.37Å; F109-V113 PolarHBondContact O-N 3.18Å; V110-V113 PolarHBondContact O-N 3.15Å; V113-K115 PolarHBondContact O-N 3.35Å; V113-A116 PolarHBondContact O-N 3.38Å; V113-Q117 HydrophobicContact CG1-CG 4.32Å; V113-Q117 WeakPolarHBondContact O-CB 3.34Å; V113-Q117 WeakPolarHBondContact O-CG 3.47Å; V113-Q117 PolarHBondContact O-N 2.89Å; V113-I152 HydrophobicContact CG1-CG2 3.65Å; V113-V172 HydrophobicContact CG1-CG1 3.58Å; V113-L180 HydrophobicContact CG2-CD2 4.04Å
114	R	96.2	Very high	95.4	Very high	93 Å²	93	46.4 Å²	46.4	35%	0.351	23%	0.234	S	C	.	.	H	α-helix	trans	-57.8	-41.9	177.1	-75.3	176.1	64.9	-169.3	-2.2	110.7	V110 I111 Q117 N118 I152	V110-R114 HydrophobicContact CG1-CG 4.28Å; V110-R114 WeakPolarHBondContact O-CB 3.45Å; V110-R114 VanDerWaalsContact O-CG 3.28Å; V110-R114 WeakPolarHBondContact O-CG 3.38Å; V110-R114 PolarHBondContact O-N 3.38Å; I111-R114 PolarHBondContact O-N 3.38Å; R114-Q117 PolarHBondContact O-N 3.22Å; R114-N118 WeakPolarHBondContact O-CB 3.41Å; R114-N118 PolarHBondContact O-N 2.9Å; R114-N118 PolarHBondContact O-ND2 2.93Å; R114-I152 HydrophobicContact CG-CG1 4.03Å
115	K	95	Very high	95.5	Very high	65 Å²	65	45 Å²	45	28%	0.283	23%	0.227	S	C	.	.	H	α-helix	trans	-61.3	-50.6	178.1	-174.1	62.1	173.2	-177	0	111.5	D58 I60 I111 L112 V113 Q117 N118 Q119	D58-K115 VanDerWaalsContact CG-CE 3.49Å; D58-K115 IonicContact OD1-NZ 3.86Å; D58-K115 WeakPolarHBondContact OD2-CE 3.48Å; D58-K115 IonicContact OD2-NZ 2.59Å; D58-K115 PolarHBondContact OD2-NZ 2.94Å; I60-K115 HydrophobicContact CB-CG 4.38Å; I60-K115 HydrophobicContact CD1-CD 4.27Å; I60-K115 HydrophobicContact CD1-CG 4.11Å; I60-K115 HydrophobicContact CG2-CG 4.11Å; I111-K115 WeakPolarHBondContact O-CB 3.38Å; I111-K115 PolarHBondContact O-N 2.98Å; L112-K115 PolarHBondContact O-N 3.29Å; V113-K115 PolarHBondContact O-N 3.35Å; K115-Q117 VanDerWaalsContact C-N 3.31Å; K115-Q117 PolarHBondContact O-N 2.95Å; K115-N118 PolarHBondContact O-N 2.99Å; K115-Q119 WeakPolarHBondContact O-CG 3.39Å; K115-Q119 PolarHBondContact O-N 3.43Å
116	A	96.1	Very high	95.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.5	-42.1	178	0	0	0	0	0	112.3	L112 V113 Q119 A120 P175 H178 L180	L112-A116 PolarHBondContact O-N 3.4Å; V113-A116 PolarHBondContact O-N 3.38Å; A116-Q119 PolarHBondContact O-N 3.34Å; A116-A120 WeakPolarHBondContact O-CB 3.3Å; A116-A120 PolarHBondContact O-N 3.28Å; A116-A120 VanDerWaalsContact O-N 3.08Å; A116-P175 HydrophobicContact CB-CG 4.11Å; A116-H178 WeakPolarHBondContact CA-NE2 3.49Å; A116-H178 WeakPolarHBondContact CB-CE1 3.44Å; A116-H178 WeakPolarHBondContact CB-NE2 3.27Å; A116-L180 HydrophobicContact CB-CD2 3.97Å
117	Q	96.6	Very high	95.5	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.009	22%	0.216	C	C	.	.	H	α-helix	trans	-68.4	-40.9	177.8	-72.1	177.4	-18.9	0	0	112.5	V113 R114 K115 Q119 A120 Y121 L153 I173	V113-Q117 HydrophobicContact CG1-CG 4.32Å; V113-Q117 WeakPolarHBondContact O-CB 3.34Å; V113-Q117 WeakPolarHBondContact O-CG 3.47Å; V113-Q117 PolarHBondContact O-N 2.89Å; R114-Q117 PolarHBondContact O-N 3.22Å; K115-Q117 VanDerWaalsContact C-N 3.31Å; K115-Q117 PolarHBondContact O-N 2.95Å; Q117-Q119 VanDerWaalsContact C-N 3.32Å; Q117-Q119 PolarHBondContact O-N 2.99Å; Q117-A120 PolarHBondContact O-N 3.27Å; Q117-Y121 CarbonylContact O-C 3.49Å; Q117-Y121 VanDerWaalsContact O-CA 3.31Å; Q117-Y121 WeakPolarHBondContact O-CA 3.49Å; Q117-Y121 WeakPolarHBondContact O-CB 3.47Å; Q117-Y121 PolarHBondContact O-N 2.71Å; Q117-L153 HydrophobicContact CG-CB 4.38Å; Q117-L153 PolarHBondContact NE2-O 3.36Å; Q117-I173 PolarHBondContact NE2-O 3.44Å
118	N	94.9	Very high	95.4	Very high	50 Å²	50	39.5 Å²	39.5	27%	0.267	20%	0.203	S	C	.	.	H	α-helix	trans	-66.9	-34	176	-74.9	-70.8	0	0	0	111.7	R114 K115 S122 V125 R129	R114-N118 WeakPolarHBondContact O-CB 3.41Å; R114-N118 PolarHBondContact O-N 2.9Å; R114-N118 PolarHBondContact O-ND2 2.93Å; K115-N118 PolarHBondContact O-N 2.99Å; N118-S122 WeakPolarHBondContact O-CA 3.34Å; N118-S122 WeakPolarHBondContact O-CB 3.38Å; N118-S122 PolarHBondContact O-N 2.89Å; N118-V125 WeakPolarHBondContact OD1-CG1 3.47Å; N118-R129 PolarHBondContact OD1-NH2 3.43Å
119	Q	93.6	Very high	95.4	Very high	80 Å²	80	44.9 Å²	44.9	37%	0.374	22%	0.223	S	C	.	.	H	α-helix	trans	-69	-41.8	176.3	-75.6	169.7	-28.9	0	0	112.2	K115 A116 Q117 H178	K115-Q119 WeakPolarHBondContact O-CG 3.39Å; K115-Q119 PolarHBondContact O-N 3.43Å; A116-Q119 PolarHBondContact O-N 3.34Å; Q117-Q119 VanDerWaalsContact C-N 3.32Å; Q117-Q119 PolarHBondContact O-N 2.99Å; Q119-H178 PolarHBondContact OE1-NE2 3.42Å
120	A	94.7	Very high	95.3	Very high	48 Å²	48	51.1 Å²	51.1	40%	0.397	25%	0.246	S	C	.	.	H	α-helix	trans	-90.7	-29.8	-175	0	0	0	0	0	114.8	A116 Q117 P175	A116-A120 WeakPolarHBondContact O-CB 3.3Å; A116-A120 PolarHBondContact O-N 3.28Å; A116-A120 VanDerWaalsContact O-N 3.08Å; Q117-A120 PolarHBondContact O-N 3.27Å; A120-P175 HydrophobicContact CB-CB 3.36Å; A120-P175 HydrophobicContact CB-CG 3.87Å
121	Y	95.5	Very high	95	Very high	16 Å²	16	59.3 Å²	59.3	6%	0.063	28%	0.283	C	S	.	.	S	Bend	trans	-131.4	37.3	-170.4	-50.8	-56.7	0	0	0	111.3	Q117 K123 E124 V125 L140 L153 I173 P175	Q117-Y121 CarbonylContact O-C 3.49Å; Q117-Y121 VanDerWaalsContact O-CA 3.31Å; Q117-Y121 WeakPolarHBondContact O-CA 3.49Å; Q117-Y121 WeakPolarHBondContact O-CB 3.47Å; Q117-Y121 PolarHBondContact O-N 2.71Å; Y121-K123 VanDerWaalsContact C-N 3.26Å; Y121-K123 PolarHBondContact O-N 3.28Å; Y121-E124 VanDerWaalsContact CA-OE2 3.29Å; Y121-E124 WeakPolarHBondContact CA-OE2 3.45Å; Y121-E124 PolarHBondContact O-N 2.86Å; Y121-V125 WeakPolarHBondContact O-CG2 3.28Å; Y121-V125 PolarHBondContact O-N 3.06Å; Y121-L140 HydrophobicContact CD1-CD1 3.69Å; Y121-L140 HydrophobicContact CD1-CG 4.29Å; Y121-L140 HydrophobicContact CD2-CD1 4.03Å; Y121-L140 HydrophobicContact CE1-CD1 3.8Å; Y121-L140 HydrophobicContact CE1-CD2 4.15Å; Y121-L140 HydrophobicContact CE1-CG 4.09Å; Y121-L140 HydrophobicContact CE2-CD1 4.13Å; Y121-L140 HydrophobicContact CG-CD1 3.81Å; Y121-L153 HydrophobicContact CD2-CD2 4.11Å; Y121-L153 HydrophobicContact CG-CD2 4.41Å; Y121-I173 HydrophobicContact CE2-CG2 3.82Å; Y121-P175 HydrophobicContact CE2-CB 4Å; Y121-P175 WeakPolarHBondContact OH-CA 3.34Å
122	S	94.3	Very high	94.8	Very high	60 Å²	60	64.8 Å²	64.8	42%	0.42	30%	0.301	S	S	.	.	H	α-helix	trans	-53.5	-42.3	-177.2	56.9	0	0	0	0	112.9	N118 T126	N118-S122 WeakPolarHBondContact O-CA 3.34Å; N118-S122 WeakPolarHBondContact O-CB 3.38Å; N118-S122 PolarHBondContact O-N 2.89Å; S122-T126 VanDerWaalsContact O-CB 3.3Å; S122-T126 WeakPolarHBondContact O-CB 3.23Å; S122-T126 PolarHBondContact O-N 3.15Å; S122-T126 PolarHBondContact O-OG1 3.47Å
123	K	94.7	Very high	94.4	Very high	175 Å²	175	73.6 Å²	73.6	76%	0.761	34%	0.342	S	S	*	.	H	α-helix	trans	-64.6	-47.8	-179.8	-65.3	-177.1	-179.2	-178.8	0	110.7	Y121 T126 A127	Y121-K123 VanDerWaalsContact C-N 3.26Å; Y121-K123 PolarHBondContact O-N 3.28Å; K123-T126 PolarHBondContact O-N 2.91Å; K123-A127 WeakPolarHBondContact O-CB 3.28Å; K123-A127 PolarHBondContact O-N 3.18Å
124	E	95.4	Very high	94.1	Very high	27 Å²	27	74.9 Å²	74.9	13%	0.126	35%	0.349	C	S	.	.	H	α-helix	trans	-63.9	-47.2	178.8	-66.9	84.8	170.6	0	0	112	Y121 T126 A127 L128 L134 S138	Y121-E124 VanDerWaalsContact CA-OE2 3.29Å; Y121-E124 WeakPolarHBondContact CA-OE2 3.45Å; Y121-E124 PolarHBondContact O-N 2.86Å; E124-T126 VanDerWaalsContact C-N 3.3Å; E124-T126 PolarHBondContact O-N 3.16Å; E124-A127 PolarHBondContact O-N 2.97Å; E124-L128 WeakPolarHBondContact O-CB 3.4Å; E124-L128 WeakPolarHBondContact O-CG 3.34Å; E124-L128 PolarHBondContact O-N 3.25Å; E124-L134 HydrophobicContact CB-CD2 3.5Å; E124-L134 VanDerWaalsContact CB-CD2 3.5Å; E124-L134 HydrophobicContact CG-CD2 3.41Å; E124-L134 VanDerWaalsContact CG-CD2 3.41Å; E124-S138 VanDerWaalsContact CG-OG 3.28Å; E124-S138 WeakPolarHBondContact CG-OG 3.39Å; E124-S138 PolarHBondContact OE1-OG 3.06Å
125	V	95.1	Very high	93.9	Very high	2 Å²	2	74 Å²	74	1%	0.012	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-40.6	178.5	174.7	0	0	0	0	110.8	N118 Y121 R129	N118-V125 WeakPolarHBondContact OD1-CG1 3.47Å; Y121-V125 WeakPolarHBondContact O-CG2 3.28Å; Y121-V125 PolarHBondContact O-N 3.06Å; V125-R129 WeakPolarHBondContact O-CB 3.41Å; V125-R129 WeakPolarHBondContact O-CG 3.41Å; V125-R129 PolarHBondContact O-N 3.02Å
126	T	95.3	Very high	93.6	Very high	57 Å²	57	74.8 Å²	74.8	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-67.6	-41.8	178.6	-56.5	0	0	0	0	111.9	S122 K123 E124 R130	S122-T126 VanDerWaalsContact O-CB 3.3Å; S122-T126 WeakPolarHBondContact O-CB 3.23Å; S122-T126 PolarHBondContact O-N 3.15Å; S122-T126 PolarHBondContact O-OG1 3.47Å; K123-T126 PolarHBondContact O-N 2.91Å; E124-T126 VanDerWaalsContact C-N 3.3Å; E124-T126 PolarHBondContact O-N 3.16Å; T126-R130 WeakPolarHBondContact O-CG 3.47Å; T126-R130 PolarHBondContact O-N 2.89Å
127	A	94.4	Very high	93.3	Very high	21 Å²	21	82 Å²	82	17%	0.174	41%	0.414	C	S	.	.	H	α-helix	trans	-60.9	-49	176.6	0	0	0	0	0	111.1	K123 E124 R129 R130 Q131 R132	K123-A127 WeakPolarHBondContact O-CB 3.28Å; K123-A127 PolarHBondContact O-N 3.18Å; E124-A127 PolarHBondContact O-N 2.97Å; A127-R129 PolarHBondContact O-N 3.49Å; A127-R130 CarbonylContact O-C 3.44Å; A127-R130 WeakPolarHBondContact O-CA 3.48Å; A127-R130 PolarHBondContact O-N 3.14Å; A127-R130 VanDerWaalsContact O-N 3.09Å; A127-Q131 PolarHBondContact O-N 3Å; A127-R132 HydrophobicContact CB-CB 4.47Å; A127-R132 PolarHBondContact O-N 3.35Å
128	L	94.5	Very high	93.1	Very high	35 Å²	35	82.5 Å²	82.5	18%	0.183	42%	0.418	C	S	.	.	H	α-helix	trans	-67.3	-37.8	-178.6	-68.7	170.3	0	0	0	112.9	E124 R130 Q131 L134 P145 L147 L153	E124-L128 WeakPolarHBondContact O-CB 3.4Å; E124-L128 WeakPolarHBondContact O-CG 3.34Å; E124-L128 PolarHBondContact O-N 3.25Å; L128-R130 PolarHBondContact O-N 3.4Å; L128-Q131 PolarHBondContact O-N 2.8Å; L128-L134 HydrophobicContact CD1-CD2 4.44Å; L128-L134 HydrophobicContact CD2-CD1 4.36Å; L128-L134 HydrophobicContact CD2-CG 4.42Å; L128-L134 HydrophobicContact CG-CD2 4.38Å; L128-P145 WeakPolarHBondContact CD1-O 3.41Å; L128-P145 WeakPolarHBondContact CD2-O 3.18Å; L128-L147 HydrophobicContact CB-CD1 3.87Å; L128-L147 HydrophobicContact CB-CG 4.02Å; L128-L153 HydrophobicContact CD1-CD1 3.26Å
129	R	94.4	Very high	92.8	Very high	113 Å²	113	84.6 Å²	84.6	43%	0.426	44%	0.436	S	S	.	.	H	α-helix	trans	-60.8	-31.1	172.3	-79.7	-171.4	-170.8	143.3	14.6	112.7	N118 V125 A127 Q131 L147	N118-R129 PolarHBondContact OD1-NH2 3.43Å; V125-R129 WeakPolarHBondContact O-CB 3.41Å; V125-R129 WeakPolarHBondContact O-CG 3.41Å; V125-R129 PolarHBondContact O-N 3.02Å; A127-R129 PolarHBondContact O-N 3.49Å; R129-Q131 VanDerWaalsContact C-N 3.27Å; R129-L147 HydrophobicContact CB-CD1 4.38Å; R129-L147 HydrophobicContact CG-CD1 3.52Å
130	R	94.1	Very high	92.8	Very high	165 Å²	165	80.8 Å²	80.8	62%	0.623	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	9.5	176.7	-67.1	177.4	176.8	175.9	-0.9	112.9	T126 A127 L128 R132	T126-R130 WeakPolarHBondContact O-CG 3.47Å; T126-R130 PolarHBondContact O-N 2.89Å; A127-R130 CarbonylContact O-C 3.44Å; A127-R130 WeakPolarHBondContact O-CA 3.48Å; A127-R130 PolarHBondContact O-N 3.14Å; A127-R130 VanDerWaalsContact O-N 3.09Å; L128-R130 PolarHBondContact O-N 3.4Å; R130-R132 HydrophobicContact CB-CG 4.14Å; R130-R132 PolarHBondContact O-N 2.88Å
131	Q	91	Very high	92.7	Very high	187 Å²	187	81.7 Å²	81.7	87%	0.874	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	37.9	-175.6	-61.1	-179	-17.2	0	0	112.9	A127 L128 R129	A127-Q131 PolarHBondContact O-N 3Å; L128-Q131 PolarHBondContact O-N 2.8Å; R129-Q131 VanDerWaalsContact C-N 3.27Å
132	R	90.8	Very high	92.4	Very high	162 Å²	162	90.3 Å²	90.3	61%	0.611	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-103.3	151.5	175.6	-64.1	-173.6	-177.1	-176	-2	110.9	A127 R130	A127-R132 HydrophobicContact CB-CB 4.47Å; A127-R132 PolarHBondContact O-N 3.35Å; R130-R132 HydrophobicContact CB-CG 4.14Å; R130-R132 PolarHBondContact O-N 2.88Å
133	E	88.8	Confident	92.4	Very high	186 Å²	186	88.7 Å²	88.7	87%	0.869	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-63.2	150.5	170.5	-64.7	-175	165	0	0	111.5
134	L	91.4	Very high	92.3	Very high	29 Å²	29	84.8 Å²	84.8	15%	0.152	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-74.7	146.3	176	-67.9	145.4	0	0	0	109.8	E124 L128 P145	E124-L134 HydrophobicContact CB-CD2 3.5Å; E124-L134 VanDerWaalsContact CB-CD2 3.5Å; E124-L134 HydrophobicContact CG-CD2 3.41Å; E124-L134 VanDerWaalsContact CG-CD2 3.41Å; L128-L134 HydrophobicContact CD1-CD2 4.44Å; L128-L134 HydrophobicContact CD2-CD1 4.36Å; L128-L134 HydrophobicContact CD2-CG 4.42Å; L128-L134 HydrophobicContact CG-CD2 4.38Å; L134-P145 VanDerWaalsContact CD1-CD 3.48Å; L134-P145 HydrophobicContact CD1-CG 3.42Å; L134-P145 VanDerWaalsContact CD1-CG 3.42Å
135	S	90.5	Very high	92.2	Very high	73 Å²	73	83.7 Å²	83.7	51%	0.51	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-57.3	142.5	171.3	175.5	0	0	0	0	110.8	D137 S138	S135-D137 PolarHBondContact O-N 2.97Å; S135-D137 VanDerWaalsContact O-N 3.09Å; S135-D137 PolarHBondContact OG-N 2.95Å; S135-S138 VanDerWaalsContact O-CB 3.28Å; S135-S138 WeakPolarHBondContact O-CB 3.35Å; S135-S138 PolarHBondContact O-N 3.32Å
136	A	89.2	Confident	92.2	Very high	82 Å²	82	87 Å²	87	68%	0.678	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-27.9	173.8	0	0	0	0	0	112.9	S138	A136-S138 VanDerWaalsContact C-N 3.3Å; A136-S138 PolarHBondContact O-N 2.88Å
137	D	90.8	Very high	92.2	Very high	153 Å²	153	85.9 Å²	85.9	82%	0.818	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-4.3	179.3	-58.8	-36	0	0	0	113.7	S135 S139	S135-D137 PolarHBondContact O-N 2.97Å; S135-D137 VanDerWaalsContact O-N 3.09Å; S135-D137 PolarHBondContact OG-N 2.95Å; D137-S139 PolarHBondContact O-N 2.85Å
138	S	90.9	Very high	92.1	Very high	12 Å²	12	86 Å²	86	8%	0.084	43%	0.43	C	S	.	.			trans	-65.4	128.5	-178.6	179.1	0	0	0	0	110.9	E124 S135 A136 L140 I141	E124-S138 VanDerWaalsContact CG-OG 3.28Å; E124-S138 WeakPolarHBondContact CG-OG 3.39Å; E124-S138 PolarHBondContact OE1-OG 3.06Å; S135-S138 VanDerWaalsContact O-CB 3.28Å; S135-S138 WeakPolarHBondContact O-CB 3.35Å; S135-S138 PolarHBondContact O-N 3.32Å; A136-S138 VanDerWaalsContact C-N 3.3Å; A136-S138 PolarHBondContact O-N 2.88Å; S138-L140 PolarHBondContact O-N 3.09Å; S138-L140 PolarHBondContact OG-N 2.97Å; S138-I141 WeakPolarHBondContact O-CG2 3.23Å; S138-I141 PolarHBondContact O-N 3.39Å; S138-I141 VanDerWaalsContact O-N 3.14Å
139	S	90.1	Very high	92	Very high	93 Å²	93	89.5 Å²	89.5	65%	0.65	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-16.5	175.5	69.4	0	0	0	0	113.9	D137	D137-S139 PolarHBondContact O-N 2.85Å
140	L	93	Very high	92	Very high	0 Å²	0	90 Å²	90	0%	0	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-5.5	-177.6	-56.7	-178.4	0	0	0	113.5	Y121 S138 K142 L143 P145 L153 I173 P211	Y121-L140 HydrophobicContact CD1-CD1 3.69Å; Y121-L140 HydrophobicContact CD1-CG 4.29Å; Y121-L140 HydrophobicContact CD2-CD1 4.03Å; Y121-L140 HydrophobicContact CE1-CD1 3.8Å; Y121-L140 HydrophobicContact CE1-CD2 4.15Å; Y121-L140 HydrophobicContact CE1-CG 4.09Å; Y121-L140 HydrophobicContact CE2-CD1 4.13Å; Y121-L140 HydrophobicContact CG-CD1 3.81Å; S138-L140 PolarHBondContact O-N 3.09Å; S138-L140 PolarHBondContact OG-N 2.97Å; L140-K142 PolarHBondContact O-N 3.19Å; L140-L143 HydrophobicContact CD2-CD1 4.01Å; L140-L143 WeakPolarHBondContact O-CB 3.5Å; L140-L143 PolarHBondContact O-N 3.24Å; L140-P145 HydrophobicContact CB-CG 4Å; L140-P145 WeakPolarHBondContact O-CD 3.43Å; L140-L153 HydrophobicContact CD1-CD2 3.56Å; L140-I173 HydrophobicContact CD1-CD1 4.39Å; L140-I173 HydrophobicContact CD1-CG2 4.08Å; L140-I173 HydrophobicContact CD2-CG2 4.04Å; L140-P211 HydrophobicContact CD2-CG 3.89Å
141	I	91.6	Very high	92	Very high	68 Å²	68	85.8 Å²	85.8	35%	0.349	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-53.5	-38.3	-171.1	-165.5	167.4	0	0	0	113.3	S138 L143 T144	S138-I141 WeakPolarHBondContact O-CG2 3.23Å; S138-I141 PolarHBondContact O-N 3.39Å; S138-I141 VanDerWaalsContact O-N 3.14Å; I141-L143 PolarHBondContact O-N 3.26Å; I141-T144 PolarHBondContact O-N 3.16Å
142	K	91.1	Very high	92.2	Very high	196 Å²	196	77.1 Å²	77.1	85%	0.852	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-67.4	-14.8	179.5	-64.3	-173.7	178.2	-176.8	0	114.5	L140 T144	L140-K142 PolarHBondContact O-N 3.19Å; K142-T144 VanDerWaalsContact C-N 3.35Å
143	L	92.6	Very high	92.5	Very high	27 Å²	27	69.4 Å²	69.4	14%	0.141	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-90	-6	176.7	-58.6	174.7	0	0	0	112.2	L140 I141 P145 V155 G156 G157 I173 W209	L140-L143 HydrophobicContact CD2-CD1 4.01Å; L140-L143 WeakPolarHBondContact O-CB 3.5Å; L140-L143 PolarHBondContact O-N 3.24Å; I141-L143 PolarHBondContact O-N 3.26Å; L143-P145 VanDerWaalsContact C-N 3.34Å; L143-V155 HydrophobicContact CB-CG1 4.32Å; L143-V155 HydrophobicContact CB-CG2 4.46Å; L143-V155 HydrophobicContact CD1-CG2 4.37Å; L143-G156 PolarHBondContact O-N 2.88Å; L143-G156 VanDerWaalsContact O-N 3.16Å; L143-G157 PolarHBondContact O-N 2.97Å; L143-I173 HydrophobicContact CD1-CD1 4.05Å; L143-W209 VanDerWaalsContact CD1-CD1 3.43Å; L143-W209 HydrophobicContact CD1-CG 4.48Å; L143-W209 HydrophobicContact CD2-CZ2 4.07Å
144	T	93	Very high	92.8	Very high	92 Å²	92	60.7 Å²	60.7	56%	0.564	34%	0.343	S	S	*	.			trans	46.5	55.9	-174.1	-36.6	0	0	0	0	110.8	I141 K142 G156	I141-T144 PolarHBondContact O-N 3.16Å; K142-T144 VanDerWaalsContact C-N 3.35Å; T144-G156 VanDerWaalsContact O-CA 3.23Å; T144-G156 WeakPolarHBondContact O-CA 3.28Å; T144-G156 PolarHBondContact O-N 3.46Å; T144-G156 VanDerWaalsContact O-N 3.15Å
145	P	94.4	Very high	93	Very high	5 Å²	5	60 Å²	60	3%	0.032	34%	0.34	C	S	.	.			trans	-70.7	145.7	-167.6	31.8	-36.2	0	0	0	110.9	L128 L134 L140 L143 L153 C154 I173	L128-P145 WeakPolarHBondContact CD1-O 3.41Å; L128-P145 WeakPolarHBondContact CD2-O 3.18Å; L134-P145 VanDerWaalsContact CD1-CD 3.48Å; L134-P145 HydrophobicContact CD1-CG 3.42Å; L134-P145 VanDerWaalsContact CD1-CG 3.42Å; L140-P145 HydrophobicContact CB-CG 4Å; L140-P145 WeakPolarHBondContact O-CD 3.43Å; L143-P145 VanDerWaalsContact C-N 3.34Å; P145-L153 HydrophobicContact CB-CD1 3.92Å; P145-L153 HydrophobicContact CB-CG 4.11Å; P145-C154 VanDerWaalsContact CA-O 3.24Å; P145-C154 WeakPolarHBondContact CA-O 3.2Å; P145-I173 HydrophobicContact CB-CD1 3.66Å
146	F	94.4	Very high	93	Very high	72 Å²	72	57.1 Å²	57.1	32%	0.316	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	165.5	178.6	74	-79.6	0	0	0	110.5	D148 L153 C154 V155 H170	F146-D148 HydrophobicContact CE2-CB 4.45Å; F146-L153 WeakPolarHBondContact O-CA 3.47Å; F146-C154 HydrophobicContact CD1-CB 4.43Å; F146-C154 HydrophobicContact CE1-CB 3.91Å; F146-C154 HydrophobicContact CZ-CB 4Å; F146-C154 PolarHBondContact N-O 3.13Å; F146-C154 PolarHBondContact O-N 2.85Å; F146-V155 WeakPolarHBondContact CE1-O 3.43Å; F146-H170 HydrophobicContact CE1-CB 4.01Å; F146-H170 AromaticContact CE1-CG 3.85Å; F146-H170 AromaticContact CE1-ND1 3.59Å; F146-H170 HydrophobicContact CZ-CB 3.93Å; F146-H170 AromaticContact CZ-CG 3.83Å; F146-H170 AromaticContact CZ-ND1 3.98Å
147	L	95.5	Very high	92.6	Very high	32 Å²	32	54.7 Å²	54.7	17%	0.168	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.6	174.1	-67.6	171.9	0	0	0	109.8	L128 R129 I152 L153	L128-L147 HydrophobicContact CB-CD1 3.87Å; L128-L147 HydrophobicContact CB-CG 4.02Å; R129-L147 HydrophobicContact CB-CD1 4.38Å; R129-L147 HydrophobicContact CG-CD1 3.52Å; L147-I152 WeakPolarHBondContact CA-O 3.35Å; L147-L153 HydrophobicContact CD2-CB 4.35Å; L147-L153 HydrophobicContact CD2-CD1 4.14Å
148	D	92.7	Very high	92.4	Very high	25 Å²	25	59.2 Å²	59.2	13%	0.134	31%	0.311	C	S	.	.			trans	-73.6	179.4	174.5	81.5	-13.2	0	0	0	112.2	F146 R150 Q151 I152	F146-D148 HydrophobicContact CE2-CB 4.45Å; D148-R150 PolarHBondContact O-N 2.83Å; D148-R150 VanDerWaalsContact O-N 3.12Å; D148-R150 VanDerWaalsContact OD1-C 3.28Å; D148-R150 VanDerWaalsContact OD1-CA 3.3Å; D148-R150 WeakPolarHBondContact OD1-CA 3.43Å; D148-R150 WeakPolarHBondContact OD1-CB 3.44Å; D148-R150 PolarHBondContact OD1-N 3.37Å; D148-R150 IonicContact OD2-CZ 3.67Å; D148-R150 IonicContact OD2-NE 3.41Å; D148-R150 PolarHBondContact OD2-NE 3.42Å; D148-R150 IonicContact OD2-NH2 2.97Å; D148-R150 PolarHBondContact OD2-NH2 2.98Å; D148-Q151 PolarHBondContact O-N 3.26Å; D148-Q151 PolarHBondContact OD1-N 3.45Å; D148-I152 PolarHBondContact N-O 3.11Å; D148-I152 WeakPolarHBondContact OD1-CB 3.42Å; D148-I152 PolarHBondContact OD1-N 3.06Å
149	A	92.2	Very high	92.3	Very high	108 Å²	108	63.2 Å²	63.2	89%	0.893	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.7	177.2	0	0	0	0	0	113.4	Q151	A149-Q151 VanDerWaalsContact C-N 3.3Å
150	R	93.1	Very high	92	Very high	123 Å²	123	64.6 Å²	64.6	46%	0.464	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	6.3	177.4	-59.8	171.9	-65	-166.6	-5	112.5	V110 D148 I152	V110-R150 HydrophobicContact CG1-CB 4.23Å; D148-R150 PolarHBondContact O-N 2.83Å; D148-R150 VanDerWaalsContact O-N 3.12Å; D148-R150 VanDerWaalsContact OD1-C 3.28Å; D148-R150 VanDerWaalsContact OD1-CA 3.3Å; D148-R150 WeakPolarHBondContact OD1-CA 3.43Å; D148-R150 WeakPolarHBondContact OD1-CB 3.44Å; D148-R150 PolarHBondContact OD1-N 3.37Å; D148-R150 IonicContact OD2-CZ 3.67Å; D148-R150 IonicContact OD2-NE 3.41Å; D148-R150 PolarHBondContact OD2-NE 3.42Å; D148-R150 IonicContact OD2-NH2 2.97Å; D148-R150 PolarHBondContact OD2-NH2 2.98Å; R150-I152 VanDerWaalsContact C-N 3.3Å; R150-I152 HydrophobicContact CB-CD1 4Å; R150-I152 HydrophobicContact CB-CG1 4.1Å; R150-I152 PolarHBondContact O-N 3.32Å
151	Q	94.2	Very high	91.7	Very high	77 Å²	77	71.9 Å²	71.9	36%	0.36	37%	0.366	S	S	.	.	S	Bend	trans	62	34.9	-177.2	-60.9	-69.8	-57.8	0	0	113.2	D148 A149	D148-Q151 PolarHBondContact O-N 3.26Å; D148-Q151 PolarHBondContact OD1-N 3.45Å; A149-Q151 VanDerWaalsContact C-N 3.3Å
152	I	96	Very high	91.6	Very high	4 Å²	4	69.7 Å²	69.7	2%	0.021	36%	0.358	C	S	.	.			trans	-101.8	137.8	175.4	-59.9	173.6	0	0	0	109.1	V110 V113 R114 L147 D148 R150 C154 V172	V110-I152 HydrophobicContact CB-CD1 4.22Å; V110-I152 HydrophobicContact CG1-CD1 3.82Å; V110-I152 HydrophobicContact CG1-CG1 4.14Å; V110-I152 HydrophobicContact CG2-CD1 3.87Å; V113-I152 HydrophobicContact CG1-CG2 3.65Å; R114-I152 HydrophobicContact CG-CG1 4.03Å; L147-I152 WeakPolarHBondContact CA-O 3.35Å; D148-I152 PolarHBondContact N-O 3.11Å; D148-I152 WeakPolarHBondContact OD1-CB 3.42Å; D148-I152 PolarHBondContact OD1-N 3.06Å; R150-I152 VanDerWaalsContact C-N 3.3Å; R150-I152 HydrophobicContact CB-CD1 4Å; R150-I152 HydrophobicContact CB-CG1 4.1Å; R150-I152 PolarHBondContact O-N 3.32Å; I152-C154 PolarHBondContact O-N 3.5Å; I152-V172 HydrophobicContact CG2-CB 4.32Å; I152-V172 HydrophobicContact CG2-CG1 3.6Å; I152-V172 HydrophobicContact CG2-CG2 3.93Å
153	L	96.3	Very high	91.6	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	116.2	175.3	-164	72.1	0	0	0	110.4	Q117 Y121 L128 L140 P145 F146 L147 I173	Q117-L153 HydrophobicContact CG-CB 4.38Å; Q117-L153 PolarHBondContact NE2-O 3.36Å; Y121-L153 HydrophobicContact CD2-CD2 4.11Å; Y121-L153 HydrophobicContact CG-CD2 4.41Å; L128-L153 HydrophobicContact CD1-CD1 3.26Å; L140-L153 HydrophobicContact CD1-CD2 3.56Å; P145-L153 HydrophobicContact CB-CD1 3.92Å; P145-L153 HydrophobicContact CB-CG 4.11Å; F146-L153 WeakPolarHBondContact O-CA 3.47Å; L147-L153 HydrophobicContact CD2-CB 4.35Å; L147-L153 HydrophobicContact CD2-CD1 4.14Å; L153-I173 HydrophobicContact CD2-CB 4.38Å; L153-I173 HydrophobicContact CD2-CD1 4.28Å; L153-I173 HydrophobicContact CD2-CG2 4.49Å; L153-I173 HydrophobicContact CG-CD1 4.18Å; L153-I173 PolarHBondContact O-N 3.36Å
154	C	95.9	Very high	91.4	Very high	4 Å²	4	68.7 Å²	68.7	3%	0.027	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	159.3	-179.9	-65	0	0	0	0	110.9	P145 F146 I152 G156 H170	P145-C154 VanDerWaalsContact CA-O 3.24Å; P145-C154 WeakPolarHBondContact CA-O 3.2Å; F146-C154 HydrophobicContact CD1-CB 4.43Å; F146-C154 HydrophobicContact CE1-CB 3.91Å; F146-C154 HydrophobicContact CZ-CB 4Å; F146-C154 PolarHBondContact N-O 3.13Å; F146-C154 PolarHBondContact O-N 2.85Å; I152-C154 PolarHBondContact O-N 3.5Å; C154-G156 PolarHBondContact O-N 3.21Å; C154-H170 HydrophobicContact CB-CB 4.34Å
155	V	94.9	Very high	91.3	Very high	13 Å²	13	68.6 Å²	68.6	8%	0.079	37%	0.37	C	S	.	.			trans	-73.9	120.8	173.5	175.1	0	0	0	0	109.6	L143 F146 H170 P171 I173 W209	L143-V155 HydrophobicContact CB-CG1 4.32Å; L143-V155 HydrophobicContact CB-CG2 4.46Å; L143-V155 HydrophobicContact CD1-CG2 4.37Å; F146-V155 WeakPolarHBondContact CE1-O 3.43Å; V155-H170 VanDerWaalsContact O-CA 3.31Å; V155-H170 WeakPolarHBondContact O-CA 3.24Å; V155-H170 WeakPolarHBondContact O-CB 3.43Å; V155-H170 PolarHBondContact O-ND1 3.43Å; V155-P171 HydrophobicContact CB-CG 4.11Å; V155-P171 HydrophobicContact CG2-CG 4.04Å; V155-P171 PolarHBondContact N-O 2.86Å; V155-I173 HydrophobicContact CG2-CD1 3.92Å; V155-I173 HydrophobicContact CG2-CG1 3.63Å; V155-W209 HydrophobicContact CG2-CB 3.57Å; V155-W209 HydrophobicContact CG2-CD2 4.39Å; V155-W209 HydrophobicContact CG2-CG 3.74Å
156	G	91	Very high	91	Very high	13 Å²	13	73.4 Å²	73.4	13%	0.134	40%	0.395	C	S	.	.			trans	-75.9	-51.9	170.1	0	0	0	0	0	110.8	L143 T144 C154 H170	L143-G156 PolarHBondContact O-N 2.88Å; L143-G156 VanDerWaalsContact O-N 3.16Å; T144-G156 VanDerWaalsContact O-CA 3.23Å; T144-G156 WeakPolarHBondContact O-CA 3.28Å; T144-G156 PolarHBondContact O-N 3.46Å; T144-G156 VanDerWaalsContact O-N 3.15Å; C154-G156 PolarHBondContact O-N 3.21Å; G156-H170 PolarHBondContact O-CE1 3.49Å; G156-H170 PolarHBondContact O-ND1 3.3Å
157	G	80.6	Confident	90.6	Very high	32 Å²	32	73.9 Å²	73.9	33%	0.33	40%	0.401	S	S	.	.			trans	52.9	-160.8	171.4	0	0	0	0	0	115.1	L143	L143-G157 PolarHBondContact O-N 2.97Å
158	R	87.6	Confident	90.3	Very high	247 Å²	247	73.9 Å²	73.9	93%	0.932	40%	0.403	S	S	*	.	S	Bend	trans	-112.7	12.3	-179	-63.5	-179.3	67.5	177.4	1.8	113.2
159	L	87.8	Confident	90.2	Very high	96 Å²	96	75.9 Å²	75.9	50%	0.503	41%	0.409	S	S	.	.			trans	-105	14.4	-172.7	-64.5	179.8	0	0	0	113.3	N161 A162 R169	L159-N161 PolarHBondContact O-N 2.71Å; L159-A162 HydrophobicContact CB-CB 4.25Å; L159-A162 HydrophobicContact CD2-CB 4.43Å; L159-A162 VanDerWaalsContact O-CB 3.29Å; L159-A162 WeakPolarHBondContact O-CB 3.48Å; L159-A162 PolarHBondContact O-N 3.41Å; L159-R169 VanDerWaalsContact O-CD 3.27Å; L159-R169 WeakPolarHBondContact O-CD 3.49Å; L159-R169 WeakPolarHBondContact O-CG 3.26Å
160	E	83.9	Confident	90.3	Very high	122 Å²	122	72.1 Å²	72.1	57%	0.57	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-39.6	-178.2	-175.4	176.2	-176.2	0	0	113	R169	E160-R169 WeakPolarHBondContact O-CD 3.22Å; E160-R169 PolarHBondContact O-NH1 3.46Å
161	N	87.1	Confident	90.4	Very high	153 Å²	153	66.6 Å²	66.6	82%	0.818	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	7.2	-178.8	-62.4	-37.3	0	0	0	114.1	L159	L159-N161 PolarHBondContact O-N 2.71Å
162	A	89.2	Confident	90.6	Very high	22 Å²	22	63.6 Å²	63.6	18%	0.182	34%	0.34	C	S	.	.	S	Bend	trans	-70.1	140.5	179.5	0	0	0	0	0	110.8	L159 I164 R169	L159-A162 HydrophobicContact CB-CB 4.25Å; L159-A162 HydrophobicContact CD2-CB 4.43Å; L159-A162 VanDerWaalsContact O-CB 3.29Å; L159-A162 WeakPolarHBondContact O-CB 3.48Å; L159-A162 PolarHBondContact O-N 3.41Å; A162-I164 HydrophobicContact CB-CD1 4.03Å; A162-I164 HydrophobicContact CB-CG1 3.94Å; A162-I164 PolarHBondContact O-N 2.6Å; A162-R169 WeakPolarHBondContact O-CD 3.14Å
163	P	91.5	Very high	90.6	Very high	136 Å²	136	63.4 Å²	63.4	88%	0.883	34%	0.339	S	S	*	.	S	Bend	trans	-78.2	54.1	178.8	34.6	-36.9	0	0	0	111.2
164	I	88.2	Confident	90.7	Very high	66 Å²	66	63.4 Å²	63.4	34%	0.338	34%	0.339	S	S	.	.	S	Bend	trans	-127	159.5	178.9	67.4	-175.8	0	0	0	109.6	A162 R169	A162-I164 HydrophobicContact CB-CD1 4.03Å; A162-I164 HydrophobicContact CB-CG1 3.94Å; A162-I164 PolarHBondContact O-N 2.6Å; I164-R169 HydrophobicContact CD1-CG 3.96Å; I164-R169 HydrophobicContact CG1-CG 3.39Å; I164-R169 PolarHBondContact O-NE 2.74Å
165	P	90.3	Very high	90.8	Very high	90 Å²	90	63.4 Å²	63.4	58%	0.584	34%	0.339	S	S	*	.			trans	-52.1	145.7	178.5	-27.7	36.2	0	0	0	112.4	D167 S168 R169	P165-D167 VanDerWaalsContact C-N 3.28Å; P165-D167 PolarHBondContact O-N 3.44Å; P165-S168 WeakPolarHBondContact O-CA 3.46Å; P165-S168 WeakPolarHBondContact O-CB 3.22Å; P165-S168 PolarHBondContact O-N 3.08Å; P165-R169 PolarHBondContact O-N 2.79Å
166	L	87.5	Confident	90.8	Very high	106 Å²	106	67.9 Å²	67.9	56%	0.555	35%	0.354	S	S	*	.	H	α-helix	trans	-55.6	-43.2	-175.4	-169.1	76.3	0	0	0	112	S168 R169 H170	L166-S168 PolarHBondContact O-N 2.95Å; L166-R169 WeakPolarHBondContact O-CB 3.46Å; L166-R169 PolarHBondContact O-N 2.66Å; L166-H170 PolarHBondContact O-N 3.29Å
167	D	87.6	Confident	90.9	Very high	83 Å²	83	73.1 Å²	73.1	44%	0.444	38%	0.377	S	S	.	.	H	α-helix	trans	-63.1	-27.9	177.9	-61.6	-36.8	0	0	0	112.9	P165 H170 P171 K206 L207	P165-D167 VanDerWaalsContact C-N 3.28Å; P165-D167 PolarHBondContact O-N 3.44Å; D167-H170 CarbonylContact O-C 3.51Å; D167-P171 WeakPolarHBondContact O-CA 3.35Å; D167-P171 VanDerWaalsContact O-N 3.12Å; D167-K206 CarbonylContact C-O 3.46Å; D167-L207 HydrophobicContact CB-CD2 3.79Å
168	S	89.1	Confident	91.7	Very high	31 Å²	31	72.4 Å²	72.4	22%	0.217	37%	0.365	C	S	.	.	H	α-helix	trans	-83.4	-25.3	174.5	-60.6	0	0	0	0	113.1	P165 L166 K206	P165-S168 WeakPolarHBondContact O-CA 3.46Å; P165-S168 WeakPolarHBondContact O-CB 3.22Å; P165-S168 PolarHBondContact O-N 3.08Å; L166-S168 PolarHBondContact O-N 2.95Å; S168-K206 WeakPolarHBondContact CA-O 3.3Å; S168-K206 WeakPolarHBondContact CB-O 3.29Å; S168-K206 PolarHBondContact N-O 2.78Å; S168-K206 PolarHBondContact OG-O 2.99Å
169	R	91	Very high	92.1	Very high	68 Å²	68	63.4 Å²	63.4	26%	0.257	33%	0.331	S	S	.	.	H	α-helix	trans	-71.1	-40.7	169.5	-67.2	-172.3	-102.7	158.8	3.6	111	L159 E160 A162 I164 P165 L166 P171	L159-R169 VanDerWaalsContact O-CD 3.27Å; L159-R169 WeakPolarHBondContact O-CD 3.49Å; L159-R169 WeakPolarHBondContact O-CG 3.26Å; E160-R169 WeakPolarHBondContact O-CD 3.22Å; E160-R169 PolarHBondContact O-NH1 3.46Å; A162-R169 WeakPolarHBondContact O-CD 3.14Å; I164-R169 HydrophobicContact CD1-CG 3.96Å; I164-R169 HydrophobicContact CG1-CG 3.39Å; I164-R169 PolarHBondContact O-NE 2.74Å; P165-R169 PolarHBondContact O-N 2.79Å; L166-R169 WeakPolarHBondContact O-CB 3.46Å; L166-R169 PolarHBondContact O-N 2.66Å; R169-P171 WeakPolarHBondContact O-CD 3.19Å
170	H	94.1	Very high	92.5	Very high	28 Å²	28	58.8 Å²	58.8	13%	0.13	31%	0.307	C	S	.	.	S	Bend	trans	-125	62.5	-174.7	-56	-61.5	0	0	0	112.2	F146 C154 V155 G156 L166 D167	F146-H170 HydrophobicContact CE1-CB 4.01Å; F146-H170 AromaticContact CE1-CG 3.85Å; F146-H170 AromaticContact CE1-ND1 3.59Å; F146-H170 HydrophobicContact CZ-CB 3.93Å; F146-H170 AromaticContact CZ-CG 3.83Å; F146-H170 AromaticContact CZ-ND1 3.98Å; C154-H170 HydrophobicContact CB-CB 4.34Å; V155-H170 VanDerWaalsContact O-CA 3.31Å; V155-H170 WeakPolarHBondContact O-CA 3.24Å; V155-H170 WeakPolarHBondContact O-CB 3.43Å; V155-H170 PolarHBondContact O-ND1 3.43Å; G156-H170 PolarHBondContact O-CE1 3.49Å; G156-H170 PolarHBondContact O-ND1 3.3Å; L166-H170 PolarHBondContact O-N 3.29Å; D167-H170 CarbonylContact O-C 3.51Å
171	P	95.2	Very high	93.1	Very high	7 Å²	7	53 Å²	53	5%	0.045	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-61.3	144.4	-178.7	25.1	-35	0	0	0	111.5	V155 D167 R169 I173 L207 W209	V155-P171 HydrophobicContact CB-CG 4.11Å; V155-P171 HydrophobicContact CG2-CG 4.04Å; V155-P171 PolarHBondContact N-O 2.86Å; D167-P171 WeakPolarHBondContact O-CA 3.35Å; D167-P171 VanDerWaalsContact O-N 3.12Å; R169-P171 WeakPolarHBondContact O-CD 3.19Å; P171-I173 PolarHBondContact O-N 2.69Å; P171-L207 CarbonylContact C-O 3.55Å; P171-L207 WeakPolarHBondContact CA-O 3.37Å; P171-W209 HydrophobicContact CB-CB 4.28Å; P171-W209 HydrophobicContact CG-CB 4.07Å
172	V	97.1	Very high	93.6	Very high	15 Å²	15	48.2 Å²	48.2	9%	0.091	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	129.4	179.2	169.3	0	0	0	0	110	V113 I152 L174 L207 Y208 W209	V113-V172 HydrophobicContact CG1-CG1 3.58Å; I152-V172 HydrophobicContact CG2-CB 4.32Å; I152-V172 HydrophobicContact CG2-CG1 3.6Å; I152-V172 HydrophobicContact CG2-CG2 3.93Å; V172-L174 HydrophobicContact CG1-CD2 4.37Å; V172-L174 PolarHBondContact O-N 3.44Å; V172-L207 PolarHBondContact N-O 3.14Å; V172-Y208 HydrophobicContact CB-CD1 3.94Å; V172-Y208 HydrophobicContact CB-CE1 4.4Å; V172-Y208 HydrophobicContact CG1-CD1 4.29Å; V172-Y208 CarbonylContact O-C 3.43Å; V172-Y208 VanDerWaalsContact O-CA 3.27Å; V172-Y208 WeakPolarHBondContact O-CA 3.49Å; V172-W209 PolarHBondContact O-N 3.49Å
173	I	97.6	Very high	94	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.4	-179.6	-61.7	179.3	0	0	0	109.8	Q117 Y121 L140 L143 P145 L153 V155 P171 W209	Q117-I173 PolarHBondContact NE2-O 3.44Å; Y121-I173 HydrophobicContact CE2-CG2 3.82Å; L140-I173 HydrophobicContact CD1-CD1 4.39Å; L140-I173 HydrophobicContact CD1-CG2 4.08Å; L140-I173 HydrophobicContact CD2-CG2 4.04Å; L143-I173 HydrophobicContact CD1-CD1 4.05Å; P145-I173 HydrophobicContact CB-CD1 3.66Å; L153-I173 HydrophobicContact CD2-CB 4.38Å; L153-I173 HydrophobicContact CD2-CD1 4.28Å; L153-I173 HydrophobicContact CD2-CG2 4.49Å; L153-I173 HydrophobicContact CG-CD1 4.18Å; L153-I173 PolarHBondContact O-N 3.36Å; V155-I173 HydrophobicContact CG2-CD1 3.92Å; V155-I173 HydrophobicContact CG2-CG1 3.63Å; P171-I173 PolarHBondContact O-N 2.69Å; I173-W209 WeakPolarHBondContact CA-O 3.31Å
174	L	97.8	Very high	94.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.203	C	C	.	.			trans	-110.8	135.1	178.2	-71.4	-178.7	0	0	0	111.5	V172 T181 I184 Y208 W209 I210 P211	V172-L174 HydrophobicContact CG1-CD2 4.37Å; V172-L174 PolarHBondContact O-N 3.44Å; L174-T181 HydrophobicContact CB-CG2 4.21Å; L174-T181 HydrophobicContact CD1-CG2 4.48Å; L174-I184 HydrophobicContact CD1-CD1 3.54Å; L174-I184 HydrophobicContact CD2-CD1 4.3Å; L174-Y208 HydrophobicContact CD1-CD1 3.59Å; L174-Y208 HydrophobicContact CD1-CD2 4.46Å; L174-Y208 HydrophobicContact CD1-CE1 4.34Å; L174-Y208 HydrophobicContact CD1-CG 3.66Å; L174-Y208 HydrophobicContact CD2-CD1 4.49Å; L174-Y208 HydrophobicContact CG-CD1 3.95Å; L174-Y208 HydrophobicContact CG-CG 4.34Å; L174-W209 PolarHBondContact N-O 3.33Å; L174-I210 HydrophobicContact CB-CG1 3.96Å; L174-P211 WeakPolarHBondContact O-CD 3.37Å
175	P	96.9	Very high	94.8	Very high	4 Å²	4	37.8 Å²	37.8	3%	0.026	19%	0.187	C	C	.	.			trans	-68.6	131.2	177.4	23.6	-29.4	0	0	0	113.5	A116 A120 Y121 M177 H178 T181	A116-P175 HydrophobicContact CB-CG 4.11Å; A120-P175 HydrophobicContact CB-CB 3.36Å; A120-P175 HydrophobicContact CB-CG 3.87Å; Y121-P175 HydrophobicContact CE2-CB 4Å; Y121-P175 WeakPolarHBondContact OH-CA 3.34Å; P175-M177 VanDerWaalsContact C-N 3.28Å; P175-M177 PolarHBondContact O-N 3.21Å; P175-H178 HydrophobicContact CB-CB 4.01Å; P175-H178 HydrophobicContact CG-CB 3.56Å; P175-T181 WeakPolarHBondContact O-CB 3.4Å; P175-T181 PolarHBondContact O-OG1 3.25Å
176	R	95.4	Very high	95.1	Very high	106 Å²	106	36.5 Å²	36.5	40%	0.4	17%	0.17	S	C	.	.	S	Bend	trans	-65.8	-25.6	-174.4	66.6	163	-157.6	151.3	4.6	114.8	I210 P211 T216 R219	R176-I210 HydrophobicContact CB-CG2 4.07Å; R176-P211 WeakPolarHBondContact CB-O 3.47Å; R176-T216 HydrophobicContact CB-CG2 4.25Å; R176-T216 WeakPolarHBondContact O-CG2 3.44Å; R176-R219 PolarHBondContact O-NH2 3.07Å
177	M	94.5	Very high	95.6	Very high	123 Å²	123	34.3 Å²	34.3	61%	0.606	16%	0.159	S	C	*	.	S	Bend	trans	-114.7	63.2	-179	-59.1	-58.4	-90.6	0	0	109.3	P175 R219	P175-M177 VanDerWaalsContact C-N 3.28Å; P175-M177 PolarHBondContact O-N 3.21Å; M177-R219 VanDerWaalsContact CE-NH1 3.34Å; M177-R219 VanDerWaalsContact SD-CZ 3.56Å; M177-R219 PolarHBondContact SD-NH1 3.29Å; M177-R219 PolarHBondContact SD-NH2 2.89Å
178	H	95.6	Very high	96	Very high	18 Å²	18	31.5 Å²	31.5	8%	0.083	15%	0.145	C	C	.	.			trans	-147.2	142.1	-177.7	-168.4	-82.8	0	0	0	111.7	E61 A116 Q119 P175 L180 T181 E182	E61-H178 IonicContact OE2-CE1 3.97Å; E61-H178 IonicContact OE2-NE2 3.76Å; A116-H178 WeakPolarHBondContact CA-NE2 3.49Å; A116-H178 WeakPolarHBondContact CB-CE1 3.44Å; A116-H178 WeakPolarHBondContact CB-NE2 3.27Å; Q119-H178 PolarHBondContact OE1-NE2 3.42Å; P175-H178 HydrophobicContact CB-CB 4.01Å; P175-H178 HydrophobicContact CG-CB 3.56Å; H178-L180 VanDerWaalsContact ND1-CB 3.34Å; H178-L180 WeakPolarHBondContact ND1-CB 3.48Å; H178-L180 PolarHBondContact ND1-N 3.12Å; H178-L180 PolarHBondContact O-N 2.89Å; H178-T181 WeakPolarHBondContact O-CB 3.39Å; H178-T181 PolarHBondContact O-N 3.05Å; H178-T181 VanDerWaalsContact O-N 3.09Å; H178-E182 PolarHBondContact O-N 3.01Å
179	R	96	Very high	96.4	Very high	57 Å²	57	30.1 Å²	30.1	22%	0.215	14%	0.135	C	C	.	.	H	α-helix	trans	-62.6	-40.6	-173.7	-176	56.6	-176.5	166.5	-1.3	113.4	L64 F67 T181 E182 L183	L64-R179 HydrophobicContact CB-CB 4.13Å; L64-R179 HydrophobicContact CB-CG 3.78Å; L64-R179 VanDerWaalsContact O-CG 3.28Å; L64-R179 WeakPolarHBondContact O-CG 3.19Å; L64-R179 PolarHBondContact O-NE 3.47Å; F67-R179 PolarHBondContact O-NH2 2.88Å; R179-T181 VanDerWaalsContact C-N 3.28Å; R179-T181 PolarHBondContact O-N 3.26Å; R179-E182 IonicContact CZ-OE2 2.8Å; R179-E182 IonicContact NH1-OE2 3.07Å; R179-E182 PolarHBondContact NH1-OE2 3.26Å; R179-E182 WeakPolarHBondContact O-CB 3.47Å; R179-E182 PolarHBondContact O-N 2.94Å; R179-E182 VanDerWaalsContact O-N 3.16Å; R179-L183 HydrophobicContact CG-CD1 4.5Å; R179-L183 WeakPolarHBondContact O-CG 3.37Å; R179-L183 PolarHBondContact O-N 2.81Å
180	L	97	Very high	96.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-54	-43.8	173	-178.6	62.7	0	0	0	112.4	L64 L70 L112 V113 A116 H178 E182 L183 I184	L64-L180 HydrophobicContact CD1-CB 4.37Å; L64-L180 HydrophobicContact CD2-CB 4.13Å; L64-L180 HydrophobicContact CD2-CD1 4.08Å; L70-L180 HydrophobicContact CD1-CD1 3.81Å; L112-L180 HydrophobicContact CB-CD1 4.24Å; L112-L180 HydrophobicContact CB-CD2 4.04Å; V113-L180 HydrophobicContact CG2-CD2 4.04Å; A116-L180 HydrophobicContact CB-CD2 3.97Å; H178-L180 VanDerWaalsContact ND1-CB 3.34Å; H178-L180 WeakPolarHBondContact ND1-CB 3.48Å; H178-L180 PolarHBondContact ND1-N 3.12Å; H178-L180 PolarHBondContact O-N 2.89Å; L180-E182 VanDerWaalsContact C-N 3.34Å; L180-E182 PolarHBondContact O-N 3.31Å; L180-L183 PolarHBondContact O-N 3.02Å; L180-I184 HydrophobicContact CD1-CD1 4.28Å; L180-I184 HydrophobicContact CG-CD1 4.03Å; L180-I184 WeakPolarHBondContact O-CG1 3.29Å; L180-I184 PolarHBondContact O-N 2.89Å
181	T	97.5	Very high	96.7	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-67.1	-37.1	-179.9	-55	0	0	0	0	111.6	L174 P175 H178 R179 I184 I185 I210	L174-T181 HydrophobicContact CB-CG2 4.21Å; L174-T181 HydrophobicContact CD1-CG2 4.48Å; P175-T181 WeakPolarHBondContact O-CB 3.4Å; P175-T181 PolarHBondContact O-OG1 3.25Å; H178-T181 WeakPolarHBondContact O-CB 3.39Å; H178-T181 PolarHBondContact O-N 3.05Å; H178-T181 VanDerWaalsContact O-N 3.09Å; R179-T181 VanDerWaalsContact C-N 3.28Å; R179-T181 PolarHBondContact O-N 3.26Å; T181-I184 PolarHBondContact O-N 3.1Å; T181-I185 HydrophobicContact CG2-CD1 4.14Å; T181-I185 VanDerWaalsContact O-CG1 3.32Å; T181-I185 WeakPolarHBondContact O-CG1 3.35Å; T181-I185 PolarHBondContact O-N 3.48Å; T181-I210 HydrophobicContact CG2-CD1 3.56Å; T181-I210 HydrophobicContact CG2-CG1 3.94Å; T181-I210 HydrophobicContact CG2-CG2 4.33Å
182	E	97.5	Very high	96.7	Very high	52 Å²	52	38.3 Å²	38.3	24%	0.243	18%	0.179	C	C	.	.	H	α-helix	trans	-62.2	-45.1	171.8	-60.2	-176.4	167.6	0	0	112.1	H178 R179 L180 I184 I185 W186 I220	H178-E182 PolarHBondContact O-N 3.01Å; R179-E182 IonicContact CZ-OE2 2.8Å; R179-E182 IonicContact NH1-OE2 3.07Å; R179-E182 PolarHBondContact NH1-OE2 3.26Å; R179-E182 WeakPolarHBondContact O-CB 3.47Å; R179-E182 PolarHBondContact O-N 2.94Å; R179-E182 VanDerWaalsContact O-N 3.16Å; L180-E182 VanDerWaalsContact C-N 3.34Å; L180-E182 PolarHBondContact O-N 3.31Å; E182-I184 VanDerWaalsContact C-N 3.35Å; E182-I184 PolarHBondContact O-N 2.8Å; E182-I185 PolarHBondContact O-N 2.97Å; E182-W186 WeakPolarHBondContact O-CB 3.27Å; E182-W186 VanDerWaalsContact O-CD1 3.26Å; E182-W186 PolarHBondContact O-N 2.89Å; E182-I220 HydrophobicContact CB-CD1 4.32Å; E182-I220 HydrophobicContact CG-CD1 3.78Å; E182-I220 HydrophobicContact CG-CG1 4.11Å
183	L	97.3	Very high	96.6	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-62.2	-41.5	178.6	-70.9	174.4	0	0	0	111.8	L64 S68 L70 V73 R179 L180 W186 D187	L64-L183 HydrophobicContact CD2-CD1 3.79Å; S68-L183 WeakPolarHBondContact O-CD2 3.45Å; L70-L183 HydrophobicContact CB-CB 4.21Å; L70-L183 HydrophobicContact CD1-CB 4.12Å; V73-L183 HydrophobicContact CG2-CD1 4.18Å; R179-L183 HydrophobicContact CG-CD1 4.5Å; R179-L183 WeakPolarHBondContact O-CG 3.37Å; R179-L183 PolarHBondContact O-N 2.81Å; L180-L183 PolarHBondContact O-N 3.02Å; L183-W186 PolarHBondContact O-N 3.21Å; L183-D187 VanDerWaalsContact O-CB 3.27Å; L183-D187 WeakPolarHBondContact O-CB 3.34Å; L183-D187 PolarHBondContact O-N 3.25Å
184	I	97.7	Very high	96.4	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.015	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-45.8	174.9	-68.7	166.8	0	0	0	110.8	L70 F109 L174 L180 T181 E182 W186 D187 T188 Y208	L70-I184 HydrophobicContact CD1-CG1 4.4Å; L70-I184 HydrophobicContact CD2-CB 4.45Å; L70-I184 HydrophobicContact CD2-CG1 3.67Å; F109-I184 HydrophobicContact CE2-CD1 4.07Å; F109-I184 HydrophobicContact CE2-CG1 4.48Å; F109-I184 HydrophobicContact CZ-CD1 3.99Å; L174-I184 HydrophobicContact CD1-CD1 3.54Å; L174-I184 HydrophobicContact CD2-CD1 4.3Å; L180-I184 HydrophobicContact CD1-CD1 4.28Å; L180-I184 HydrophobicContact CG-CD1 4.03Å; L180-I184 WeakPolarHBondContact O-CG1 3.29Å; L180-I184 PolarHBondContact O-N 2.89Å; T181-I184 PolarHBondContact O-N 3.1Å; E182-I184 VanDerWaalsContact C-N 3.35Å; E182-I184 PolarHBondContact O-N 2.8Å; I184-W186 VanDerWaalsContact C-N 3.33Å; I184-W186 PolarHBondContact O-N 3.44Å; I184-D187 PolarHBondContact O-N 3.48Å; I184-T188 PolarHBondContact O-N 3.49Å; I184-T188 PolarHBondContact O-OG1 3.43Å; I184-T188 VanDerWaalsContact O-OG1 3.04Å; I184-Y208 HydrophobicContact CG2-CD2 4.09Å; I184-Y208 HydrophobicContact CG2-CE2 3.99Å
185	I	98	Very high	96.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-44.1	177.5	-72	165.7	0	0	0	111.1	T181 E182 H189 I204 I210 T216 V217 I220 L221	T181-I185 HydrophobicContact CG2-CD1 4.14Å; T181-I185 VanDerWaalsContact O-CG1 3.32Å; T181-I185 WeakPolarHBondContact O-CG1 3.35Å; T181-I185 PolarHBondContact O-N 3.48Å; E182-I185 PolarHBondContact O-N 2.97Å; I185-H189 WeakPolarHBondContact O-CB 3.27Å; I185-H189 PolarHBondContact O-N 2.85Å; I185-I204 HydrophobicContact CB-CD1 4.23Å; I185-I204 HydrophobicContact CG1-CD1 3.56Å; I185-I210 HydrophobicContact CD1-CD1 3.91Å; I185-I210 HydrophobicContact CG1-CD1 4.2Å; I185-T216 HydrophobicContact CD1-CG2 4.22Å; I185-V217 HydrophobicContact CD1-CG2 3.89Å; I185-V217 HydrophobicContact CG1-CG2 4.13Å; I185-V217 HydrophobicContact CG2-CG1 4.35Å; I185-I220 HydrophobicContact CB-CG2 4.25Å; I185-I220 HydrophobicContact CD1-CD1 3.34Å; I185-I220 HydrophobicContact CG1-CD1 4.49Å; I185-I220 HydrophobicContact CG2-CB 4.18Å; I185-I220 HydrophobicContact CG2-CG2 3.75Å; I185-L221 HydrophobicContact CG2-CD1 4.48Å; I185-L221 HydrophobicContact CG2-CD2 3.85Å; I185-L221 HydrophobicContact CG2-CG 4.02Å
186	W	96.9	Very high	95.9	Very high	63 Å²	63	47.3 Å²	47.3	24%	0.239	25%	0.246	C	C	.	.	H	α-helix	trans	-64.7	-43.5	177.3	-88.3	113.6	0	0	0	112.8	E182 L183 I184 H189 N190 L221 C224	E182-W186 WeakPolarHBondContact O-CB 3.27Å; E182-W186 VanDerWaalsContact O-CD1 3.26Å; E182-W186 PolarHBondContact O-N 2.89Å; L183-W186 PolarHBondContact O-N 3.21Å; I184-W186 VanDerWaalsContact C-N 3.33Å; I184-W186 PolarHBondContact O-N 3.44Å; W186-H189 AromaticContact CZ3-CD2 3.83Å; W186-H189 PolarHBondContact O-N 3.1Å; W186-N190 WeakPolarHBondContact O-CB 3.14Å; W186-N190 VanDerWaalsContact O-CG 3.24Å; W186-N190 PolarHBondContact O-N 3.21Å; W186-N190 PolarHBondContact O-ND2 2.87Å; W186-L221 HydrophobicContact CE3-CD2 4.43Å; W186-C224 HydrophobicContact CH2-CB 3.59Å; W186-C224 HydrophobicContact CZ3-CB 4.07Å
187	D	96.9	Very high	95.9	Very high	61 Å²	61	43.4 Å²	43.4	33%	0.326	24%	0.236	S	C	.	.	H	α-helix	trans	-62.5	-48.3	179.3	-166.1	75.2	0	0	0	111	L70 L183 I184 H189 N190 H191	L70-D187 HydrophobicContact CB-CB 4.1Å; L70-D187 HydrophobicContact CD2-CB 4.14Å; L183-D187 VanDerWaalsContact O-CB 3.27Å; L183-D187 WeakPolarHBondContact O-CB 3.34Å; L183-D187 PolarHBondContact O-N 3.25Å; I184-D187 PolarHBondContact O-N 3.48Å; D187-H189 PolarHBondContact O-N 2.85Å; D187-N190 PolarHBondContact O-N 3.02Å; D187-H191 WeakPolarHBondContact O-CB 3.47Å; D187-H191 PolarHBondContact O-N 3.18Å
188	T	97.4	Very high	95.9	Very high	24 Å²	24	40.5 Å²	40.5	15%	0.147	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-41	175.5	-52.8	0	0	0	0	112	I184 N190 H191 L192 T200 E203 I204	I184-T188 PolarHBondContact O-N 3.49Å; I184-T188 PolarHBondContact O-OG1 3.43Å; I184-T188 VanDerWaalsContact O-OG1 3.04Å; T188-N190 VanDerWaalsContact C-N 3.34Å; T188-N190 PolarHBondContact O-N 2.79Å; T188-H191 PolarHBondContact O-N 2.95Å; T188-L192 HydrophobicContact CG2-CD1 3.81Å; T188-L192 HydrophobicContact CG2-CG 4.29Å; T188-L192 WeakPolarHBondContact O-CB 3.36Å; T188-L192 VanDerWaalsContact O-CG 3.3Å; T188-L192 WeakPolarHBondContact O-CG 3.29Å; T188-L192 PolarHBondContact O-N 3.49Å; T188-T200 HydrophobicContact CG2-CG2 4.1Å; T188-E203 HydrophobicContact CG2-CB 3.88Å; T188-E203 HydrophobicContact CG2-CG 4Å; T188-I204 HydrophobicContact CG2-CG1 3.98Å
189	H	97.1	Very high	96	Very high	2 Å²	2	45 Å²	45	1%	0.009	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-39.9	177.5	178.8	65.6	0	0	0	112.6	I185 W186 D187 H194 S195 T200 L221 C224 C227	I185-H189 WeakPolarHBondContact O-CB 3.27Å; I185-H189 PolarHBondContact O-N 2.85Å; W186-H189 AromaticContact CZ3-CD2 3.83Å; W186-H189 PolarHBondContact O-N 3.1Å; D187-H189 PolarHBondContact O-N 2.85Å; H189-H194 AromaticContact CD2-CE1 3.84Å; H189-H194 AromaticContact CD2-ND1 3.35Å; H189-H194 PolarHBondContact CD2-ND1 3Å; H189-H194 VanDerWaalsContact CD2-ND1 3.35Å; H189-H194 VanDerWaalsContact CE1-CA 3.41Å; H189-H194 WeakPolarHBondContact CE1-CA 3.38Å; H189-H194 AromaticContact CE1-ND1 3.75Å; H189-H194 AromaticContact NE2-CE1 3.79Å; H189-H194 AromaticContact NE2-CG 3.76Å; H189-H194 AromaticContact NE2-ND1 2.89Å; H189-H194 PolarHBondContact NE2-ND1 2.8Å; H189-H194 WeakPolarHBondContact O-CA 3.45Å; H189-H194 PolarHBondContact O-N 3.42Å; H189-S195 PolarHBondContact CE1-O 2.94Å; H189-S195 PolarHBondContact ND1-O 3.28Å; H189-T200 HydrophobicContact CB-CG2 4.15Å; H189-L221 HydrophobicContact CB-CD1 4.26Å; H189-L221 HydrophobicContact CB-CD2 3.66Å; H189-L221 VanDerWaalsContact CG-CD2 3.48Å; H189-C224 PolarHBondContact NE2-SG 2.9Å; H189-C227 PolarHBondContact CE1-SG 2.99Å; H189-C227 PolarHBondContact NE2-SG 3.01Å
190	N	95.6	Very high	96	Very high	79 Å²	79	42.3 Å²	42.3	42%	0.422	23%	0.229	S	C	.	.	H	α-helix	trans	-69.3	-42.2	175.5	-71.4	-40.3	0	0	0	111.6	W186 D187 T188 L192 A193 H194	W186-N190 WeakPolarHBondContact O-CB 3.14Å; W186-N190 VanDerWaalsContact O-CG 3.24Å; W186-N190 PolarHBondContact O-N 3.21Å; W186-N190 PolarHBondContact O-ND2 2.87Å; D187-N190 PolarHBondContact O-N 3.02Å; T188-N190 VanDerWaalsContact C-N 3.34Å; T188-N190 PolarHBondContact O-N 2.79Å; N190-L192 VanDerWaalsContact C-N 3.31Å; N190-L192 PolarHBondContact O-N 2.71Å; N190-A193 PolarHBondContact O-N 3.44Å; N190-H194 PolarHBondContact OD1-CE1 3.4Å; N190-H194 PolarHBondContact OD1-NE2 3.23Å
191	H	95.7	Very high	96.1	Very high	158 Å²	158	42.8 Å²	42.8	73%	0.731	23%	0.231	S	C	*	.	H	α-helix	trans	-62.9	-38	177.8	-174.4	72.2	0	0	0	112.1	D187 T188 A193	D187-H191 WeakPolarHBondContact O-CB 3.47Å; D187-H191 PolarHBondContact O-N 3.18Å; T188-H191 PolarHBondContact O-N 2.95Å; H191-A193 PolarHBondContact O-N 2.94Å
192	L	95.7	Very high	96	Very high	38 Å²	38	47.6 Å²	47.6	20%	0.199	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	21.1	173.9	-63	174.1	0	0	0	113.4	T188 N190 H194 S195 R199 E203	T188-L192 HydrophobicContact CG2-CD1 3.81Å; T188-L192 HydrophobicContact CG2-CG 4.29Å; T188-L192 WeakPolarHBondContact O-CB 3.36Å; T188-L192 VanDerWaalsContact O-CG 3.3Å; T188-L192 WeakPolarHBondContact O-CG 3.29Å; T188-L192 PolarHBondContact O-N 3.49Å; N190-L192 VanDerWaalsContact C-N 3.31Å; N190-L192 PolarHBondContact O-N 2.71Å; L192-H194 VanDerWaalsContact C-N 3.32Å; L192-H194 PolarHBondContact O-N 3.42Å; L192-S195 VanDerWaalsContact O-CB 3.3Å; L192-S195 WeakPolarHBondContact O-CB 3.37Å; L192-S195 PolarHBondContact O-N 3.23Å; L192-S195 VanDerWaalsContact O-N 3.08Å; L192-R199 HydrophobicContact CD1-CG 4.34Å; L192-E203 HydrophobicContact CD1-CB 3.77Å; L192-E203 HydrophobicContact CD1-CG 4.13Å; L192-E203 HydrophobicContact CD2-CG 4.37Å
193	A	94.7	Very high	95.9	Very high	79 Å²	79	47.6 Å²	47.6	65%	0.653	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	47	176.9	0	0	0	0	0	114	N190 H191 S195	N190-A193 PolarHBondContact O-N 3.44Å; H191-A193 PolarHBondContact O-N 2.94Å; A193-S195 VanDerWaalsContact C-N 3.3Å; A193-S195 PolarHBondContact O-N 3.44Å
194	H	93.9	Very high	95.9	Very high	18 Å²	18	47.7 Å²	47.7	8%	0.083	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	31.1	179	-64.3	-78.9	0	0	0	115	H189 N190 L192 C224 K226	H189-H194 AromaticContact CD2-CE1 3.84Å; H189-H194 AromaticContact CD2-ND1 3.35Å; H189-H194 PolarHBondContact CD2-ND1 3Å; H189-H194 VanDerWaalsContact CD2-ND1 3.35Å; H189-H194 VanDerWaalsContact CE1-CA 3.41Å; H189-H194 WeakPolarHBondContact CE1-CA 3.38Å; H189-H194 AromaticContact CE1-ND1 3.75Å; H189-H194 AromaticContact NE2-CE1 3.79Å; H189-H194 AromaticContact NE2-CG 3.76Å; H189-H194 AromaticContact NE2-ND1 2.89Å; H189-H194 PolarHBondContact NE2-ND1 2.8Å; H189-H194 WeakPolarHBondContact O-CA 3.45Å; H189-H194 PolarHBondContact O-N 3.42Å; N190-H194 PolarHBondContact OD1-CE1 3.4Å; N190-H194 PolarHBondContact OD1-NE2 3.23Å; L192-H194 VanDerWaalsContact C-N 3.32Å; L192-H194 PolarHBondContact O-N 3.42Å; H194-C224 PolarHBondContact ND1-SG 3.06Å; H194-K226 VanDerWaalsContact CE1-CD 3.45Å; H194-K226 WeakPolarHBondContact CE1-CD 3.32Å; H194-K226 WeakPolarHBondContact NE2-CD 3.41Å; H194-K226 PolarHBondContact NE2-NZ 3.4Å
195	S	91.4	Very high	95.7	Very high	42 Å²	42	53.2 Å²	53.2	29%	0.294	28%	0.275	S	S	.	.			trans	-58.9	172.1	174	-162.5	0	0	0	0	113.6	H189 L192 A193 R199	H189-S195 PolarHBondContact CE1-O 2.94Å; H189-S195 PolarHBondContact ND1-O 3.28Å; L192-S195 VanDerWaalsContact O-CB 3.3Å; L192-S195 WeakPolarHBondContact O-CB 3.37Å; L192-S195 PolarHBondContact O-N 3.23Å; L192-S195 VanDerWaalsContact O-N 3.08Å; A193-S195 VanDerWaalsContact C-N 3.3Å; A193-S195 PolarHBondContact O-N 3.44Å; S195-R199 WeakPolarHBondContact OG-CB 3.46Å; S195-R199 WeakPolarHBondContact OG-CG 3.43Å
196	S	92.3	Very high	95.5	Very high	69 Å²	69	56.9 Å²	56.9	48%	0.483	29%	0.291	S	S	.	.			trans	-60	150.8	-177.1	76.6	0	0	0	0	112.3	D198 R199 T200	S196-D198 PolarHBondContact O-N 3.15Å; S196-D198 VanDerWaalsContact O-N 3.14Å; S196-R199 PolarHBondContact O-N 3.36Å; S196-R199 PolarHBondContact OG-N 2.97Å; S196-T200 PolarHBondContact O-N 2.74Å; S196-T200 PolarHBondContact O-OG1 3.02Å
197	A	95	Very high	95.4	Very high	24 Å²	24	57.7 Å²	57.7	20%	0.198	30%	0.299	C	S	.	.	H	α-helix	trans	-56.1	-32.9	177.4	0	0	0	0	0	112.8	L201 V217 R218 L221	A197-L201 WeakPolarHBondContact O-CB 3.2Å; A197-L201 PolarHBondContact O-N 3.13Å; A197-V217 HydrophobicContact CB-CG1 4.09Å; A197-V217 WeakPolarHBondContact O-CG1 3.37Å; A197-R218 HydrophobicContact CB-CG 3.89Å; A197-L221 HydrophobicContact CB-CD1 4.33Å
198	D	95.9	Very high	95.4	Very high	61 Å²	61	56.6 Å²	56.6	33%	0.326	29%	0.291	S	S	.	.	H	α-helix	trans	-73.1	-36.4	177.9	-68.9	-34.2	0	0	0	111.6	S196 L201 H202 R214 R218	S196-D198 PolarHBondContact O-N 3.15Å; S196-D198 VanDerWaalsContact O-N 3.14Å; D198-L201 PolarHBondContact O-N 3.23Å; D198-H202 PolarHBondContact O-N 3.32Å; D198-R214 VanDerWaalsContact CG-NH2 3.26Å; D198-R214 IonicContact OD1-CZ 2.97Å; D198-R214 IonicContact OD1-NE 3.56Å; D198-R214 PolarHBondContact OD1-NE 2.89Å; D198-R214 IonicContact OD1-NH2 2.85Å; D198-R214 PolarHBondContact OD1-NH2 3.04Å; D198-R214 VanDerWaalsContact OD1-NH2 3.12Å; D198-R214 IonicContact OD2-CZ 3.42Å; D198-R214 IonicContact OD2-NE 3.91Å; D198-R214 IonicContact OD2-NH2 2.95Å; D198-R214 PolarHBondContact OD2-NH2 3.38Å; D198-R218 IonicContact OD1-NH2 3.68Å; D198-R218 IonicContact OD2-NH2 2.66Å
199	R	96.1	Very high	95.3	Very high	114 Å²	114	59.5 Å²	59.5	43%	0.43	30%	0.299	S	S	.	.	H	α-helix	trans	-68.1	-43.6	173	-179.4	58.5	-178	-167.7	1.8	111.6	L192 S195 S196 L201 H202 E203	L192-R199 HydrophobicContact CD1-CG 4.34Å; S195-R199 WeakPolarHBondContact OG-CB 3.46Å; S195-R199 WeakPolarHBondContact OG-CG 3.43Å; S196-R199 PolarHBondContact O-N 3.36Å; S196-R199 PolarHBondContact OG-N 2.97Å; R199-L201 VanDerWaalsContact C-N 3.32Å; R199-L201 PolarHBondContact O-N 3.38Å; R199-H202 PolarHBondContact O-N 3.01Å; R199-E203 PolarHBondContact O-N 3.43Å
200	T	97.2	Very high	95.3	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-44.1	174.3	-55	0	0	0	0	111.1	T188 H189 S196 H202 E203 I204 V217 L221	T188-T200 HydrophobicContact CG2-CG2 4.1Å; H189-T200 HydrophobicContact CB-CG2 4.15Å; S196-T200 PolarHBondContact O-N 2.74Å; S196-T200 PolarHBondContact O-OG1 3.02Å; T200-H202 VanDerWaalsContact C-N 3.35Å; T200-H202 PolarHBondContact O-N 3.37Å; T200-E203 PolarHBondContact O-N 2.92Å; T200-I204 HydrophobicContact CG2-CD1 3.88Å; T200-I204 HydrophobicContact CG2-CG1 4.5Å; T200-I204 VanDerWaalsContact O-CG1 3.27Å; T200-I204 WeakPolarHBondContact O-CG1 3.36Å; T200-I204 PolarHBondContact O-N 2.95Å; T200-V217 HydrophobicContact CG2-CG1 4.42Å; T200-L221 HydrophobicContact CG2-CD1 4.24Å
201	L	97.6	Very high	95.3	Very high	9 Å²	9	57.3 Å²	57.3	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-62.3	-41.2	176.1	177.8	65.1	0	0	0	112.5	A197 D198 R199 E203 I204 R205 R214 V217	A197-L201 WeakPolarHBondContact O-CB 3.2Å; A197-L201 PolarHBondContact O-N 3.13Å; D198-L201 PolarHBondContact O-N 3.23Å; R199-L201 VanDerWaalsContact C-N 3.32Å; R199-L201 PolarHBondContact O-N 3.38Å; L201-E203 VanDerWaalsContact C-N 3.32Å; L201-E203 PolarHBondContact O-N 3.04Å; L201-I204 PolarHBondContact O-N 3.33Å; L201-R205 HydrophobicContact CD1-CG 4.26Å; L201-R205 HydrophobicContact CG-CG 4.46Å; L201-R205 WeakPolarHBondContact O-CB 3.34Å; L201-R205 WeakPolarHBondContact O-CG 3.46Å; L201-R205 PolarHBondContact O-N 2.99Å; L201-R214 HydrophobicContact CD2-CB 3.83Å; L201-R214 HydrophobicContact CD2-CG 4.22Å; L201-V217 HydrophobicContact CB-CG2 4.34Å; L201-V217 HydrophobicContact CD1-CG2 4.03Å
202	H	96.2	Very high	95.3	Very high	102 Å²	102	56.9 Å²	56.9	47%	0.472	29%	0.285	S	S	.	.	H	α-helix	trans	-60.7	-43	177.7	178.5	81.3	0	0	0	111.6	D198 R199 T200 R205	D198-H202 PolarHBondContact O-N 3.32Å; R199-H202 PolarHBondContact O-N 3.01Å; T200-H202 VanDerWaalsContact C-N 3.35Å; T200-H202 PolarHBondContact O-N 3.37Å; H202-R205 PolarHBondContact O-N 2.92Å
203	E	96.1	Very high	95.3	Very high	53 Å²	53	55.3 Å²	55.3	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-66.7	-44.5	178.5	-159.4	61.7	-145	0	0	111.9	T188 L192 R199 T200 L201 R205 K206	T188-E203 HydrophobicContact CG2-CB 3.88Å; T188-E203 HydrophobicContact CG2-CG 4Å; L192-E203 HydrophobicContact CD1-CB 3.77Å; L192-E203 HydrophobicContact CD1-CG 4.13Å; L192-E203 HydrophobicContact CD2-CG 4.37Å; R199-E203 PolarHBondContact O-N 3.43Å; T200-E203 PolarHBondContact O-N 2.92Å; L201-E203 VanDerWaalsContact C-N 3.32Å; L201-E203 PolarHBondContact O-N 3.04Å; E203-R205 VanDerWaalsContact C-N 3.26Å; E203-R205 PolarHBondContact O-N 2.89Å; E203-K206 WeakPolarHBondContact O-CB 3.45Å; E203-K206 PolarHBondContact O-N 2.81Å; E203-K206 IonicContact OE1-NZ 3.76Å; E203-K206 PolarHBondContact OE1-NZ 3.47Å; E203-K206 WeakPolarHBondContact OE2-CE 3.37Å; E203-K206 IonicContact OE2-NZ 3.98Å; E203-K206 PolarHBondContact OE2-NZ 3.15Å
204	I	96.5	Very high	95.4	Very high	3 Å²	3	57.5 Å²	57.5	2%	0.015	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-39.4	176	-69.3	172.2	0	0	0	111.2	I185 T188 T200 L201 K206 L207 Y208 I210 V217	I185-I204 HydrophobicContact CB-CD1 4.23Å; I185-I204 HydrophobicContact CG1-CD1 3.56Å; T188-I204 HydrophobicContact CG2-CG1 3.98Å; T200-I204 HydrophobicContact CG2-CD1 3.88Å; T200-I204 HydrophobicContact CG2-CG1 4.5Å; T200-I204 VanDerWaalsContact O-CG1 3.27Å; T200-I204 WeakPolarHBondContact O-CG1 3.36Å; T200-I204 PolarHBondContact O-N 2.95Å; L201-I204 PolarHBondContact O-N 3.33Å; I204-K206 PolarHBondContact O-N 3.12Å; I204-K206 VanDerWaalsContact O-N 3.15Å; I204-L207 PolarHBondContact O-N 3.45Å; I204-L207 VanDerWaalsContact O-N 3.13Å; I204-Y208 HydrophobicContact CG2-CD2 4.15Å; I204-Y208 HydrophobicContact CG2-CG 4.49Å; I204-Y208 PolarHBondContact O-N 2.97Å; I204-I210 HydrophobicContact CG2-CD1 3.93Å; I204-V217 HydrophobicContact CD1-CG2 4.38Å
205	R	94.8	Very high	95.5	Very high	119 Å²	119	61.4 Å²	61.4	45%	0.449	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-17.1	-178	-85.2	177.3	170.7	170.9	-4.5	115	L201 H202 E203 L207 Y208	L201-R205 HydrophobicContact CD1-CG 4.26Å; L201-R205 HydrophobicContact CG-CG 4.46Å; L201-R205 WeakPolarHBondContact O-CB 3.34Å; L201-R205 WeakPolarHBondContact O-CG 3.46Å; L201-R205 PolarHBondContact O-N 2.99Å; H202-R205 PolarHBondContact O-N 2.92Å; E203-R205 VanDerWaalsContact C-N 3.26Å; E203-R205 PolarHBondContact O-N 2.89Å; R205-L207 PolarHBondContact O-N 3.27Å; R205-Y208 WeakPolarHBondContact CA-O 3.22Å
206	K	93.6	Very high	95.8	Very high	77 Å²	77	59.6 Å²	59.6	34%	0.335	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-25.4	175.1	-63.4	177.7	-177.9	170.3	0	112.6	D167 S168 E203 I204	D167-K206 CarbonylContact C-O 3.46Å; S168-K206 WeakPolarHBondContact CA-O 3.3Å; S168-K206 WeakPolarHBondContact CB-O 3.29Å; S168-K206 PolarHBondContact N-O 2.78Å; S168-K206 PolarHBondContact OG-O 2.99Å; E203-K206 WeakPolarHBondContact O-CB 3.45Å; E203-K206 PolarHBondContact O-N 2.81Å; E203-K206 IonicContact OE1-NZ 3.76Å; E203-K206 PolarHBondContact OE1-NZ 3.47Å; E203-K206 WeakPolarHBondContact OE2-CE 3.37Å; E203-K206 IonicContact OE2-NZ 3.98Å; E203-K206 PolarHBondContact OE2-NZ 3.15Å; I204-K206 PolarHBondContact O-N 3.12Å; I204-K206 VanDerWaalsContact O-N 3.15Å
207	L	94.2	Very high	96.1	Very high	79 Å²	79	56.3 Å²	56.3	41%	0.414	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.9	-26.1	-174.6	-62	175.4	0	0	0	113	D167 P171 V172 I204 R205	D167-L207 HydrophobicContact CB-CD2 3.79Å; P171-L207 CarbonylContact C-O 3.55Å; P171-L207 WeakPolarHBondContact CA-O 3.37Å; V172-L207 PolarHBondContact N-O 3.14Å; I204-L207 PolarHBondContact O-N 3.45Å; I204-L207 VanDerWaalsContact O-N 3.13Å; R205-L207 PolarHBondContact O-N 3.27Å
208	Y	96.8	Very high	96.1	Very high	38 Å²	38	60.6 Å²	60.6	15%	0.149	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	141.9	-170.1	-49.5	-74.4	0	0	0	112.9	F109 V172 L174 I184 I204 R205	F109-Y208 HydrophobicContact CE1-CE1 4.04Å; F109-Y208 WeakPolarHBondContact CE1-OH 3.32Å; F109-Y208 AromaticContact CZ-CE1 3.85Å; F109-Y208 HydrophobicContact CZ-CE1 3.85Å; F109-Y208 AromaticContact CZ-CZ 3.85Å; F109-Y208 WeakPolarHBondContact CZ-OH 3.27Å; V172-Y208 HydrophobicContact CB-CD1 3.94Å; V172-Y208 HydrophobicContact CB-CE1 4.4Å; V172-Y208 HydrophobicContact CG1-CD1 4.29Å; V172-Y208 CarbonylContact O-C 3.43Å; V172-Y208 VanDerWaalsContact O-CA 3.27Å; V172-Y208 WeakPolarHBondContact O-CA 3.49Å; L174-Y208 HydrophobicContact CD1-CD1 3.59Å; L174-Y208 HydrophobicContact CD1-CD2 4.46Å; L174-Y208 HydrophobicContact CD1-CE1 4.34Å; L174-Y208 HydrophobicContact CD1-CG 3.66Å; L174-Y208 HydrophobicContact CD2-CD1 4.49Å; L174-Y208 HydrophobicContact CG-CD1 3.95Å; L174-Y208 HydrophobicContact CG-CG 4.34Å; I184-Y208 HydrophobicContact CG2-CD2 4.09Å; I184-Y208 HydrophobicContact CG2-CE2 3.99Å; I204-Y208 HydrophobicContact CG2-CD2 4.15Å; I204-Y208 HydrophobicContact CG2-CG 4.49Å; I204-Y208 PolarHBondContact O-N 2.97Å; R205-Y208 WeakPolarHBondContact CA-O 3.22Å
209	W	96.1	Very high	96.2	Very high	86 Å²	86	62.5 Å²	62.5	33%	0.326	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	113.1	172.5	-169.3	-93.3	0	0	0	111.1	L143 V155 P171 V172 I173 L174	L143-W209 VanDerWaalsContact CD1-CD1 3.43Å; L143-W209 HydrophobicContact CD1-CG 4.48Å; L143-W209 HydrophobicContact CD2-CZ2 4.07Å; V155-W209 HydrophobicContact CG2-CB 3.57Å; V155-W209 HydrophobicContact CG2-CD2 4.39Å; V155-W209 HydrophobicContact CG2-CG 3.74Å; P171-W209 HydrophobicContact CB-CB 4.28Å; P171-W209 HydrophobicContact CG-CB 4.07Å; V172-W209 PolarHBondContact O-N 3.49Å; I173-W209 WeakPolarHBondContact CA-O 3.31Å; L174-W209 PolarHBondContact N-O 3.33Å
210	I	97.1	Very high	96.2	Very high	10 Å²	10	57.6 Å²	57.6	5%	0.051	25%	0.254	C	S	.	.			trans	-104.8	119	176.6	-57.8	168	0	0	0	108.7	L174 R176 T181 I185 I204 K212 G213 T216	L174-I210 HydrophobicContact CB-CG1 3.96Å; R176-I210 HydrophobicContact CB-CG2 4.07Å; T181-I210 HydrophobicContact CG2-CD1 3.56Å; T181-I210 HydrophobicContact CG2-CG1 3.94Å; T181-I210 HydrophobicContact CG2-CG2 4.33Å; I185-I210 HydrophobicContact CD1-CD1 3.91Å; I185-I210 HydrophobicContact CG1-CD1 4.2Å; I204-I210 HydrophobicContact CG2-CD1 3.93Å; I210-K212 PolarHBondContact O-N 3.07Å; I210-G213 VanDerWaalsContact O-CA 3.24Å; I210-G213 WeakPolarHBondContact O-CA 3.3Å; I210-G213 PolarHBondContact O-N 3.44Å; I210-T216 HydrophobicContact CG2-CG2 3.99Å
211	P	94.8	Very high	96.1	Very high	25 Å²	25	58.2 Å²	58.2	16%	0.162	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	132.7	172	-27	36.5	0	0	0	111.5	L140 L174 R176 G213	L140-P211 HydrophobicContact CD2-CG 3.89Å; L174-P211 WeakPolarHBondContact O-CD 3.37Å; R176-P211 WeakPolarHBondContact CB-O 3.47Å; P211-G213 PolarHBondContact O-N 2.92Å
212	K	95	Very high	95.9	Very high	149 Å²	149	63.2 Å²	63.2	65%	0.648	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	34.9	-171.7	-57.4	-179.7	177.9	179.4	0	112.9	I210 R214 T215 T216	I210-K212 PolarHBondContact O-N 3.07Å; K212-R214 VanDerWaalsContact C-N 3.32Å; K212-R214 PolarHBondContact O-N 3.46Å; K212-R214 VanDerWaalsContact O-N 3.12Å; K212-T215 PolarHBondContact O-N 3.21Å; K212-T216 PolarHBondContact O-N 3.37Å; K212-T216 VanDerWaalsContact O-N 3.07Å; K212-T216 PolarHBondContact O-OG1 2.89Å
213	G	95.3	Very high	95.7	Very high	5 Å²	5	62 Å²	62	5%	0.052	29%	0.286	C	S	.	.	H	α-helix	trans	-50	-41.3	-170	0	0	0	0	0	115.5	I210 P211 T215 T216 V217	I210-G213 VanDerWaalsContact O-CA 3.24Å; I210-G213 WeakPolarHBondContact O-CA 3.3Å; I210-G213 PolarHBondContact O-N 3.44Å; P211-G213 PolarHBondContact O-N 2.92Å; G213-T215 PolarHBondContact O-N 2.87Å; G213-T216 PolarHBondContact O-N 2.91Å; G213-V217 WeakPolarHBondContact O-CB 3.19Å; G213-V217 VanDerWaalsContact O-CG2 3.29Å; G213-V217 WeakPolarHBondContact O-CG2 3.43Å; G213-V217 PolarHBondContact O-N 2.87Å
214	R	96.7	Very high	95.6	Very high	125 Å²	125	59.7 Å²	59.7	47%	0.472	28%	0.275	S	S	.	.	H	α-helix	trans	-60	-45.8	177.8	-164.7	177.6	-157	176.3	2.7	112.8	D198 L201 K212 R218	D198-R214 VanDerWaalsContact CG-NH2 3.26Å; D198-R214 IonicContact OD1-CZ 2.97Å; D198-R214 IonicContact OD1-NE 3.56Å; D198-R214 PolarHBondContact OD1-NE 2.89Å; D198-R214 IonicContact OD1-NH2 2.85Å; D198-R214 PolarHBondContact OD1-NH2 3.04Å; D198-R214 VanDerWaalsContact OD1-NH2 3.12Å; D198-R214 IonicContact OD2-CZ 3.42Å; D198-R214 IonicContact OD2-NE 3.91Å; D198-R214 IonicContact OD2-NH2 2.95Å; D198-R214 PolarHBondContact OD2-NH2 3.38Å; L201-R214 HydrophobicContact CD2-CB 3.83Å; L201-R214 HydrophobicContact CD2-CG 4.22Å; K212-R214 VanDerWaalsContact C-N 3.32Å; K212-R214 PolarHBondContact O-N 3.46Å; K212-R214 VanDerWaalsContact O-N 3.12Å; R214-R218 WeakPolarHBondContact O-CB 2.98Å; R214-R218 WeakPolarHBondContact O-CG 3.42Å; R214-R218 PolarHBondContact O-N 2.76Å; R214-R218 VanDerWaalsContact O-N 3.1Å
215	T	97.3	Very high	95.2	Very high	100 Å²	100	65.5 Å²	65.5	61%	0.613	31%	0.306	S	S	*	.	H	α-helix	trans	-66.8	-41.8	177.6	-50.3	0	0	0	0	110.7	K212 G213 R218 R219	K212-T215 PolarHBondContact O-N 3.21Å; G213-T215 PolarHBondContact O-N 2.87Å; T215-R218 PolarHBondContact O-N 3.28Å; T215-R219 WeakPolarHBondContact O-CB 3.36Å; T215-R219 PolarHBondContact O-N 3.41Å
216	T	97.4	Very high	95	Very high	4 Å²	4	65.9 Å²	65.9	3%	0.025	31%	0.31	C	S	.	.	H	α-helix	trans	-62.6	-49	179.3	-54.6	0	0	0	0	111.9	R176 I185 I210 K212 G213 R219 I220	R176-T216 HydrophobicContact CB-CG2 4.25Å; R176-T216 WeakPolarHBondContact O-CG2 3.44Å; I185-T216 HydrophobicContact CD1-CG2 4.22Å; I210-T216 HydrophobicContact CG2-CG2 3.99Å; K212-T216 PolarHBondContact O-N 3.37Å; K212-T216 VanDerWaalsContact O-N 3.07Å; K212-T216 PolarHBondContact O-OG1 2.89Å; G213-T216 PolarHBondContact O-N 2.91Å; T216-R219 WeakPolarHBondContact O-CB 3.4Å; T216-R219 PolarHBondContact O-N 3.24Å; T216-I220 HydrophobicContact CG2-CD1 3.84Å; T216-I220 WeakPolarHBondContact O-CD1 3.3Å; T216-I220 WeakPolarHBondContact O-CG1 3.41Å; T216-I220 PolarHBondContact O-N 3.46Å; T216-I220 VanDerWaalsContact O-N 3.1Å
217	V	97.8	Very high	94.9	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.9	-47.1	178.1	173.4	0	0	0	0	110.8	I185 A197 T200 L201 I204 G213 R219 I220 L221	I185-V217 HydrophobicContact CD1-CG2 3.89Å; I185-V217 HydrophobicContact CG1-CG2 4.13Å; I185-V217 HydrophobicContact CG2-CG1 4.35Å; A197-V217 HydrophobicContact CB-CG1 4.09Å; A197-V217 WeakPolarHBondContact O-CG1 3.37Å; T200-V217 HydrophobicContact CG2-CG1 4.42Å; L201-V217 HydrophobicContact CB-CG2 4.34Å; L201-V217 HydrophobicContact CD1-CG2 4.03Å; I204-V217 HydrophobicContact CD1-CG2 4.38Å; G213-V217 WeakPolarHBondContact O-CB 3.19Å; G213-V217 VanDerWaalsContact O-CG2 3.29Å; G213-V217 WeakPolarHBondContact O-CG2 3.43Å; G213-V217 PolarHBondContact O-N 2.87Å; V217-R219 VanDerWaalsContact C-N 3.34Å; V217-R219 PolarHBondContact O-N 3.46Å; V217-I220 PolarHBondContact O-N 3.35Å; V217-L221 HydrophobicContact CG1-CD1 3.63Å; V217-L221 HydrophobicContact CG1-CG 4.17Å; V217-L221 WeakPolarHBondContact O-CB 3.49Å; V217-L221 WeakPolarHBondContact O-CG 3.44Å; V217-L221 PolarHBondContact O-N 3.36Å
218	R	96.6	Very high	94.5	Very high	113 Å²	113	65.5 Å²	65.5	43%	0.426	31%	0.308	S	S	.	.	H	α-helix	trans	-59.3	-43.8	176.8	-76	-178.6	177.6	-174.2	-2.5	112.2	A197 D198 R214 T215 I220 L221 N222	A197-R218 HydrophobicContact CB-CG 3.89Å; D198-R218 IonicContact OD1-NH2 3.68Å; D198-R218 IonicContact OD2-NH2 2.66Å; R214-R218 WeakPolarHBondContact O-CB 2.98Å; R214-R218 WeakPolarHBondContact O-CG 3.42Å; R214-R218 PolarHBondContact O-N 2.76Å; R214-R218 VanDerWaalsContact O-N 3.1Å; T215-R218 PolarHBondContact O-N 3.28Å; R218-I220 VanDerWaalsContact C-N 3.32Å; R218-I220 PolarHBondContact O-N 3.43Å; R218-L221 PolarHBondContact O-N 3.43Å; R218-N222 VanDerWaalsContact O-CB 3.22Å; R218-N222 WeakPolarHBondContact O-CB 3.39Å; R218-N222 PolarHBondContact O-N 2.93Å; R218-N222 PolarHBondContact O-ND2 3.36Å; R218-N222 PolarHBondContact O-OD1 3.34Å
219	R	96.9	Very high	93.9	Very high	102 Å²	102	72 Å²	72	39%	0.385	33%	0.332	S	S	.	.	H	α-helix	trans	-57.1	-45.7	177.1	179.1	-174.1	64.9	139.1	-2.5	111.8	R176 M177 T215 T216 V217 P223	R176-R219 PolarHBondContact O-NH2 3.07Å; M177-R219 VanDerWaalsContact CE-NH1 3.34Å; M177-R219 VanDerWaalsContact SD-CZ 3.56Å; M177-R219 PolarHBondContact SD-NH1 3.29Å; M177-R219 PolarHBondContact SD-NH2 2.89Å; T215-R219 WeakPolarHBondContact O-CB 3.36Å; T215-R219 PolarHBondContact O-N 3.41Å; T216-R219 WeakPolarHBondContact O-CB 3.4Å; T216-R219 PolarHBondContact O-N 3.24Å; V217-R219 VanDerWaalsContact C-N 3.34Å; V217-R219 PolarHBondContact O-N 3.46Å; R219-P223 WeakPolarHBondContact O-CD 3.03Å
220	I	96.2	Very high	93.1	Very high	10 Å²	10	73.5 Å²	73.5	5%	0.051	35%	0.347	C	S	.	.	H	α-helix	trans	-73.5	-36.5	-176.1	-69.6	160.3	0	0	0	111.8	E182 I185 T216 V217 R218 P223	E182-I220 HydrophobicContact CB-CD1 4.32Å; E182-I220 HydrophobicContact CG-CD1 3.78Å; E182-I220 HydrophobicContact CG-CG1 4.11Å; I185-I220 HydrophobicContact CB-CG2 4.25Å; I185-I220 HydrophobicContact CD1-CD1 3.34Å; I185-I220 HydrophobicContact CG1-CD1 4.49Å; I185-I220 HydrophobicContact CG2-CB 4.18Å; I185-I220 HydrophobicContact CG2-CG2 3.75Å; T216-I220 HydrophobicContact CG2-CD1 3.84Å; T216-I220 WeakPolarHBondContact O-CD1 3.3Å; T216-I220 WeakPolarHBondContact O-CG1 3.41Å; T216-I220 PolarHBondContact O-N 3.46Å; T216-I220 VanDerWaalsContact O-N 3.1Å; V217-I220 PolarHBondContact O-N 3.35Å; R218-I220 VanDerWaalsContact C-N 3.32Å; R218-I220 PolarHBondContact O-N 3.43Å; I220-P223 VanDerWaalsContact O-CD 3.3Å; I220-P223 WeakPolarHBondContact O-CD 3.45Å; I220-P223 WeakPolarHBondContact O-CG 3.04Å
221	L	95.7	Very high	92.2	Very high	14 Å²	14	80 Å²	80	7%	0.073	37%	0.371	C	S	.	.	H	α-helix	trans	-88.1	-21.8	-177.4	-61	-175.4	0	0	0	114.3	I185 W186 H189 A197 T200 V217 R218 P223 C224	I185-L221 HydrophobicContact CG2-CD1 4.48Å; I185-L221 HydrophobicContact CG2-CD2 3.85Å; I185-L221 HydrophobicContact CG2-CG 4.02Å; W186-L221 HydrophobicContact CE3-CD2 4.43Å; H189-L221 HydrophobicContact CB-CD1 4.26Å; H189-L221 HydrophobicContact CB-CD2 3.66Å; H189-L221 VanDerWaalsContact CG-CD2 3.48Å; A197-L221 HydrophobicContact CB-CD1 4.33Å; T200-L221 HydrophobicContact CG2-CD1 4.24Å; V217-L221 HydrophobicContact CG1-CD1 3.63Å; V217-L221 HydrophobicContact CG1-CG 4.17Å; V217-L221 WeakPolarHBondContact O-CB 3.49Å; V217-L221 WeakPolarHBondContact O-CG 3.44Å; V217-L221 PolarHBondContact O-N 3.36Å; R218-L221 PolarHBondContact O-N 3.43Å; L221-P223 VanDerWaalsContact C-CD 3.46Å; L221-P223 VanDerWaalsContact C-N 3.32Å; L221-C224 WeakPolarHBondContact O-CB 2.95Å; L221-C224 PolarHBondContact O-N 3.4Å
222	N	92.6	Very high	91.2	Very high	114 Å²	114	81.4 Å²	81.4	61%	0.61	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-41.2	175.1	-87.4	-6.3	0	0	0	114.8	R218 C224 K228	R218-N222 VanDerWaalsContact O-CB 3.22Å; R218-N222 WeakPolarHBondContact O-CB 3.39Å; R218-N222 PolarHBondContact O-N 2.93Å; R218-N222 PolarHBondContact O-ND2 3.36Å; R218-N222 PolarHBondContact O-OD1 3.34Å; N222-C224 PolarHBondContact O-N 3.5Å; N222-K228 WeakPolarHBondContact O-CE 3.3Å
223	P	92.1	Very high	90	Very high	76 Å²	76	82.9 Å²	82.9	49%	0.494	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-0.9	176.1	28.8	-35.8	0	0	0	114.7	R219 I220 L221 L225	R219-P223 WeakPolarHBondContact O-CD 3.03Å; I220-P223 VanDerWaalsContact O-CD 3.3Å; I220-P223 WeakPolarHBondContact O-CD 3.45Å; I220-P223 WeakPolarHBondContact O-CG 3.04Å; L221-P223 VanDerWaalsContact C-CD 3.46Å; L221-P223 VanDerWaalsContact C-N 3.32Å; P223-L225 PolarHBondContact O-N 3.47Å
224	C	93.3	Very high	88.9	Confident	4 Å²	4	87.3 Å²	87.3	3%	0.027	42%	0.419	C	S	.	.			trans	-60.5	108.5	-177.7	-178.1	0	0	0	0	112.6	W186 H189 H194 L221 N222 K226 C227 K228	W186-C224 HydrophobicContact CH2-CB 3.59Å; W186-C224 HydrophobicContact CZ3-CB 4.07Å; H189-C224 PolarHBondContact NE2-SG 2.9Å; H194-C224 PolarHBondContact ND1-SG 3.06Å; L221-C224 WeakPolarHBondContact O-CB 2.95Å; L221-C224 PolarHBondContact O-N 3.4Å; N222-C224 PolarHBondContact O-N 3.5Å; C224-K226 VanDerWaalsContact C-N 3.34Å; C224-K226 PolarHBondContact O-N 3.37Å; C224-C227 HydrophobicContact CB-CB 4Å; C224-C227 PolarHBondContact O-N 3.4Å; C224-C227 PolarHBondContact SG-SG 3.19Å; C224-K228 WeakPolarHBondContact O-CG 3.4Å; C224-K228 PolarHBondContact O-N 3.22Å
225	L	89.9	Confident	87.8	Confident	126 Å²	126	88.6 Å²	88.6	66%	0.66	43%	0.428	S	S	*	.	H	α-helix	trans	-63.3	-37.6	-177.6	-65.5	176.2	0	0	0	112.7	P223 K228 R229	P223-L225 PolarHBondContact O-N 3.47Å; L225-K228 PolarHBondContact O-N 3.01Å; L225-R229 WeakPolarHBondContact O-CB 3.5Å; L225-R229 PolarHBondContact O-N 3.17Å
226	K	90.1	Very high	86.6	Confident	126 Å²	126	86 Å²	86	55%	0.548	41%	0.413	S	S	.	.	H	α-helix	trans	-62.3	-47.5	176.1	-73.7	176.4	176	-177	0	111.1	H194 C224 R229 L230	H194-K226 VanDerWaalsContact CE1-CD 3.45Å; H194-K226 WeakPolarHBondContact CE1-CD 3.32Å; H194-K226 WeakPolarHBondContact NE2-CD 3.41Å; H194-K226 PolarHBondContact NE2-NZ 3.4Å; C224-K226 VanDerWaalsContact C-N 3.34Å; C224-K226 PolarHBondContact O-N 3.37Å; K226-R229 PolarHBondContact O-N 3.37Å; K226-L230 WeakPolarHBondContact O-CB 3.2Å; K226-L230 VanDerWaalsContact O-CG 3.26Å; K226-L230 WeakPolarHBondContact O-CG 3.43Å; K226-L230 PolarHBondContact O-N 2.95Å
227	C	90.6	Very high	85.6	Confident	24 Å²	24	88.2 Å²	88.2	16%	0.162	43%	0.427	C	S	.	.	H	α-helix	trans	-63.5	-44.2	175.1	-65.1	0	0	0	0	112	H189 C224 R229 L230 Y231	H189-C227 PolarHBondContact CE1-SG 2.99Å; H189-C227 PolarHBondContact NE2-SG 3.01Å; C224-C227 HydrophobicContact CB-CB 4Å; C224-C227 PolarHBondContact O-N 3.4Å; C224-C227 PolarHBondContact SG-SG 3.19Å; C227-R229 VanDerWaalsContact C-N 3.26Å; C227-R229 PolarHBondContact O-N 3.44Å; C227-L230 PolarHBondContact O-N 2.91Å; C227-Y231 HydrophobicContact CB-CD2 4.3Å; C227-Y231 WeakPolarHBondContact O-CD2 3.44Å; C227-Y231 PolarHBondContact O-N 3.3Å
228	K	86.9	Confident	84.8	Confident	125 Å²	125	93.7 Å²	93.7	54%	0.543	45%	0.448	S	S	.	.	H	α-helix	trans	-58.8	-38.7	177.1	-76.2	-171.3	-179.6	-171	0	111.8	N222 C224 L225 A232	N222-K228 WeakPolarHBondContact O-CE 3.3Å; C224-K228 WeakPolarHBondContact O-CG 3.4Å; C224-K228 PolarHBondContact O-N 3.22Å; L225-K228 PolarHBondContact O-N 3.01Å; K228-A232 WeakPolarHBondContact O-CA 3.06Å; K228-A232 WeakPolarHBondContact O-CB 3.44Å; K228-A232 PolarHBondContact O-N 3.26Å
229	R	82.9	Confident	83.9	Confident	173 Å²	173	91.3 Å²	91.3	65%	0.653	44%	0.442	S	S	*	.	H	α-helix	trans	-72.3	-47.4	177.3	-176.3	176.4	172.9	178.5	-4.1	112.1	L225 K226 C227 Y231	L225-R229 WeakPolarHBondContact O-CB 3.5Å; L225-R229 PolarHBondContact O-N 3.17Å; K226-R229 PolarHBondContact O-N 3.37Å; C227-R229 VanDerWaalsContact C-N 3.26Å; C227-R229 PolarHBondContact O-N 3.44Å; R229-Y231 PolarHBondContact O-N 3.36Å
230	L	79.6	Confident	83.1	Confident	119 Å²	119	90.2 Å²	90.2	62%	0.623	46%	0.455	S	S	*	.	H	α-helix	trans	-67.5	-34.8	-176	-72.9	169.5	0	0	0	113.2	K226 C227	K226-L230 WeakPolarHBondContact O-CB 3.2Å; K226-L230 VanDerWaalsContact O-CG 3.26Å; K226-L230 WeakPolarHBondContact O-CG 3.43Å; K226-L230 PolarHBondContact O-N 2.95Å; C227-L230 PolarHBondContact O-N 2.91Å
231	Y	77.5	Confident	82.5	Confident	146 Å²	146	93.4 Å²	93.4	57%	0.573	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	19.5	-173.7	-53.2	-67.7	0	0	0	112.9	C227 R229 F233	C227-Y231 HydrophobicContact CB-CD2 4.3Å; C227-Y231 WeakPolarHBondContact O-CD2 3.44Å; C227-Y231 PolarHBondContact O-N 3.3Å; R229-Y231 PolarHBondContact O-N 3.36Å; Y231-F233 WeakPolarHBondContact O-CD2 3.37Å
232	A	74.2	Confident	81.8	Confident	54 Å²	54	95.5 Å²	95.5	45%	0.446	49%	0.494	S	S	.	.			trans	-66.7	136.7	174.6	0	0	0	0	0	111.2	K228	K228-A232 WeakPolarHBondContact O-CA 3.06Å; K228-A232 WeakPolarHBondContact O-CB 3.44Å; K228-A232 PolarHBondContact O-N 3.26Å
233	F	71.3	Confident	81.3	Confident	181 Å²	181	92.5 Å²	92.5	79%	0.794	48%	0.481	S	S	*	.			trans	-113	142.9	166.4	-67	-83.9	0	0	0	109.3	Y231 K235	Y231-F233 WeakPolarHBondContact O-CD2 3.37Å; F233-K235 PolarHBondContact O-N 3.34Å; F233-K235 VanDerWaalsContact O-N 3.11Å
234	P	72.1	Confident	80.9	Confident	97 Å²	97	97.2 Å²	97.2	63%	0.63	49%	0.493	S	S	*	.			trans	-57.8	117.7	176.2	-22.4	32.3	0	0	0	110.5	T236	P234-T236 PolarHBondContact O-N 3.44Å
235	K	71.9	Confident	80.2	Confident	152 Å²	152	98.5 Å²	98.5	66%	0.661	50%	0.499	S	S	*	.			trans	-78.5	114	169.9	-71.2	-169.6	177.8	-176.8	0	108.2	F233 E481	F233-K235 PolarHBondContact O-N 3.34Å; F233-K235 VanDerWaalsContact O-N 3.11Å; K235-E481 VanDerWaalsContact CA-OE2 3.3Å; K235-E481 WeakPolarHBondContact CA-OE2 2.77Å; K235-E481 WeakPolarHBondContact CB-OE2 3.49Å
236	T	73.2	Confident	79.8	Confident	46 Å²	46	95.7 Å²	95.7	28%	0.282	48%	0.479	S	S	.	.			trans	-106.2	114.1	-176.9	48.9	0	0	0	0	108.2	P234 E481	P234-T236 PolarHBondContact O-N 3.44Å; T236-E481 PolarHBondContact N-OE2 2.87Å
237	P	76.4	Confident	79.3	Confident	51 Å²	51	93.1 Å²	93.1	33%	0.331	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-63.2	156.7	178.2	29.1	-34.7	0	0	0	109.3	M239 W477 N483	P237-M239 PolarHBondContact O-N 3.37Å; P237-W477 WeakPolarHBondContact O-CB 3.26Å; P237-N483 WeakPolarHBondContact CB-OD1 3.47Å
238	R	81.1	Confident	78.8	Confident	115 Å²	115	94 Å²	94	43%	0.434	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-53.4	136	175.7	-177.4	172.4	169.8	-172.1	1	109.3	A240 W477 N480	R238-A240 PolarHBondContact O-N 3.23Å; R238-W477 WeakPolarHBondContact CA-O 3.33Å; R238-N480 WeakPolarHBondContact CD-OD1 3.28Å; R238-N480 PolarHBondContact NH1-OD1 3.08Å
239	M	77.9	Confident	78.5	Confident	63 Å²	63	90.7 Å²	90.7	31%	0.31	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-50.6	139.9	177.5	-173.1	174.7	-75.9	0	0	109.6	P237 R474 K476 W477	P237-M239 PolarHBondContact O-N 3.37Å; M239-R474 PolarHBondContact O-NH1 2.88Å; M239-R474 PolarHBondContact O-NH2 3.47Å; M239-K476 HydrophobicContact CE-CB 3.93Å; M239-K476 WeakPolarHBondContact CE-O 3.4Å; M239-W477 HydrophobicContact CB-CB 4.42Å; M239-W477 HydrophobicContact CB-CE3 4.28Å; M239-W477 HydrophobicContact CE-CE3 4.1Å; M239-W477 PolarHBondContact N-O 2.87Å
240	A	79	Confident	78.3	Confident	78 Å²	78	85 Å²	85	65%	0.645	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-69.8	161.4	179.9	0	0	0	0	0	111.4	R238 R474	R238-A240 PolarHBondContact O-N 3.23Å; A240-R474 PolarHBondContact O-NH1 3.31Å
241	A	84	Confident	78.4	Confident	78 Å²	78	81.7 Å²	81.7	65%	0.645	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-64.4	154.4	166.8	0	0	0	0	0	110.2
242	L	81.5	Confident	78.8	Confident	58 Å²	58	79.3 Å²	79.3	30%	0.304	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-65.4	139.7	175	-67.1	179.5	0	0	0	110	L247 L471	L242-L247 HydrophobicContact CB-CD1 4.31Å; L242-L247 HydrophobicContact CB-CD2 4.48Å; L242-L247 HydrophobicContact CB-CG 4.36Å; L242-L247 HydrophobicContact CD1-CD2 4.22Å; L242-L471 HydrophobicContact CD1-CB 3.77Å; L242-L471 HydrophobicContact CD1-CD1 4.05Å; L242-L471 HydrophobicContact CD1-CG 4.43Å
243	P	81.8	Confident	79.4	Confident	51 Å²	51	77.7 Å²	77.7	33%	0.331	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-65.7	149.9	179.7	26.6	-33.9	0	0	0	111.3	F245 R246	P243-F245 VanDerWaalsContact C-N 3.27Å; P243-F245 HydrophobicContact CB-CD1 3.93Å; P243-F245 HydrophobicContact CB-CD2 4.36Å; P243-F245 HydrophobicContact CB-CE1 3.47Å; P243-F245 VanDerWaalsContact CB-CE1 3.47Å; P243-F245 HydrophobicContact CB-CE2 3.89Å; P243-F245 HydrophobicContact CB-CG 4.36Å; P243-F245 HydrophobicContact CB-CZ 3.45Å; P243-F245 VanDerWaalsContact CB-CZ 3.45Å; P243-F245 HydrophobicContact CG-CD1 4.44Å; P243-F245 HydrophobicContact CG-CD2 4.05Å; P243-F245 HydrophobicContact CG-CE1 3.84Å; P243-F245 HydrophobicContact CG-CE2 3.33Å; P243-F245 HydrophobicContact CG-CZ 3.23Å; P243-F245 PolarHBondContact O-N 3.22Å; P243-R246 HydrophobicContact CG-CB 4.13Å; P243-R246 WeakPolarHBondContact O-CA 3.38Å; P243-R246 VanDerWaalsContact O-CB 3.3Å; P243-R246 WeakPolarHBondContact O-CB 3.34Å; P243-R246 PolarHBondContact O-N 2.91Å
244	K	84	Confident	80.3	Confident	175 Å²	175	69.2 Å²	69.2	76%	0.761	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-52.9	-41.8	-175	-175.6	178.9	178.9	-177.9	0	113.2	R246 L247 T248	K244-R246 PolarHBondContact O-N 3.32Å; K244-R246 VanDerWaalsContact O-N 3.13Å; K244-L247 CarbonylContact O-C 3.59Å; K244-L247 PolarHBondContact O-N 2.88Å; K244-T248 PolarHBondContact O-N 3.18Å; K244-T248 VanDerWaalsContact O-N 3.08Å; K244-T248 PolarHBondContact O-OG1 3.28Å
245	F	79.1	Confident	81.2	Confident	31 Å²	31	65.9 Å²	65.9	14%	0.136	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-61.2	-22.5	178.4	56.1	-108.7	0	0	0	113.7	P243 L247 H256 L284 A285 W320	P243-F245 VanDerWaalsContact C-N 3.27Å; P243-F245 HydrophobicContact CB-CD1 3.93Å; P243-F245 HydrophobicContact CB-CD2 4.36Å; P243-F245 HydrophobicContact CB-CE1 3.47Å; P243-F245 VanDerWaalsContact CB-CE1 3.47Å; P243-F245 HydrophobicContact CB-CE2 3.89Å; P243-F245 HydrophobicContact CB-CG 4.36Å; P243-F245 HydrophobicContact CB-CZ 3.45Å; P243-F245 VanDerWaalsContact CB-CZ 3.45Å; P243-F245 HydrophobicContact CG-CD1 4.44Å; P243-F245 HydrophobicContact CG-CD2 4.05Å; P243-F245 HydrophobicContact CG-CE1 3.84Å; P243-F245 HydrophobicContact CG-CE2 3.33Å; P243-F245 HydrophobicContact CG-CZ 3.23Å; P243-F245 PolarHBondContact O-N 3.22Å; F245-L247 VanDerWaalsContact C-N 3.27Å; F245-H256 HydrophobicContact CB-CB 4.4Å; F245-H256 WeakPolarHBondContact CB-CD2 3.3Å; F245-H256 HydrophobicContact CD2-CB 4.3Å; F245-H256 HydrophobicContact CG-CB 4.26Å; F245-H256 AromaticContact CG-CD2 3.88Å; F245-H256 AromaticContact CG-CG 3.99Å; F245-L284 HydrophobicContact CD2-CB 3.83Å; F245-L284 HydrophobicContact CE2-CB 3.49Å; F245-L284 VanDerWaalsContact CE2-CB 3.49Å; F245-L284 HydrophobicContact CE2-CD1 3.8Å; F245-L284 HydrophobicContact CE2-CG 4.29Å; F245-L284 HydrophobicContact CZ-CB 4.41Å; F245-L284 HydrophobicContact CZ-CD1 3.9Å; F245-A285 VanDerWaalsContact O-CB 3.26Å; F245-A285 WeakPolarHBondContact O-CB 3.21Å; F245-W320 AromaticContact CE1-CZ2 3.73Å; F245-W320 HydrophobicContact CE1-CZ2 3.73Å; F245-W320 HydrophobicContact CZ-CZ2 4.21Å
246	R	79.8	Confident	81.9	Confident	67 Å²	67	60.6 Å²	60.6	25%	0.253	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-80.2	-12.8	176	-166.8	166.2	178.9	178.4	0.4	113.1	P243 K244 W464	P243-R246 HydrophobicContact CG-CB 4.13Å; P243-R246 WeakPolarHBondContact O-CA 3.38Å; P243-R246 VanDerWaalsContact O-CB 3.3Å; P243-R246 WeakPolarHBondContact O-CB 3.34Å; P243-R246 PolarHBondContact O-N 2.91Å; K244-R246 PolarHBondContact O-N 3.32Å; K244-R246 VanDerWaalsContact O-N 3.13Å; R246-W464 VanDerWaalsContact O-CH2 3.3Å; R246-W464 WeakPolarHBondContact O-CH2 2.99Å; R246-W464 WeakPolarHBondContact O-CZ2 3.36Å
247	L	80.9	Confident	82.6	Confident	71 Å²	71	58.4 Å²	58.4	37%	0.372	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-2.8	-176.1	-59.3	179.1	0	0	0	112.6	L242 K244 F245 P249 V468	L242-L247 HydrophobicContact CB-CD1 4.31Å; L242-L247 HydrophobicContact CB-CD2 4.48Å; L242-L247 HydrophobicContact CB-CG 4.36Å; L242-L247 HydrophobicContact CD1-CD2 4.22Å; K244-L247 CarbonylContact O-C 3.59Å; K244-L247 PolarHBondContact O-N 2.88Å; F245-L247 VanDerWaalsContact C-N 3.27Å; L247-P249 VanDerWaalsContact O-CD 3.27Å; L247-P249 WeakPolarHBondContact O-CD 3.36Å; L247-V468 HydrophobicContact CD2-CG1 4.09Å
248	T	80	Confident	83	Confident	42 Å²	42	56.6 Å²	56.6	26%	0.258	33%	0.329	S	S	.	.			trans	-92	110.7	-176.4	-54.5	0	0	0	0	110.3	K244 L251	K244-T248 PolarHBondContact O-N 3.18Å; K244-T248 VanDerWaalsContact O-N 3.08Å; K244-T248 PolarHBondContact O-OG1 3.28Å; T248-L251 HydrophobicContact CG2-CD1 3.91Å; T248-L251 HydrophobicContact CG2-CG 4.06Å
249	P	81	Confident	83.2	Confident	57 Å²	57	51.6 Å²	51.6	37%	0.37	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	162.5	174.7	32.8	-35.9	0	0	0	111.6	L247 L251 W461 W464 M465	L247-P249 VanDerWaalsContact O-CD 3.27Å; L247-P249 WeakPolarHBondContact O-CD 3.36Å; P249-L251 VanDerWaalsContact C-N 3.31Å; P249-L251 PolarHBondContact O-N 3.12Å; P249-W461 VanDerWaalsContact CA-CE3 3.47Å; P249-W461 HydrophobicContact CB-CB 4.35Å; P249-W461 HydrophobicContact CB-CD2 4.3Å; P249-W461 HydrophobicContact CB-CE3 3.76Å; P249-W461 HydrophobicContact CB-CZ3 4.46Å; P249-W464 HydrophobicContact CB-CE3 4.1Å; P249-W464 HydrophobicContact CB-CZ3 4Å; P249-M465 HydrophobicContact CB-CG 4.35Å; P249-M465 HydrophobicContact CB-SD 4.06Å; P249-M465 HydrophobicContact CG-CG 4.45Å; P249-M465 HydrophobicContact CG-SD 3.84Å
250	G	78.5	Confident	83.3	Confident	52 Å²	52	49.9 Å²	49.9	54%	0.536	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-8.1	171.2	0	0	0	0	0	115.6
251	L	82	Confident	83.4	Confident	51 Å²	51	46.9 Å²	46.9	27%	0.267	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-73.3	141	174	-66	176.8	0	0	0	110.7	T248 P249 T255 W461	T248-L251 HydrophobicContact CG2-CD1 3.91Å; T248-L251 HydrophobicContact CG2-CG 4.06Å; P249-L251 VanDerWaalsContact C-N 3.31Å; P249-L251 PolarHBondContact O-N 3.12Å; L251-T255 HydrophobicContact CD1-CG2 4.29Å; L251-W461 WeakPolarHBondContact O-CZ2 3.21Å
252	P	85.5	Confident	83.1	Confident	95 Å²	95	43.3 Å²	43.3	62%	0.617	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-53.5	146.9	171.8	-26	34.6	0	0	0	112.2	F254 T255	P252-F254 PolarHBondContact O-N 3.41Å; P252-T255 WeakPolarHBondContact O-CB 3.39Å; P252-T255 PolarHBondContact O-N 3.31Å; P252-T255 PolarHBondContact O-OG1 3.34Å
253	A	87.4	Confident	82.9	Confident	20 Å²	20	41.2 Å²	41.2	17%	0.165	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	145.1	170.2	0	0	0	0	0	109.6	T255 L425 L426	A253-T255 PolarHBondContact O-N 3.11Å; A253-L425 HydrophobicContact CB-CD2 3.67Å; A253-L425 HydrophobicContact CB-CG 4.04Å; A253-L426 HydrophobicContact CB-CD2 3.76Å
254	F	89.9	Confident	83	Confident	4 Å²	4	40.6 Å²	40.6	2%	0.018	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	17.3	-179.2	-54.2	-74.1	0	0	0	115.9	P252 H256 C257 C283 A288 H290 F309 R313 P316 L426	P252-F254 PolarHBondContact O-N 3.41Å; F254-H256 VanDerWaalsContact C-N 3.26Å; F254-H256 PolarHBondContact O-N 2.91Å; F254-C257 WeakPolarHBondContact CA-SG 3.47Å; F254-C257 WeakPolarHBondContact CB-SG 3.48Å; F254-C257 PolarHBondContact O-SG 3.39Å; F254-C283 HydrophobicContact CD1-CB 3.85Å; F254-C283 HydrophobicContact CE1-CB 4.12Å; F254-C283 HydrophobicContact CG-CB 4.37Å; F254-C283 PolarHBondContact N-SG 2.86Å; F254-A288 HydrophobicContact CE1-CB 4.37Å; F254-A288 WeakPolarHBondContact CE1-O 3.49Å; F254-A288 HydrophobicContact CE2-CB 4.41Å; F254-A288 HydrophobicContact CZ-CB 3.93Å; F254-H290 HydrophobicContact CE1-CB 4.2Å; F254-H290 HydrophobicContact CZ-CB 4.04Å; F254-F309 HydrophobicContact CB-CZ 3.93Å; F254-F309 AromaticContact CD1-CE2 3.93Å; F254-F309 HydrophobicContact CD1-CE2 3.93Å; F254-F309 AromaticContact CD1-CZ 3.92Å; F254-F309 HydrophobicContact CD1-CZ 3.92Å; F254-F309 HydrophobicContact CE1-CE2 4.26Å; F254-F309 HydrophobicContact CG-CE2 4.12Å; F254-F309 AromaticContact CG-CZ 3.99Å; F254-F309 HydrophobicContact CG-CZ 3.99Å; F254-R313 HydrophobicContact CD2-CB 3.86Å; F254-R313 HydrophobicContact CD2-CG 4.07Å; F254-R313 HydrophobicContact CE2-CB 4.27Å; F254-R313 HydrophobicContact CE2-CG 3.96Å; F254-R313 HydrophobicContact CG-CB 4.38Å; F254-P316 VanDerWaalsContact O-CB 3.24Å; F254-P316 WeakPolarHBondContact O-CB 3.42Å; F254-P316 WeakPolarHBondContact O-CG 3.38Å; F254-L426 HydrophobicContact CD2-CD2 4.31Å; F254-L426 HydrophobicContact CE2-CD2 3.55Å; F254-L426 HydrophobicContact CZ-CD2 4.35Å
255	T	89.8	Confident	82.9	Confident	26 Å²	26	34.1 Å²	34.1	16%	0.16	21%	0.206	C	C	.	.	S	Bend	trans	-58.2	-39.7	169.7	-61.1	0	0	0	0	112.2	L251 P252 A253 A317 A318	L251-T255 HydrophobicContact CD1-CG2 4.29Å; P252-T255 WeakPolarHBondContact O-CB 3.39Å; P252-T255 PolarHBondContact O-N 3.31Å; P252-T255 PolarHBondContact O-OG1 3.34Å; A253-T255 PolarHBondContact O-N 3.11Å; T255-A317 HydrophobicContact CG2-CB 3.96Å; T255-A317 WeakPolarHBondContact O-CB 3.36Å; T255-A317 PolarHBondContact O-N 2.95Å; T255-A318 PolarHBondContact O-N 3.49Å
256	H	88.2	Confident	83.3	Confident	41 Å²	41	38.8 Å²	38.8	19%	0.19	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125.9	170.6	-61.4	-76.2	0	0	0	109.2	F245 F254 C283 L284 A318	F245-H256 HydrophobicContact CB-CB 4.4Å; F245-H256 WeakPolarHBondContact CB-CD2 3.3Å; F245-H256 HydrophobicContact CD2-CB 4.3Å; F245-H256 HydrophobicContact CG-CB 4.26Å; F245-H256 AromaticContact CG-CD2 3.88Å; F245-H256 AromaticContact CG-CG 3.99Å; F254-H256 VanDerWaalsContact C-N 3.26Å; F254-H256 PolarHBondContact O-N 2.91Å; H256-C283 CarbonylContact O-C 3.52Å; H256-L284 HydrophobicContact CB-CB 4.24Å; H256-L284 HydrophobicContact CB-CD1 4.2Å; H256-L284 HydrophobicContact CB-CG 4.48Å; H256-L284 PolarHBondContact O-N 3.23Å; H256-A318 WeakPolarHBondContact CA-O 3.11Å
257	C	87	Confident	83.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.7	-169.6	-74.7	0	0	0	0	112.1	F254 T282 P316 A318 Y319 W320	F254-C257 WeakPolarHBondContact CA-SG 3.47Å; F254-C257 WeakPolarHBondContact CB-SG 3.48Å; F254-C257 PolarHBondContact O-SG 3.39Å; C257-T282 CarbonylContact C-O 3.5Å; C257-T282 WeakPolarHBondContact CA-O 3.26Å; C257-P316 HydrophobicContact CB-CG 4.43Å; C257-A318 PolarHBondContact N-O 3.19Å; C257-Y319 HydrophobicContact CB-CD1 3.73Å; C257-Y319 HydrophobicContact CB-CE1 4.01Å; C257-Y319 CarbonylContact O-C 3.56Å; C257-Y319 VanDerWaalsContact O-CA 3.28Å; C257-Y319 WeakPolarHBondContact O-CA 3.37Å; C257-W320 PolarHBondContact O-N 2.72Å
258	G	85.5	Confident	83.9	Confident	13 Å²	13	35 Å²	35	13%	0.134	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	135.7	160.7	0	0	0	0	0	109.6	F281 T282 W320	G258-F281 CarbonylContact O-C 2.95Å; G258-F281 WeakPolarHBondContact O-CA 3.33Å; G258-T282 PolarHBondContact N-O 2.65Å; G258-T282 PolarHBondContact O-N 2.81Å; G258-W320 CarbonylContact C-O 3.52Å; G258-W320 VanDerWaalsContact CA-O 3.23Å; G258-W320 WeakPolarHBondContact CA-O 3.44Å
259	V	84.2	Confident	84.1	Confident	11 Å²	11	34.4 Å²	34.4	7%	0.067	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131.6	176	-173.4	0	0	0	0	108.8	L280 F281 F302 Y319 W320 W357	V259-L280 WeakPolarHBondContact CA-O 3.19Å; V259-F281 HydrophobicContact CG1-CE1 4.15Å; V259-F281 HydrophobicContact CG2-CD1 3.87Å; V259-F281 HydrophobicContact CG2-CE1 3.81Å; V259-F302 HydrophobicContact CG1-CE2 3.92Å; V259-F302 HydrophobicContact CG1-CZ 4.28Å; V259-Y319 HydrophobicContact CG2-CD1 3.44Å; V259-Y319 VanDerWaalsContact CG2-CD1 3.44Å; V259-Y319 HydrophobicContact CG2-CE1 4.14Å; V259-Y319 HydrophobicContact CG2-CG 4.19Å; V259-W320 PolarHBondContact N-O 2.65Å; V259-W357 HydrophobicContact CB-CH2 4.13Å; V259-W357 HydrophobicContact CB-CZ2 4.49Å; V259-W357 HydrophobicContact CG1-CH2 4.27Å; V259-W357 HydrophobicContact CG2-CH2 3.84Å; V259-W357 HydrophobicContact CG2-CZ3 4.36Å
260	D	81.1	Confident	84.2	Confident	27 Å²	27	41.7 Å²	41.7	14%	0.144	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	161.7	177.2	-144.6	-34.8	0	0	0	111.8	C279 L280 H366 I370	D260-C279 CarbonylContact O-C 3.39Å; D260-C279 WeakPolarHBondContact O-CA 3.05Å; D260-L280 HydrophobicContact CB-CB 4.31Å; D260-L280 PolarHBondContact N-O 3.08Å; D260-L280 PolarHBondContact O-N 3.34Å; D260-H366 IonicContact OD2-CD2 3.82Å; D260-H366 PolarHBondContact OD2-CD2 3.1Å; D260-H366 IonicContact OD2-CG 3.88Å; D260-H366 IonicContact OD2-NE2 2.81Å; D260-H366 PolarHBondContact OD2-NE2 3.4Å; D260-I370 HydrophobicContact CB-CD1 4.12Å; D260-I370 WeakPolarHBondContact OD2-CD1 3.22Å
261	Y	80.2	Confident	84.4	Confident	15 Å²	15	51 Å²	51	6%	0.059	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144.3	178.4	-90.7	-85.4	0	0	0	111.3	W277 A278 C279 A294 L297 F302 I334 I338	Y261-W277 HydrophobicContact CD1-CB 4.04Å; Y261-W277 HydrophobicContact CE1-CB 4.35Å; Y261-A278 WeakPolarHBondContact CA-O 3.35Å; Y261-C279 HydrophobicContact CD1-CB 4.36Å; Y261-C279 HydrophobicContact CE1-CB 4.02Å; Y261-A294 HydrophobicContact CE1-CB 3.54Å; Y261-L297 HydrophobicContact CD1-CD2 3.79Å; Y261-L297 HydrophobicContact CE1-CD2 3.88Å; Y261-L297 HydrophobicContact CG-CD2 4.28Å; Y261-F302 AromaticContact CE2-CD2 3.73Å; Y261-F302 HydrophobicContact CE2-CD2 3.73Å; Y261-F302 HydrophobicContact CE2-CE2 4.22Å; Y261-F302 AromaticContact CZ-CD2 3.84Å; Y261-F302 WeakPolarHBondContact OH-CB 3.43Å; Y261-F302 WeakPolarHBondContact OH-CD2 3.27Å; Y261-I334 HydrophobicContact CG-CG2 4.45Å; Y261-I338 HydrophobicContact CD2-CD1 4.06Å; Y261-I338 HydrophobicContact CD2-CG1 4.29Å
262	F	78.3	Confident	84.7	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.009	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	155.8	172.5	64.6	-81.3	0	0	0	112.5	F265 A278 L280 L291 I370 A373 K374 L377 L395	F262-F265 HydrophobicContact CD2-CE2 4.05Å; F262-F265 AromaticContact CD2-CZ 3.79Å; F262-F265 HydrophobicContact CD2-CZ 3.79Å; F262-F265 HydrophobicContact CE2-CE2 4.02Å; F262-F265 AromaticContact CE2-CZ 3.69Å; F262-F265 HydrophobicContact CE2-CZ 3.69Å; F262-A278 HydrophobicContact CD1-CB 4.14Å; F262-A278 WeakPolarHBondContact CD1-O 3.32Å; F262-A278 HydrophobicContact CD2-CB 4.14Å; F262-A278 HydrophobicContact CE1-CB 3.56Å; F262-A278 HydrophobicContact CE2-CB 3.57Å; F262-A278 HydrophobicContact CG-CB 4.4Å; F262-A278 HydrophobicContact CZ-CB 3.27Å; F262-A278 PolarHBondContact N-O 3.13Å; F262-A278 PolarHBondContact O-N 2.92Å; F262-L280 HydrophobicContact CD1-CB 4.23Å; F262-L280 HydrophobicContact CE1-CB 3.93Å; F262-L291 HydrophobicContact CE1-CD2 3.71Å; F262-L291 HydrophobicContact CZ-CD2 3.78Å; F262-I370 HydrophobicContact CB-CG2 4.12Å; F262-I370 HydrophobicContact CG-CG2 4.42Å; F262-A373 HydrophobicContact CZ-CB 4.41Å; F262-K374 HydrophobicContact CD2-CG 4.05Å; F262-L377 HydrophobicContact CD2-CD1 4.47Å; F262-L377 HydrophobicContact CE2-CD1 3.35Å; F262-L377 HydrophobicContact CZ-CD1 3.86Å; F262-L395 HydrophobicContact CZ-CD2 4.32Å
263	G	77.5	Confident	84.8	Confident	14 Å²	14	58.3 Å²	58.3	14%	0.144	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	141	-155.1	-168.2	0	0	0	0	0	109.6
264	P	83.2	Confident	85	Confident	38 Å²	38	59.4 Å²	59.4	25%	0.247	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	cis	-70.8	151.5	-7.2	29.9	-34.1	0	0	0	112.3	K275 R276 W277	P264-K275 HydrophobicContact CB-CB 3.93Å; P264-K275 HydrophobicContact CB-CD 3.83Å; P264-K275 HydrophobicContact CB-CG 3.9Å; P264-K275 HydrophobicContact CG-CD 4.04Å; P264-K275 HydrophobicContact CG-CG 4.45Å; P264-R276 CarbonylContact C-O 3.52Å; P264-R276 WeakPolarHBondContact CA-O 3.12Å; P264-W277 HydrophobicContact CB-CZ2 4.32Å
265	F	82.3	Confident	84.9	Confident	40 Å²	40	63 Å²	63	18%	0.175	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	128.2	165.1	-58	-79.9	0	0	0	108	F262 V267 K275 R276 A278 L377 L391	F262-F265 HydrophobicContact CD2-CE2 4.05Å; F262-F265 AromaticContact CD2-CZ 3.79Å; F262-F265 HydrophobicContact CD2-CZ 3.79Å; F262-F265 HydrophobicContact CE2-CE2 4.02Å; F262-F265 AromaticContact CE2-CZ 3.69Å; F262-F265 HydrophobicContact CE2-CZ 3.69Å; F265-V267 HydrophobicContact CB-CG2 4.31Å; F265-K275 CarbonylContact O-C 3.6Å; F265-K275 WeakPolarHBondContact O-CA 3.17Å; F265-R276 PolarHBondContact N-O 3.14Å; F265-R276 PolarHBondContact O-N 3.42Å; F265-A278 HydrophobicContact CE2-CB 3.84Å; F265-L377 HydrophobicContact CE1-CD1 4.44Å; F265-L377 HydrophobicContact CZ-CD1 3.98Å; F265-L391 HydrophobicContact CB-CD1 4.41Å; F265-L391 HydrophobicContact CB-CD2 4.26Å; F265-L391 HydrophobicContact CD1-CD1 4.42Å; F265-L391 HydrophobicContact CD2-CD1 4.17Å; F265-L391 HydrophobicContact CD2-CD2 4.43Å; F265-L391 HydrophobicContact CG-CD1 4.07Å
266	E	86.8	Confident	84.9	Confident	128 Å²	128	62.9 Å²	62.9	60%	0.598	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	119.8	174.4	-57.1	-170.7	155.7	0	0	109.3	M273	E266-M273 HydrophobicContact CB-CE 3.45Å; E266-M273 VanDerWaalsContact CB-CE 3.45Å
267	V	86.7	Confident	84.9	Confident	0 Å²	0	62 Å²	62	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.6	-172.8	-178.2	0	0	0	0	109.3	F265 S269 V274 R276 L386 D388 L391	F265-V267 HydrophobicContact CB-CG2 4.31Å; V267-S269 PolarHBondContact O-N 3.08Å; V267-V274 PolarHBondContact N-O 3.46Å; V267-V274 WeakPolarHBondContact O-CG2 3.49Å; V267-V274 PolarHBondContact O-N 3.43Å; V267-R276 HydrophobicContact CB-CG 3.87Å; V267-R276 HydrophobicContact CG1-CG 4.49Å; V267-R276 HydrophobicContact CG2-CB 3.89Å; V267-R276 HydrophobicContact CG2-CG 3.5Å; V267-L386 CarbonylContact C-O 3.58Å; V267-L386 WeakPolarHBondContact CA-O 3.3Å; V267-L386 WeakPolarHBondContact CG1-O 3.48Å; V267-L386 HydrophobicContact CG2-CB 4.19Å; V267-D388 VanDerWaalsContact CG1-N 3.3Å; V267-L391 HydrophobicContact CG2-CD2 3.86Å
268	N	86.1	Confident	84.8	Confident	59 Å²	59	62 Å²	62	32%	0.316	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	112.5	169.9	-82.7	-46.8	0	0	0	109.4	M273 T385 L386	N268-M273 HydrophobicContact CB-SD 4.32Å; N268-M273 VanDerWaalsContact CG-SD 3.52Å; N268-M273 PolarHBondContact OD1-SD 2.77Å; N268-T385 WeakPolarHBondContact ND2-CG2 3.35Å; N268-L386 PolarHBondContact N-O 3.14Å
269	S	85.5	Confident	84.9	Confident	30 Å²	30	61.3 Å²	61.3	21%	0.21	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	106	170.7	-169.5	0	0	0	0	108.4	V267 R271 R272 V274	V267-S269 PolarHBondContact O-N 3.08Å; S269-R271 PolarHBondContact O-N 2.78Å; S269-R272 PolarHBondContact N-O 3.29Å; S269-R272 PolarHBondContact O-N 3.44Å; S269-R272 VanDerWaalsContact O-O 3.07Å; S269-V274 VanDerWaalsContact CB-CG2 3.46Å
270	F	82.4	Confident	85.1	Confident	209 Å²	209	61 Å²	61	92%	0.917	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	-105.1	-173.8	-60.3	-88.3	0	0	0	112.8
271	R	83.2	Confident	85.4	Confident	249 Å²	249	59.7 Å²	59.7	94%	0.94	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	9.7	-177.9	-61.3	-174	-178.2	175.5	1.1	113.4	S269	S269-R271 PolarHBondContact O-N 2.78Å
272	R	87.9	Confident	85.8	Confident	195 Å²	195	59.2 Å²	59.2	74%	0.736	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.6	-176	-63.3	-176.8	-178	174.6	0.9	111.4	S269 V274	S269-R272 PolarHBondContact N-O 3.29Å; S269-R272 PolarHBondContact O-N 3.44Å; S269-R272 VanDerWaalsContact O-O 3.07Å; R272-V274 HydrophobicContact CB-CG1 4.4Å
273	M	87.4	Confident	86.3	Confident	104 Å²	104	59.2 Å²	59.2	51%	0.512	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	124	164.7	-78.7	-71.2	-90.2	0	0	108.8	E266 N268	E266-M273 HydrophobicContact CB-CE 3.45Å; E266-M273 VanDerWaalsContact CB-CE 3.45Å; N268-M273 HydrophobicContact CB-SD 4.32Å; N268-M273 VanDerWaalsContact CG-SD 3.52Å; N268-M273 PolarHBondContact OD1-SD 2.77Å
274	V	91.1	Very high	86.7	Confident	42 Å²	42	59.8 Å²	59.8	26%	0.255	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	146.6	-178.2	-67.6	0	0	0	0	110	V267 S269 R272	V267-V274 PolarHBondContact N-O 3.46Å; V267-V274 WeakPolarHBondContact O-CG2 3.49Å; V267-V274 PolarHBondContact O-N 3.43Å; S269-V274 VanDerWaalsContact CB-CG2 3.46Å; R272-V274 HydrophobicContact CB-CG1 4.4Å
275	K	89.1	Confident	86.6	Confident	80 Å²	80	58.5 Å²	58.5	35%	0.348	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	139.5	174.4	-67	-178	-179.9	-179.8	0	109.9	P264 F265 W277 E333	P264-K275 HydrophobicContact CB-CB 3.93Å; P264-K275 HydrophobicContact CB-CD 3.83Å; P264-K275 HydrophobicContact CB-CG 3.9Å; P264-K275 HydrophobicContact CG-CD 4.04Å; P264-K275 HydrophobicContact CG-CG 4.45Å; F265-K275 CarbonylContact O-C 3.6Å; F265-K275 WeakPolarHBondContact O-CA 3.17Å; K275-W277 HydrophobicContact CB-CH2 3.49Å; K275-W277 VanDerWaalsContact CB-CH2 3.49Å; K275-W277 HydrophobicContact CB-CZ2 3.79Å; K275-W277 HydrophobicContact CB-CZ3 3.95Å; K275-W277 HydrophobicContact CD-CH2 4.31Å; K275-W277 HydrophobicContact CD-CZ2 4.04Å; K275-W277 WeakPolarHBondContact O-CZ3 3.19Å; K275-E333 VanDerWaalsContact NZ-CD 3.28Å; K275-E333 IonicContact NZ-OE1 2.74Å; K275-E333 PolarHBondContact NZ-OE1 3.02Å; K275-E333 IonicContact NZ-OE2 3.45Å; K275-E333 PolarHBondContact NZ-OE2 3.48Å
276	R	88.8	Confident	86.5	Confident	23 Å²	23	56.7 Å²	56.7	9%	0.087	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	157.2	168.8	-63.1	-63.1	-175.7	-107.4	-2.3	109.7	P264 F265 V267 V293 Y295 D388 L391	P264-R276 CarbonylContact C-O 3.52Å; P264-R276 WeakPolarHBondContact CA-O 3.12Å; F265-R276 PolarHBondContact N-O 3.14Å; F265-R276 PolarHBondContact O-N 3.42Å; V267-R276 HydrophobicContact CB-CG 3.87Å; V267-R276 HydrophobicContact CG1-CG 4.49Å; V267-R276 HydrophobicContact CG2-CB 3.89Å; V267-R276 HydrophobicContact CG2-CG 3.5Å; R276-V293 HydrophobicContact CB-CG1 4.46Å; R276-Y295 VanDerWaalsContact CZ-CD1 3.47Å; R276-Y295 VanDerWaalsContact NE-CD1 3.29Å; R276-Y295 PolarHBondContact NH1-O 3.18Å; R276-D388 IonicContact CZ-OD1 3.54Å; R276-D388 IonicContact CZ-OD2 3.13Å; R276-D388 IonicContact NE-OD1 3.03Å; R276-D388 PolarHBondContact NE-OD1 3.21Å; R276-D388 IonicContact NE-OD2 3.36Å; R276-D388 IonicContact NH2-OD1 3.47Å; R276-D388 PolarHBondContact NH2-OD1 3.29Å; R276-D388 IonicContact NH2-OD2 2.86Å; R276-D388 PolarHBondContact NH2-OD2 2.8Å; R276-L391 HydrophobicContact CB-CD2 3.56Å; R276-L391 HydrophobicContact CG-CD2 4.08Å
277	W	87.7	Confident	86.4	Confident	22 Å²	22	52.9 Å²	52.9	8%	0.083	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	159.6	176.4	-62.1	-97.4	0	0	0	109.5	Y261 P264 K275 A294 L297	Y261-W277 HydrophobicContact CD1-CB 4.04Å; Y261-W277 HydrophobicContact CE1-CB 4.35Å; P264-W277 HydrophobicContact CB-CZ2 4.32Å; K275-W277 HydrophobicContact CB-CH2 3.49Å; K275-W277 VanDerWaalsContact CB-CH2 3.49Å; K275-W277 HydrophobicContact CB-CZ2 3.79Å; K275-W277 HydrophobicContact CB-CZ3 3.95Å; K275-W277 HydrophobicContact CD-CH2 4.31Å; K275-W277 HydrophobicContact CD-CZ2 4.04Å; K275-W277 WeakPolarHBondContact O-CZ3 3.19Å; W277-A294 HydrophobicContact CB-CB 4.31Å; W277-A294 PolarHBondContact N-O 3.19Å; W277-A294 PolarHBondContact O-N 2.96Å; W277-L297 HydrophobicContact CB-CD2 4.11Å; W277-L297 HydrophobicContact CD2-CD1 3.94Å; W277-L297 HydrophobicContact CD2-CD2 3.92Å; W277-L297 HydrophobicContact CD2-CG 3.56Å; W277-L297 HydrophobicContact CE3-CG 3.99Å; W277-L297 HydrophobicContact CG-CD1 4.26Å; W277-L297 HydrophobicContact CG-CD2 3.7Å; W277-L297 HydrophobicContact CG-CG 3.91Å; W277-L297 HydrophobicContact CH2-CD1 4.41Å; W277-L297 HydrophobicContact CH2-CG 4.33Å; W277-L297 HydrophobicContact CZ2-CD1 3.63Å; W277-L297 HydrophobicContact CZ2-CG 3.94Å; W277-L297 HydrophobicContact CZ3-CG 4.37Å
278	A	86	Confident	86.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.2	171.4	0	0	0	0	0	108.7	Y261 F262 F265 E292 L395	Y261-A278 WeakPolarHBondContact CA-O 3.35Å; F262-A278 HydrophobicContact CD1-CB 4.14Å; F262-A278 WeakPolarHBondContact CD1-O 3.32Å; F262-A278 HydrophobicContact CD2-CB 4.14Å; F262-A278 HydrophobicContact CE1-CB 3.56Å; F262-A278 HydrophobicContact CE2-CB 3.57Å; F262-A278 HydrophobicContact CG-CB 4.4Å; F262-A278 HydrophobicContact CZ-CB 3.27Å; F262-A278 PolarHBondContact N-O 3.13Å; F262-A278 PolarHBondContact O-N 2.92Å; F265-A278 HydrophobicContact CE2-CB 3.84Å; A278-E292 CarbonylContact C-O 3.35Å; A278-E292 WeakPolarHBondContact CA-O 3.45Å; A278-L395 HydrophobicContact CB-CD1 3.87Å; A278-L395 HydrophobicContact CB-CD2 3.82Å
279	C	87.4	Confident	86.6	Confident	0 Å²	0	50 Å²	50	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	128.4	170.8	-167.9	0	0	0	0	109	D260 Y261 F281 L291 E292 V305	D260-C279 CarbonylContact O-C 3.39Å; D260-C279 WeakPolarHBondContact O-CA 3.05Å; Y261-C279 HydrophobicContact CD1-CB 4.36Å; Y261-C279 HydrophobicContact CE1-CB 4.02Å; C279-F281 HydrophobicContact CB-CE2 4.28Å; C279-L291 WeakPolarHBondContact O-CA 3.42Å; C279-E292 PolarHBondContact N-O 2.96Å; C279-E292 PolarHBondContact O-N 2.75Å; C279-V305 HydrophobicContact CB-CG1 3.51Å
280	L	87.6	Confident	87	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	114.2	177.7	173.2	63.2	0	0	0	109.5	V259 D260 F262 V289 L291 I370	V259-L280 WeakPolarHBondContact CA-O 3.19Å; D260-L280 HydrophobicContact CB-CB 4.31Å; D260-L280 PolarHBondContact N-O 3.08Å; D260-L280 PolarHBondContact O-N 3.34Å; F262-L280 HydrophobicContact CD1-CB 4.23Å; F262-L280 HydrophobicContact CE1-CB 3.93Å; L280-V289 HydrophobicContact CD1-CB 4.31Å; L280-V289 HydrophobicContact CD1-CG1 3.34Å; L280-V289 HydrophobicContact CD1-CG2 4.19Å; L280-L291 HydrophobicContact CB-CD2 4.05Å; L280-L291 HydrophobicContact CD1-CD2 3.6Å; L280-L291 HydrophobicContact CD1-CG 4.47Å; L280-L291 HydrophobicContact CG-CD2 4.44Å; L280-I370 HydrophobicContact CD2-CG1 3.72Å
281	F	89.2	Confident	87.4	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	129.5	164.6	-62.3	-87.5	0	0	0	108.8	G258 V259 C279 V289 H290 V305 F309 Y319	G258-F281 CarbonylContact O-C 2.95Å; G258-F281 WeakPolarHBondContact O-CA 3.33Å; V259-F281 HydrophobicContact CG1-CE1 4.15Å; V259-F281 HydrophobicContact CG2-CD1 3.87Å; V259-F281 HydrophobicContact CG2-CE1 3.81Å; C279-F281 HydrophobicContact CB-CE2 4.28Å; F281-V289 CarbonylContact O-C 3.55Å; F281-V289 WeakPolarHBondContact O-CA 3.49Å; F281-H290 HydrophobicContact CB-CB 4.18Å; F281-H290 PolarHBondContact N-O 2.93Å; F281-H290 PolarHBondContact O-N 3.07Å; F281-V305 HydrophobicContact CE2-CG1 3.69Å; F281-V305 HydrophobicContact CZ-CG1 3.9Å; F281-F309 HydrophobicContact CB-CD2 3.93Å; F281-F309 HydrophobicContact CB-CE2 3.66Å; F281-F309 HydrophobicContact CB-CZ 4.06Å; F281-F309 AromaticContact CD1-CD1 3.79Å; F281-F309 HydrophobicContact CD1-CD1 3.79Å; F281-F309 HydrophobicContact CD1-CD2 4.22Å; F281-F309 AromaticContact CD1-CE1 3.88Å; F281-F309 HydrophobicContact CD1-CE1 3.88Å; F281-F309 HydrophobicContact CD1-CE2 4.29Å; F281-F309 AromaticContact CD1-CG 3.96Å; F281-F309 HydrophobicContact CD1-CG 3.96Å; F281-F309 HydrophobicContact CD1-CZ 4.12Å; F281-F309 HydrophobicContact CD2-CB 3.96Å; F281-F309 HydrophobicContact CD2-CD1 4.43Å; F281-F309 AromaticContact CD2-CD2 3.74Å; F281-F309 HydrophobicContact CD2-CD2 3.74Å; F281-F309 HydrophobicContact CD2-CE2 4.35Å; F281-F309 AromaticContact CD2-CG 3.77Å; F281-F309 HydrophobicContact CD2-CG 3.77Å; F281-F309 HydrophobicContact CE1-CB 4.42Å; F281-F309 AromaticContact CE1-CD1 3.81Å; F281-F309 HydrophobicContact CE1-CD1 3.81Å; F281-F309 HydrophobicContact CE1-CE1 4.27Å; F281-F309 HydrophobicContact CE1-CG 4.06Å; F281-F309 HydrophobicContact CE2-CB 3.64Å; F281-F309 HydrophobicContact CE2-CD1 4.44Å; F281-F309 HydrophobicContact CE2-CD2 4.31Å; F281-F309 AromaticContact CE2-CG 3.87Å; F281-F309 HydrophobicContact CE2-CG 3.87Å; F281-F309 HydrophobicContact CG-CB 4.47Å; F281-F309 HydrophobicContact CG-CD1 4.11Å; F281-F309 AromaticContact CG-CD2 3.69Å; F281-F309 HydrophobicContact CG-CD2 3.69Å; F281-F309 HydrophobicContact CG-CE1 4.27Å; F281-F309 AromaticContact CG-CE2 3.85Å; F281-F309 HydrophobicContact CG-CE2 3.85Å; F281-F309 AromaticContact CG-CG 3.8Å; F281-F309 HydrophobicContact CG-CG 3.8Å; F281-F309 HydrophobicContact CG-CZ 4.14Å; F281-F309 HydrophobicContact CZ-CB 3.9Å; F281-F309 HydrophobicContact CZ-CD1 4.15Å; F281-F309 HydrophobicContact CZ-CG 4.02Å; F281-Y319 HydrophobicContact CD1-CE1 4.01Å; F281-Y319 HydrophobicContact CE1-CD1 4.5Å; F281-Y319 AromaticContact CE1-CE1 3.86Å; F281-Y319 HydrophobicContact CE1-CE1 3.86Å
282	T	88	Confident	87.9	Confident	6 Å²	6	28.2 Å²	28.2	4%	0.037	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125	174.5	-44.5	0	0	0	0	111.4	C257 G258 L284 R287 A288 V289 L369	C257-T282 CarbonylContact C-O 3.5Å; C257-T282 WeakPolarHBondContact CA-O 3.26Å; G258-T282 PolarHBondContact N-O 2.65Å; G258-T282 PolarHBondContact O-N 2.81Å; T282-L284 PolarHBondContact O-N 3.13Å; T282-R287 VanDerWaalsContact CG2-CZ 3.48Å; T282-R287 WeakPolarHBondContact CG2-O 3.08Å; T282-A288 CarbonylContact C-O 3.51Å; T282-A288 WeakPolarHBondContact CA-O 3.44Å; T282-A288 WeakPolarHBondContact CG2-O 3.26Å; T282-V289 HydrophobicContact CG2-CG2 4.13Å; T282-L369 HydrophobicContact CG2-CD1 3.42Å; T282-L369 VanDerWaalsContact CG2-CD1 3.42Å
283	C	88.4	Confident	88.1	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.007	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	124.9	169.6	-176.7	0	0	0	0	110.1	F254 H256 A285 T286 R287 A288	F254-C283 HydrophobicContact CD1-CB 3.85Å; F254-C283 HydrophobicContact CE1-CB 4.12Å; F254-C283 HydrophobicContact CG-CB 4.37Å; F254-C283 PolarHBondContact N-SG 2.86Å; H256-C283 CarbonylContact O-C 3.52Å; C283-A285 VanDerWaalsContact C-N 3.34Å; C283-T286 PolarHBondContact SG-N 2.85Å; C283-T286 PolarHBondContact SG-OG1 2.82Å; C283-T286 VanDerWaalsContact SG-OG1 3.37Å; C283-R287 WeakPolarHBondContact O-CA 3.29Å; C283-R287 PolarHBondContact O-N 3.46Å; C283-R287 PolarHBondContact O-NH1 3.18Å; C283-A288 HydrophobicContact CB-CB 4.09Å; C283-A288 PolarHBondContact N-O 3Å
284	L	84.9	Confident	88.2	Confident	27 Å²	27	14.2 Å²	14.2	14%	0.141	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-23.2	-178.2	-60.6	-179	0	0	0	112.7	F245 H256 T282 W320	F245-L284 HydrophobicContact CD2-CB 3.83Å; F245-L284 HydrophobicContact CE2-CB 3.49Å; F245-L284 VanDerWaalsContact CE2-CB 3.49Å; F245-L284 HydrophobicContact CE2-CD1 3.8Å; F245-L284 HydrophobicContact CE2-CG 4.29Å; F245-L284 HydrophobicContact CZ-CB 4.41Å; F245-L284 HydrophobicContact CZ-CD1 3.9Å; H256-L284 HydrophobicContact CB-CB 4.24Å; H256-L284 HydrophobicContact CB-CD1 4.2Å; H256-L284 HydrophobicContact CB-CG 4.48Å; H256-L284 PolarHBondContact O-N 3.23Å; T282-L284 PolarHBondContact O-N 3.13Å; L284-W320 HydrophobicContact CD1-CB 3.98Å; L284-W320 HydrophobicContact CD1-CD2 4.27Å; L284-W320 HydrophobicContact CD1-CG 3.6Å
285	A	81.5	Confident	88.2	Confident	11 Å²	11	16.9 Å²	16.9	9%	0.091	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-61.6	174.3	0	0	0	0	0	111.2	F245 C283	F245-A285 VanDerWaalsContact O-CB 3.26Å; F245-A285 WeakPolarHBondContact O-CB 3.21Å; C283-A285 VanDerWaalsContact C-N 3.34Å
286	T	80.7	Confident	88.1	Confident	2 Å²	2	15.8 Å²	15.8	1%	0.012	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-26.1	-171.4	66.2	0	0	0	0	112.5	C283 A288 F422 L425 F460 W461	C283-T286 PolarHBondContact SG-N 2.85Å; C283-T286 PolarHBondContact SG-OG1 2.82Å; C283-T286 VanDerWaalsContact SG-OG1 3.37Å; T286-A288 VanDerWaalsContact C-N 3.34Å; T286-A288 PolarHBondContact OG1-N 2.75Å; T286-F422 WeakPolarHBondContact O-CE1 3.36Å; T286-F422 VanDerWaalsContact O-CZ 3.31Å; T286-F422 WeakPolarHBondContact O-CZ 3.33Å; T286-L425 HydrophobicContact CG2-CD2 3.58Å; T286-F460 HydrophobicContact CG2-CE1 4.23Å; T286-F460 HydrophobicContact CG2-CZ 4.35Å; T286-W461 HydrophobicContact CG2-CH2 3.57Å; T286-W461 HydrophobicContact CG2-CZ2 4.3Å; T286-W461 HydrophobicContact CG2-CZ3 4.23Å
287	R	84.1	Confident	87.8	Confident	47 Å²	47	15.5 Å²	15.5	18%	0.177	7%	0.074	C	C	.	.			trans	80.1	5.6	-169	-44.5	-57.4	-62.5	137.3	-6.7	114.6	T282 C283 R405 F422	T282-R287 VanDerWaalsContact CG2-CZ 3.48Å; T282-R287 WeakPolarHBondContact CG2-O 3.08Å; C283-R287 WeakPolarHBondContact O-CA 3.29Å; C283-R287 PolarHBondContact O-N 3.46Å; C283-R287 PolarHBondContact O-NH1 3.18Å; R287-R405 PolarHBondContact O-NH2 3.34Å; R287-F422 HydrophobicContact CB-CE1 4.41Å; R287-F422 HydrophobicContact CB-CZ 4.13Å
288	A	88	Confident	87.5	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.088	C	C	.	.			trans	-50.5	144.6	168.5	0	0	0	0	0	111.6	F254 T282 C283 T286 F422 L426	F254-A288 HydrophobicContact CE1-CB 4.37Å; F254-A288 WeakPolarHBondContact CE1-O 3.49Å; F254-A288 HydrophobicContact CE2-CB 4.41Å; F254-A288 HydrophobicContact CZ-CB 3.93Å; T282-A288 CarbonylContact C-O 3.51Å; T282-A288 WeakPolarHBondContact CA-O 3.44Å; T282-A288 WeakPolarHBondContact CG2-O 3.26Å; C283-A288 HydrophobicContact CB-CB 4.09Å; C283-A288 PolarHBondContact N-O 3Å; T286-A288 VanDerWaalsContact C-N 3.34Å; T286-A288 PolarHBondContact OG1-N 2.75Å; A288-F422 HydrophobicContact CB-CB 4.24Å; A288-F422 HydrophobicContact CB-CD1 4.33Å; A288-F422 HydrophobicContact CB-CG 4.41Å; A288-L426 HydrophobicContact CB-CD1 4.16Å; A288-L426 HydrophobicContact CB-CD2 4.32Å; A288-L426 HydrophobicContact CB-CG 4.4Å
289	V	90.2	Very high	86.9	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	142.3	-173.2	167	0	0	0	0	110.2	L280 F281 T282 L291 L369 E399 L402 N403	L280-V289 HydrophobicContact CD1-CB 4.31Å; L280-V289 HydrophobicContact CD1-CG1 3.34Å; L280-V289 HydrophobicContact CD1-CG2 4.19Å; F281-V289 CarbonylContact O-C 3.55Å; F281-V289 WeakPolarHBondContact O-CA 3.49Å; T282-V289 HydrophobicContact CG2-CG2 4.13Å; V289-L291 HydrophobicContact CG1-CD2 4.39Å; V289-L291 HydrophobicContact CG1-CG 4.05Å; V289-L369 HydrophobicContact CG2-CD1 4.31Å; V289-E399 WeakPolarHBondContact O-CG 3.31Å; V289-L402 HydrophobicContact CB-CB 4.43Å; V289-L402 HydrophobicContact CG1-CD1 3.95Å; V289-N403 PolarHBondContact N-OD1 3.09Å; V289-N403 PolarHBondContact O-ND2 3.41Å
290	H	92.5	Very high	86.5	Confident	4 Å²	4	23.1 Å²	23.1	2%	0.019	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.1	165.7	-174.7	97.5	0	0	0	109.3	F254 F281 E292 F309 R313 E399	F254-H290 HydrophobicContact CE1-CB 4.2Å; F254-H290 HydrophobicContact CZ-CB 4.04Å; F281-H290 HydrophobicContact CB-CB 4.18Å; F281-H290 PolarHBondContact N-O 2.93Å; F281-H290 PolarHBondContact O-N 3.07Å; H290-E292 IonicContact CE1-OE1 3.89Å; H290-E292 WeakPolarHBondContact NE2-CG 3.43Å; H290-E292 IonicContact NE2-OE1 3.11Å; H290-E292 PolarHBondContact NE2-OE1 3.09Å; H290-F309 HydrophobicContact CB-CD2 3.92Å; H290-F309 HydrophobicContact CB-CE2 3.92Å; H290-F309 AromaticContact CD2-CD2 3.57Å; H290-F309 AromaticContact CG-CD2 3.68Å; H290-R313 HydrophobicContact CB-CG 4.39Å; H290-R313 PolarHBondContact ND1-NE 3.48Å; H290-E399 VanDerWaalsContact CA-OE2 3.3Å; H290-E399 WeakPolarHBondContact CA-OE2 3.48Å; H290-E399 IonicContact CE1-OE2 3.69Å; H290-E399 IonicContact CG-OE2 3.43Å; H290-E399 IonicContact ND1-OE1 3.31Å; H290-E399 IonicContact ND1-OE2 3.48Å
291	L	91.6	Very high	86.5	Confident	7 Å²	7	23.7 Å²	23.7	4%	0.037	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	136.1	-176.8	-69.1	174.6	0	0	0	111.1	F262 C279 L280 V289 L395 V398 E399 L402	F262-L291 HydrophobicContact CE1-CD2 3.71Å; F262-L291 HydrophobicContact CZ-CD2 3.78Å; C279-L291 WeakPolarHBondContact O-CA 3.42Å; L280-L291 HydrophobicContact CB-CD2 4.05Å; L280-L291 HydrophobicContact CD1-CD2 3.6Å; L280-L291 HydrophobicContact CD1-CG 4.47Å; L280-L291 HydrophobicContact CG-CD2 4.44Å; V289-L291 HydrophobicContact CG1-CD2 4.39Å; V289-L291 HydrophobicContact CG1-CG 4.05Å; L291-L395 HydrophobicContact CB-CB 4.06Å; L291-L395 HydrophobicContact CB-CD2 4.4Å; L291-L395 HydrophobicContact CD1-CD2 4.12Å; L291-V398 HydrophobicContact CD1-CB 4.29Å; L291-V398 HydrophobicContact CD1-CG1 3.98Å; L291-E399 HydrophobicContact CB-CB 4.47Å; L291-E399 HydrophobicContact CD1-CB 4.26Å; L291-E399 HydrophobicContact CG-CB 4.44Å; L291-E399 PolarHBondContact N-OE2 2.92Å; L291-L402 HydrophobicContact CD1-CD1 4.5Å
292	E	93	Very high	86.3	Confident	18 Å²	18	23.8 Å²	23.8	8%	0.084	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	144.5	177.9	-77.2	-69.9	163.6	0	0	111.1	A278 C279 H290 V305 R308 R312	A278-E292 CarbonylContact C-O 3.35Å; A278-E292 WeakPolarHBondContact CA-O 3.45Å; C279-E292 PolarHBondContact N-O 2.96Å; C279-E292 PolarHBondContact O-N 2.75Å; H290-E292 IonicContact CE1-OE1 3.89Å; H290-E292 WeakPolarHBondContact NE2-CG 3.43Å; H290-E292 IonicContact NE2-OE1 3.11Å; H290-E292 PolarHBondContact NE2-OE1 3.09Å; E292-V305 HydrophobicContact CB-CG1 3.76Å; E292-V305 HydrophobicContact CB-CG2 4.47Å; E292-V305 HydrophobicContact CG-CG1 4.42Å; E292-R308 IonicContact OE2-CZ 2.72Å; E292-R308 IonicContact OE2-NE 2.65Å; E292-R308 PolarHBondContact OE2-NE 2.95Å; E292-R308 IonicContact OE2-NH2 3.97Å; E292-R308 PolarHBondContact OE2-NH2 3.43Å; E292-R312 IonicContact OE1-NE 2.71Å; E292-R312 PolarHBondContact OE1-NE 2.86Å
293	V	92.1	Very high	86	Confident	6 Å²	6	25.2 Å²	25.2	4%	0.036	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	129	173.3	-176.7	0	0	0	0	110.2	R276 Y295 V305 R308 L391 L395	R276-V293 HydrophobicContact CB-CG1 4.46Å; V293-Y295 HydrophobicContact CG1-CD2 4.25Å; V293-Y295 HydrophobicContact CG1-CE2 4.1Å; V293-V305 WeakPolarHBondContact O-CG2 3.26Å; V293-R308 PolarHBondContact O-NH2 3.21Å; V293-L391 HydrophobicContact CG1-CD2 4.02Å; V293-L391 HydrophobicContact CG2-CD2 4.28Å; V293-L391 HydrophobicContact CG2-CG 4.06Å; V293-L395 HydrophobicContact CB-CD1 4.4Å; V293-L395 HydrophobicContact CG2-CD1 3.46Å; V293-L395 VanDerWaalsContact CG2-CD1 3.46Å
294	A	90.1	Very high	86	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	127.9	165	0	0	0	0	0	109.7	Y261 W277 V305	Y261-A294 HydrophobicContact CE1-CB 3.54Å; W277-A294 HydrophobicContact CB-CB 4.31Å; W277-A294 PolarHBondContact N-O 3.19Å; W277-A294 PolarHBondContact O-N 2.96Å; A294-V305 HydrophobicContact CB-CG2 3.88Å
295	Y	90.3	Very high	86.2	Confident	98 Å²	98	26.8 Å²	26.8	38%	0.384	14%	0.143	S	C	.	.	S	Bend	trans	-78.7	-28.3	-175.7	-78.6	-108.5	0	0	0	112.2	R276 V293 S301 D388	R276-Y295 VanDerWaalsContact CZ-CD1 3.47Å; R276-Y295 VanDerWaalsContact NE-CD1 3.29Å; R276-Y295 PolarHBondContact NH1-O 3.18Å; V293-Y295 HydrophobicContact CG1-CD2 4.25Å; V293-Y295 HydrophobicContact CG1-CE2 4.1Å; Y295-S301 PolarHBondContact N-OG 2.95Å; Y295-D388 HydrophobicContact CE1-CB 4.41Å
296	T	87.3	Confident	86.5	Confident	56 Å²	56	26.5 Å²	26.5	34%	0.344	14%	0.139	S	C	.	.	S	Bend	trans	-145.7	165.4	-178.7	49.8	0	0	0	0	108.3	D298 S301	T296-D298 VanDerWaalsContact C-N 3.34Å; T296-D298 WeakPolarHBondContact CB-OD2 3.34Å; T296-D298 PolarHBondContact OG1-OD1 2.76Å; T296-D298 PolarHBondContact OG1-OD2 3.01Å; T296-S301 PolarHBondContact N-OG 2.92Å; T296-S301 VanDerWaalsContact N-OG 3.16Å; T296-S301 WeakPolarHBondContact O-CB 3.4Å; T296-S301 PolarHBondContact O-OG 3.37Å; T296-S301 WeakPolarHBondContact OG1-CB 3.49Å; T296-S301 PolarHBondContact OG1-OG 2.87Å; T296-S301 VanDerWaalsContact OG1-OG 3.1Å
297	L	83.4	Confident	86.8	Confident	18 Å²	18	32 Å²	32	9%	0.094	16%	0.163	C	C	.	.	S	Bend	trans	-101.4	46.7	172.4	-63.7	168.5	0	0	0	110.7	Y261 W277 I334 C337	Y261-L297 HydrophobicContact CD1-CD2 3.79Å; Y261-L297 HydrophobicContact CE1-CD2 3.88Å; Y261-L297 HydrophobicContact CG-CD2 4.28Å; W277-L297 HydrophobicContact CB-CD2 4.11Å; W277-L297 HydrophobicContact CD2-CD1 3.94Å; W277-L297 HydrophobicContact CD2-CD2 3.92Å; W277-L297 HydrophobicContact CD2-CG 3.56Å; W277-L297 HydrophobicContact CE3-CG 3.99Å; W277-L297 HydrophobicContact CG-CD1 4.26Å; W277-L297 HydrophobicContact CG-CD2 3.7Å; W277-L297 HydrophobicContact CG-CG 3.91Å; W277-L297 HydrophobicContact CH2-CD1 4.41Å; W277-L297 HydrophobicContact CH2-CG 4.33Å; W277-L297 HydrophobicContact CZ2-CD1 3.63Å; W277-L297 HydrophobicContact CZ2-CG 3.94Å; W277-L297 HydrophobicContact CZ3-CG 4.37Å; L297-I334 HydrophobicContact CD1-CB 4.43Å; L297-I334 HydrophobicContact CD1-CG1 4.08Å; L297-C337 HydrophobicContact CB-CB 3.38Å; L297-C337 HydrophobicContact CD1-CB 3.75Å; L297-C337 HydrophobicContact CG-CB 4.19Å
298	D	80.6	Confident	87.3	Confident	69 Å²	69	33.3 Å²	33.3	37%	0.369	17%	0.168	S	C	.	.	S	Bend	trans	-108.9	169	172.9	62.7	47.4	0	0	0	110.9	T296 D300 S301 F302 L341	T296-D298 VanDerWaalsContact C-N 3.34Å; T296-D298 WeakPolarHBondContact CB-OD2 3.34Å; T296-D298 PolarHBondContact OG1-OD1 2.76Å; T296-D298 PolarHBondContact OG1-OD2 3.01Å; D298-D300 VanDerWaalsContact C-N 3.32Å; D298-D300 PolarHBondContact O-N 3.04Å; D298-D300 PolarHBondContact OD1-N 2.65Å; D298-S301 WeakPolarHBondContact OD1-CB 3.27Å; D298-S301 PolarHBondContact OD1-N 3.23Å; D298-F302 PolarHBondContact O-N 3.28Å; D298-F302 VanDerWaalsContact O-N 3.1Å; D298-L341 VanDerWaalsContact C-CD2 3.44Å; D298-L341 WeakPolarHBondContact O-CD2 3.12Å
299	T	73.6	Confident	87.5	Confident	19 Å²	19	33.3 Å²	33.3	12%	0.117	17%	0.168	C	C	.	.	H	α-helix	trans	-61.4	-39.3	-175.9	-51.4	0	0	0	0	112.2	F302 L303 D342 K345 I346	T299-F302 PolarHBondContact O-N 3.16Å; T299-L303 HydrophobicContact CG2-CD1 4.11Å; T299-L303 HydrophobicContact CG2-CG 4.37Å; T299-L303 WeakPolarHBondContact O-CB 3.17Å; T299-L303 VanDerWaalsContact O-CG 3.27Å; T299-L303 WeakPolarHBondContact O-CG 3.3Å; T299-L303 PolarHBondContact O-N 3.46Å; T299-D342 HydrophobicContact CG2-CB 4.41Å; T299-D342 PolarHBondContact OG1-N 3.03Å; T299-D342 VanDerWaalsContact OG1-N 3.08Å; T299-K345 HydrophobicContact CG2-CD 4.16Å; T299-I346 HydrophobicContact CG2-CD1 4.23Å; T299-I346 HydrophobicContact CG2-CG1 3.94Å
300	D	80.2	Confident	87.4	Confident	94 Å²	94	33.5 Å²	33.5	50%	0.503	17%	0.169	S	C	.	.	H	α-helix	trans	-75.2	-35.7	-173.7	-62.7	-26.9	0	0	0	111.7	D298 L303 S304 K345	D298-D300 VanDerWaalsContact C-N 3.32Å; D298-D300 PolarHBondContact O-N 3.04Å; D298-D300 PolarHBondContact OD1-N 2.65Å; D300-L303 PolarHBondContact O-N 3.44Å; D300-S304 WeakPolarHBondContact O-CB 3.36Å; D300-S304 PolarHBondContact O-N 3.32Å; D300-S304 PolarHBondContact O-OG 3.12Å; D300-K345 IonicContact OD1-NZ 2.76Å; D300-K345 PolarHBondContact OD1-NZ 3.34Å
301	S	86.7	Confident	87.5	Confident	14 Å²	14	39.1 Å²	39.1	10%	0.098	20%	0.195	C	C	.	.	H	α-helix	trans	-64.8	-41.3	171.6	-151	0	0	0	0	111.3	Y295 T296 D298 S304 V305	Y295-S301 PolarHBondContact N-OG 2.95Å; T296-S301 PolarHBondContact N-OG 2.92Å; T296-S301 VanDerWaalsContact N-OG 3.16Å; T296-S301 WeakPolarHBondContact O-CB 3.4Å; T296-S301 PolarHBondContact O-OG 3.37Å; T296-S301 WeakPolarHBondContact OG1-CB 3.49Å; T296-S301 PolarHBondContact OG1-OG 2.87Å; T296-S301 VanDerWaalsContact OG1-OG 3.1Å; D298-S301 WeakPolarHBondContact OD1-CB 3.27Å; D298-S301 PolarHBondContact OD1-N 3.23Å; S301-S304 WeakPolarHBondContact O-CB 3.22Å; S301-S304 PolarHBondContact O-N 2.7Å; S301-V305 VanDerWaalsContact O-CG2 3.29Å; S301-V305 WeakPolarHBondContact O-CG2 3.43Å; S301-V305 PolarHBondContact O-N 2.86Å
302	F	85.1	Confident	87.5	Confident	3 Å²	3	46.8 Å²	46.8	1%	0.013	22%	0.224	C	C	.	.	H	α-helix	trans	-66	-43.7	174.3	177.6	-114.5	0	0	0	112.2	V259 Y261 D298 T299 S304 V305 L306 L341 I346 W357	V259-F302 HydrophobicContact CG1-CE2 3.92Å; V259-F302 HydrophobicContact CG1-CZ 4.28Å; Y261-F302 AromaticContact CE2-CD2 3.73Å; Y261-F302 HydrophobicContact CE2-CD2 3.73Å; Y261-F302 HydrophobicContact CE2-CE2 4.22Å; Y261-F302 AromaticContact CZ-CD2 3.84Å; Y261-F302 WeakPolarHBondContact OH-CB 3.43Å; Y261-F302 WeakPolarHBondContact OH-CD2 3.27Å; D298-F302 PolarHBondContact O-N 3.28Å; D298-F302 VanDerWaalsContact O-N 3.1Å; T299-F302 PolarHBondContact O-N 3.16Å; F302-S304 VanDerWaalsContact C-N 3.27Å; F302-S304 PolarHBondContact O-N 3.13Å; F302-V305 WeakPolarHBondContact O-CB 3.44Å; F302-V305 PolarHBondContact O-N 3.28Å; F302-L306 HydrophobicContact CE1-CD1 4.06Å; F302-L306 HydrophobicContact CZ-CB 4.4Å; F302-L306 HydrophobicContact CZ-CD1 3.74Å; F302-L306 WeakPolarHBondContact O-CB 3.38Å; F302-L306 PolarHBondContact O-N 2.9Å; F302-L341 HydrophobicContact CB-CD2 4.04Å; F302-L341 HydrophobicContact CD1-CD1 4.45Å; F302-L341 HydrophobicContact CG-CD1 4.5Å; F302-I346 HydrophobicContact CD1-CD1 3.68Å; F302-I346 HydrophobicContact CD1-CG1 4.35Å; F302-I346 HydrophobicContact CE1-CD1 4Å; F302-I346 HydrophobicContact CE1-CG2 4.31Å; F302-W357 AromaticContact CE1-CH2 3.79Å; F302-W357 HydrophobicContact CE1-CH2 3.79Å; F302-W357 HydrophobicContact CE1-CZ3 4.09Å; F302-W357 HydrophobicContact CE2-CH2 4.43Å; F302-W357 AromaticContact CZ-CH2 3.38Å; F302-W357 HydrophobicContact CZ-CH2 3.38Å; F302-W357 HydrophobicContact CZ-CZ2 4.4Å; F302-W357 AromaticContact CZ-CZ3 3.83Å; F302-W357 HydrophobicContact CZ-CZ3 3.83Å
303	L	81.7	Confident	87.4	Confident	35 Å²	35	49.5 Å²	49.5	18%	0.183	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-38.2	175.3	-72.7	173.4	0	0	0	111.6	T299 D300 L306 F307 I346 T349	T299-L303 HydrophobicContact CG2-CD1 4.11Å; T299-L303 HydrophobicContact CG2-CG 4.37Å; T299-L303 WeakPolarHBondContact O-CB 3.17Å; T299-L303 VanDerWaalsContact O-CG 3.27Å; T299-L303 WeakPolarHBondContact O-CG 3.3Å; T299-L303 PolarHBondContact O-N 3.46Å; D300-L303 PolarHBondContact O-N 3.44Å; L303-L306 PolarHBondContact O-N 2.81Å; L303-F307 WeakPolarHBondContact O-CB 3.27Å; L303-F307 PolarHBondContact O-N 3.08Å; L303-I346 HydrophobicContact CD2-CG1 4.48Å; L303-T349 HydrophobicContact CD2-CG2 4.42Å
304	S	88	Confident	87.2	Confident	61 Å²	61	51 Å²	51	43%	0.427	25%	0.25	S	S	.	.	H	α-helix	trans	-64.1	-42.4	174.8	-61.3	0	0	0	0	112.2	D300 S301 F302 F307 R308	D300-S304 WeakPolarHBondContact O-CB 3.36Å; D300-S304 PolarHBondContact O-N 3.32Å; D300-S304 PolarHBondContact O-OG 3.12Å; S301-S304 WeakPolarHBondContact O-CB 3.22Å; S301-S304 PolarHBondContact O-N 2.7Å; F302-S304 VanDerWaalsContact C-N 3.27Å; F302-S304 PolarHBondContact O-N 3.13Å; S304-F307 PolarHBondContact O-N 3.26Å; S304-R308 WeakPolarHBondContact O-CG 3.47Å; S304-R308 PolarHBondContact O-N 2.98Å
305	V	90.5	Very high	87.1	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-62	-48	174.6	162.9	0	0	0	0	111.3	C279 F281 E292 V293 A294 S301 F302 F307 R308 F309	C279-V305 HydrophobicContact CB-CG1 3.51Å; F281-V305 HydrophobicContact CE2-CG1 3.69Å; F281-V305 HydrophobicContact CZ-CG1 3.9Å; E292-V305 HydrophobicContact CB-CG1 3.76Å; E292-V305 HydrophobicContact CB-CG2 4.47Å; E292-V305 HydrophobicContact CG-CG1 4.42Å; V293-V305 WeakPolarHBondContact O-CG2 3.26Å; A294-V305 HydrophobicContact CB-CG2 3.88Å; S301-V305 VanDerWaalsContact O-CG2 3.29Å; S301-V305 WeakPolarHBondContact O-CG2 3.43Å; S301-V305 PolarHBondContact O-N 2.86Å; F302-V305 WeakPolarHBondContact O-CB 3.44Å; F302-V305 PolarHBondContact O-N 3.28Å; V305-F307 VanDerWaalsContact C-N 3.33Å; V305-F307 PolarHBondContact O-N 3.06Å; V305-R308 PolarHBondContact O-N 3.18Å; V305-F309 PolarHBondContact O-N 3.12Å
306	L	85.9	Confident	87	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-43.8	178.6	-175.5	133.1	0	0	0	110.8	F302 L303 R308 F309 E310 Y319 L350 W357	F302-L306 HydrophobicContact CE1-CD1 4.06Å; F302-L306 HydrophobicContact CZ-CB 4.4Å; F302-L306 HydrophobicContact CZ-CD1 3.74Å; F302-L306 WeakPolarHBondContact O-CB 3.38Å; F302-L306 PolarHBondContact O-N 2.9Å; L303-L306 PolarHBondContact O-N 2.81Å; L306-R308 PolarHBondContact O-N 3.09Å; L306-F309 PolarHBondContact O-N 2.74Å; L306-E310 VanDerWaalsContact CD2-OE1 3.27Å; L306-E310 WeakPolarHBondContact CD2-OE1 3.27Å; L306-E310 VanDerWaalsContact O-CG 3.29Å; L306-E310 WeakPolarHBondContact O-CG 3.23Å; L306-E310 PolarHBondContact O-N 2.79Å; L306-Y319 HydrophobicContact CD1-CD2 4.45Å; L306-Y319 HydrophobicContact CD1-CE1 4.39Å; L306-Y319 HydrophobicContact CD1-CE2 3.83Å; L306-L350 HydrophobicContact CD1-CD2 4.39Å; L306-L350 HydrophobicContact CD2-CD2 4.08Å; L306-W357 HydrophobicContact CD1-CZ3 4.02Å
307	F	87.6	Confident	87.1	Confident	119 Å²	119	49.8 Å²	49.8	52%	0.522	26%	0.258	S	S	.	.	H	α-helix	trans	-58.5	-50.3	175.2	-172.9	-98	0	0	0	111.6	L303 S304 V305 F309 E310 Q311	L303-F307 WeakPolarHBondContact O-CB 3.27Å; L303-F307 PolarHBondContact O-N 3.08Å; S304-F307 PolarHBondContact O-N 3.26Å; V305-F307 VanDerWaalsContact C-N 3.33Å; V305-F307 PolarHBondContact O-N 3.06Å; F307-F309 VanDerWaalsContact C-N 3.33Å; F307-F309 PolarHBondContact O-N 3.37Å; F307-E310 PolarHBondContact O-N 3.35Å; F307-Q311 HydrophobicContact CD1-CG 3.97Å; F307-Q311 HydrophobicContact CE1-CG 3.64Å; F307-Q311 HydrophobicContact CE2-CG 4.36Å; F307-Q311 HydrophobicContact CG-CG 4.46Å; F307-Q311 HydrophobicContact CZ-CG 3.85Å; F307-Q311 VanDerWaalsContact O-CG 3.29Å; F307-Q311 WeakPolarHBondContact O-CG 3.33Å; F307-Q311 PolarHBondContact O-N 3.27Å
308	R	94.2	Very high	87.2	Confident	73 Å²	73	49 Å²	49	28%	0.275	25%	0.254	S	S	.	.	H	α-helix	trans	-60.5	-41.6	178.3	-70.4	-168.7	-48.9	-90.6	-0.7	112.6	E292 V293 S304 V305 L306 Q311 R312	E292-R308 IonicContact OE2-CZ 2.72Å; E292-R308 IonicContact OE2-NE 2.65Å; E292-R308 PolarHBondContact OE2-NE 2.95Å; E292-R308 IonicContact OE2-NH2 3.97Å; E292-R308 PolarHBondContact OE2-NH2 3.43Å; V293-R308 PolarHBondContact O-NH2 3.21Å; S304-R308 WeakPolarHBondContact O-CG 3.47Å; S304-R308 PolarHBondContact O-N 2.98Å; V305-R308 PolarHBondContact O-N 3.18Å; L306-R308 PolarHBondContact O-N 3.09Å; R308-Q311 PolarHBondContact O-N 3.16Å; R308-R312 WeakPolarHBondContact O-CG 3.28Å; R308-R312 PolarHBondContact O-N 2.91Å; R308-R312 VanDerWaalsContact O-N 3.16Å
309	F	92.5	Very high	87.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.4	-50	175.5	164.1	-105.8	0	0	0	111.4	F254 F281 H290 V305 L306 F307 Q311 R312 R313 P316 Y319	F254-F309 HydrophobicContact CB-CZ 3.93Å; F254-F309 AromaticContact CD1-CE2 3.93Å; F254-F309 HydrophobicContact CD1-CE2 3.93Å; F254-F309 AromaticContact CD1-CZ 3.92Å; F254-F309 HydrophobicContact CD1-CZ 3.92Å; F254-F309 HydrophobicContact CE1-CE2 4.26Å; F254-F309 HydrophobicContact CG-CE2 4.12Å; F254-F309 AromaticContact CG-CZ 3.99Å; F254-F309 HydrophobicContact CG-CZ 3.99Å; F281-F309 HydrophobicContact CB-CD2 3.93Å; F281-F309 HydrophobicContact CB-CE2 3.66Å; F281-F309 HydrophobicContact CB-CZ 4.06Å; F281-F309 AromaticContact CD1-CD1 3.79Å; F281-F309 HydrophobicContact CD1-CD1 3.79Å; F281-F309 HydrophobicContact CD1-CD2 4.22Å; F281-F309 AromaticContact CD1-CE1 3.88Å; F281-F309 HydrophobicContact CD1-CE1 3.88Å; F281-F309 HydrophobicContact CD1-CE2 4.29Å; F281-F309 AromaticContact CD1-CG 3.96Å; F281-F309 HydrophobicContact CD1-CG 3.96Å; F281-F309 HydrophobicContact CD1-CZ 4.12Å; F281-F309 HydrophobicContact CD2-CB 3.96Å; F281-F309 HydrophobicContact CD2-CD1 4.43Å; F281-F309 AromaticContact CD2-CD2 3.74Å; F281-F309 HydrophobicContact CD2-CD2 3.74Å; F281-F309 HydrophobicContact CD2-CE2 4.35Å; F281-F309 AromaticContact CD2-CG 3.77Å; F281-F309 HydrophobicContact CD2-CG 3.77Å; F281-F309 HydrophobicContact CE1-CB 4.42Å; F281-F309 AromaticContact CE1-CD1 3.81Å; F281-F309 HydrophobicContact CE1-CD1 3.81Å; F281-F309 HydrophobicContact CE1-CE1 4.27Å; F281-F309 HydrophobicContact CE1-CG 4.06Å; F281-F309 HydrophobicContact CE2-CB 3.64Å; F281-F309 HydrophobicContact CE2-CD1 4.44Å; F281-F309 HydrophobicContact CE2-CD2 4.31Å; F281-F309 AromaticContact CE2-CG 3.87Å; F281-F309 HydrophobicContact CE2-CG 3.87Å; F281-F309 HydrophobicContact CG-CB 4.47Å; F281-F309 HydrophobicContact CG-CD1 4.11Å; F281-F309 AromaticContact CG-CD2 3.69Å; F281-F309 HydrophobicContact CG-CD2 3.69Å; F281-F309 HydrophobicContact CG-CE1 4.27Å; F281-F309 AromaticContact CG-CE2 3.85Å; F281-F309 HydrophobicContact CG-CE2 3.85Å; F281-F309 AromaticContact CG-CG 3.8Å; F281-F309 HydrophobicContact CG-CG 3.8Å; F281-F309 HydrophobicContact CG-CZ 4.14Å; F281-F309 HydrophobicContact CZ-CB 3.9Å; F281-F309 HydrophobicContact CZ-CD1 4.15Å; F281-F309 HydrophobicContact CZ-CG 4.02Å; H290-F309 HydrophobicContact CB-CD2 3.92Å; H290-F309 HydrophobicContact CB-CE2 3.92Å; H290-F309 AromaticContact CD2-CD2 3.57Å; H290-F309 AromaticContact CG-CD2 3.68Å; V305-F309 PolarHBondContact O-N 3.12Å; L306-F309 PolarHBondContact O-N 2.74Å; F307-F309 VanDerWaalsContact C-N 3.33Å; F307-F309 PolarHBondContact O-N 3.37Å; F309-Q311 VanDerWaalsContact C-N 3.34Å; F309-Q311 PolarHBondContact O-N 3.45Å; F309-R312 PolarHBondContact O-N 3.26Å; F309-R312 VanDerWaalsContact O-N 3.1Å; F309-R313 HydrophobicContact CD2-CB 4.11Å; F309-R313 HydrophobicContact CD2-CG 3.9Å; F309-R313 HydrophobicContact CE2-CB 3.71Å; F309-R313 HydrophobicContact CE2-CG 3.71Å; F309-R313 HydrophobicContact CZ-CB 4.17Å; F309-R313 PolarHBondContact O-N 2.74Å; F309-P316 HydrophobicContact CE1-CG 3.64Å; F309-P316 HydrophobicContact CZ-CG 4.23Å; F309-Y319 HydrophobicContact CD1-CE1 4.3Å; F309-Y319 AromaticContact CE1-CE1 3.9Å; F309-Y319 HydrophobicContact CE1-CE1 3.9Å
310	E	88.9	Confident	87.8	Confident	5 Å²	5	48 Å²	48	2%	0.023	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-36.8	-178.4	-70.3	175.8	166.9	0	0	112.6	L306 F307 R312 G314 Y319 R353	L306-E310 VanDerWaalsContact CD2-OE1 3.27Å; L306-E310 WeakPolarHBondContact CD2-OE1 3.27Å; L306-E310 VanDerWaalsContact O-CG 3.29Å; L306-E310 WeakPolarHBondContact O-CG 3.23Å; L306-E310 PolarHBondContact O-N 2.79Å; F307-E310 PolarHBondContact O-N 3.35Å; E310-R312 VanDerWaalsContact C-N 3.25Å; E310-R312 PolarHBondContact O-N 3.3Å; E310-G314 CarbonylContact O-C 3.57Å; E310-G314 WeakPolarHBondContact O-CA 3.47Å; E310-G314 PolarHBondContact O-N 3.25Å; E310-Y319 VanDerWaalsContact CG-OH 3.32Å; E310-Y319 WeakPolarHBondContact CG-OH 3.27Å; E310-Y319 PolarHBondContact OE1-OH 2.83Å; E310-R353 IonicContact OE1-NH1 3.62Å; E310-R353 IonicContact OE1-NH2 3.99Å; E310-R353 IonicContact OE2-CZ 2.78Å; E310-R353 IonicContact OE2-NH1 3.66Å; E310-R353 PolarHBondContact OE2-NH1 2.76Å; E310-R353 IonicContact OE2-NH2 3.71Å; E310-R353 PolarHBondContact OE2-NH2 2.86Å
311	Q	94	Very high	87.6	Confident	121 Å²	121	44 Å²	44	57%	0.565	22%	0.222	S	C	*	.	H	α-helix	trans	-66.5	-27.7	174.9	-65.1	-41.5	-55.4	0	0	112.6	F307 R308 F309	F307-Q311 HydrophobicContact CD1-CG 3.97Å; F307-Q311 HydrophobicContact CE1-CG 3.64Å; F307-Q311 HydrophobicContact CE2-CG 4.36Å; F307-Q311 HydrophobicContact CG-CG 4.46Å; F307-Q311 HydrophobicContact CZ-CG 3.85Å; F307-Q311 VanDerWaalsContact O-CG 3.29Å; F307-Q311 WeakPolarHBondContact O-CG 3.33Å; F307-Q311 PolarHBondContact O-N 3.27Å; R308-Q311 PolarHBondContact O-N 3.16Å; F309-Q311 VanDerWaalsContact C-N 3.34Å; F309-Q311 PolarHBondContact O-N 3.45Å
312	R	91.7	Very high	86.7	Confident	169 Å²	169	44.5 Å²	44.5	64%	0.638	22%	0.224	S	C	*	.	H	α-helix	trans	-90.8	-34	179.7	-69.3	177.6	-171.6	-91.7	2	113.5	E292 R308 F309 E310	E292-R312 IonicContact OE1-NE 2.71Å; E292-R312 PolarHBondContact OE1-NE 2.86Å; R308-R312 WeakPolarHBondContact O-CG 3.28Å; R308-R312 PolarHBondContact O-N 2.91Å; R308-R312 VanDerWaalsContact O-N 3.16Å; F309-R312 PolarHBondContact O-N 3.26Å; F309-R312 VanDerWaalsContact O-N 3.1Å; E310-R312 VanDerWaalsContact C-N 3.25Å; E310-R312 PolarHBondContact O-N 3.3Å
313	R	90.4	Very high	85.3	Confident	75 Å²	75	47.5 Å²	47.5	28%	0.283	24%	0.24	S	C	.	.	H	α-helix	trans	-118	-7.6	-169.4	-60	-56.2	-174.1	-176.2	-0.7	114.4	F254 H290 F309 E399	F254-R313 HydrophobicContact CD2-CB 3.86Å; F254-R313 HydrophobicContact CD2-CG 4.07Å; F254-R313 HydrophobicContact CE2-CB 4.27Å; F254-R313 HydrophobicContact CE2-CG 3.96Å; F254-R313 HydrophobicContact CG-CB 4.38Å; H290-R313 HydrophobicContact CB-CG 4.39Å; H290-R313 PolarHBondContact ND1-NE 3.48Å; F309-R313 HydrophobicContact CD2-CB 4.11Å; F309-R313 HydrophobicContact CD2-CG 3.9Å; F309-R313 HydrophobicContact CE2-CB 3.71Å; F309-R313 HydrophobicContact CE2-CG 3.71Å; F309-R313 HydrophobicContact CZ-CB 4.17Å; F309-R313 PolarHBondContact O-N 2.74Å; R313-E399 IonicContact CZ-OE1 3.8Å; R313-E399 IonicContact NH2-OE1 2.97Å; R313-E399 PolarHBondContact NH2-OE1 2.81Å
314	G	88.4	Confident	83.7	Confident	38 Å²	38	46.3 Å²	46.3	39%	0.392	24%	0.237	S	C	.	.			trans	90.6	164.1	-172.4	0	0	0	0	0	112.2	E310 P316	E310-G314 CarbonylContact O-C 3.57Å; E310-G314 WeakPolarHBondContact O-CA 3.47Å; E310-G314 PolarHBondContact O-N 3.25Å; G314-P316 WeakPolarHBondContact O-CD 3.45Å
315	T	88.4	Confident	81.3	Confident	76 Å²	76	47.5 Å²	47.5	47%	0.466	24%	0.241	S	C	.	.			trans	-81.4	121.2	-179.5	-59.2	0	0	0	0	110.5	R353 I355	T315-R353 PolarHBondContact OG1-NH2 3.31Å; T315-R353 VanDerWaalsContact OG1-NH2 3.16Å; T315-I355 HydrophobicContact CG2-CD1 3.33Å; T315-I355 HydrophobicContact CG2-CG1 3.83Å
316	P	89	Confident	78.6	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.026	26%	0.263	C	S	.	.			trans	-66.9	158.3	175.2	-24.4	37.7	0	0	0	113	F254 C257 F309 G314 Y319	F254-P316 VanDerWaalsContact O-CB 3.24Å; F254-P316 WeakPolarHBondContact O-CB 3.42Å; F254-P316 WeakPolarHBondContact O-CG 3.38Å; C257-P316 HydrophobicContact CB-CG 4.43Å; F309-P316 HydrophobicContact CE1-CG 3.64Å; F309-P316 HydrophobicContact CZ-CG 4.23Å; G314-P316 WeakPolarHBondContact O-CD 3.45Å; P316-Y319 HydrophobicContact CB-CE1 4.4Å; P316-Y319 HydrophobicContact CB-CE2 4.44Å; P316-Y319 VanDerWaalsContact CD-OH 3.27Å; P316-Y319 WeakPolarHBondContact CD-OH 3.22Å; P316-Y319 HydrophobicContact CG-CD1 4.5Å; P316-Y319 HydrophobicContact CG-CE1 3.72Å; P316-Y319 HydrophobicContact CG-CE2 4.18Å; P316-Y319 WeakPolarHBondContact CG-OH 3.22Å
317	A	88.2	Confident	76	Confident	48 Å²	48	53.6 Å²	53.6	40%	0.397	27%	0.274	S	S	.	.	S	Bend	trans	-77.2	-35.2	167.1	0	0	0	0	0	111.8	T255 S356	T255-A317 HydrophobicContact CG2-CB 3.96Å; T255-A317 WeakPolarHBondContact O-CB 3.36Å; T255-A317 PolarHBondContact O-N 2.95Å; A317-S356 PolarHBondContact O-N 3.41Å; A317-S356 VanDerWaalsContact O-N 3.13Å
318	A	85.3	Confident	73.2	Confident	2 Å²	2	53 Å²	53	2%	0.017	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	144.3	178.9	0	0	0	0	0	114.3	T255 H256 C257 S356	T255-A318 PolarHBondContact O-N 3.49Å; H256-A318 WeakPolarHBondContact CA-O 3.11Å; C257-A318 PolarHBondContact N-O 3.19Å; A318-S356 CarbonylContact C-O 3.37Å; A318-S356 WeakPolarHBondContact CA-O 3.32Å; A318-S356 WeakPolarHBondContact CB-OG 3.45Å
319	Y	85	Confident	70.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	149.5	169.5	-68.8	-75	0	0	0	111.8	C257 V259 F281 L306 F309 E310 P316 L350 I355 S356 W357 H358	C257-Y319 HydrophobicContact CB-CD1 3.73Å; C257-Y319 HydrophobicContact CB-CE1 4.01Å; C257-Y319 CarbonylContact O-C 3.56Å; C257-Y319 VanDerWaalsContact O-CA 3.28Å; C257-Y319 WeakPolarHBondContact O-CA 3.37Å; V259-Y319 HydrophobicContact CG2-CD1 3.44Å; V259-Y319 VanDerWaalsContact CG2-CD1 3.44Å; V259-Y319 HydrophobicContact CG2-CE1 4.14Å; V259-Y319 HydrophobicContact CG2-CG 4.19Å; F281-Y319 HydrophobicContact CD1-CE1 4.01Å; F281-Y319 HydrophobicContact CE1-CD1 4.5Å; F281-Y319 AromaticContact CE1-CE1 3.86Å; F281-Y319 HydrophobicContact CE1-CE1 3.86Å; L306-Y319 HydrophobicContact CD1-CD2 4.45Å; L306-Y319 HydrophobicContact CD1-CE1 4.39Å; L306-Y319 HydrophobicContact CD1-CE2 3.83Å; F309-Y319 HydrophobicContact CD1-CE1 4.3Å; F309-Y319 AromaticContact CE1-CE1 3.9Å; F309-Y319 HydrophobicContact CE1-CE1 3.9Å; E310-Y319 VanDerWaalsContact CG-OH 3.32Å; E310-Y319 WeakPolarHBondContact CG-OH 3.27Å; E310-Y319 PolarHBondContact OE1-OH 2.83Å; P316-Y319 HydrophobicContact CB-CE1 4.4Å; P316-Y319 HydrophobicContact CB-CE2 4.44Å; P316-Y319 VanDerWaalsContact CD-OH 3.27Å; P316-Y319 WeakPolarHBondContact CD-OH 3.22Å; P316-Y319 HydrophobicContact CG-CD1 4.5Å; P316-Y319 HydrophobicContact CG-CE1 3.72Å; P316-Y319 HydrophobicContact CG-CE2 4.18Å; P316-Y319 WeakPolarHBondContact CG-OH 3.22Å; Y319-L350 HydrophobicContact CD2-CD1 4.3Å; Y319-L350 HydrophobicContact CE2-CD2 4.23Å; Y319-I355 HydrophobicContact CD2-CG2 3.65Å; Y319-I355 HydrophobicContact CE2-CG2 3.8Å; Y319-S356 PolarHBondContact N-O 2.85Å; Y319-W357 VanDerWaalsContact CB-CZ3 3.48Å; Y319-W357 HydrophobicContact CD1-CZ3 4.19Å; Y319-W357 AromaticContact CD2-CE3 3.7Å; Y319-W357 HydrophobicContact CD2-CE3 3.7Å; Y319-W357 AromaticContact CD2-CZ3 3.76Å; Y319-W357 HydrophobicContact CD2-CZ3 3.76Å; Y319-W357 HydrophobicContact CE2-CZ3 4.5Å; Y319-W357 AromaticContact CG-CE3 3.69Å; Y319-W357 HydrophobicContact CG-CE3 3.69Å; Y319-W357 HydrophobicContact CG-CH2 4.43Å; Y319-W357 AromaticContact CG-CZ3 3.56Å; Y319-W357 HydrophobicContact CG-CZ3 3.56Å; Y319-H358 PolarHBondContact O-N 2.87Å
320	W	81.8	Confident	67.9	Low	65 Å²	65	54.1 Å²	54.1	25%	0.246	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	117.9	178.8	-69.4	70	0	0	0	110.2	F245 C257 G258 V259 L284 H358	F245-W320 AromaticContact CE1-CZ2 3.73Å; F245-W320 HydrophobicContact CE1-CZ2 3.73Å; F245-W320 HydrophobicContact CZ-CZ2 4.21Å; C257-W320 PolarHBondContact O-N 2.72Å; G258-W320 CarbonylContact C-O 3.52Å; G258-W320 VanDerWaalsContact CA-O 3.23Å; G258-W320 WeakPolarHBondContact CA-O 3.44Å; V259-W320 PolarHBondContact N-O 2.65Å; L284-W320 HydrophobicContact CD1-CB 3.98Å; L284-W320 HydrophobicContact CD1-CD2 4.27Å; L284-W320 HydrophobicContact CD1-CG 3.6Å; W320-H358 CarbonylContact C-O 3.57Å; W320-H358 VanDerWaalsContact CA-O 3.27Å; W320-H358 WeakPolarHBondContact CA-O 3.27Å; W320-H358 HydrophobicContact CD2-CB 3.73Å; W320-H358 AromaticContact CE2-CD2 3.7Å; W320-H358 AromaticContact CE2-CG 3.96Å; W320-H358 HydrophobicContact CE3-CB 3.84Å; W320-H358 HydrophobicContact CG-CB 4.17Å; W320-H358 HydrophobicContact CH2-CB 4.39Å; W320-H358 HydrophobicContact CZ2-CB 4.26Å; W320-H358 AromaticContact CZ2-CD2 3.96Å; W320-H358 HydrophobicContact CZ3-CB 4.19Å; W320-H358 AromaticContact NE1-CD2 3.58Å
321	S	76.3	Confident	65.9	Low	10 Å²	10	57 Å²	57	7%	0.07	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	158.8	176.7	61.9	0	0	0	0	111.6	W357 H358 F359 N360	S321-W357 PolarHBondContact OG-NE1 3.18Å; S321-H358 PolarHBondContact N-O 3.37Å; S321-F359 CarbonylContact O-C 3.56Å; S321-F359 WeakPolarHBondContact O-CA 2.92Å; S321-F359 VanDerWaalsContact OG-CD1 3.26Å; S321-F359 WeakPolarHBondContact OG-CD1 3.41Å; S321-F359 WeakPolarHBondContact OG-CE1 3.42Å; S321-N360 PolarHBondContact O-N 2.91Å
322	D	66.8	Low	63.8	Low	25 Å²	25	58.1 Å²	58.1	13%	0.134	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	141	175.3	-157.8	8.5	0	0	0	111.4	G324 P362 A363 H366	D322-G324 PolarHBondContact O-N 2.79Å; D322-P362 VanDerWaalsContact OD1-CA 3.29Å; D322-P362 WeakPolarHBondContact OD1-CA 3.45Å; D322-A363 PolarHBondContact OD2-N 2.92Å; D322-H366 IonicContact OD2-CE1 3.12Å; D322-H366 PolarHBondContact OD2-CE1 2.85Å; D322-H366 VanDerWaalsContact OD2-CE1 3.31Å; D322-H366 IonicContact OD2-NE2 3.34Å
323	N	56.5	Low	61.9	Low	66 Å²	66	53.3 Å²	53.3	35%	0.353	31%	0.305	S	S	.	.			trans	-77.3	99.9	167.5	-88.1	-23.2	0	0	0	107.9	T325 F359 N360	N323-T325 PolarHBondContact O-N 2.98Å; N323-F359 WeakPolarHBondContact ND2-CB 3.19Å; N323-F359 WeakPolarHBondContact OD1-CB 3.38Å; N323-F359 WeakPolarHBondContact OD1-CD1 3.4Å; N323-F359 VanDerWaalsContact OD1-CG 3.26Å; N323-F359 WeakPolarHBondContact OD1-CG 3.32Å; N323-N360 WeakPolarHBondContact CB-O 3.16Å; N323-N360 PolarHBondContact N-O 3.04Å
324	G	47.3	Very low	60.1	Low	11 Å²	11	50.2 Å²	50.2	11%	0.113	29%	0.294	C	S	.	.			trans	-68.6	42.5	-168.3	0	0	0	0	0	116.8	D322 N326 Q335 Q339	D322-G324 PolarHBondContact O-N 2.79Å; G324-N326 PolarHBondContact O-N 2.85Å; G324-Q335 WeakPolarHBondContact O-CB 3.42Å; G324-Q335 PolarHBondContact O-OE1 3.36Å; G324-Q339 PolarHBondContact O-NE2 3.36Å
325	T	38.6	Very low	58.7	Low	85 Å²	85	49.1 Å²	49.1	52%	0.521	28%	0.279	S	S	.	.			trans	-82.4	-5.8	-169.5	44.7	0	0	0	0	116	N323	N323-T325 PolarHBondContact O-N 2.98Å
326	N	33.6	Very low	57.2	Low	85 Å²	85	48.5 Å²	48.5	46%	0.455	27%	0.271	S	S	.	.			trans	-144.9	127.1	178	-72.2	-42.3	0	0	0	111.5	G324 Q335	G324-N326 PolarHBondContact O-N 2.85Å; N326-Q335 PolarHBondContact O-NE2 3.44Å
327	I	31	Very low	55.7	Low	49 Å²	49	49.2 Å²	49.2	25%	0.251	28%	0.275	S	S	.	.			trans	154.6	138.2	146.1	-74.3	149.3	0	0	0	111	K331 R332 M367 N496	I327-K331 HydrophobicContact CB-CD 4.14Å; I327-K331 HydrophobicContact CD1-CD 4.11Å; I327-K331 HydrophobicContact CG2-CB 4.32Å; I327-K331 HydrophobicContact CG2-CD 3.96Å; I327-R332 WeakPolarHBondContact O-CB 3.46Å; I327-M367 HydrophobicContact CD1-CE 4.26Å; I327-N496 VanDerWaalsContact CG1-ND2 3.33Å; I327-N496 WeakPolarHBondContact CG1-ND2 3.34Å
328	V	30.2	Very low	54.3	Low	107 Å²	107	48.3 Å²	48.3	65%	0.648	26%	0.264	S	S	*	.			trans	-77.6	145.2	-174.7	-170.1	0	0	0	0	113	N496	V328-N496 HydrophobicContact CG2-CB 4.25Å
329	G	42.9	Very low	53.2	Low	45 Å²	45	53 Å²	53	46%	0.464	29%	0.285	S	S	.	.	S	Bend	trans	102.3	-152.8	169.6	0	0	0	0	0	115.2	K331 R332 E333	G329-K331 PolarHBondContact O-N 3.17Å; G329-R332 WeakPolarHBondContact O-CA 3.33Å; G329-R332 WeakPolarHBondContact O-CB 3.32Å; G329-R332 PolarHBondContact O-N 3.4Å; G329-E333 PolarHBondContact O-N 3.23Å
330	A	32.6	Very low	52.2	Low	51 Å²	51	61.6 Å²	61.6	42%	0.421	32%	0.317	S	S	.	.	H	α-helix	trans	-56.8	-22.5	179.2	0	0	0	0	0	114	I334	A330-I334 WeakPolarHBondContact O-CG1 3.1Å; A330-I334 PolarHBondContact O-N 2.75Å
331	K	46.4	Very low	51.5	Low	66 Å²	66	59.1 Å²	59.1	29%	0.287	31%	0.309	S	S	.	.	H	α-helix	trans	-70.1	-32.9	171.6	-163.8	178.1	179.5	-169.1	0	112.2	I327 G329 I334 Q335	I327-K331 HydrophobicContact CB-CD 4.14Å; I327-K331 HydrophobicContact CD1-CD 4.11Å; I327-K331 HydrophobicContact CG2-CB 4.32Å; I327-K331 HydrophobicContact CG2-CD 3.96Å; G329-K331 PolarHBondContact O-N 3.17Å; K331-I334 PolarHBondContact O-N 2.97Å; K331-Q335 WeakPolarHBondContact O-CB 3.39Å; K331-Q335 WeakPolarHBondContact O-CG 3.46Å; K331-Q335 PolarHBondContact O-N 3.41Å
332	R	49.2	Very low	51.2	Low	143 Å²	143	62.3 Å²	62.3	54%	0.54	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-43.6	173.9	-167.2	177.2	164.7	173	-3.2	111.4	I327 G329 I334 Q335 E336	I327-R332 WeakPolarHBondContact O-CB 3.46Å; G329-R332 WeakPolarHBondContact O-CA 3.33Å; G329-R332 WeakPolarHBondContact O-CB 3.32Å; G329-R332 PolarHBondContact O-N 3.4Å; R332-I334 VanDerWaalsContact C-N 3.33Å; R332-I334 PolarHBondContact O-N 2.87Å; R332-Q335 PolarHBondContact O-N 3.17Å; R332-Q335 VanDerWaalsContact O-N 3.17Å; R332-E336 HydrophobicContact CG-CG 4.12Å; R332-E336 IonicContact CZ-OE1 3.8Å; R332-E336 IonicContact NE-OE1 2.87Å; R332-E336 PolarHBondContact NE-OE1 2.83Å; R332-E336 IonicContact NH2-OE1 2.68Å; R332-E336 PolarHBondContact NH2-OE1 3.03Å; R332-E336 VanDerWaalsContact NH2-OE1 3.13Å; R332-E336 WeakPolarHBondContact O-CB 3.31Å; R332-E336 WeakPolarHBondContact O-CG 3.43Å; R332-E336 PolarHBondContact O-N 2.71Å
333	E	52.1	Low	51.4	Low	68 Å²	68	64 Å²	64	32%	0.318	33%	0.332	S	S	.	.	H	α-helix	trans	-58.7	-45.8	176	-173	179.7	-175.4	0	0	110.6	K275 G329 C337	K275-E333 VanDerWaalsContact NZ-CD 3.28Å; K275-E333 IonicContact NZ-OE1 2.74Å; K275-E333 PolarHBondContact NZ-OE1 3.02Å; K275-E333 IonicContact NZ-OE2 3.45Å; K275-E333 PolarHBondContact NZ-OE2 3.48Å; G329-E333 PolarHBondContact O-N 3.23Å; E333-C337 VanDerWaalsContact O-CB 3.32Å; E333-C337 WeakPolarHBondContact O-CB 3.25Å; E333-C337 PolarHBondContact O-N 3.13Å; E333-C337 PolarHBondContact O-SG 3.48Å
334	I	51.6	Low	52	Low	10 Å²	10	64.1 Å²	64.1	5%	0.051	34%	0.342	C	S	.	.	H	α-helix	trans	-62	-45	175.1	-63.4	169.4	0	0	0	111.2	Y261 L297 A330 K331 R332 C337 I338	Y261-I334 HydrophobicContact CG-CG2 4.45Å; L297-I334 HydrophobicContact CD1-CB 4.43Å; L297-I334 HydrophobicContact CD1-CG1 4.08Å; A330-I334 WeakPolarHBondContact O-CG1 3.1Å; A330-I334 PolarHBondContact O-N 2.75Å; K331-I334 PolarHBondContact O-N 2.97Å; R332-I334 VanDerWaalsContact C-N 3.33Å; R332-I334 PolarHBondContact O-N 2.87Å; I334-C337 PolarHBondContact O-N 3.48Å; I334-I338 HydrophobicContact CG2-CD1 3.76Å; I334-I338 HydrophobicContact CG2-CG1 4.38Å; I334-I338 WeakPolarHBondContact O-CB 3.19Å; I334-I338 WeakPolarHBondContact O-CG1 3.09Å; I334-I338 PolarHBondContact O-N 3.49Å
335	Q	59	Low	53.2	Low	16 Å²	16	67.4 Å²	67.4	8%	0.075	35%	0.353	C	S	.	.	H	α-helix	trans	-68.9	-43.6	-178.6	-76.5	173.6	-28.6	0	0	113.2	G324 N326 K331 R332 C337 I338 Q339	G324-Q335 WeakPolarHBondContact O-CB 3.42Å; G324-Q335 PolarHBondContact O-OE1 3.36Å; N326-Q335 PolarHBondContact O-NE2 3.44Å; K331-Q335 WeakPolarHBondContact O-CB 3.39Å; K331-Q335 WeakPolarHBondContact O-CG 3.46Å; K331-Q335 PolarHBondContact O-N 3.41Å; R332-Q335 PolarHBondContact O-N 3.17Å; R332-Q335 VanDerWaalsContact O-N 3.17Å; Q335-C337 VanDerWaalsContact C-N 3.29Å; Q335-C337 PolarHBondContact O-N 3.17Å; Q335-I338 PolarHBondContact O-N 3.08Å; Q335-Q339 WeakPolarHBondContact O-CG 3.36Å; Q335-Q339 PolarHBondContact O-N 3.37Å
336	E	58.8	Low	54.8	Low	63 Å²	63	63.5 Å²	63.5	29%	0.294	33%	0.33	S	S	.	.	H	α-helix	trans	-61.9	-40.4	175.2	-75.4	178.9	176.9	0	0	110.3	R332 Q339 R340	R332-E336 HydrophobicContact CG-CG 4.12Å; R332-E336 IonicContact CZ-OE1 3.8Å; R332-E336 IonicContact NE-OE1 2.87Å; R332-E336 PolarHBondContact NE-OE1 2.83Å; R332-E336 IonicContact NH2-OE1 2.68Å; R332-E336 PolarHBondContact NH2-OE1 3.03Å; R332-E336 VanDerWaalsContact NH2-OE1 3.13Å; R332-E336 WeakPolarHBondContact O-CB 3.31Å; R332-E336 WeakPolarHBondContact O-CG 3.43Å; R332-E336 PolarHBondContact O-N 2.71Å; E336-Q339 PolarHBondContact O-N 3.05Å; E336-R340 WeakPolarHBondContact O-CG 3.24Å; E336-R340 PolarHBondContact O-N 3.28Å
337	C	55.9	Low	56.5	Low	18 Å²	18	61.8 Å²	61.8	12%	0.122	33%	0.327	C	S	.	.	H	α-helix	trans	-70.2	-37.9	173.7	-71.2	0	0	0	0	113	L297 E333 I334 Q335 Q339 R340 L341	L297-C337 HydrophobicContact CB-CB 3.38Å; L297-C337 HydrophobicContact CD1-CB 3.75Å; L297-C337 HydrophobicContact CG-CB 4.19Å; E333-C337 VanDerWaalsContact O-CB 3.32Å; E333-C337 WeakPolarHBondContact O-CB 3.25Å; E333-C337 PolarHBondContact O-N 3.13Å; E333-C337 PolarHBondContact O-SG 3.48Å; I334-C337 PolarHBondContact O-N 3.48Å; Q335-C337 VanDerWaalsContact C-N 3.29Å; Q335-C337 PolarHBondContact O-N 3.17Å; C337-Q339 VanDerWaalsContact C-N 3.27Å; C337-Q339 PolarHBondContact O-N 3.44Å; C337-R340 CarbonylContact O-C 3.56Å; C337-R340 WeakPolarHBondContact O-CA 3.33Å; C337-R340 WeakPolarHBondContact O-CB 3.48Å; C337-R340 PolarHBondContact O-N 2.9Å; C337-L341 PolarHBondContact O-N 3.44Å
338	I	59.8	Low	58.5	Low	30 Å²	30	65.1 Å²	65.1	15%	0.154	34%	0.341	C	S	.	.	H	α-helix	trans	-60.4	-39.2	172.3	-73.6	167.9	0	0	0	110.5	Y261 I334 Q335 R340 L341 H343	Y261-I338 HydrophobicContact CD2-CD1 4.06Å; Y261-I338 HydrophobicContact CD2-CG1 4.29Å; I334-I338 HydrophobicContact CG2-CD1 3.76Å; I334-I338 HydrophobicContact CG2-CG1 4.38Å; I334-I338 WeakPolarHBondContact O-CB 3.19Å; I334-I338 WeakPolarHBondContact O-CG1 3.09Å; I334-I338 PolarHBondContact O-N 3.49Å; Q335-I338 PolarHBondContact O-N 3.08Å; I338-R340 VanDerWaalsContact C-N 3.31Å; I338-L341 HydrophobicContact CB-CD1 4.3Å; I338-L341 HydrophobicContact CG1-CD1 4.26Å; I338-L341 HydrophobicContact CG2-CD1 4.26Å; I338-L341 WeakPolarHBondContact O-CB 2.92Å; I338-L341 WeakPolarHBondContact O-CG 3.46Å; I338-L341 PolarHBondContact O-N 3.09Å; I338-H343 PolarHBondContact O-CE1 3.11Å; I338-H343 PolarHBondContact O-NE2 3Å; I338-H343 VanDerWaalsContact O-NE2 3.13Å
339	Q	62.8	Low	60.4	Low	100 Å²	100	62.5 Å²	62.5	47%	0.467	33%	0.326	S	S	.	.	H	α-helix	trans	-69.2	-27.5	174.2	-71.8	174.5	10.7	0	0	113.1	G324 Q335 E336 C337 L341	G324-Q339 PolarHBondContact O-NE2 3.36Å; Q335-Q339 WeakPolarHBondContact O-CG 3.36Å; Q335-Q339 PolarHBondContact O-N 3.37Å; E336-Q339 PolarHBondContact O-N 3.05Å; C337-Q339 VanDerWaalsContact C-N 3.27Å; C337-Q339 PolarHBondContact O-N 3.44Å; Q339-L341 VanDerWaalsContact C-N 3.3Å
340	R	63.9	Low	61.9	Low	180 Å²	180	60.4 Å²	60.4	68%	0.679	30%	0.304	S	S	*	.	H	α-helix	trans	-77.7	-14.6	171.2	-72.8	178.1	-165.1	146.5	7.4	113.1	E336 C337 I338 D342	E336-R340 WeakPolarHBondContact O-CG 3.24Å; E336-R340 PolarHBondContact O-N 3.28Å; C337-R340 CarbonylContact O-C 3.56Å; C337-R340 WeakPolarHBondContact O-CA 3.33Å; C337-R340 WeakPolarHBondContact O-CB 3.48Å; C337-R340 PolarHBondContact O-N 2.9Å; I338-R340 VanDerWaalsContact C-N 3.31Å; R340-D342 PolarHBondContact O-N 3.29Å
341	L	67	Low	63.7	Low	13 Å²	13	61.4 Å²	61.4	7%	0.068	31%	0.308	C	S	.	.	S	Bend	trans	-57.3	132.4	169.8	-64.4	170	0	0	0	106.8	D298 F302 C337 I338 Q339 H343 I346	D298-L341 VanDerWaalsContact C-CD2 3.44Å; D298-L341 WeakPolarHBondContact O-CD2 3.12Å; F302-L341 HydrophobicContact CB-CD2 4.04Å; F302-L341 HydrophobicContact CD1-CD1 4.45Å; F302-L341 HydrophobicContact CG-CD1 4.5Å; C337-L341 PolarHBondContact O-N 3.44Å; I338-L341 HydrophobicContact CB-CD1 4.3Å; I338-L341 HydrophobicContact CG1-CD1 4.26Å; I338-L341 HydrophobicContact CG2-CD1 4.26Å; I338-L341 WeakPolarHBondContact O-CB 2.92Å; I338-L341 WeakPolarHBondContact O-CG 3.46Å; I338-L341 PolarHBondContact O-N 3.09Å; Q339-L341 VanDerWaalsContact C-N 3.3Å; L341-H343 PolarHBondContact O-N 3.41Å; L341-I346 HydrophobicContact CB-CD1 3.81Å; L341-I346 HydrophobicContact CD1-CD1 4.31Å; L341-I346 HydrophobicContact CG-CD1 4.45Å
342	D	69.6	Low	65	Low	78 Å²	78	64.5 Å²	64.5	42%	0.417	33%	0.326	S	S	.	.			trans	-71.3	85.6	176.5	-173.8	-15.4	0	0	0	107.7	T299 R340 A344 K345 I346	T299-D342 HydrophobicContact CG2-CB 4.41Å; T299-D342 PolarHBondContact OG1-N 3.03Å; T299-D342 VanDerWaalsContact OG1-N 3.08Å; R340-D342 PolarHBondContact O-N 3.29Å; D342-A344 PolarHBondContact O-N 2.86Å; D342-A344 WeakPolarHBondContact OD1-CB 3.05Å; D342-A344 PolarHBondContact OD1-N 2.65Å; D342-A344 VanDerWaalsContact OD1-N 3.14Å; D342-K345 HydrophobicContact CB-CB 3.79Å; D342-K345 VanDerWaalsContact CG-CB 3.4Å; D342-K345 PolarHBondContact O-N 3.17Å; D342-K345 VanDerWaalsContact O-N 3.09Å; D342-K345 PolarHBondContact OD1-N 2.85Å; D342-K345 WeakPolarHBondContact OD2-CB 3.31Å; D342-I346 WeakPolarHBondContact O-CG1 3.47Å; D342-I346 PolarHBondContact O-N 3.37Å
343	H	70.7	Confident	66.2	Low	60 Å²	60	62.3 Å²	62.3	28%	0.278	32%	0.318	S	S	.	.	H	α-helix	trans	-60.1	-26.5	-179.6	-67.4	-54.4	0	0	0	111.1	I338 L341 A347 F359	I338-H343 PolarHBondContact O-CE1 3.11Å; I338-H343 PolarHBondContact O-NE2 3Å; I338-H343 VanDerWaalsContact O-NE2 3.13Å; L341-H343 PolarHBondContact O-N 3.41Å; H343-A347 WeakPolarHBondContact O-CB 2.76Å; H343-A347 PolarHBondContact O-N 3.48Å; H343-F359 HydrophobicContact CB-CZ 4.48Å; H343-F359 AromaticContact CE1-CE1 3.78Å; H343-F359 AromaticContact CE1-CZ 3.82Å; H343-F359 AromaticContact CG-CZ 3.93Å; H343-F359 AromaticContact ND1-CE1 4Å; H343-F359 AromaticContact ND1-CZ 3.56Å
344	A	68.4	Low	67.5	Low	68 Å²	68	70.1 Å²	70.1	56%	0.562	34%	0.344	S	S	*	.	H	α-helix	trans	-69.1	-49.9	173	0	0	0	0	0	110.4	D342 I346 A347 E348	D342-A344 PolarHBondContact O-N 2.86Å; D342-A344 WeakPolarHBondContact OD1-CB 3.05Å; D342-A344 PolarHBondContact OD1-N 2.65Å; D342-A344 VanDerWaalsContact OD1-N 3.14Å; A344-I346 PolarHBondContact O-N 3.47Å; A344-A347 PolarHBondContact O-N 3.33Å; A344-E348 VanDerWaalsContact O-CB 3.22Å; A344-E348 WeakPolarHBondContact O-CB 3.42Å; A344-E348 PolarHBondContact O-N 3.23Å
345	K	73	Confident	68.8	Low	80 Å²	80	70.1 Å²	70.1	35%	0.348	34%	0.344	S	S	.	.	H	α-helix	trans	-59.8	-42.7	175.2	-175.2	-178.4	-179.9	-170.4	0	112.4	T299 D300 D342 T349	T299-K345 HydrophobicContact CG2-CD 4.16Å; D300-K345 IonicContact OD1-NZ 2.76Å; D300-K345 PolarHBondContact OD1-NZ 3.34Å; D342-K345 HydrophobicContact CB-CB 3.79Å; D342-K345 VanDerWaalsContact CG-CB 3.4Å; D342-K345 PolarHBondContact O-N 3.17Å; D342-K345 VanDerWaalsContact O-N 3.09Å; D342-K345 PolarHBondContact OD1-N 2.85Å; D342-K345 WeakPolarHBondContact OD2-CB 3.31Å; K345-T349 VanDerWaalsContact O-CB 3.31Å; K345-T349 WeakPolarHBondContact O-CB 3.24Å; K345-T349 PolarHBondContact O-N 2.8Å; K345-T349 PolarHBondContact O-OG1 3.05Å
346	I	71.3	Confident	69.8	Low	4 Å²	4	71.7 Å²	71.7	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-64.5	-49.3	176.6	-66.6	167.5	0	0	0	109.9	T299 F302 L303 L341 D342 A344 E348 T349 L350 W357	T299-I346 HydrophobicContact CG2-CD1 4.23Å; T299-I346 HydrophobicContact CG2-CG1 3.94Å; F302-I346 HydrophobicContact CD1-CD1 3.68Å; F302-I346 HydrophobicContact CD1-CG1 4.35Å; F302-I346 HydrophobicContact CE1-CD1 4Å; F302-I346 HydrophobicContact CE1-CG2 4.31Å; L303-I346 HydrophobicContact CD2-CG1 4.48Å; L341-I346 HydrophobicContact CB-CD1 3.81Å; L341-I346 HydrophobicContact CD1-CD1 4.31Å; L341-I346 HydrophobicContact CG-CD1 4.45Å; D342-I346 WeakPolarHBondContact O-CG1 3.47Å; D342-I346 PolarHBondContact O-N 3.37Å; A344-I346 PolarHBondContact O-N 3.47Å; I346-E348 VanDerWaalsContact C-N 3.33Å; I346-E348 PolarHBondContact O-N 3.07Å; I346-T349 PolarHBondContact O-N 2.78Å; I346-L350 HydrophobicContact CG2-CD1 3.68Å; I346-L350 HydrophobicContact CG2-CG 4.32Å; I346-L350 WeakPolarHBondContact O-CB 3.47Å; I346-L350 WeakPolarHBondContact O-CG 3.49Å; I346-L350 PolarHBondContact O-N 3.25Å; I346-W357 HydrophobicContact CG2-CE3 4.35Å
347	A	71.1	Confident	70.8	Confident	48 Å²	48	70.9 Å²	70.9	40%	0.397	35%	0.351	S	S	.	.	H	α-helix	trans	-62.5	-40.4	179.1	0	0	0	0	0	111.7	H343 A344 L350 S351	H343-A347 WeakPolarHBondContact O-CB 2.76Å; H343-A347 PolarHBondContact O-N 3.48Å; A344-A347 PolarHBondContact O-N 3.33Å; A347-L350 PolarHBondContact O-N 3.13Å; A347-S351 WeakPolarHBondContact O-CA 3.4Å; A347-S351 WeakPolarHBondContact O-CB 3.5Å; A347-S351 PolarHBondContact O-N 3.39Å; A347-S351 PolarHBondContact O-OG 2.94Å
348	E	71.2	Confident	71.9	Confident	120 Å²	120	73.5 Å²	73.5	56%	0.561	36%	0.362	S	S	*	.	H	α-helix	trans	-61.2	-53.7	175.5	-177	177.1	-154.3	0	0	110.6	A344 I346 L350 S351 I352	A344-E348 VanDerWaalsContact O-CB 3.22Å; A344-E348 WeakPolarHBondContact O-CB 3.42Å; A344-E348 PolarHBondContact O-N 3.23Å; I346-E348 VanDerWaalsContact C-N 3.33Å; I346-E348 PolarHBondContact O-N 3.07Å; E348-L350 PolarHBondContact O-N 2.86Å; E348-S351 WeakPolarHBondContact CA-OG 3.19Å; E348-S351 PolarHBondContact O-N 2.83Å; E348-S351 VanDerWaalsContact O-N 3.09Å; E348-S351 PolarHBondContact O-OG 3.24Å; E348-I352 HydrophobicContact CG-CD1 4.31Å; E348-I352 WeakPolarHBondContact O-CG1 3.37Å; E348-I352 PolarHBondContact O-N 3.32Å; E348-I352 VanDerWaalsContact O-N 3.08Å
349	T	70.9	Confident	72.4	Confident	51 Å²	51	75.7 Å²	75.7	31%	0.313	37%	0.37	S	S	.	.	H	α-helix	trans	-55.3	-40.8	178.6	-56.1	0	0	0	0	111.7	L303 K345 I346	L303-T349 HydrophobicContact CD2-CG2 4.42Å; K345-T349 VanDerWaalsContact O-CB 3.31Å; K345-T349 WeakPolarHBondContact O-CB 3.24Å; K345-T349 PolarHBondContact O-N 2.8Å; K345-T349 PolarHBondContact O-OG1 3.05Å; I346-T349 PolarHBondContact O-N 2.78Å
350	L	73.9	Confident	72.5	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.005	36%	0.357	C	S	.	.	H	α-helix	trans	-78.1	-34.1	179.2	-68.2	177	0	0	0	112.8	L306 Y319 I346 A347 E348 R353 R354 I355 W357	L306-L350 HydrophobicContact CD1-CD2 4.39Å; L306-L350 HydrophobicContact CD2-CD2 4.08Å; Y319-L350 HydrophobicContact CD2-CD1 4.3Å; Y319-L350 HydrophobicContact CE2-CD2 4.23Å; I346-L350 HydrophobicContact CG2-CD1 3.68Å; I346-L350 HydrophobicContact CG2-CG 4.32Å; I346-L350 WeakPolarHBondContact O-CB 3.47Å; I346-L350 WeakPolarHBondContact O-CG 3.49Å; I346-L350 PolarHBondContact O-N 3.25Å; A347-L350 PolarHBondContact O-N 3.13Å; E348-L350 PolarHBondContact O-N 2.86Å; L350-R353 CarbonylContact O-C 3.54Å; L350-R353 WeakPolarHBondContact O-CA 3.29Å; L350-R353 PolarHBondContact O-N 3.5Å; L350-R354 PolarHBondContact O-N 3.49Å; L350-R354 VanDerWaalsContact O-N 3.09Å; L350-I355 HydrophobicContact CB-CB 4.14Å; L350-I355 HydrophobicContact CD2-CB 4.24Å; L350-I355 HydrophobicContact CD2-CD1 3.74Å; L350-I355 HydrophobicContact CD2-CG2 4.3Å; L350-I355 PolarHBondContact O-N 3.47Å; L350-W357 HydrophobicContact CD1-CB 4.35Å; L350-W357 HydrophobicContact CD1-CD2 4.22Å; L350-W357 HydrophobicContact CD1-CE3 3.33Å; L350-W357 HydrophobicContact CD1-CZ3 4.01Å
351	S	70.9	Confident	71.8	Confident	72 Å²	72	68.8 Å²	68.8	50%	0.503	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-39	-180	73.5	0	0	0	0	111.7	A347 E348 R353 R354	A347-S351 WeakPolarHBondContact O-CA 3.4Å; A347-S351 WeakPolarHBondContact O-CB 3.5Å; A347-S351 PolarHBondContact O-N 3.39Å; A347-S351 PolarHBondContact O-OG 2.94Å; E348-S351 WeakPolarHBondContact CA-OG 3.19Å; E348-S351 PolarHBondContact O-N 2.83Å; E348-S351 VanDerWaalsContact O-N 3.09Å; E348-S351 PolarHBondContact O-OG 3.24Å; S351-R353 PolarHBondContact O-N 2.86Å; S351-R354 WeakPolarHBondContact O-CA 3.39Å; S351-R354 PolarHBondContact O-N 3.45Å
352	I	74.3	Confident	70.8	Confident	131 Å²	131	71.3 Å²	71.3	67%	0.672	37%	0.372	S	S	*	.	H	α-helix	trans	-57.3	-35.6	173	-66.9	166	0	0	0	110.1	E348 R354	E348-I352 HydrophobicContact CG-CD1 4.31Å; E348-I352 WeakPolarHBondContact O-CG1 3.37Å; E348-I352 PolarHBondContact O-N 3.32Å; E348-I352 VanDerWaalsContact O-N 3.08Å; I352-R354 VanDerWaalsContact C-N 3.33Å
353	R	74.2	Confident	69.7	Low	97 Å²	97	71.7 Å²	71.7	37%	0.366	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	5.7	178.5	-62.2	178.8	63	-165.5	-5.1	113.8	E310 T315 L350 S351 I355	E310-R353 IonicContact OE1-NH1 3.62Å; E310-R353 IonicContact OE1-NH2 3.99Å; E310-R353 IonicContact OE2-CZ 2.78Å; E310-R353 IonicContact OE2-NH1 3.66Å; E310-R353 PolarHBondContact OE2-NH1 2.76Å; E310-R353 IonicContact OE2-NH2 3.71Å; E310-R353 PolarHBondContact OE2-NH2 2.86Å; T315-R353 PolarHBondContact OG1-NH2 3.31Å; T315-R353 VanDerWaalsContact OG1-NH2 3.16Å; L350-R353 CarbonylContact O-C 3.54Å; L350-R353 WeakPolarHBondContact O-CA 3.29Å; L350-R353 PolarHBondContact O-N 3.5Å; S351-R353 PolarHBondContact O-N 2.86Å; R353-I355 VanDerWaalsContact C-N 3.29Å; R353-I355 HydrophobicContact CB-CD1 3.84Å; R353-I355 HydrophobicContact CB-CG1 4.11Å; R353-I355 PolarHBondContact O-N 2.93Å
354	R	79	Confident	68.5	Low	233 Å²	233	69.6 Å²	69.6	88%	0.879	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	32.7	-178.5	-54.2	-178.4	178.8	-166.7	-0.9	114.2	L350 S351 I352	L350-R354 PolarHBondContact O-N 3.49Å; L350-R354 VanDerWaalsContact O-N 3.09Å; S351-R354 WeakPolarHBondContact O-CA 3.39Å; S351-R354 PolarHBondContact O-N 3.45Å; I352-R354 VanDerWaalsContact C-N 3.33Å
355	I	79.2	Confident	67.3	Low	10 Å²	10	72 Å²	72	5%	0.051	39%	0.389	C	S	.	.			trans	-101.1	129	177.8	-54.9	164.7	0	0	0	108.8	T315 Y319 L350 R353	T315-I355 HydrophobicContact CG2-CD1 3.33Å; T315-I355 HydrophobicContact CG2-CG1 3.83Å; Y319-I355 HydrophobicContact CD2-CG2 3.65Å; Y319-I355 HydrophobicContact CE2-CG2 3.8Å; L350-I355 HydrophobicContact CB-CB 4.14Å; L350-I355 HydrophobicContact CD2-CB 4.24Å; L350-I355 HydrophobicContact CD2-CD1 3.74Å; L350-I355 HydrophobicContact CD2-CG2 4.3Å; L350-I355 PolarHBondContact O-N 3.47Å; R353-I355 VanDerWaalsContact C-N 3.29Å; R353-I355 HydrophobicContact CB-CD1 3.84Å; R353-I355 HydrophobicContact CB-CG1 4.11Å; R353-I355 PolarHBondContact O-N 2.93Å
356	S	79.1	Confident	66.2	Low	49 Å²	49	69.7 Å²	69.7	34%	0.343	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	138.7	176.8	68.3	0	0	0	0	112	A317 A318 Y319 H358	A317-S356 PolarHBondContact O-N 3.41Å; A317-S356 VanDerWaalsContact O-N 3.13Å; A318-S356 CarbonylContact C-O 3.37Å; A318-S356 WeakPolarHBondContact CA-O 3.32Å; A318-S356 WeakPolarHBondContact CB-OG 3.45Å; Y319-S356 PolarHBondContact N-O 2.85Å; S356-H358 PolarHBondContact OG-NE2 3.45Å
357	W	80.7	Confident	65.2	Low	45 Å²	45	73.5 Å²	73.5	17%	0.17	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126	173.1	-167.2	-75	0	0	0	110.1	V259 F302 L306 Y319 S321 I346 L350 F359	V259-W357 HydrophobicContact CB-CH2 4.13Å; V259-W357 HydrophobicContact CB-CZ2 4.49Å; V259-W357 HydrophobicContact CG1-CH2 4.27Å; V259-W357 HydrophobicContact CG2-CH2 3.84Å; V259-W357 HydrophobicContact CG2-CZ3 4.36Å; F302-W357 AromaticContact CE1-CH2 3.79Å; F302-W357 HydrophobicContact CE1-CH2 3.79Å; F302-W357 HydrophobicContact CE1-CZ3 4.09Å; F302-W357 HydrophobicContact CE2-CH2 4.43Å; F302-W357 AromaticContact CZ-CH2 3.38Å; F302-W357 HydrophobicContact CZ-CH2 3.38Å; F302-W357 HydrophobicContact CZ-CZ2 4.4Å; F302-W357 AromaticContact CZ-CZ3 3.83Å; F302-W357 HydrophobicContact CZ-CZ3 3.83Å; L306-W357 HydrophobicContact CD1-CZ3 4.02Å; Y319-W357 VanDerWaalsContact CB-CZ3 3.48Å; Y319-W357 HydrophobicContact CD1-CZ3 4.19Å; Y319-W357 AromaticContact CD2-CE3 3.7Å; Y319-W357 HydrophobicContact CD2-CE3 3.7Å; Y319-W357 AromaticContact CD2-CZ3 3.76Å; Y319-W357 HydrophobicContact CD2-CZ3 3.76Å; Y319-W357 HydrophobicContact CE2-CZ3 4.5Å; Y319-W357 AromaticContact CG-CE3 3.69Å; Y319-W357 HydrophobicContact CG-CE3 3.69Å; Y319-W357 HydrophobicContact CG-CH2 4.43Å; Y319-W357 AromaticContact CG-CZ3 3.56Å; Y319-W357 HydrophobicContact CG-CZ3 3.56Å; S321-W357 PolarHBondContact OG-NE1 3.18Å; I346-W357 HydrophobicContact CG2-CE3 4.35Å; L350-W357 HydrophobicContact CD1-CB 4.35Å; L350-W357 HydrophobicContact CD1-CD2 4.22Å; L350-W357 HydrophobicContact CD1-CE3 3.33Å; L350-W357 HydrophobicContact CD1-CZ3 4.01Å; W357-F359 AromaticContact CD1-CE2 3.68Å; W357-F359 AromaticContact CD1-CZ 3.68Å; W357-F359 AromaticContact NE1-CE1 3.66Å; W357-F359 AromaticContact NE1-CZ 3.59Å
358	H	78.3	Confident	64.3	Low	73 Å²	73	74.1 Å²	74.1	34%	0.338	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	142.6	-179.1	-57.7	-73.7	0	0	0	110.8	Y319 W320 S321 S356	Y319-H358 PolarHBondContact O-N 2.87Å; W320-H358 CarbonylContact C-O 3.57Å; W320-H358 VanDerWaalsContact CA-O 3.27Å; W320-H358 WeakPolarHBondContact CA-O 3.27Å; W320-H358 HydrophobicContact CD2-CB 3.73Å; W320-H358 AromaticContact CE2-CD2 3.7Å; W320-H358 AromaticContact CE2-CG 3.96Å; W320-H358 HydrophobicContact CE3-CB 3.84Å; W320-H358 HydrophobicContact CG-CB 4.17Å; W320-H358 HydrophobicContact CH2-CB 4.39Å; W320-H358 HydrophobicContact CZ2-CB 4.26Å; W320-H358 AromaticContact CZ2-CD2 3.96Å; W320-H358 HydrophobicContact CZ3-CB 4.19Å; W320-H358 AromaticContact NE1-CD2 3.58Å; S321-H358 PolarHBondContact N-O 3.37Å; S356-H358 PolarHBondContact OG-NE2 3.45Å
359	F	71.8	Confident	63.9	Low	77 Å²	77	69.5 Å²	69.5	34%	0.338	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126.8	171.5	-65.4	-85.3	0	0	0	110.4	S321 N323 H343 W357	S321-F359 CarbonylContact O-C 3.56Å; S321-F359 WeakPolarHBondContact O-CA 2.92Å; S321-F359 VanDerWaalsContact OG-CD1 3.26Å; S321-F359 WeakPolarHBondContact OG-CD1 3.41Å; S321-F359 WeakPolarHBondContact OG-CE1 3.42Å; N323-F359 WeakPolarHBondContact ND2-CB 3.19Å; N323-F359 WeakPolarHBondContact OD1-CB 3.38Å; N323-F359 WeakPolarHBondContact OD1-CD1 3.4Å; N323-F359 VanDerWaalsContact OD1-CG 3.26Å; N323-F359 WeakPolarHBondContact OD1-CG 3.32Å; H343-F359 HydrophobicContact CB-CZ 4.48Å; H343-F359 AromaticContact CE1-CE1 3.78Å; H343-F359 AromaticContact CE1-CZ 3.82Å; H343-F359 AromaticContact CG-CZ 3.93Å; H343-F359 AromaticContact ND1-CE1 4Å; H343-F359 AromaticContact ND1-CZ 3.56Å; W357-F359 AromaticContact CD1-CE2 3.68Å; W357-F359 AromaticContact CD1-CZ 3.68Å; W357-F359 AromaticContact NE1-CE1 3.66Å; W357-F359 AromaticContact NE1-CZ 3.59Å
360	N	65	Low	63.4	Low	35 Å²	35	68 Å²	68	19%	0.187	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	148.1	172.4	-77.2	-49.8	0	0	0	110.4	S321 N323 A364	S321-N360 PolarHBondContact O-N 2.91Å; N323-N360 WeakPolarHBondContact CB-O 3.16Å; N323-N360 PolarHBondContact N-O 3.04Å; N360-A364 HydrophobicContact CB-CB 4Å
361	P	48.7	Very low	63	Low	99 Å²	99	76.4 Å²	76.4	64%	0.643	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-60.4	143.3	163.8	26	-31.7	0	0	0	109.8	A363	P361-A363 PolarHBondContact O-N 3.39Å
362	P	45.1	Very low	62.8	Low	66 Å²	66	75.7 Å²	75.7	43%	0.429	40%	0.399	S	S	.	.	S	Bend	trans	-50.6	136.7	-174	15.2	-28.5	0	0	0	112.4	D322	D322-P362 VanDerWaalsContact OD1-CA 3.29Å; D322-P362 WeakPolarHBondContact OD1-CA 3.45Å
363	A	47.6	Very low	62.4	Low	87 Å²	87	69.5 Å²	69.5	72%	0.719	37%	0.367	S	S	*	.	S	Bend	trans	80.9	43.9	177.8	0	0	0	0	0	117.2	D322 P361	D322-A363 PolarHBondContact OD2-N 2.92Å; P361-A363 PolarHBondContact O-N 3.39Å
364	A	43.9	Very low	62	Low	16 Å²	16	69.3 Å²	69.3	13%	0.132	37%	0.369	C	S	.	.			trans	-74.9	157.3	173.6	0	0	0	0	0	114.2	N360 H366	N360-A364 HydrophobicContact CB-CB 4Å; A364-H366 PolarHBondContact O-CE1 3.18Å; A364-H366 VanDerWaalsContact O-CE1 3.25Å; A364-H366 PolarHBondContact O-N 2.87Å; A364-H366 PolarHBondContact O-ND1 2.8Å
365	P	44	Very low	61.6	Low	117 Å²	117	67.8 Å²	67.8	76%	0.76	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	11.9	-169.2	25.6	-35.2	0	0	0	117.2	M367	P365-M367 PolarHBondContact O-N 3.42Å
366	H	51	Low	60.9	Low	33 Å²	33	68 Å²	68	15%	0.153	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.6	176.8	55.7	-100.4	0	0	0	113	D260 D322 A364 A368 L369 I370	D260-H366 IonicContact OD2-CD2 3.82Å; D260-H366 PolarHBondContact OD2-CD2 3.1Å; D260-H366 IonicContact OD2-CG 3.88Å; D260-H366 IonicContact OD2-NE2 2.81Å; D260-H366 PolarHBondContact OD2-NE2 3.4Å; D322-H366 IonicContact OD2-CE1 3.12Å; D322-H366 PolarHBondContact OD2-CE1 2.85Å; D322-H366 VanDerWaalsContact OD2-CE1 3.31Å; D322-H366 IonicContact OD2-NE2 3.34Å; A364-H366 PolarHBondContact O-CE1 3.18Å; A364-H366 VanDerWaalsContact O-CE1 3.25Å; A364-H366 PolarHBondContact O-N 2.87Å; A364-H366 PolarHBondContact O-ND1 2.8Å; H366-A368 PolarHBondContact O-N 3.34Å; H366-L369 PolarHBondContact O-N 3.37Å; H366-L369 VanDerWaalsContact O-N 3.14Å; H366-I370 PolarHBondContact O-N 3.37Å
367	M	49.6	Very low	60.3	Low	84 Å²	84	65.9 Å²	65.9	41%	0.414	35%	0.352	S	S	.	.	H	α-helix	trans	-53.2	-31.1	-178.3	-77.8	-162.7	152.7	0	0	114.9	I327 P365 R371	I327-M367 HydrophobicContact CD1-CE 4.26Å; P365-M367 PolarHBondContact O-N 3.42Å; M367-R371 WeakPolarHBondContact O-CB 3.44Å; M367-R371 PolarHBondContact O-N 3.18Å
368	A	52.5	Low	59.7	Low	61 Å²	61	68.2 Å²	68.2	50%	0.504	37%	0.371	S	S	.	.	H	α-helix	trans	-66.6	-39.9	-178.5	0	0	0	0	0	112.4	H366 R371 S372	H366-A368 PolarHBondContact O-N 3.34Å; A368-R371 PolarHBondContact O-N 3.27Å; A368-S372 PolarHBondContact O-N 3.43Å; A368-S372 PolarHBondContact O-OG 2.79Å
369	L	62.1	Low	58.9	Low	22 Å²	22	68.5 Å²	68.5	12%	0.115	39%	0.386	C	S	.	.	H	α-helix	trans	-76.7	-36.8	-179.6	-72.8	-177.6	0	0	0	112.5	T282 V289 H366 R371 S372 A373	T282-L369 HydrophobicContact CG2-CD1 3.42Å; T282-L369 VanDerWaalsContact CG2-CD1 3.42Å; V289-L369 HydrophobicContact CG2-CD1 4.31Å; H366-L369 PolarHBondContact O-N 3.37Å; H366-L369 VanDerWaalsContact O-N 3.14Å; L369-R371 PolarHBondContact O-N 2.84Å; L369-S372 PolarHBondContact O-N 2.59Å; L369-A373 WeakPolarHBondContact O-CB 3.48Å; L369-A373 PolarHBondContact O-N 3.42Å
370	I	60.5	Low	58.5	Low	21 Å²	21	67.7 Å²	67.7	11%	0.108	39%	0.387	C	S	.	.	H	α-helix	trans	-60.1	-40.9	171.3	-62.9	169.8	0	0	0	110.1	D260 F262 L280 H366 S372 A373 K374	D260-I370 HydrophobicContact CB-CD1 4.12Å; D260-I370 WeakPolarHBondContact OD2-CD1 3.22Å; F262-I370 HydrophobicContact CB-CG2 4.12Å; F262-I370 HydrophobicContact CG-CG2 4.42Å; L280-I370 HydrophobicContact CD2-CG1 3.72Å; H366-I370 PolarHBondContact O-N 3.37Å; I370-S372 VanDerWaalsContact C-N 3.31Å; I370-S372 PolarHBondContact O-N 2.84Å; I370-A373 PolarHBondContact O-N 3.14Å; I370-K374 HydrophobicContact CG2-CD 3.91Å; I370-K374 HydrophobicContact CG2-CG 3.95Å; I370-K374 VanDerWaalsContact O-CB 3.29Å; I370-K374 WeakPolarHBondContact O-CB 3.5Å; I370-K374 WeakPolarHBondContact O-CG 3.21Å; I370-K374 PolarHBondContact O-N 3.39Å
371	R	65.8	Low	58.2	Low	177 Å²	177	68.8 Å²	68.8	67%	0.668	39%	0.39	S	S	*	.	H	α-helix	trans	-60.9	-42.9	177.9	-168.2	-176.8	-62.2	153.4	0.5	111.1	M367 A368 L369 R375	M367-R371 WeakPolarHBondContact O-CB 3.44Å; M367-R371 PolarHBondContact O-N 3.18Å; A368-R371 PolarHBondContact O-N 3.27Å; L369-R371 PolarHBondContact O-N 2.84Å; R371-R375 WeakPolarHBondContact O-CB 3.41Å; R371-R375 PolarHBondContact O-N 3.4Å
372	S	67.3	Low	58.3	Low	57 Å²	57	72.8 Å²	72.8	40%	0.399	39%	0.394	S	S	.	.	H	α-helix	trans	-64.8	-44.3	175.5	-59.9	0	0	0	0	112.2	A368 L369 I370 R375 A376	A368-S372 PolarHBondContact O-N 3.43Å; A368-S372 PolarHBondContact O-OG 2.79Å; L369-S372 PolarHBondContact O-N 2.59Å; I370-S372 VanDerWaalsContact C-N 3.31Å; I370-S372 PolarHBondContact O-N 2.84Å; S372-R375 PolarHBondContact O-N 2.77Å; S372-A376 WeakPolarHBondContact O-CB 3.06Å; S372-A376 PolarHBondContact O-N 2.89Å
373	A	64.1	Low	58.8	Low	0 Å²	0	78.3 Å²	78.3	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-62.8	-47.7	177.2	0	0	0	0	0	111.9	F262 L369 I370 A376 L377 L402	F262-A373 HydrophobicContact CZ-CB 4.41Å; L369-A373 WeakPolarHBondContact O-CB 3.48Å; L369-A373 PolarHBondContact O-N 3.42Å; I370-A373 PolarHBondContact O-N 3.14Å; A373-A376 PolarHBondContact O-N 3.33Å; A373-L377 WeakPolarHBondContact O-CB 3.43Å; A373-L377 WeakPolarHBondContact O-CG 3.32Å; A373-L377 PolarHBondContact O-N 3.31Å; A373-L402 HydrophobicContact CB-CD1 3.77Å
374	K	67.6	Low	59.3	Low	94 Å²	94	76.6 Å²	76.6	41%	0.409	40%	0.402	S	S	.	.	H	α-helix	trans	-59.5	-47.8	175	-77.4	-171.8	175.6	-168.7	0	111.1	F262 I370 A376 L377 T378	F262-K374 HydrophobicContact CD2-CG 4.05Å; I370-K374 HydrophobicContact CG2-CD 3.91Å; I370-K374 HydrophobicContact CG2-CG 3.95Å; I370-K374 VanDerWaalsContact O-CB 3.29Å; I370-K374 WeakPolarHBondContact O-CB 3.5Å; I370-K374 WeakPolarHBondContact O-CG 3.21Å; I370-K374 PolarHBondContact O-N 3.39Å; K374-A376 VanDerWaalsContact C-N 3.33Å; K374-A376 PolarHBondContact O-N 2.99Å; K374-L377 PolarHBondContact O-N 2.82Å; K374-T378 WeakPolarHBondContact O-CB 3.45Å; K374-T378 PolarHBondContact O-N 3.48Å; K374-T378 PolarHBondContact O-OG1 3.31Å
375	R	69	Low	60.5	Low	201 Å²	201	80.9 Å²	80.9	76%	0.758	43%	0.427	S	S	*	.	H	α-helix	trans	-62.5	-41.9	180	-171.8	175.9	-178.7	-179.6	0.4	111.6	R371 S372 A379	R371-R375 WeakPolarHBondContact O-CB 3.41Å; R371-R375 PolarHBondContact O-N 3.4Å; S372-R375 PolarHBondContact O-N 2.77Å; R375-A379 VanDerWaalsContact O-CB 3.28Å; R375-A379 WeakPolarHBondContact O-CB 3.38Å; R375-A379 PolarHBondContact O-N 3.29Å
376	A	65.5	Low	62.1	Low	14 Å²	14	76.5 Å²	76.5	12%	0.116	40%	0.397	C	S	.	.	H	α-helix	trans	-61	-48.5	174.4	0	0	0	0	0	110.8	S372 A373 K374 A379 T380 V398 L401	S372-A376 WeakPolarHBondContact O-CB 3.06Å; S372-A376 PolarHBondContact O-N 2.89Å; A373-A376 PolarHBondContact O-N 3.33Å; K374-A376 VanDerWaalsContact C-N 3.33Å; K374-A376 PolarHBondContact O-N 2.99Å; A376-A379 PolarHBondContact O-N 3.42Å; A376-T380 PolarHBondContact O-N 3.02Å; A376-T380 PolarHBondContact O-OG1 3.4Å; A376-V398 HydrophobicContact CB-CB 4.49Å; A376-V398 HydrophobicContact CB-CG1 3.75Å; A376-V398 HydrophobicContact CB-CG2 4Å; A376-L401 HydrophobicContact CB-CD2 4.01Å
377	L	67.1	Low	63.8	Low	5 Å²	5	77.3 Å²	77.3	3%	0.026	40%	0.404	C	S	.	.	H	α-helix	trans	-63.9	-43.5	178.1	-72.8	163.3	0	0	0	113.1	F262 F265 A373 K374 A379 T380 F381 A394 L395 V398	F262-L377 HydrophobicContact CD2-CD1 4.47Å; F262-L377 HydrophobicContact CE2-CD1 3.35Å; F262-L377 HydrophobicContact CZ-CD1 3.86Å; F265-L377 HydrophobicContact CE1-CD1 4.44Å; F265-L377 HydrophobicContact CZ-CD1 3.98Å; A373-L377 WeakPolarHBondContact O-CB 3.43Å; A373-L377 WeakPolarHBondContact O-CG 3.32Å; A373-L377 PolarHBondContact O-N 3.31Å; K374-L377 PolarHBondContact O-N 2.82Å; L377-A379 VanDerWaalsContact C-N 3.28Å; L377-A379 PolarHBondContact O-N 2.82Å; L377-T380 PolarHBondContact O-N 3.05Å; L377-F381 WeakPolarHBondContact O-CD2 3.18Å; L377-F381 PolarHBondContact O-N 3.09Å; L377-A394 HydrophobicContact CD2-CB 4.13Å; L377-L395 HydrophobicContact CD1-CD2 3.76Å; L377-L395 HydrophobicContact CD2-CD2 3.94Å; L377-L395 HydrophobicContact CG-CD2 4.48Å; L377-V398 HydrophobicContact CD2-CB 4.1Å; L377-V398 HydrophobicContact CD2-CG2 3.54Å; L377-V398 HydrophobicContact CG-CB 4.25Å; L377-V398 HydrophobicContact CG-CG1 4.17Å; L377-V398 HydrophobicContact CG-CG2 3.79Å
378	T	67.2	Low	65.6	Low	93 Å²	93	74.8 Å²	74.8	57%	0.571	39%	0.392	S	S	*	.	H	α-helix	trans	-62.4	-38.2	176.3	-55.6	0	0	0	0	111.2	K374 Y382	K374-T378 WeakPolarHBondContact O-CB 3.45Å; K374-T378 PolarHBondContact O-N 3.48Å; K374-T378 PolarHBondContact O-OG1 3.31Å; T378-Y382 PolarHBondContact O-N 2.64Å
379	A	61.8	Low	67.3	Low	79 Å²	79	79 Å²	79	65%	0.653	40%	0.402	S	S	*	.	H	α-helix	trans	-67.6	-38.6	175.3	0	0	0	0	0	112.1	R375 A376 L377	R375-A379 VanDerWaalsContact O-CB 3.28Å; R375-A379 WeakPolarHBondContact O-CB 3.38Å; R375-A379 PolarHBondContact O-N 3.29Å; A376-A379 PolarHBondContact O-N 3.42Å; L377-A379 VanDerWaalsContact C-N 3.28Å; L377-A379 PolarHBondContact O-N 2.82Å
380	T	62.8	Low	68.3	Low	61 Å²	61	81.3 Å²	81.3	37%	0.374	41%	0.413	S	S	.	.	H	α-helix	trans	-72.9	-27.8	178.7	-45.3	0	0	0	0	112.6	A376 L377 Y397	A376-T380 PolarHBondContact O-N 3.02Å; A376-T380 PolarHBondContact O-OG1 3.4Å; L377-T380 PolarHBondContact O-N 3.05Å; T380-Y397 HydrophobicContact CG2-CD1 4.31Å
381	F	58.5	Low	69.6	Low	57 Å²	57	80.4 Å²	80.4	25%	0.25	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	39.8	-171.1	-67.7	-80.6	0	0	0	114.7	L377 K383 L386 I390 A394	L377-F381 WeakPolarHBondContact O-CD2 3.18Å; L377-F381 PolarHBondContact O-N 3.09Å; F381-K383 VanDerWaalsContact C-N 3.25Å; F381-K383 PolarHBondContact O-N 2.85Å; F381-K383 VanDerWaalsContact O-N 3.15Å; F381-L386 HydrophobicContact CD1-CD2 4.1Å; F381-L386 HydrophobicContact CD1-CG 4.28Å; F381-L386 HydrophobicContact CE1-CD2 4.41Å; F381-L386 HydrophobicContact CG-CD2 4.44Å; F381-I390 HydrophobicContact CD1-CG2 4.39Å; F381-I390 HydrophobicContact CE1-CG2 3.52Å; F381-I390 HydrophobicContact CZ-CG2 4.23Å; F381-A394 HydrophobicContact CD2-CB 4.05Å; F381-A394 HydrophobicContact CE1-CB 4.23Å; F381-A394 HydrophobicContact CE2-CB 3.07Å; F381-A394 HydrophobicContact CZ-CB 3.18Å
382	Y	52.5	Low	70.7	Confident	183 Å²	183	74.9 Å²	74.9	72%	0.718	39%	0.394	S	S	*	.	S	Bend	trans	-62.4	-24.1	-174.5	-170.9	-121.4	0	0	0	114.4	T378	T378-Y382 PolarHBondContact O-N 2.64Å
383	K	53.7	Low	71.6	Confident	183 Å²	183	76.3 Å²	76.3	80%	0.796	40%	0.401	S	S	*	.	S	Bend	trans	-155.7	39	-173.4	-67.8	-168.7	174.5	179	0	117.3	F381	F381-K383 VanDerWaalsContact C-N 3.25Å; F381-K383 PolarHBondContact O-N 2.85Å; F381-K383 VanDerWaalsContact O-N 3.15Å
384	G	59.2	Low	72.4	Confident	50 Å²	50	76.5 Å²	76.5	52%	0.515	40%	0.402	S	S	.	.			trans	-122.3	151	-179.1	0	0	0	0	0	114.6	L386	G384-L386 PolarHBondContact O-N 2.73Å
385	T	68.4	Low	73.4	Confident	107 Å²	107	72.1 Å²	72.1	66%	0.656	38%	0.384	S	S	*	.			trans	-68.2	114.5	165.2	38.5	0	0	0	0	109.2	N268	N268-T385 WeakPolarHBondContact ND2-CG2 3.35Å
386	L	78.4	Confident	74.2	Confident	25 Å²	25	66.2 Å²	66.2	13%	0.131	37%	0.372	C	S	.	.			trans	-79.2	132.8	176.2	-83.2	127.3	0	0	0	110.4	V267 N268 F381 G384 I390 L391	V267-L386 CarbonylContact C-O 3.58Å; V267-L386 WeakPolarHBondContact CA-O 3.3Å; V267-L386 WeakPolarHBondContact CG1-O 3.48Å; V267-L386 HydrophobicContact CG2-CB 4.19Å; N268-L386 PolarHBondContact N-O 3.14Å; F381-L386 HydrophobicContact CD1-CD2 4.1Å; F381-L386 HydrophobicContact CD1-CG 4.28Å; F381-L386 HydrophobicContact CE1-CD2 4.41Å; F381-L386 HydrophobicContact CG-CD2 4.44Å; G384-L386 PolarHBondContact O-N 2.73Å; L386-I390 HydrophobicContact CD2-CG2 4.42Å; L386-L391 HydrophobicContact CD2-CB 3.95Å; L386-L391 HydrophobicContact CD2-CD1 4.01Å
387	T	85.9	Confident	75	Confident	50 Å²	50	71.4 Å²	71.4	31%	0.307	39%	0.389	S	S	.	.			trans	-109.4	166.2	163	64.7	0	0	0	0	109.5	E389 I390 L391	T387-E389 PolarHBondContact O-N 3.18Å; T387-I390 HydrophobicContact CG2-CD1 4.26Å; T387-I390 PolarHBondContact O-N 3.42Å; T387-I390 WeakPolarHBondContact OG1-CD1 3.47Å; T387-I390 VanDerWaalsContact OG1-CG1 3.25Å; T387-I390 WeakPolarHBondContact OG1-CG1 3.39Å; T387-I390 PolarHBondContact OG1-N 2.84Å; T387-L391 WeakPolarHBondContact O-CB 3.3Å; T387-L391 PolarHBondContact O-N 3.1Å
388	D	88.1	Confident	75.8	Confident	30 Å²	30	71.1 Å²	71.1	16%	0.16	39%	0.388	C	S	.	.	H	α-helix	trans	-59.1	-36.7	179.8	-78.8	-39.4	0	0	0	111.9	V267 R276 Y295 T392	V267-D388 VanDerWaalsContact CG1-N 3.3Å; R276-D388 IonicContact CZ-OD1 3.54Å; R276-D388 IonicContact CZ-OD2 3.13Å; R276-D388 IonicContact NE-OD1 3.03Å; R276-D388 PolarHBondContact NE-OD1 3.21Å; R276-D388 IonicContact NE-OD2 3.36Å; R276-D388 IonicContact NH2-OD1 3.47Å; R276-D388 PolarHBondContact NH2-OD1 3.29Å; R276-D388 IonicContact NH2-OD2 2.86Å; R276-D388 PolarHBondContact NH2-OD2 2.8Å; Y295-D388 HydrophobicContact CE1-CB 4.41Å; D388-T392 WeakPolarHBondContact O-CB 3.46Å; D388-T392 PolarHBondContact O-N 3.42Å; D388-T392 PolarHBondContact O-OG1 2.85Å
389	E	87.8	Confident	76.9	Confident	151 Å²	151	67.7 Å²	67.7	71%	0.706	37%	0.366	S	S	*	.	H	α-helix	trans	-68.2	-44.7	175.9	-176.6	178.6	-168.5	0	0	112.3	T387 T392 T393	T387-E389 PolarHBondContact O-N 3.18Å; E389-T392 PolarHBondContact O-N 3Å; E389-T393 WeakPolarHBondContact O-CB 3.48Å; E389-T393 PolarHBondContact O-N 3.4Å; E389-T393 PolarHBondContact O-OG1 2.77Å
390	I	84	Confident	77.9	Confident	69 Å²	69	65.8 Å²	65.8	35%	0.354	34%	0.344	S	S	.	.	H	α-helix	trans	-63.7	-43.9	177.7	-68.3	170.4	0	0	0	110	F381 L386 T387 T392 T393 A394	F381-I390 HydrophobicContact CD1-CG2 4.39Å; F381-I390 HydrophobicContact CE1-CG2 3.52Å; F381-I390 HydrophobicContact CZ-CG2 4.23Å; L386-I390 HydrophobicContact CD2-CG2 4.42Å; T387-I390 HydrophobicContact CG2-CD1 4.26Å; T387-I390 PolarHBondContact O-N 3.42Å; T387-I390 WeakPolarHBondContact OG1-CD1 3.47Å; T387-I390 VanDerWaalsContact OG1-CG1 3.25Å; T387-I390 WeakPolarHBondContact OG1-CG1 3.39Å; T387-I390 PolarHBondContact OG1-N 2.84Å; I390-T392 VanDerWaalsContact C-N 3.34Å; I390-T392 PolarHBondContact O-N 2.86Å; I390-T393 PolarHBondContact O-N 3.05Å; I390-A394 VanDerWaalsContact O-CB 3.26Å; I390-A394 WeakPolarHBondContact O-CB 3.47Å; I390-A394 PolarHBondContact O-N 3.29Å
391	L	86.2	Confident	78.8	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.01	35%	0.349	C	S	.	.	H	α-helix	trans	-63.1	-40.3	177	178.7	61.4	0	0	0	111.7	F265 V267 R276 V293 L386 T387 A394 L395	F265-L391 HydrophobicContact CB-CD1 4.41Å; F265-L391 HydrophobicContact CB-CD2 4.26Å; F265-L391 HydrophobicContact CD1-CD1 4.42Å; F265-L391 HydrophobicContact CD2-CD1 4.17Å; F265-L391 HydrophobicContact CD2-CD2 4.43Å; F265-L391 HydrophobicContact CG-CD1 4.07Å; V267-L391 HydrophobicContact CG2-CD2 3.86Å; R276-L391 HydrophobicContact CB-CD2 3.56Å; R276-L391 HydrophobicContact CG-CD2 4.08Å; V293-L391 HydrophobicContact CG1-CD2 4.02Å; V293-L391 HydrophobicContact CG2-CD2 4.28Å; V293-L391 HydrophobicContact CG2-CG 4.06Å; L386-L391 HydrophobicContact CD2-CB 3.95Å; L386-L391 HydrophobicContact CD2-CD1 4.01Å; T387-L391 WeakPolarHBondContact O-CB 3.3Å; T387-L391 PolarHBondContact O-N 3.1Å; L391-A394 VanDerWaalsContact O-CB 3.29Å; L391-A394 WeakPolarHBondContact O-CB 3.38Å; L391-A394 PolarHBondContact O-N 3.43Å; L391-L395 HydrophobicContact CD1-CG 4.41Å; L391-L395 WeakPolarHBondContact O-CG 3.33Å; L391-L395 PolarHBondContact O-N 3.21Å; L391-L395 VanDerWaalsContact O-N 3.09Å
392	T	89.9	Confident	80	Confident	61 Å²	61	65 Å²	65	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-63.4	-46.5	176.6	-58.4	0	0	0	0	110.8	D388 E389 I390 A394 L395 C396	D388-T392 WeakPolarHBondContact O-CB 3.46Å; D388-T392 PolarHBondContact O-N 3.42Å; D388-T392 PolarHBondContact O-OG1 2.85Å; E389-T392 PolarHBondContact O-N 3Å; I390-T392 VanDerWaalsContact C-N 3.34Å; I390-T392 PolarHBondContact O-N 2.86Å; T392-A394 VanDerWaalsContact C-N 3.32Å; T392-A394 PolarHBondContact O-N 2.86Å; T392-L395 PolarHBondContact O-N 3.16Å; T392-C396 PolarHBondContact O-N 2.94Å; T392-C396 VanDerWaalsContact O-N 3.12Å; T392-C396 PolarHBondContact O-SG 2.96Å; T392-C396 VanDerWaalsContact O-SG 3.39Å
393	T	85.2	Confident	81.7	Confident	88 Å²	88	56.4 Å²	56.4	54%	0.54	31%	0.307	S	S	.	.	H	α-helix	trans	-62.6	-40.2	178.1	-55.2	0	0	0	0	111.8	E389 I390 L395 C396 Y397	E389-T393 WeakPolarHBondContact O-CB 3.48Å; E389-T393 PolarHBondContact O-N 3.4Å; E389-T393 PolarHBondContact O-OG1 2.77Å; I390-T393 PolarHBondContact O-N 3.05Å; T393-L395 PolarHBondContact O-N 3.48Å; T393-C396 WeakPolarHBondContact O-CB 3.3Å; T393-C396 PolarHBondContact O-N 3.39Å; T393-Y397 PolarHBondContact O-N 2.97Å
394	A	82.7	Confident	83	Confident	3 Å²	3	49.3 Å²	49.3	3%	0.025	29%	0.285	C	S	.	.	H	α-helix	trans	-54.9	-50	174.1	0	0	0	0	0	112.5	L377 F381 I390 L391 T392 C396 Y397 V398	L377-A394 HydrophobicContact CD2-CB 4.13Å; F381-A394 HydrophobicContact CD2-CB 4.05Å; F381-A394 HydrophobicContact CE1-CB 4.23Å; F381-A394 HydrophobicContact CE2-CB 3.07Å; F381-A394 HydrophobicContact CZ-CB 3.18Å; I390-A394 VanDerWaalsContact O-CB 3.26Å; I390-A394 WeakPolarHBondContact O-CB 3.47Å; I390-A394 PolarHBondContact O-N 3.29Å; L391-A394 VanDerWaalsContact O-CB 3.29Å; L391-A394 WeakPolarHBondContact O-CB 3.38Å; L391-A394 PolarHBondContact O-N 3.43Å; T392-A394 VanDerWaalsContact C-N 3.32Å; T392-A394 PolarHBondContact O-N 2.86Å; A394-C396 VanDerWaalsContact C-N 3.34Å; A394-Y397 PolarHBondContact O-N 3.04Å; A394-V398 WeakPolarHBondContact O-CG2 3.36Å; A394-V398 PolarHBondContact O-N 3.29Å
395	L	87.2	Confident	84	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-65.3	-40	-178.6	-69.5	-178.9	0	0	0	111	F262 A278 L291 V293 L377 L391 T392 T393 Y397 V398 E399	F262-L395 HydrophobicContact CZ-CD2 4.32Å; A278-L395 HydrophobicContact CB-CD1 3.87Å; A278-L395 HydrophobicContact CB-CD2 3.82Å; L291-L395 HydrophobicContact CB-CB 4.06Å; L291-L395 HydrophobicContact CB-CD2 4.4Å; L291-L395 HydrophobicContact CD1-CD2 4.12Å; V293-L395 HydrophobicContact CB-CD1 4.4Å; V293-L395 HydrophobicContact CG2-CD1 3.46Å; V293-L395 VanDerWaalsContact CG2-CD1 3.46Å; L377-L395 HydrophobicContact CD1-CD2 3.76Å; L377-L395 HydrophobicContact CD2-CD2 3.94Å; L377-L395 HydrophobicContact CG-CD2 4.48Å; L391-L395 HydrophobicContact CD1-CG 4.41Å; L391-L395 WeakPolarHBondContact O-CG 3.33Å; L391-L395 PolarHBondContact O-N 3.21Å; L391-L395 VanDerWaalsContact O-N 3.09Å; T392-L395 PolarHBondContact O-N 3.16Å; T393-L395 PolarHBondContact O-N 3.48Å; L395-Y397 VanDerWaalsContact C-N 3.35Å; L395-Y397 PolarHBondContact O-N 3.04Å; L395-V398 PolarHBondContact O-N 2.7Å; L395-E399 VanDerWaalsContact O-CB 3.3Å; L395-E399 WeakPolarHBondContact O-CB 3.29Å; L395-E399 PolarHBondContact O-N 3.07Å
396	C	86.8	Confident	84.3	Confident	76 Å²	76	47.8 Å²	47.8	51%	0.514	26%	0.26	S	S	.	.	H	α-helix	trans	-58.6	-44.8	173.4	-67.9	0	0	0	0	112	T392 T393 A394 E399 N400	T392-C396 PolarHBondContact O-N 2.94Å; T392-C396 VanDerWaalsContact O-N 3.12Å; T392-C396 PolarHBondContact O-SG 2.96Å; T392-C396 VanDerWaalsContact O-SG 3.39Å; T393-C396 WeakPolarHBondContact O-CB 3.3Å; T393-C396 PolarHBondContact O-N 3.39Å; A394-C396 VanDerWaalsContact C-N 3.34Å; C396-E399 PolarHBondContact O-N 2.8Å; C396-N400 PolarHBondContact O-N 2.85Å
397	Y	82.4	Confident	84.1	Confident	123 Å²	123	47.4 Å²	47.4	48%	0.482	26%	0.258	S	S	.	.	H	α-helix	trans	-64.3	-44.5	177.5	178.3	-102	0	0	0	112.1	T380 T393 A394 L395 N400 L401	T380-Y397 HydrophobicContact CG2-CD1 4.31Å; T393-Y397 PolarHBondContact O-N 2.97Å; A394-Y397 PolarHBondContact O-N 3.04Å; L395-Y397 VanDerWaalsContact C-N 3.35Å; L395-Y397 PolarHBondContact O-N 3.04Å; Y397-N400 WeakPolarHBondContact O-CB 3.46Å; Y397-N400 PolarHBondContact O-N 3.29Å; Y397-L401 PolarHBondContact O-N 3.16Å
398	V	83.6	Confident	83	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.2	-37.1	178.9	170.7	0	0	0	0	111.6	L291 A376 L377 A394 L395 N400 L401 L402	L291-V398 HydrophobicContact CD1-CB 4.29Å; L291-V398 HydrophobicContact CD1-CG1 3.98Å; A376-V398 HydrophobicContact CB-CB 4.49Å; A376-V398 HydrophobicContact CB-CG1 3.75Å; A376-V398 HydrophobicContact CB-CG2 4Å; L377-V398 HydrophobicContact CD2-CB 4.1Å; L377-V398 HydrophobicContact CD2-CG2 3.54Å; L377-V398 HydrophobicContact CG-CB 4.25Å; L377-V398 HydrophobicContact CG-CG1 4.17Å; L377-V398 HydrophobicContact CG-CG2 3.79Å; A394-V398 WeakPolarHBondContact O-CG2 3.36Å; A394-V398 PolarHBondContact O-N 3.29Å; L395-V398 PolarHBondContact O-N 2.7Å; V398-N400 VanDerWaalsContact C-N 3.35Å; V398-L401 PolarHBondContact O-N 3.22Å; V398-L402 HydrophobicContact CG1-CD1 3.88Å; V398-L402 HydrophobicContact CG1-CG 4.16Å; V398-L402 WeakPolarHBondContact O-CB 3.41Å; V398-L402 WeakPolarHBondContact O-CG 3.29Å; V398-L402 PolarHBondContact O-N 3.1Å
399	E	89.1	Confident	81.6	Confident	21 Å²	21	56.3 Å²	56.3	10%	0.098	30%	0.295	C	S	.	.	H	α-helix	trans	-57.9	-48.3	171.5	-179.4	-179.8	133.8	0	0	111	V289 H290 L291 R313 L395 C396 L401 L402 N403	V289-E399 WeakPolarHBondContact O-CG 3.31Å; H290-E399 VanDerWaalsContact CA-OE2 3.3Å; H290-E399 WeakPolarHBondContact CA-OE2 3.48Å; H290-E399 IonicContact CE1-OE2 3.69Å; H290-E399 IonicContact CG-OE2 3.43Å; H290-E399 IonicContact ND1-OE1 3.31Å; H290-E399 IonicContact ND1-OE2 3.48Å; L291-E399 HydrophobicContact CB-CB 4.47Å; L291-E399 HydrophobicContact CD1-CB 4.26Å; L291-E399 HydrophobicContact CG-CB 4.44Å; L291-E399 PolarHBondContact N-OE2 2.92Å; R313-E399 IonicContact CZ-OE1 3.8Å; R313-E399 IonicContact NH2-OE1 2.97Å; R313-E399 PolarHBondContact NH2-OE1 2.81Å; L395-E399 VanDerWaalsContact O-CB 3.3Å; L395-E399 WeakPolarHBondContact O-CB 3.29Å; L395-E399 PolarHBondContact O-N 3.07Å; C396-E399 PolarHBondContact O-N 2.8Å; E399-L401 VanDerWaalsContact C-N 3.35Å; E399-L401 PolarHBondContact O-N 3Å; E399-L402 PolarHBondContact O-N 2.77Å; E399-N403 WeakPolarHBondContact O-CB 3.33Å; E399-N403 PolarHBondContact O-N 3.42Å; E399-N403 PolarHBondContact O-ND2 3.06Å
400	N	84	Confident	79.9	Confident	38 Å²	38	51.5 Å²	51.5	20%	0.203	28%	0.281	C	S	.	.	H	α-helix	trans	-57.5	-47.6	177.2	-179.3	51	0	0	0	111.6	C396 Y397 V398 L402 N403 G404 H423 P432 N433	C396-N400 PolarHBondContact O-N 2.85Å; Y397-N400 WeakPolarHBondContact O-CB 3.46Å; Y397-N400 PolarHBondContact O-N 3.29Å; V398-N400 VanDerWaalsContact C-N 3.35Å; N400-L402 PolarHBondContact O-N 2.9Å; N400-N403 PolarHBondContact O-N 2.87Å; N400-G404 PolarHBondContact O-N 3.23Å; N400-H423 PolarHBondContact O-NE2 3.3Å; N400-H423 PolarHBondContact OD1-CE1 3.4Å; N400-H423 PolarHBondContact OD1-NE2 3.39Å; N400-P432 VanDerWaalsContact OD1-CG 3.26Å; N400-P432 WeakPolarHBondContact OD1-CG 3.4Å; N400-N433 PolarHBondContact ND2-ND2 3.32Å
401	L	81.4	Confident	78.3	Confident	90 Å²	90	51.2 Å²	51.2	47%	0.471	29%	0.285	S	S	.	.	H	α-helix	trans	-60.1	-47	177.7	-176.1	71.4	0	0	0	111.7	A376 Y397 V398 E399 N403 G404	A376-L401 HydrophobicContact CB-CD2 4.01Å; Y397-L401 PolarHBondContact O-N 3.16Å; V398-L401 PolarHBondContact O-N 3.22Å; E399-L401 VanDerWaalsContact C-N 3.35Å; E399-L401 PolarHBondContact O-N 3Å; L401-N403 VanDerWaalsContact C-N 3.33Å; L401-N403 PolarHBondContact O-N 2.83Å; L401-G404 PolarHBondContact O-N 3.38Å; L401-G404 VanDerWaalsContact O-N 3.17Å
402	L	83.8	Confident	76.6	Confident	12 Å²	12	58.7 Å²	58.7	6%	0.063	32%	0.324	C	S	.	.	H	α-helix	trans	-64.6	-38.9	-179.3	-71.4	174.6	0	0	0	111.4	V289 L291 A373 V398 E399 N400 G404 R405	V289-L402 HydrophobicContact CB-CB 4.43Å; V289-L402 HydrophobicContact CG1-CD1 3.95Å; L291-L402 HydrophobicContact CD1-CD1 4.5Å; A373-L402 HydrophobicContact CB-CD1 3.77Å; V398-L402 HydrophobicContact CG1-CD1 3.88Å; V398-L402 HydrophobicContact CG1-CG 4.16Å; V398-L402 WeakPolarHBondContact O-CB 3.41Å; V398-L402 WeakPolarHBondContact O-CG 3.29Å; V398-L402 PolarHBondContact O-N 3.1Å; E399-L402 PolarHBondContact O-N 2.77Å; N400-L402 PolarHBondContact O-N 2.9Å; L402-G404 VanDerWaalsContact C-N 3.28Å; L402-R405 WeakPolarHBondContact O-CD 3.44Å; L402-R405 WeakPolarHBondContact O-CG 3.45Å; L402-R405 PolarHBondContact O-N 2.87Å; L402-R405 PolarHBondContact O-NH1 3.04Å
403	N	87.3	Confident	74.9	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-74.8	-19.4	177.5	-72	-35	0	0	0	112.9	V289 E399 N400 L401 R405 F422 H423 L426	V289-N403 PolarHBondContact N-OD1 3.09Å; V289-N403 PolarHBondContact O-ND2 3.41Å; E399-N403 WeakPolarHBondContact O-CB 3.33Å; E399-N403 PolarHBondContact O-N 3.42Å; E399-N403 PolarHBondContact O-ND2 3.06Å; N400-N403 PolarHBondContact O-N 2.87Å; L401-N403 VanDerWaalsContact C-N 3.33Å; L401-N403 PolarHBondContact O-N 2.83Å; N403-R405 PolarHBondContact O-N 3.2Å; N403-F422 HydrophobicContact CB-CB 4.05Å; N403-F422 WeakPolarHBondContact O-CB 3.29Å; N403-F422 PolarHBondContact O-N 3.46Å; N403-F422 VanDerWaalsContact O-N 3.15Å; N403-H423 PolarHBondContact O-CD2 3.39Å; N403-H423 PolarHBondContact O-N 3.04Å; N403-L426 HydrophobicContact CB-CD1 4.33Å; N403-L426 WeakPolarHBondContact ND2-CD1 3.35Å
404	G	80.7	Confident	73.2	Confident	33 Å²	33	63.4 Å²	63.4	34%	0.34	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.1	172.7	0	0	0	0	0	114.8	N400 L401 L402 T421 H423	N400-G404 PolarHBondContact O-N 3.23Å; L401-G404 PolarHBondContact O-N 3.38Å; L401-G404 VanDerWaalsContact O-N 3.17Å; L402-G404 VanDerWaalsContact C-N 3.28Å; G404-T421 WeakPolarHBondContact O-CG2 3.35Å; G404-H423 VanDerWaalsContact CA-CD2 3.43Å; G404-H423 WeakPolarHBondContact CA-CD2 3.37Å; G404-H423 PolarHBondContact N-CD2 2.74Å; G404-H423 PolarHBondContact N-NE2 3.28Å
405	R	80.2	Confident	71.7	Confident	56 Å²	56	74.4 Å²	74.4	21%	0.211	38%	0.382	C	S	.	.	S	Bend	trans	-71	143	-172.7	77.7	-165.3	-177.3	-101.1	-4	112.3	R287 L402 N403 F422	R287-R405 PolarHBondContact O-NH2 3.34Å; L402-R405 WeakPolarHBondContact O-CD 3.44Å; L402-R405 WeakPolarHBondContact O-CG 3.45Å; L402-R405 PolarHBondContact O-N 2.87Å; L402-R405 PolarHBondContact O-NH1 3.04Å; N403-R405 PolarHBondContact O-N 3.2Å; R405-F422 HydrophobicContact CG-CD2 3.86Å; R405-F422 HydrophobicContact CG-CE2 3.49Å; R405-F422 VanDerWaalsContact CG-CE2 3.49Å; R405-F422 VanDerWaalsContact NE-CE2 3.27Å; R405-F422 VanDerWaalsContact NH2-CE2 3.33Å
406	P	75.5	Confident	70	Confident	69 Å²	69	83.6 Å²	83.6	45%	0.448	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-56.1	138.7	171	-28.4	37	0	0	0	113.2	V419	P406-V419 HydrophobicContact CB-CG1 3.49Å; P406-V419 VanDerWaalsContact CB-CG1 3.49Å; P406-V419 HydrophobicContact CG-CG1 3.8Å
407	L	73.3	Confident	68.5	Low	17 Å²	17	82.9 Å²	82.9	9%	0.089	42%	0.418	C	S	.	.	S	Bend	trans	-71.5	-42.8	167.1	-97.2	154.1	0	0	0	111.4	L420 F422 F460 Y467	L407-L420 WeakPolarHBondContact CB-O 3.38Å; L407-L420 HydrophobicContact CD1-CB 4.36Å; L407-L420 HydrophobicContact CD1-CD2 3.69Å; L407-L420 HydrophobicContact CD1-CG 3.91Å; L407-L420 PolarHBondContact N-O 3.37Å; L407-F422 HydrophobicContact CD1-CD1 4.26Å; L407-F422 HydrophobicContact CD1-CE1 3.82Å; L407-F422 HydrophobicContact CD1-CZ 4.46Å; L407-F422 HydrophobicContact CD2-CE1 3.4Å; L407-F422 VanDerWaalsContact CD2-CE1 3.4Å; L407-F422 HydrophobicContact CD2-CZ 3.62Å; L407-F422 HydrophobicContact CG-CD1 4.24Å; L407-F422 HydrophobicContact CG-CE1 3.41Å; L407-F422 VanDerWaalsContact CG-CE1 3.41Å; L407-F422 HydrophobicContact CG-CE2 4.48Å; L407-F422 HydrophobicContact CG-CZ 3.59Å; L407-F460 HydrophobicContact CD1-CE2 3.7Å; L407-F460 HydrophobicContact CD1-CZ 3.79Å; L407-Y467 HydrophobicContact CD2-CD1 4.15Å; L407-Y467 HydrophobicContact CD2-CE1 4Å; L407-Y467 WeakPolarHBondContact O-CE2 3.43Å
408	A	64.6	Low	67.7	Low	42 Å²	42	81.7 Å²	81.7	35%	0.347	42%	0.416	S	S	.	.	S	Bend	trans	-139.3	148.4	179.1	0	0	0	0	0	109.1	A410 Y467	A408-A410 PolarHBondContact O-N 2.93Å; A408-Y467 HydrophobicContact CB-CD2 3.78Å; A408-Y467 HydrophobicContact CB-CE2 4.41Å
409	Y	57.2	Low	67.1	Low	225 Å²	225	84.3 Å²	84.3	88%	0.882	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-68.5	128.4	164.9	-71.5	-83.4	0	0	0	108
410	A	52.4	Low	66.3	Low	50 Å²	50	83.8 Å²	83.8	41%	0.413	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-60.6	140.9	173.2	0	0	0	0	0	109.5	A408 L412 V419	A408-A410 PolarHBondContact O-N 2.93Å; A410-L412 PolarHBondContact O-N 3.46Å; A410-V419 HydrophobicContact CB-CG2 4.17Å
411	S	50.1	Low	66	Low	64 Å²	64	82.5 Å²	82.5	45%	0.448	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-56.8	132.9	170.2	178	0	0	0	0	109	E413 T414	S411-E413 PolarHBondContact O-N 3.39Å; S411-E413 PolarHBondContact OG-N 2.91Å; S411-T414 PolarHBondContact O-N 2.67Å
412	L	51.2	Low	66	Low	159 Å²	159	78.4 Å²	78.4	83%	0.832	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-22.3	176.4	-85.4	153.4	0	0	0	112.6	A410	A410-L412 PolarHBondContact O-N 3.46Å
413	E	53.5	Low	65.7	Low	178 Å²	178	78.3 Å²	78.3	83%	0.832	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-18.3	-175.5	-64.7	174	171.1	0	0	113.5	S411	S411-E413 PolarHBondContact O-N 3.39Å; S411-E413 PolarHBondContact OG-N 2.91Å
414	T	50.8	Low	65.1	Low	69 Å²	69	79 Å²	79	42%	0.423	41%	0.405	S	S	.	.			trans	-124.2	77.5	-179	52.7	0	0	0	0	110.6	S411 E416 V417	S411-T414 PolarHBondContact O-N 2.67Å; T414-E416 PolarHBondContact O-N 3.4Å; T414-E416 VanDerWaalsContact O-N 3.13Å; T414-V417 PolarHBondContact O-N 3.46Å
415	R	49.9	Very low	65	Low	235 Å²	235	79 Å²	79	89%	0.887	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-11.2	177.6	-76.3	-175.6	174.1	179.6	-1.7	114.4
416	E	51.4	Low	65	Low	196 Å²	196	78 Å²	78	92%	0.916	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-10	-175.4	-62.8	-177.1	169.5	0	0	114.1	T414	T414-E416 PolarHBondContact O-N 3.4Å; T414-E416 VanDerWaalsContact O-N 3.13Å
417	V	56.8	Low	65	Low	61 Å²	61	77.9 Å²	77.9	37%	0.37	39%	0.393	S	S	.	.	S	Bend	trans	-95.3	112	-174.6	-172.2	0	0	0	0	110.2	T414 R463	T414-V417 PolarHBondContact O-N 3.46Å; V417-R463 VanDerWaalsContact CG1-CZ 3.43Å; V417-R463 VanDerWaalsContact CG1-NH2 3.25Å
418	E	65.1	Low	64.8	Low	97 Å²	97	78.3 Å²	78.3	45%	0.453	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-48.5	139.2	176.6	-175.1	174.6	-158.5	0	0	111.7	L420 H424 S430 R463	E418-L420 PolarHBondContact O-N 3.26Å; E418-H424 IonicContact OE1-NE2 3.51Å; E418-H424 IonicContact OE2-NE2 3.59Å; E418-S430 WeakPolarHBondContact OE1-CB 3.41Å; E418-S430 PolarHBondContact OE1-OG 3.45Å; E418-R463 VanDerWaalsContact O-CZ 3.23Å; E418-R463 PolarHBondContact O-NH1 3.32Å; E418-R463 PolarHBondContact O-NH2 3.12Å
419	V	70	Confident	64.9	Low	56 Å²	56	80.9 Å²	80.9	34%	0.339	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-74.7	124.1	-178.5	179.2	0	0	0	0	109.8	P406 A410 T421 H424	P406-V419 HydrophobicContact CB-CG1 3.49Å; P406-V419 VanDerWaalsContact CB-CG1 3.49Å; P406-V419 HydrophobicContact CG-CG1 3.8Å; A410-V419 HydrophobicContact CB-CG2 4.17Å; V419-T421 PolarHBondContact O-N 3.2Å; V419-H424 PolarHBondContact O-CE1 3.17Å
420	L	73.5	Confident	65.1	Low	10 Å²	10	72 Å²	72	5%	0.052	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-69	126.8	178.3	-158.6	73.7	0	0	0	110.1	L407 E418 H424 F460 R463 W464	L407-L420 WeakPolarHBondContact CB-O 3.38Å; L407-L420 HydrophobicContact CD1-CB 4.36Å; L407-L420 HydrophobicContact CD1-CD2 3.69Å; L407-L420 HydrophobicContact CD1-CG 3.91Å; L407-L420 PolarHBondContact N-O 3.37Å; E418-L420 PolarHBondContact O-N 3.26Å; L420-H424 HydrophobicContact CD1-CB 4.32Å; L420-F460 HydrophobicContact CD1-CD2 3.81Å; L420-F460 HydrophobicContact CD1-CE2 4.32Å; L420-F460 HydrophobicContact CD2-CD2 3.95Å; L420-F460 HydrophobicContact CD2-CE2 3.84Å; L420-F460 HydrophobicContact CD2-CZ 4.45Å; L420-F460 HydrophobicContact CG-CD2 3.95Å; L420-F460 HydrophobicContact CG-CE2 3.94Å; L420-R463 HydrophobicContact CD1-CB 4.14Å; L420-R463 HydrophobicContact CD2-CB 3.84Å; L420-W464 HydrophobicContact CD2-CB 4.49Å
421	T	77.9	Confident	65.6	Low	10 Å²	10	75 Å²	75	6%	0.061	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-125.6	168.1	179.2	67.7	0	0	0	0	110.4	G404 V419 H423 H424	G404-T421 WeakPolarHBondContact O-CG2 3.35Å; V419-T421 PolarHBondContact O-N 3.2Å; T421-H423 PolarHBondContact O-N 2.93Å; T421-H424 PolarHBondContact N-ND1 3.03Å; T421-H424 WeakPolarHBondContact O-CB 3.49Å; T421-H424 PolarHBondContact O-N 3.36Å; T421-H424 PolarHBondContact O-ND1 3.06Å; T421-H424 PolarHBondContact OG1-ND1 3.06Å
422	F	80.1	Confident	66.1	Low	5 Å²	5	74.1 Å²	74.1	2%	0.022	37%	0.372	C	S	.	.	H	α-helix	trans	-69.4	-24	177.4	-56.2	-62.7	0	0	0	113.1	T286 R287 A288 N403 R405 L407 H424 L425 L426	T286-F422 WeakPolarHBondContact O-CE1 3.36Å; T286-F422 VanDerWaalsContact O-CZ 3.31Å; T286-F422 WeakPolarHBondContact O-CZ 3.33Å; R287-F422 HydrophobicContact CB-CE1 4.41Å; R287-F422 HydrophobicContact CB-CZ 4.13Å; A288-F422 HydrophobicContact CB-CB 4.24Å; A288-F422 HydrophobicContact CB-CD1 4.33Å; A288-F422 HydrophobicContact CB-CG 4.41Å; N403-F422 HydrophobicContact CB-CB 4.05Å; N403-F422 WeakPolarHBondContact O-CB 3.29Å; N403-F422 PolarHBondContact O-N 3.46Å; N403-F422 VanDerWaalsContact O-N 3.15Å; R405-F422 HydrophobicContact CG-CD2 3.86Å; R405-F422 HydrophobicContact CG-CE2 3.49Å; R405-F422 VanDerWaalsContact CG-CE2 3.49Å; R405-F422 VanDerWaalsContact NE-CE2 3.27Å; R405-F422 VanDerWaalsContact NH2-CE2 3.33Å; L407-F422 HydrophobicContact CD1-CD1 4.26Å; L407-F422 HydrophobicContact CD1-CE1 3.82Å; L407-F422 HydrophobicContact CD1-CZ 4.46Å; L407-F422 HydrophobicContact CD2-CE1 3.4Å; L407-F422 VanDerWaalsContact CD2-CE1 3.4Å; L407-F422 HydrophobicContact CD2-CZ 3.62Å; L407-F422 HydrophobicContact CG-CD1 4.24Å; L407-F422 HydrophobicContact CG-CE1 3.41Å; L407-F422 VanDerWaalsContact CG-CE1 3.41Å; L407-F422 HydrophobicContact CG-CE2 4.48Å; L407-F422 HydrophobicContact CG-CZ 3.59Å; F422-H424 VanDerWaalsContact C-N 3.27Å; F422-H424 PolarHBondContact O-N 2.85Å; F422-L425 PolarHBondContact O-N 2.93Å; F422-L425 VanDerWaalsContact O-N 3.17Å; F422-L426 WeakPolarHBondContact O-CG 3.38Å; F422-L426 PolarHBondContact O-N 3.15Å
423	H	78.2	Confident	66.7	Low	9 Å²	9	72.1 Å²	72.1	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-59.4	-38.6	172.9	-77.1	-82.8	0	0	0	112.3	N400 N403 G404 T421 L425 L426 T427 G428 R429 P432	N400-H423 PolarHBondContact O-NE2 3.3Å; N400-H423 PolarHBondContact OD1-CE1 3.4Å; N400-H423 PolarHBondContact OD1-NE2 3.39Å; N403-H423 PolarHBondContact O-CD2 3.39Å; N403-H423 PolarHBondContact O-N 3.04Å; G404-H423 VanDerWaalsContact CA-CD2 3.43Å; G404-H423 WeakPolarHBondContact CA-CD2 3.37Å; G404-H423 PolarHBondContact N-CD2 2.74Å; G404-H423 PolarHBondContact N-NE2 3.28Å; T421-H423 PolarHBondContact O-N 2.93Å; H423-L425 PolarHBondContact O-N 3.42Å; H423-L426 PolarHBondContact O-N 3.23Å; H423-T427 PolarHBondContact O-N 3.21Å; H423-T427 PolarHBondContact O-OG1 3.04Å; H423-G428 PolarHBondContact O-N 2.99Å; H423-R429 CarbonylContact C-O 3.5Å; H423-R429 WeakPolarHBondContact CB-O 3.47Å; H423-P432 WeakPolarHBondContact CE1-CG 3.44Å; H423-P432 WeakPolarHBondContact ND1-CD 3.35Å; H423-P432 VanDerWaalsContact ND1-CG 3.35Å; H423-P432 WeakPolarHBondContact ND1-CG 3.23Å
424	H	75.8	Confident	66.8	Low	19 Å²	19	70.1 Å²	70.1	9%	0.088	35%	0.35	C	S	.	.	H	α-helix	trans	-54.7	-35.3	178	-69.3	95.6	0	0	0	112.3	E418 V419 L420 T421 F422 G428 R429 S430 F460	E418-H424 IonicContact OE1-NE2 3.51Å; E418-H424 IonicContact OE2-NE2 3.59Å; V419-H424 PolarHBondContact O-CE1 3.17Å; L420-H424 HydrophobicContact CD1-CB 4.32Å; T421-H424 PolarHBondContact N-ND1 3.03Å; T421-H424 WeakPolarHBondContact O-CB 3.49Å; T421-H424 PolarHBondContact O-N 3.36Å; T421-H424 PolarHBondContact O-ND1 3.06Å; T421-H424 PolarHBondContact OG1-ND1 3.06Å; F422-H424 VanDerWaalsContact C-N 3.27Å; F422-H424 PolarHBondContact O-N 2.85Å; H424-G428 VanDerWaalsContact O-CA 3.26Å; H424-G428 WeakPolarHBondContact O-CA 3.46Å; H424-G428 PolarHBondContact O-N 2.77Å; H424-R429 WeakPolarHBondContact CA-O 3.47Å; H424-R429 PolarHBondContact N-O 3.25Å; H424-S430 WeakPolarHBondContact CE1-CB 3.26Å; H424-S430 WeakPolarHBondContact NE2-CB 3.48Å; H424-F460 HydrophobicContact CB-CD2 3.92Å
425	L	77.2	Confident	66.9	Low	32 Å²	32	70.6 Å²	70.6	17%	0.168	36%	0.355	C	S	.	.	H	α-helix	trans	-81.4	-40.3	176.4	-178	66.5	0	0	0	113.1	A253 T286 F422 H423 F460 W461	A253-L425 HydrophobicContact CB-CD2 3.67Å; A253-L425 HydrophobicContact CB-CG 4.04Å; T286-L425 HydrophobicContact CG2-CD2 3.58Å; F422-L425 PolarHBondContact O-N 2.93Å; F422-L425 VanDerWaalsContact O-N 3.17Å; H423-L425 PolarHBondContact O-N 3.42Å; L425-F460 HydrophobicContact CB-CD1 4.22Å; L425-F460 HydrophobicContact CB-CD2 3.89Å; L425-F460 HydrophobicContact CB-CE1 4.09Å; L425-F460 HydrophobicContact CB-CE2 3.74Å; L425-F460 HydrophobicContact CB-CG 4.13Å; L425-F460 HydrophobicContact CB-CZ 3.85Å; L425-F460 HydrophobicContact CD1-CD1 3.7Å; L425-F460 HydrophobicContact CD1-CE1 3.92Å; L425-F460 HydrophobicContact CD1-CG 4.17Å; L425-F460 HydrophobicContact CD2-CD1 4.47Å; L425-F460 HydrophobicContact CD2-CE1 3.84Å; L425-F460 HydrophobicContact CD2-CZ 3.95Å; L425-F460 HydrophobicContact CG-CD1 4.35Å; L425-F460 HydrophobicContact CG-CE1 4.18Å; L425-F460 HydrophobicContact CG-CZ 4.35Å; L425-W461 HydrophobicContact CD1-CZ2 4.11Å; L425-W461 HydrophobicContact CD2-CZ2 4.45Å
426	L	81	Confident	67.1	Low	35 Å²	35	62 Å²	62	18%	0.183	33%	0.33	C	S	.	.	H	α-helix	trans	-83.8	-35.9	-171.9	-65.8	-177.7	0	0	0	113.9	A253 F254 A288 N403 F422 H423	A253-L426 HydrophobicContact CB-CD2 3.76Å; F254-L426 HydrophobicContact CD2-CD2 4.31Å; F254-L426 HydrophobicContact CE2-CD2 3.55Å; F254-L426 HydrophobicContact CZ-CD2 4.35Å; A288-L426 HydrophobicContact CB-CD1 4.16Å; A288-L426 HydrophobicContact CB-CD2 4.32Å; A288-L426 HydrophobicContact CB-CG 4.4Å; N403-L426 HydrophobicContact CB-CD1 4.33Å; N403-L426 WeakPolarHBondContact ND2-CD1 3.35Å; F422-L426 WeakPolarHBondContact O-CG 3.38Å; F422-L426 PolarHBondContact O-N 3.15Å; H423-L426 PolarHBondContact O-N 3.23Å
427	T	74.4	Confident	66.8	Low	67 Å²	67	59.2 Å²	59.2	41%	0.411	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-8.1	-173.3	62.5	0	0	0	0	112.4	H423 R429 P432	H423-T427 PolarHBondContact O-N 3.21Å; H423-T427 PolarHBondContact O-OG1 3.04Å; T427-R429 PolarHBondContact O-N 3.17Å; T427-R429 PolarHBondContact OG1-O 3.18Å; T427-P432 HydrophobicContact CG2-CB 4.3Å
428	G	69.2	Low	66.3	Low	26 Å²	26	62.6 Å²	62.6	27%	0.268	34%	0.341	S	S	.	.	S	Bend	trans	74.8	10.5	-175.7	0	0	0	0	0	113.9	H423 H424	H423-G428 PolarHBondContact O-N 2.99Å; H424-G428 VanDerWaalsContact O-CA 3.26Å; H424-G428 WeakPolarHBondContact O-CA 3.46Å; H424-G428 PolarHBondContact O-N 2.77Å
429	R	66.6	Low	65.3	Low	95 Å²	95	62 Å²	62	36%	0.358	34%	0.337	S	S	.	.	S	Bend	trans	-138.9	158	-175.9	-55.9	-176.1	-173.6	-175.1	1	110.4	H423 H424 T427	H423-R429 CarbonylContact C-O 3.5Å; H423-R429 WeakPolarHBondContact CB-O 3.47Å; H424-R429 WeakPolarHBondContact CA-O 3.47Å; H424-R429 PolarHBondContact N-O 3.25Å; T427-R429 PolarHBondContact O-N 3.17Å; T427-R429 PolarHBondContact OG1-O 3.18Å
430	S	62.1	Low	63.9	Low	38 Å²	38	63.8 Å²	63.8	27%	0.266	35%	0.348	S	S	.	.	S	Bend	trans	-77.5	-35.4	173.4	51.3	0	0	0	0	113.3	E418 H424	E418-S430 WeakPolarHBondContact OE1-CB 3.41Å; E418-S430 PolarHBondContact OE1-OG 3.45Å; H424-S430 WeakPolarHBondContact CE1-CB 3.26Å; H424-S430 WeakPolarHBondContact NE2-CB 3.48Å
431	Q	62.9	Low	62.5	Low	114 Å²	114	70.4 Å²	70.4	53%	0.533	38%	0.384	S	S	.	.			trans	-128.1	105.4	179.9	-57.3	-156.3	12.4	0	0	110.8	N433 F434	Q431-N433 PolarHBondContact O-N 3.48Å; Q431-F434 HydrophobicContact CB-CD2 3.96Å
432	P	60.9	Low	60.9	Low	46 Å²	46	74.1 Å²	74.1	30%	0.299	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-15.2	-176.7	33.8	-40.7	0	0	0	113.5	N400 H423 T427 F434	N400-P432 VanDerWaalsContact OD1-CG 3.26Å; N400-P432 WeakPolarHBondContact OD1-CG 3.4Å; H423-P432 WeakPolarHBondContact CE1-CG 3.44Å; H423-P432 WeakPolarHBondContact ND1-CD 3.35Å; H423-P432 VanDerWaalsContact ND1-CG 3.35Å; H423-P432 WeakPolarHBondContact ND1-CG 3.23Å; T427-P432 HydrophobicContact CG2-CB 4.3Å; P432-F434 VanDerWaalsContact C-N 3.31Å; P432-F434 PolarHBondContact O-N 3.3Å
433	N	62.5	Low	59.3	Low	116 Å²	116	78.5 Å²	78.5	62%	0.62	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-2.5	-174.1	-65.3	-6.3	0	0	0	113.5	N400 Q431	N400-N433 PolarHBondContact ND2-ND2 3.32Å; Q431-N433 PolarHBondContact O-N 3.48Å
434	F	56.2	Low	57.5	Low	136 Å²	136	84.2 Å²	84.2	60%	0.596	46%	0.459	S	S	*	.	S	Bend	trans	-94.8	127.1	172.8	-79.7	-90.1	0	0	0	109.5	Q431 P432	Q431-F434 HydrophobicContact CB-CD2 3.96Å; P432-F434 VanDerWaalsContact C-N 3.31Å; P432-F434 PolarHBondContact O-N 3.3Å
435	P	53.2	Low	55.8	Low	80 Å²	80	88.6 Å²	88.6	52%	0.519	49%	0.487	S	S	.	.			trans	-58.9	145.8	176.6	22.6	-29.6	0	0	0	109.5	D437	P435-D437 PolarHBondContact O-N 3.34Å
436	P	54.3	Low	54.4	Low	55 Å²	55	95 Å²	95	36%	0.357	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-58	-7.7	177.7	17.9	-24.8	0	0	0	114.4	V438 F439	P436-V438 PolarHBondContact O-N 2.93Å; P436-F439 HydrophobicContact CB-CD2 3.95Å; P436-F439 HydrophobicContact CB-CE2 3.59Å; P436-F439 WeakPolarHBondContact O-CD2 3.14Å; P436-F439 VanDerWaalsContact O-CE2 3.28Å; P436-F439 WeakPolarHBondContact O-CE2 3.48Å; P436-F439 WeakPolarHBondContact O-CG 3.15Å; P436-F439 PolarHBondContact O-N 3.45Å
437	D	44	Very low	53	Low	137 Å²	137	105.9 Å²	105.9	73%	0.733	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-80.2	17.1	-160.5	-45.7	-27.5	0	0	0	114.1	P435	P435-D437 PolarHBondContact O-N 3.34Å
438	V	47.3	Very low	51.9	Low	131 Å²	131	107.4 Å²	107.4	79%	0.794	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-110.5	25.8	169.3	-157.5	0	0	0	0	111.2	P436	P436-V438 PolarHBondContact O-N 2.93Å
439	F	43.5	Very low	51.1	Low	85 Å²	85	116.4 Å²	116.4	37%	0.373	58%	0.58	S	S	.	*			trans	-82.8	118.1	164.9	-67.4	-59.7	0	0	0	108.3	P436 D443 F444	P436-F439 HydrophobicContact CB-CD2 3.95Å; P436-F439 HydrophobicContact CB-CE2 3.59Å; P436-F439 WeakPolarHBondContact O-CD2 3.14Å; P436-F439 VanDerWaalsContact O-CE2 3.28Å; P436-F439 WeakPolarHBondContact O-CE2 3.48Å; P436-F439 WeakPolarHBondContact O-CG 3.15Å; P436-F439 PolarHBondContact O-N 3.45Å; F439-D443 HydrophobicContact CB-CB 4.5Å; F439-D443 HydrophobicContact CD1-CB 4.46Å; F439-F444 HydrophobicContact CB-CD2 4.33Å; F439-F444 HydrophobicContact CB-CE2 3.44Å; F439-F444 VanDerWaalsContact CB-CE2 3.44Å; F439-F444 HydrophobicContact CB-CZ 3.99Å; F439-F444 HydrophobicContact CD2-CZ 4.25Å; F439-F444 HydrophobicContact CG-CE2 4.28Å; F439-F444 HydrophobicContact CG-CZ 4.39Å
440	T	40.6	Very low	50.6	Low	93 Å²	93	118.8 Å²	118.8	57%	0.571	59%	0.589	S	S	*	*			trans	-71.5	148.2	170.9	36.8	0	0	0	0	108.8	S442 D443	T440-S442 PolarHBondContact O-N 3.28Å; T440-S442 PolarHBondContact OG1-OG 2.88Å; T440-D443 PolarHBondContact O-N 3.49Å
441	D	44.6	Very low	50.3	Low	149 Å²	149	123.5 Å²	123.5	80%	0.797	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-53.7	-16.3	-177.4	-83.9	-34	0	0	0	114.2	D443 F444	D441-D443 PolarHBondContact O-N 2.81Å; D441-F444 PolarHBondContact O-N 3.44Å
442	S	45.3	Very low	50.2	Low	89 Å²	89	124.5 Å²	124.5	62%	0.622	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-64.2	-19.6	170.5	43.8	0	0	0	0	114.8	T440	T440-S442 PolarHBondContact O-N 3.28Å; T440-S442 PolarHBondContact OG1-OG 2.88Å
443	D	45	Very low	50.2	Low	97 Å²	97	125.1 Å²	125.1	52%	0.519	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-86.7	-6.3	179.5	-69.6	-32.1	0	0	0	113.5	F439 T440 D441	F439-D443 HydrophobicContact CB-CB 4.5Å; F439-D443 HydrophobicContact CD1-CB 4.46Å; T440-D443 PolarHBondContact O-N 3.49Å; D441-D443 PolarHBondContact O-N 2.81Å
444	F	40.9	Very low	50.3	Low	128 Å²	128	124.7 Å²	124.7	56%	0.561	60%	0.604	S	S	*	*			trans	-107.9	26	-166.5	-79.5	-72.7	0	0	0	116.7	F439 D441 F446	F439-F444 HydrophobicContact CB-CD2 4.33Å; F439-F444 HydrophobicContact CB-CE2 3.44Å; F439-F444 VanDerWaalsContact CB-CE2 3.44Å; F439-F444 HydrophobicContact CB-CZ 3.99Å; F439-F444 HydrophobicContact CD2-CZ 4.25Å; F439-F444 HydrophobicContact CG-CE2 4.28Å; F439-F444 HydrophobicContact CG-CZ 4.39Å; D441-F444 PolarHBondContact O-N 3.44Å; F444-F446 PolarHBondContact O-N 2.68Å
445	T	40.9	Very low	50.7	Low	111 Å²	111	120.8 Å²	120.8	68%	0.681	60%	0.597	S	S	*	*			trans	-100	52	176.6	38.2	0	0	0	0	114.6
446	F	46.1	Very low	51.4	Low	167 Å²	167	119.2 Å²	119.2	73%	0.732	58%	0.583	S	S	*	*			trans	-139.4	111.4	161.2	-69.8	-74.7	0	0	0	112.8	F444 K448	F444-F446 PolarHBondContact O-N 2.68Å; F446-K448 PolarHBondContact O-N 3.41Å
447	R	51.9	Low	52	Low	264 Å²	264	118.5 Å²	118.5	100%	0.996	58%	0.582	S	S	*	*	S	Bend	trans	-57.1	11.9	170.6	-73.8	-176.9	-177.6	179.3	1	114.8
448	K	51.6	Low	53.3	Low	99 Å²	99	116.6 Å²	116.6	43%	0.43	58%	0.575	S	S	.	*			trans	-140.5	71.2	-177.5	-63.4	-173.2	-178.6	-176.7	0	111	F446 W450 R451	F446-K448 PolarHBondContact O-N 3.41Å; K448-W450 PolarHBondContact O-N 2.89Å; K448-R451 HydrophobicContact CB-CB 4.25Å; K448-R451 HydrophobicContact CB-CG 3.97Å; K448-R451 HydrophobicContact CD-CG 4.46Å; K448-R451 WeakPolarHBondContact O-CB 3.48Å; K448-R451 PolarHBondContact O-N 3.36Å
449	R	53.8	Low	54.6	Low	215 Å²	215	114 Å²	114	81%	0.811	55%	0.552	S	S	*	*	H	α-helix	trans	-47.2	-33.9	177.7	-67.7	179.3	178.2	170.7	-1.6	114.1	R451 Y452 A453	R449-R451 VanDerWaalsContact C-N 3.34Å; R449-R451 PolarHBondContact O-N 2.78Å; R449-Y452 WeakPolarHBondContact O-CB 3.39Å; R449-Y452 PolarHBondContact O-N 2.74Å; R449-A453 PolarHBondContact O-N 2.9Å
450	W	55.7	Low	56.1	Low	145 Å²	145	110 Å²	110	55%	0.549	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-33.3	176.6	75.9	-90.7	0	0	0	113.5	K448 Y452 A453 Q454	K448-W450 PolarHBondContact O-N 2.89Å; W450-Y452 VanDerWaalsContact C-N 3.31Å; W450-A453 PolarHBondContact O-N 2.9Å; W450-Q454 HydrophobicContact CE3-CG 4.21Å; W450-Q454 HydrophobicContact CZ3-CG 4.43Å; W450-Q454 PolarHBondContact O-N 3.45Å
451	R	55.2	Low	57.9	Low	137 Å²	137	106.8 Å²	106.8	52%	0.517	51%	0.512	S	S	.	.	H	α-helix	trans	-68.5	-33.8	176.4	-71.5	-172.5	165.6	-178.7	-10.2	111.5	K448 R449 Q454 A455	K448-R451 HydrophobicContact CB-CB 4.25Å; K448-R451 HydrophobicContact CB-CG 3.97Å; K448-R451 HydrophobicContact CD-CG 4.46Å; K448-R451 WeakPolarHBondContact O-CB 3.48Å; K448-R451 PolarHBondContact O-N 3.36Å; R449-R451 VanDerWaalsContact C-N 3.34Å; R449-R451 PolarHBondContact O-N 2.78Å; R451-Q454 PolarHBondContact O-N 3.24Å; R451-A455 WeakPolarHBondContact O-CB 3.21Å; R451-A455 PolarHBondContact O-N 2.94Å
452	Y	60.5	Low	59.5	Low	134 Å²	134	107.4 Å²	107.4	53%	0.525	50%	0.503	S	S	.	.	H	α-helix	trans	-65.7	-45.3	174.8	-175.2	-105.1	0	0	0	111.4	R449 W450 Q454 A455 L456	R449-Y452 WeakPolarHBondContact O-CB 3.39Å; R449-Y452 PolarHBondContact O-N 2.74Å; W450-Y452 VanDerWaalsContact C-N 3.31Å; Y452-Q454 VanDerWaalsContact C-N 3.32Å; Y452-Q454 PolarHBondContact O-N 2.76Å; Y452-A455 WeakPolarHBondContact O-CB 3.49Å; Y452-A455 PolarHBondContact O-N 3.48Å; Y452-A455 VanDerWaalsContact O-N 3.14Å; Y452-L456 HydrophobicContact CD1-CD1 3.93Å; Y452-L456 HydrophobicContact CD1-CG 4.43Å; Y452-L456 HydrophobicContact CE1-CD1 3.52Å; Y452-L456 HydrophobicContact CE1-CG 4.1Å; Y452-L456 WeakPolarHBondContact O-CG 3.3Å; Y452-L456 PolarHBondContact O-N 2.63Å
453	A	60.7	Low	60.9	Low	59 Å²	59	104.6 Å²	104.6	49%	0.488	48%	0.479	S	S	.	.	H	α-helix	trans	-60.1	-40.7	174.4	0	0	0	0	0	112.5	R449 W450 L456 A457	R449-A453 PolarHBondContact O-N 2.9Å; W450-A453 PolarHBondContact O-N 2.9Å; A453-L456 PolarHBondContact O-N 3.45Å; A453-A457 PolarHBondContact O-N 2.82Å; A453-A457 VanDerWaalsContact O-N 3.09Å
454	Q	64.4	Low	62.4	Low	108 Å²	108	100 Å²	100	51%	0.505	45%	0.454	S	S	.	.	H	α-helix	trans	-64.7	-42.8	172.6	-75.8	-169.1	-22.5	0	0	112.5	W450 R451 Y452 L456 A457 T458	W450-Q454 HydrophobicContact CE3-CG 4.21Å; W450-Q454 HydrophobicContact CZ3-CG 4.43Å; W450-Q454 PolarHBondContact O-N 3.45Å; R451-Q454 PolarHBondContact O-N 3.24Å; Y452-Q454 VanDerWaalsContact C-N 3.32Å; Y452-Q454 PolarHBondContact O-N 2.76Å; Q454-L456 VanDerWaalsContact C-N 3.3Å; Q454-L456 PolarHBondContact O-N 2.97Å; Q454-A457 PolarHBondContact O-N 3.13Å; Q454-T458 PolarHBondContact O-N 3.46Å; Q454-T458 PolarHBondContact O-OG1 2.93Å; Q454-T458 VanDerWaalsContact O-OG1 3.05Å
455	A	66.3	Low	64.3	Low	54 Å²	54	98.3 Å²	98.3	45%	0.446	45%	0.449	S	S	.	.	H	α-helix	trans	-60.3	-40	177.5	0	0	0	0	0	111.7	R451 Y452 T458 Y459	R451-A455 WeakPolarHBondContact O-CB 3.21Å; R451-A455 PolarHBondContact O-N 2.94Å; Y452-A455 WeakPolarHBondContact O-CB 3.49Å; Y452-A455 PolarHBondContact O-N 3.48Å; Y452-A455 VanDerWaalsContact O-N 3.14Å; A455-T458 PolarHBondContact O-N 3.43Å; A455-Y459 VanDerWaalsContact O-CB 3.3Å; A455-Y459 WeakPolarHBondContact O-CB 3.38Å; A455-Y459 PolarHBondContact O-N 2.93Å
456	L	67.2	Low	66.2	Low	46 Å²	46	98.7 Å²	98.7	24%	0.241	44%	0.443	C	S	.	.	H	α-helix	trans	-63.3	-44.6	173.7	-72.5	174.1	0	0	0	112.2	Y452 A453 Q454 Y459 F460	Y452-L456 HydrophobicContact CD1-CD1 3.93Å; Y452-L456 HydrophobicContact CD1-CG 4.43Å; Y452-L456 HydrophobicContact CE1-CD1 3.52Å; Y452-L456 HydrophobicContact CE1-CG 4.1Å; Y452-L456 WeakPolarHBondContact O-CG 3.3Å; Y452-L456 PolarHBondContact O-N 2.63Å; A453-L456 PolarHBondContact O-N 3.45Å; Q454-L456 VanDerWaalsContact C-N 3.3Å; Q454-L456 PolarHBondContact O-N 2.97Å; L456-Y459 PolarHBondContact O-N 2.97Å; L456-F460 PolarHBondContact O-N 3.03Å
457	A	66.5	Low	67.6	Low	40 Å²	40	93 Å²	93	33%	0.331	42%	0.417	S	S	.	.	H	α-helix	trans	-62.6	-44.1	175.5	0	0	0	0	0	111.6	A453 Q454 Y459 F460 W461	A453-A457 PolarHBondContact O-N 2.82Å; A453-A457 VanDerWaalsContact O-N 3.09Å; Q454-A457 PolarHBondContact O-N 3.13Å; A457-Y459 VanDerWaalsContact C-N 3.34Å; A457-Y459 PolarHBondContact O-N 3.34Å; A457-F460 PolarHBondContact O-N 3.46Å; A457-W461 PolarHBondContact O-N 2.8Å
458	T	71.7	Confident	69	Low	97 Å²	97	81.8 Å²	81.8	60%	0.595	38%	0.378	S	S	*	.	H	α-helix	trans	-61.2	-42.7	175.1	-59.3	0	0	0	0	111.4	Q454 A455 W461 R462	Q454-T458 PolarHBondContact O-N 3.46Å; Q454-T458 PolarHBondContact O-OG1 2.93Å; Q454-T458 VanDerWaalsContact O-OG1 3.05Å; A455-T458 PolarHBondContact O-N 3.43Å; T458-W461 PolarHBondContact O-N 3.31Å; T458-R462 WeakPolarHBondContact O-CB 3.36Å; T458-R462 PolarHBondContact O-N 3.27Å
459	Y	73.3	Confident	70.5	Confident	78 Å²	78	80.7 Å²	80.7	31%	0.306	38%	0.381	S	S	.	.	H	α-helix	trans	-61.9	-45.7	176.1	174.6	-104.1	0	0	0	111.7	A455 L456 A457 W461 R462 R463	A455-Y459 VanDerWaalsContact O-CB 3.3Å; A455-Y459 WeakPolarHBondContact O-CB 3.38Å; A455-Y459 PolarHBondContact O-N 2.93Å; L456-Y459 PolarHBondContact O-N 2.97Å; A457-Y459 VanDerWaalsContact C-N 3.34Å; A457-Y459 PolarHBondContact O-N 3.34Å; Y459-W461 VanDerWaalsContact C-N 3.34Å; Y459-W461 PolarHBondContact O-N 3.32Å; Y459-R462 PolarHBondContact O-N 3.03Å; Y459-R463 HydrophobicContact CD2-CG 4.44Å; Y459-R463 HydrophobicContact CE1-CG 4.46Å; Y459-R463 HydrophobicContact CE2-CG 4.04Å; Y459-R463 PolarHBondContact O-N 2.95Å; Y459-R463 VanDerWaalsContact OH-CD 3.23Å; Y459-R463 WeakPolarHBondContact OH-CD 3.34Å; Y459-R463 PolarHBondContact OH-NH1 3.28Å
460	F	76	Confident	71.8	Confident	1 Å²	1	74.2 Å²	74.2	0%	0.004	37%	0.369	C	S	.	.	H	α-helix	trans	-55.3	-50	174.1	175.7	-86.8	0	0	0	110.9	T286 L407 L420 H424 L425 L456 A457 R462 R463 W464	T286-F460 HydrophobicContact CG2-CE1 4.23Å; T286-F460 HydrophobicContact CG2-CZ 4.35Å; L407-F460 HydrophobicContact CD1-CE2 3.7Å; L407-F460 HydrophobicContact CD1-CZ 3.79Å; L420-F460 HydrophobicContact CD1-CD2 3.81Å; L420-F460 HydrophobicContact CD1-CE2 4.32Å; L420-F460 HydrophobicContact CD2-CD2 3.95Å; L420-F460 HydrophobicContact CD2-CE2 3.84Å; L420-F460 HydrophobicContact CD2-CZ 4.45Å; L420-F460 HydrophobicContact CG-CD2 3.95Å; L420-F460 HydrophobicContact CG-CE2 3.94Å; H424-F460 HydrophobicContact CB-CD2 3.92Å; L425-F460 HydrophobicContact CB-CD1 4.22Å; L425-F460 HydrophobicContact CB-CD2 3.89Å; L425-F460 HydrophobicContact CB-CE1 4.09Å; L425-F460 HydrophobicContact CB-CE2 3.74Å; L425-F460 HydrophobicContact CB-CG 4.13Å; L425-F460 HydrophobicContact CB-CZ 3.85Å; L425-F460 HydrophobicContact CD1-CD1 3.7Å; L425-F460 HydrophobicContact CD1-CE1 3.92Å; L425-F460 HydrophobicContact CD1-CG 4.17Å; L425-F460 HydrophobicContact CD2-CD1 4.47Å; L425-F460 HydrophobicContact CD2-CE1 3.84Å; L425-F460 HydrophobicContact CD2-CZ 3.95Å; L425-F460 HydrophobicContact CG-CD1 4.35Å; L425-F460 HydrophobicContact CG-CE1 4.18Å; L425-F460 HydrophobicContact CG-CZ 4.35Å; L456-F460 PolarHBondContact O-N 3.03Å; A457-F460 PolarHBondContact O-N 3.46Å; F460-R462 VanDerWaalsContact C-N 3.34Å; F460-R462 PolarHBondContact O-N 2.92Å; F460-R463 PolarHBondContact O-N 3.39Å; F460-W464 HydrophobicContact CD1-CB 4.46Å; F460-W464 HydrophobicContact CE1-CB 4.15Å; F460-W464 HydrophobicContact CE1-CG 4.36Å; F460-W464 VanDerWaalsContact O-CB 3.25Å; F460-W464 WeakPolarHBondContact O-CB 3.33Å; F460-W464 PolarHBondContact O-N 3.47Å
461	W	78.5	Confident	72.9	Confident	25 Å²	25	69 Å²	69	10%	0.095	35%	0.351	C	S	.	.	H	α-helix	trans	-67	-33.9	-178.1	-73.2	116.8	0	0	0	113.3	P249 L251 T286 L425 A457 T458 Y459 W464 M465	P249-W461 VanDerWaalsContact CA-CE3 3.47Å; P249-W461 HydrophobicContact CB-CB 4.35Å; P249-W461 HydrophobicContact CB-CD2 4.3Å; P249-W461 HydrophobicContact CB-CE3 3.76Å; P249-W461 HydrophobicContact CB-CZ3 4.46Å; L251-W461 WeakPolarHBondContact O-CZ2 3.21Å; T286-W461 HydrophobicContact CG2-CH2 3.57Å; T286-W461 HydrophobicContact CG2-CZ2 4.3Å; T286-W461 HydrophobicContact CG2-CZ3 4.23Å; L425-W461 HydrophobicContact CD1-CZ2 4.11Å; L425-W461 HydrophobicContact CD2-CZ2 4.45Å; A457-W461 PolarHBondContact O-N 2.8Å; T458-W461 PolarHBondContact O-N 3.31Å; Y459-W461 VanDerWaalsContact C-N 3.34Å; Y459-W461 PolarHBondContact O-N 3.32Å; W461-W464 HydrophobicContact CE3-CB 4.16Å; W461-W464 AromaticContact CE3-CD2 3.93Å; W461-W464 HydrophobicContact CE3-CD2 3.93Å; W461-W464 AromaticContact CE3-CE3 3.85Å; W461-W464 HydrophobicContact CE3-CE3 3.85Å; W461-W464 HydrophobicContact CE3-CG 4.08Å; W461-W464 HydrophobicContact CE3-CZ3 4.49Å; W461-W464 AromaticContact CZ3-CD2 3.78Å; W461-W464 HydrophobicContact CZ3-CD2 3.78Å; W461-W464 AromaticContact CZ3-CE3 3.94Å; W461-W464 HydrophobicContact CZ3-CE3 3.94Å; W461-W464 HydrophobicContact CZ3-CG 4.09Å; W461-W464 HydrophobicContact CZ3-CZ2 4.5Å; W461-W464 HydrophobicContact CZ3-CZ3 4.34Å; W461-W464 PolarHBondContact O-N 2.94Å; W461-M465 WeakPolarHBondContact O-CG 3.43Å; W461-M465 PolarHBondContact O-N 3.45Å; W461-M465 VanDerWaalsContact O-N 3.09Å
462	R	78.1	Confident	74.2	Confident	162 Å²	162	69.2 Å²	69.2	61%	0.611	36%	0.361	S	S	*	.	H	α-helix	trans	-62	-49	172.6	-170.2	179.4	74.6	-171.1	3.1	111.1	T458 Y459 F460 W464 M465 E466	T458-R462 WeakPolarHBondContact O-CB 3.36Å; T458-R462 PolarHBondContact O-N 3.27Å; Y459-R462 PolarHBondContact O-N 3.03Å; F460-R462 VanDerWaalsContact C-N 3.34Å; F460-R462 PolarHBondContact O-N 2.92Å; R462-W464 VanDerWaalsContact C-N 3.33Å; R462-W464 PolarHBondContact O-N 3.26Å; R462-M465 WeakPolarHBondContact O-CB 3.43Å; R462-M465 PolarHBondContact O-N 2.83Å; R462-E466 PolarHBondContact O-N 3.44Å
463	R	74.5	Confident	75.1	Confident	29 Å²	29	65.9 Å²	65.9	11%	0.109	37%	0.368	C	S	.	.	H	α-helix	trans	-70.2	-30.5	178	-69.4	-159.1	62.8	-163.1	-6	113.3	V417 E418 L420 Y459 F460 M465 E466 Y467	V417-R463 VanDerWaalsContact CG1-CZ 3.43Å; V417-R463 VanDerWaalsContact CG1-NH2 3.25Å; E418-R463 VanDerWaalsContact O-CZ 3.23Å; E418-R463 PolarHBondContact O-NH1 3.32Å; E418-R463 PolarHBondContact O-NH2 3.12Å; L420-R463 HydrophobicContact CD1-CB 4.14Å; L420-R463 HydrophobicContact CD2-CB 3.84Å; Y459-R463 HydrophobicContact CD2-CG 4.44Å; Y459-R463 HydrophobicContact CE1-CG 4.46Å; Y459-R463 HydrophobicContact CE2-CG 4.04Å; Y459-R463 PolarHBondContact O-N 2.95Å; Y459-R463 VanDerWaalsContact OH-CD 3.23Å; Y459-R463 WeakPolarHBondContact OH-CD 3.34Å; Y459-R463 PolarHBondContact OH-NH1 3.28Å; F460-R463 PolarHBondContact O-N 3.39Å; R463-M465 PolarHBondContact O-N 3.09Å; R463-E466 IonicContact NE-OE2 3.81Å; R463-E466 VanDerWaalsContact O-CB 3.31Å; R463-E466 WeakPolarHBondContact O-CB 3.36Å; R463-E466 PolarHBondContact O-N 3.43Å; R463-E466 VanDerWaalsContact O-N 3.08Å; R463-Y467 PolarHBondContact O-N 3.41Å
464	W	76.4	Confident	76	Confident	1 Å²	1	66.9 Å²	66.9	0%	0.004	36%	0.359	C	S	.	.	H	α-helix	trans	-63.4	-34.3	172.4	-178	86.8	0	0	0	111.4	R246 P249 L420 F460 W461 R462 E466 Y467 V468	R246-W464 VanDerWaalsContact O-CH2 3.3Å; R246-W464 WeakPolarHBondContact O-CH2 2.99Å; R246-W464 WeakPolarHBondContact O-CZ2 3.36Å; P249-W464 HydrophobicContact CB-CE3 4.1Å; P249-W464 HydrophobicContact CB-CZ3 4Å; L420-W464 HydrophobicContact CD2-CB 4.49Å; F460-W464 HydrophobicContact CD1-CB 4.46Å; F460-W464 HydrophobicContact CE1-CB 4.15Å; F460-W464 HydrophobicContact CE1-CG 4.36Å; F460-W464 VanDerWaalsContact O-CB 3.25Å; F460-W464 WeakPolarHBondContact O-CB 3.33Å; F460-W464 PolarHBondContact O-N 3.47Å; W461-W464 HydrophobicContact CE3-CB 4.16Å; W461-W464 AromaticContact CE3-CD2 3.93Å; W461-W464 HydrophobicContact CE3-CD2 3.93Å; W461-W464 AromaticContact CE3-CE3 3.85Å; W461-W464 HydrophobicContact CE3-CE3 3.85Å; W461-W464 HydrophobicContact CE3-CG 4.08Å; W461-W464 HydrophobicContact CE3-CZ3 4.49Å; W461-W464 AromaticContact CZ3-CD2 3.78Å; W461-W464 HydrophobicContact CZ3-CD2 3.78Å; W461-W464 AromaticContact CZ3-CE3 3.94Å; W461-W464 HydrophobicContact CZ3-CE3 3.94Å; W461-W464 HydrophobicContact CZ3-CG 4.09Å; W461-W464 HydrophobicContact CZ3-CZ2 4.5Å; W461-W464 HydrophobicContact CZ3-CZ3 4.34Å; W461-W464 PolarHBondContact O-N 2.94Å; R462-W464 VanDerWaalsContact C-N 3.33Å; R462-W464 PolarHBondContact O-N 3.26Å; W464-E466 VanDerWaalsContact C-N 3.25Å; W464-E466 PolarHBondContact O-N 2.83Å; W464-Y467 WeakPolarHBondContact O-CA 3.46Å; W464-Y467 WeakPolarHBondContact O-CB 2.99Å; W464-Y467 PolarHBondContact O-N 3.41Å; W464-V468 HydrophobicContact CD2-CG2 4.13Å; W464-V468 HydrophobicContact CE3-CG2 3.72Å; W464-V468 HydrophobicContact CH2-CG2 3.68Å; W464-V468 HydrophobicContact CZ2-CG2 4.04Å; W464-V468 HydrophobicContact CZ3-CG2 3.48Å; W464-V468 VanDerWaalsContact CZ3-CG2 3.48Å; W464-V468 WeakPolarHBondContact O-CG2 3.28Å; W464-V468 PolarHBondContact O-N 3.26Å; W464-V468 VanDerWaalsContact O-N 3.11Å
465	M	81.6	Confident	76.6	Confident	92 Å²	92	65.2 Å²	65.2	45%	0.453	37%	0.371	S	S	.	.	H	α-helix	trans	-65.7	-26.2	172.6	-70	-62.1	-65.1	0	0	113.2	P249 W461 R462 R463 Y467 V468 P469	P249-M465 HydrophobicContact CB-CG 4.35Å; P249-M465 HydrophobicContact CB-SD 4.06Å; P249-M465 HydrophobicContact CG-CG 4.45Å; P249-M465 HydrophobicContact CG-SD 3.84Å; W461-M465 WeakPolarHBondContact O-CG 3.43Å; W461-M465 PolarHBondContact O-N 3.45Å; W461-M465 VanDerWaalsContact O-N 3.09Å; R462-M465 WeakPolarHBondContact O-CB 3.43Å; R462-M465 PolarHBondContact O-N 2.83Å; R463-M465 PolarHBondContact O-N 3.09Å; M465-Y467 VanDerWaalsContact C-N 3.3Å; M465-V468 HydrophobicContact SD-CG2 4.17Å; M465-P469 VanDerWaalsContact O-CD 3.24Å; M465-P469 WeakPolarHBondContact O-CD 3.35Å
466	E	79.8	Confident	77	Confident	120 Å²	120	69.5 Å²	69.5	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-71.6	-26.5	171	-58.7	163.4	-168.5	0	0	111.9	R462 R463 W464 P469	R462-E466 PolarHBondContact O-N 3.44Å; R463-E466 IonicContact NE-OE2 3.81Å; R463-E466 VanDerWaalsContact O-CB 3.31Å; R463-E466 WeakPolarHBondContact O-CB 3.36Å; R463-E466 PolarHBondContact O-N 3.43Å; R463-E466 VanDerWaalsContact O-N 3.08Å; W464-E466 VanDerWaalsContact C-N 3.25Å; W464-E466 PolarHBondContact O-N 2.83Å; E466-P469 WeakPolarHBondContact O-CD 3.49Å
467	Y	76.7	Confident	77.7	Confident	46 Å²	46	73.6 Å²	73.6	18%	0.18	39%	0.392	C	S	.	.	H	α-helix	trans	-78.1	-33.2	174.4	165.3	-109	0	0	0	113	L407 A408 R463 W464 M465 P469 S470 L471	L407-Y467 HydrophobicContact CD2-CD1 4.15Å; L407-Y467 HydrophobicContact CD2-CE1 4Å; L407-Y467 WeakPolarHBondContact O-CE2 3.43Å; A408-Y467 HydrophobicContact CB-CD2 3.78Å; A408-Y467 HydrophobicContact CB-CE2 4.41Å; R463-Y467 PolarHBondContact O-N 3.41Å; W464-Y467 WeakPolarHBondContact O-CA 3.46Å; W464-Y467 WeakPolarHBondContact O-CB 2.99Å; W464-Y467 PolarHBondContact O-N 3.41Å; M465-Y467 VanDerWaalsContact C-N 3.3Å; Y467-P469 VanDerWaalsContact C-CD 3.45Å; Y467-P469 VanDerWaalsContact C-N 3.31Å; Y467-P469 VanDerWaalsContact O-N 3.15Å; Y467-S470 WeakPolarHBondContact CD2-OG 3.26Å; Y467-S470 WeakPolarHBondContact CE2-OG 3.29Å; Y467-S470 WeakPolarHBondContact O-CB 3.26Å; Y467-S470 PolarHBondContact O-N 2.8Å; Y467-S470 PolarHBondContact O-OG 3.34Å; Y467-L471 HydrophobicContact CD1-CD1 4.49Å; Y467-L471 HydrophobicContact CE1-CD1 3.9Å; Y467-L471 HydrophobicContact CE1-CD2 4.12Å; Y467-L471 HydrophobicContact CE1-CG 4.06Å; Y467-L471 WeakPolarHBondContact OH-CD2 3.39Å
468	V	80.8	Confident	78.5	Confident	30 Å²	30	76.2 Å²	76.2	18%	0.182	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-49.6	-41.9	-176.6	171.3	0	0	0	0	113.8	L247 W464 M465 S470 L471	L247-V468 HydrophobicContact CD2-CG1 4.09Å; W464-V468 HydrophobicContact CD2-CG2 4.13Å; W464-V468 HydrophobicContact CE3-CG2 3.72Å; W464-V468 HydrophobicContact CH2-CG2 3.68Å; W464-V468 HydrophobicContact CZ2-CG2 4.04Å; W464-V468 HydrophobicContact CZ3-CG2 3.48Å; W464-V468 VanDerWaalsContact CZ3-CG2 3.48Å; W464-V468 WeakPolarHBondContact O-CG2 3.28Å; W464-V468 PolarHBondContact O-N 3.26Å; W464-V468 VanDerWaalsContact O-N 3.11Å; M465-V468 HydrophobicContact SD-CG2 4.17Å; V468-S470 PolarHBondContact O-N 2.95Å; V468-L471 VanDerWaalsContact O-CB 3.27Å; V468-L471 WeakPolarHBondContact O-CB 3.44Å; V468-L471 PolarHBondContact O-N 3.21Å
469	P	83.4	Confident	78.9	Confident	75 Å²	75	79.2 Å²	79.2	49%	0.487	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-55.1	-30.3	174.2	-28.9	35.7	0	0	0	115	M465 E466 Y467 L471 I472	M465-P469 VanDerWaalsContact O-CD 3.24Å; M465-P469 WeakPolarHBondContact O-CD 3.35Å; E466-P469 WeakPolarHBondContact O-CD 3.49Å; Y467-P469 VanDerWaalsContact C-CD 3.45Å; Y467-P469 VanDerWaalsContact C-N 3.31Å; Y467-P469 VanDerWaalsContact O-N 3.15Å; P469-L471 PolarHBondContact O-N 2.95Å; P469-L471 VanDerWaalsContact O-N 3.12Å; P469-I472 HydrophobicContact CB-CD1 4.23Å; P469-I472 WeakPolarHBondContact O-CB 3.46Å; P469-I472 WeakPolarHBondContact O-CD1 3.41Å; P469-I472 WeakPolarHBondContact O-CG1 3.46Å; P469-I472 PolarHBondContact O-N 3Å
470	S	80	Confident	79.3	Confident	79 Å²	79	81.7 Å²	81.7	55%	0.552	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-68.1	-10.9	176.9	89.3	0	0	0	0	112.9	Y467 V468	Y467-S470 WeakPolarHBondContact CD2-OG 3.26Å; Y467-S470 WeakPolarHBondContact CE2-OG 3.29Å; Y467-S470 WeakPolarHBondContact O-CB 3.26Å; Y467-S470 PolarHBondContact O-N 2.8Å; Y467-S470 PolarHBondContact O-OG 3.34Å; V468-S470 PolarHBondContact O-N 2.95Å
471	L	79.5	Confident	79.4	Confident	36 Å²	36	85.3 Å²	85.3	19%	0.188	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-92.8	-1.1	178.1	-60.3	178.8	0	0	0	113.9	L242 Y467 V468 P469 G473	L242-L471 HydrophobicContact CD1-CB 3.77Å; L242-L471 HydrophobicContact CD1-CD1 4.05Å; L242-L471 HydrophobicContact CD1-CG 4.43Å; Y467-L471 HydrophobicContact CD1-CD1 4.49Å; Y467-L471 HydrophobicContact CE1-CD1 3.9Å; Y467-L471 HydrophobicContact CE1-CD2 4.12Å; Y467-L471 HydrophobicContact CE1-CG 4.06Å; Y467-L471 WeakPolarHBondContact OH-CD2 3.39Å; V468-L471 VanDerWaalsContact O-CB 3.27Å; V468-L471 WeakPolarHBondContact O-CB 3.44Å; V468-L471 PolarHBondContact O-N 3.21Å; P469-L471 PolarHBondContact O-N 2.95Å; P469-L471 VanDerWaalsContact O-N 3.12Å; L471-G473 VanDerWaalsContact C-N 3.31Å; L471-G473 PolarHBondContact O-N 3.48Å
472	I	83.2	Confident	79.5	Confident	141 Å²	141	92.1 Å²	92.1	72%	0.723	47%	0.47	S	S	*	.			trans	-63.9	-37	-178.3	-67.9	168.9	0	0	0	111.7	P469	P469-I472 HydrophobicContact CB-CD1 4.23Å; P469-I472 WeakPolarHBondContact O-CB 3.46Å; P469-I472 WeakPolarHBondContact O-CD1 3.41Å; P469-I472 WeakPolarHBondContact O-CG1 3.46Å; P469-I472 PolarHBondContact O-N 3Å
473	G	78.6	Confident	79.6	Confident	65 Å²	65	89.7 Å²	89.7	67%	0.67	47%	0.469	S	S	*	.			trans	-67.5	130.4	-174	0	0	0	0	0	113.8	L471 G475	L471-G473 VanDerWaalsContact C-N 3.31Å; L471-G473 PolarHBondContact O-N 3.48Å; G473-G475 PolarHBondContact O-N 2.86Å
474	R	80.1	Confident	79.7	Confident	80 Å²	80	94.3 Å²	94.3	30%	0.302	49%	0.493	S	S	.	.			trans	-86.9	101.9	168.1	-62	-175.9	179.4	-76.8	15.1	109.4	M239 A240 K476 T478	M239-R474 PolarHBondContact O-NH1 2.88Å; M239-R474 PolarHBondContact O-NH2 3.47Å; A240-R474 PolarHBondContact O-NH1 3.31Å; R474-K476 PolarHBondContact O-N 3.29Å; R474-T478 HydrophobicContact CB-CG2 4.24Å
475	G	75.9	Confident	79.9	Confident	73 Å²	73	97 Å²	97	75%	0.753	51%	0.513	S	S	*	.			trans	-67.4	-18.3	-177.9	0	0	0	0	0	115.3	G473	G473-G475 PolarHBondContact O-N 2.86Å
476	K	76	Confident	79.9	Confident	144 Å²	144	99.4 Å²	99.4	63%	0.626	53%	0.532	S	S	*	.	S	Bend	trans	-148.4	163.7	176.8	-61.8	-173.9	-178.8	-178.2	0	110.3	M239 R474	M239-K476 HydrophobicContact CE-CB 3.93Å; M239-K476 WeakPolarHBondContact CE-O 3.4Å; R474-K476 PolarHBondContact O-N 3.29Å
477	W	81.3	Confident	79.9	Confident	132 Å²	132	99.3 Å²	99.3	50%	0.5	55%	0.545	S	S	.	.			trans	53.2	64.9	173.5	-43	-41.7	0	0	0	113.3	P237 R238 M239	P237-W477 WeakPolarHBondContact O-CB 3.26Å; R238-W477 WeakPolarHBondContact CA-O 3.33Å; M239-W477 HydrophobicContact CB-CB 4.42Å; M239-W477 HydrophobicContact CB-CE3 4.28Å; M239-W477 HydrophobicContact CE-CE3 4.1Å; M239-W477 PolarHBondContact N-O 2.87Å
478	T	83.2	Confident	79.9	Confident	94 Å²	94	99.9 Å²	99.9	58%	0.577	55%	0.55	S	S	*	*			trans	-89.7	-23.5	-175.6	53.2	0	0	0	0	113.6	R474	R474-T478 HydrophobicContact CB-CG2 4.24Å
479	K	80.5	Confident	79.6	Confident	161 Å²	161	106.3 Å²	106.3	70%	0.7	58%	0.582	S	S	*	*	S	Bend	trans	-79.3	140.2	-178	-65	-176.1	179.6	-180	0	111	E481	K479-E481 PolarHBondContact O-N 3.3Å; K479-E481 VanDerWaalsContact O-N 3.12Å
480	N	80.4	Confident	79.2	Confident	129 Å²	129	106.4 Å²	106.4	69%	0.69	58%	0.581	S	S	*	*			trans	-74.4	97.7	168.9	-85.7	-5.7	0	0	0	108.7	R238	R238-N480 WeakPolarHBondContact CD-OD1 3.28Å; R238-N480 PolarHBondContact NH1-OD1 3.08Å
481	E	79.6	Confident	78.8	Confident	77 Å²	77	107.4 Å²	107.4	36%	0.36	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-98.2	151.6	167.2	-62.5	-160.4	172.4	0	0	110.4	K235 T236 K479 N483	K235-E481 VanDerWaalsContact CA-OE2 3.3Å; K235-E481 WeakPolarHBondContact CA-OE2 2.77Å; K235-E481 WeakPolarHBondContact CB-OE2 3.49Å; T236-E481 PolarHBondContact N-OE2 2.87Å; K479-E481 PolarHBondContact O-N 3.3Å; K479-E481 VanDerWaalsContact O-N 3.12Å; E481-N483 PolarHBondContact O-N 2.87Å
482	R	80.9	Confident	78.2	Confident	169 Å²	169	113 Å²	113	64%	0.638	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-57.9	128.2	173.1	164.7	176.3	169.5	-157.5	-6.6	109	S485 D488	R482-S485 PolarHBondContact NH2-OG 3.04Å; R482-D488 IonicContact CZ-OD1 2.71Å; R482-D488 IonicContact CZ-OD2 3.01Å; R482-D488 IonicContact NH1-OD1 2.71Å; R482-D488 IonicContact NH2-OD1 3.27Å; R482-D488 PolarHBondContact NH2-OD1 3Å; R482-D488 IonicContact NH2-OD2 3.4Å; R482-D488 PolarHBondContact NH2-OD2 2.99Å
483	N	78.6	Confident	77.3	Confident	111 Å²	111	110 Å²	110	59%	0.594	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-63.1	141.9	169.2	-69.8	-20.7	0	0	0	110.2	P237 E481 S485	P237-N483 WeakPolarHBondContact CB-OD1 3.47Å; E481-N483 PolarHBondContact O-N 2.87Å; N483-S485 PolarHBondContact O-N 3.34Å
484	M	77.9	Confident	76.5	Confident	125 Å²	125	109.2 Å²	109.2	62%	0.616	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-61.6	133.4	168.9	-66.5	178.6	-74.9	0	0	108.8	V490	M484-V490 HydrophobicContact CG-CG1 4.25Å; M484-V490 HydrophobicContact SD-CB 4.44Å; M484-V490 HydrophobicContact SD-CG1 3.59Å; M484-V490 VanDerWaalsContact SD-CG1 3.59Å
485	S	80.4	Confident	75.4	Confident	59 Å²	59	111.2 Å²	111.2	41%	0.413	61%	0.613	S	S	.	*			trans	-110.4	159.2	176.2	52.9	0	0	0	0	110.7	R482 N483 S487 D488	R482-S485 PolarHBondContact NH2-OG 3.04Å; N483-S485 PolarHBondContact O-N 3.34Å; S485-S487 PolarHBondContact O-N 3.34Å; S485-D488 PolarHBondContact N-OD2 3.49Å; S485-D488 WeakPolarHBondContact O-CB 3.25Å; S485-D488 PolarHBondContact O-N 3.4Å; S485-D488 PolarHBondContact OG-OD2 3.24Å
486	V	80.5	Confident	74.4	Confident	142 Å²	142	111.1 Å²	111.1	86%	0.861	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.9	137.8	165.7	-177.3	0	0	0	0	108.2
487	S	79.7	Confident	73.2	Confident	118 Å²	118	107.8 Å²	107.8	83%	0.825	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.5	0.9	-173.8	-49.2	0	0	0	0	117.3	S485	S485-S487 PolarHBondContact O-N 3.34Å
488	D	76.8	Confident	71.5	Confident	57 Å²	57	106.1 Å²	106.1	31%	0.305	59%	0.594	S	S	.	*			trans	-72.6	134.2	166.1	-75.7	-25.1	0	0	0	110.9	R482 S485 V490	R482-D488 IonicContact CZ-OD1 2.71Å; R482-D488 IonicContact CZ-OD2 3.01Å; R482-D488 IonicContact NH1-OD1 2.71Å; R482-D488 IonicContact NH2-OD1 3.27Å; R482-D488 PolarHBondContact NH2-OD1 3Å; R482-D488 IonicContact NH2-OD2 3.4Å; R482-D488 PolarHBondContact NH2-OD2 2.99Å; S485-D488 PolarHBondContact N-OD2 3.49Å; S485-D488 WeakPolarHBondContact O-CB 3.25Å; S485-D488 PolarHBondContact O-N 3.4Å; S485-D488 PolarHBondContact OG-OD2 3.24Å; D488-V490 HydrophobicContact CB-CG1 4.32Å; D488-V490 PolarHBondContact O-N 2.89Å
489	I	74.5	Confident	69.5	Low	165 Å²	165	114 Å²	114	85%	0.846	61%	0.612	S	S	*	*			trans	-80	114.3	170.4	-58.5	174.5	0	0	0	108
490	V	75.5	Confident	68	Low	77 Å²	77	110.6 Å²	110.6	47%	0.467	62%	0.623	S	S	.	*			trans	-114.9	145.9	-178.2	-61.4	0	0	0	0	111	M484 D488	M484-V490 HydrophobicContact CG-CG1 4.25Å; M484-V490 HydrophobicContact SD-CB 4.44Å; M484-V490 HydrophobicContact SD-CG1 3.59Å; M484-V490 VanDerWaalsContact SD-CG1 3.59Å; D488-V490 HydrophobicContact CB-CG1 4.32Å; D488-V490 PolarHBondContact O-N 2.89Å
491	V	70.9	Confident	66.1	Low	100 Å²	100	110.1 Å²	110.1	61%	0.606	63%	0.63	S	S	*	*			trans	-100.6	118.4	167.1	-179.7	0	0	0	0	106.7	A493	V491-A493 PolarHBondContact O-N 3.21Å
492	L	67.4	Low	65.4	Low	153 Å²	153	111.8 Å²	111.8	80%	0.801	64%	0.644	S	S	*	*			trans	-76.2	113.2	175.3	-74.5	166.5	0	0	0	108.9	D494	L492-D494 PolarHBondContact O-N 3.3Å
493	A	64.8	Low	64.6	Low	78 Å²	78	108.7 Å²	108.7	65%	0.645	64%	0.644	S	S	*	*			trans	-87.4	100.8	172	0	0	0	0	0	109	V491 P495	V491-A493 PolarHBondContact O-N 3.21Å; A493-P495 WeakPolarHBondContact O-CD 3.43Å
494	D	60.9	Low	63.8	Low	49 Å²	49	108.6 Å²	108.6	26%	0.262	65%	0.647	S	S	.	*			trans	-82.2	120.3	170.3	-175	-9.9	0	0	0	109.1	L492 N496 T497	L492-D494 PolarHBondContact O-N 3.3Å; D494-N496 PolarHBondContact O-N 3.15Å; D494-N496 WeakPolarHBondContact OD1-CB 3.49Å; D494-N496 PolarHBondContact OD1-N 2.85Å; D494-N496 PolarHBondContact OD1-ND2 3.39Å; D494-T497 HydrophobicContact CB-CG2 4.38Å; D494-T497 PolarHBondContact O-N 2.78Å; D494-T497 PolarHBondContact O-OG1 3.31Å
495	P	58	Low	63	Low	122 Å²	122	107.6 Å²	107.6	79%	0.792	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-14.1	174.7	22.8	-32.2	0	0	0	114.2	A493	A493-P495 WeakPolarHBondContact O-CD 3.43Å
496	N	54.6	Low	61.9	Low	72 Å²	72	110.7 Å²	110.7	39%	0.385	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.9	-2.8	176.5	-49	-66	0	0	0	114.3	I327 V328 D494	I327-N496 VanDerWaalsContact CG1-ND2 3.33Å; I327-N496 WeakPolarHBondContact CG1-ND2 3.34Å; V328-N496 HydrophobicContact CG2-CB 4.25Å; D494-N496 PolarHBondContact O-N 3.15Å; D494-N496 WeakPolarHBondContact OD1-CB 3.49Å; D494-N496 PolarHBondContact OD1-N 2.85Å; D494-N496 PolarHBondContact OD1-ND2 3.39Å
497	T	50.8	Low	60.7	Low	74 Å²	74	108.6 Å²	108.6	45%	0.454	65%	0.65	S	S	.	*	S	Bend	trans	-68.4	134.3	171.6	21.5	0	0	0	0	110.3	D494 R499	D494-T497 HydrophobicContact CB-CG2 4.38Å; D494-T497 PolarHBondContact O-N 2.78Å; D494-T497 PolarHBondContact O-OG1 3.31Å; T497-R499 PolarHBondContact O-N 3.18Å
498	P	44.5	Very low	59.3	Low	97 Å²	97	107.9 Å²	107.9	63%	0.63	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-58.5	134.1	179.5	21.5	-29.7	0	0	0	110.1	G500 S501	P498-G500 PolarHBondContact O-N 3.23Å; P498-G500 VanDerWaalsContact O-N 3.12Å; P498-S501 PolarHBondContact O-N 2.92Å; P498-S501 PolarHBondContact O-OG 2.89Å
499	R	43.2	Very low	57.9	Low	258 Å²	258	111.8 Å²	111.8	97%	0.974	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	118.7	178.5	-73	-174	-179.4	-172.1	1.3	109.1	T497	T497-R499 PolarHBondContact O-N 3.18Å
500	G	49	Very low	56.6	Low	90 Å²	90	107.4 Å²	107.4	93%	0.928	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	103	17.1	178.2	0	0	0	0	0	116	P498	P498-G500 PolarHBondContact O-N 3.23Å; P498-G500 VanDerWaalsContact O-N 3.12Å
501	S	39.1	Very low	54.8	Low	119 Å²	119	110.2 Å²	110.2	83%	0.832	66%	0.664	S	S	*	*			trans	-90	0	171.3	42.7	0	0	0	0	114.3	P498	P498-S501 PolarHBondContact O-N 2.92Å; P498-S501 PolarHBondContact O-OG 2.89Å

Retrieved 501 of 501 residues in 705.7 ms (Link to these results)

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