A0A087X5B3_POEFO Loading...

T-complex protein 1 subunit eta

Molecular chaperone; assists the folding of proteins upon ATP hydrolysis. Known to play a role, in vitro, in the folding of actin and tubulin.

AlphaFold DB , UniProt , Accession A0A087X5B3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 546 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	45.1	Very low	58.3	Low	240 Å²	240	145 Å²	145	100%	1.182	77%	0.772	S	S	*	*				0	111.1	0	-77.3	174.9	169.9	0	0	107
2	M	43.2	Very low	58.5	Low	184 Å²	184	138 Å²	138	91%	0.906	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-65.3	134.2	167	-65.4	-164.3	-164.6	0	0	107.3	T4	M2-T4 PolarHBondContact O-N 2.9Å
3	P	49.9	Very low	58.8	Low	122 Å²	122	129 Å²	129	79%	0.792	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-60.4	123.9	175.9	23.7	-29.8	0	0	0	108.2
4	T	56.3	Low	59.1	Low	126 Å²	126	128.6 Å²	128.6	77%	0.773	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-55.3	123.8	172.6	-11.8	0	0	0	0	107.5	M2 V6	M2-T4 PolarHBondContact O-N 2.9Å; T4-V6 PolarHBondContact O-N 2.86Å; T4-V6 VanDerWaalsContact O-N 3.09Å
5	P	54.4	Low	59.8	Low	109 Å²	109	123.7 Å²	123.7	71%	0.708	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-60.8	119.7	177.1	22.5	-30	0	0	0	108.2	I7	P5-I7 PolarHBondContact O-N 3.24Å
6	V	65.1	Low	60.7	Low	128 Å²	128	119.8 Å²	119.8	78%	0.776	67%	0.667	S	S	*	*			trans	-66.8	107.6	172.6	176.5	0	0	0	0	106.5	T4 L8	T4-V6 PolarHBondContact O-N 2.86Å; T4-V6 VanDerWaalsContact O-N 3.09Å; V6-L8 PolarHBondContact O-N 3.15Å; V6-L8 VanDerWaalsContact O-N 3.1Å
7	I	65.5	Low	62.1	Low	127 Å²	127	119.5 Å²	119.5	65%	0.651	66%	0.66	S	S	*	*			trans	-70	105.4	176.2	-61.2	173.7	0	0	0	107.3	P5 L9	P5-I7 PolarHBondContact O-N 3.24Å; I7-L9 WeakPolarHBondContact CG2-O 3.29Å
8	L	64.8	Low	63.4	Low	160 Å²	160	114.8 Å²	114.8	84%	0.838	64%	0.643	S	S	*	*			trans	-74.2	-32.4	-178.9	-85	153.3	0	0	0	112.9	V6	V6-L8 PolarHBondContact O-N 3.15Å; V6-L8 VanDerWaalsContact O-N 3.1Å
9	L	66.8	Low	64.7	Low	80 Å²	80	112.8 Å²	112.8	42%	0.419	63%	0.63	S	S	.	*	S	Bend	trans	-137.5	152.2	-176.8	-64.6	171.9	0	0	0	110.5	I7 T13 T15	I7-L9 WeakPolarHBondContact CG2-O 3.29Å; L9-T13 HydrophobicContact CB-CG2 4.18Å; L9-T13 HydrophobicContact CD1-CG2 3.97Å; L9-T13 HydrophobicContact CD2-CG2 4.44Å; L9-T13 HydrophobicContact CG-CG2 4.43Å; L9-T15 HydrophobicContact CD1-CG2 3.33Å
10	K	70.1	Confident	65.9	Low	133 Å²	133	112 Å²	112	58%	0.578	63%	0.629	S	S	*	*			trans	-61.2	144.7	179.2	-66.6	-177.9	-179.5	179.6	0	110.7	G12 T13	K10-G12 PolarHBondContact O-N 3.13Å; K10-T13 WeakPolarHBondContact O-CB 3.19Å; K10-T13 PolarHBondContact O-N 2.96Å; K10-T13 PolarHBondContact O-OG1 3.27Å
11	E	60.3	Low	67.1	Low	186 Å²	186	107.1 Å²	107.1	87%	0.869	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.7	127.2	170.8	-73.4	-178.8	164	0	0	110.1
12	G	60.1	Low	69.2	Low	61 Å²	61	96 Å²	96	63%	0.629	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	-1.4	-173.9	0	0	0	0	0	115.8	K10 D14	K10-G12 PolarHBondContact O-N 3.13Å; G12-D14 PolarHBondContact O-N 3.14Å
13	T	63.5	Low	71.6	Confident	21 Å²	21	88.8 Å²	88.8	13%	0.129	51%	0.512	C	S	.	.			trans	-80.5	97.3	172.2	-47.8	0	0	0	0	109.8	L9 K10 T15 I520 K521	L9-T13 HydrophobicContact CB-CG2 4.18Å; L9-T13 HydrophobicContact CD1-CG2 3.97Å; L9-T13 HydrophobicContact CD2-CG2 4.44Å; L9-T13 HydrophobicContact CG-CG2 4.43Å; K10-T13 WeakPolarHBondContact O-CB 3.19Å; K10-T13 PolarHBondContact O-N 2.96Å; K10-T13 PolarHBondContact O-OG1 3.27Å; T13-T15 HydrophobicContact CG2-CG2 4.44Å; T13-T15 PolarHBondContact O-N 3.19Å; T13-I520 HydrophobicContact CG2-CG2 3.87Å; T13-K521 WeakPolarHBondContact CG2-O 3.31Å
14	D	63.1	Low	73.6	Confident	123 Å²	123	85.5 Å²	85.5	66%	0.658	49%	0.492	S	S	*	.			trans	-68.2	123.3	170.1	-89.9	-27.8	0	0	0	109.6	G12	G12-D14 PolarHBondContact O-N 3.14Å
15	T	68.5	Low	75.3	Confident	56 Å²	56	79.7 Å²	79.7	34%	0.344	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.1	170.1	51	0	0	0	0	108.8	L9 T13	L9-T15 HydrophobicContact CD1-CG2 3.33Å; T13-T15 HydrophobicContact CG2-CG2 4.44Å; T13-T15 PolarHBondContact O-N 3.19Å
16	S	74.9	Confident	77.2	Confident	61 Å²	61	74.5 Å²	74.5	43%	0.427	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	124.2	171.5	-69.8	0	0	0	0	106.4	Q21 E518 T519	S16-Q21 WeakPolarHBondContact O-CG 3.48Å; S16-E518 WeakPolarHBondContact O-CA 3.17Å; S16-T519 PolarHBondContact O-N 3.27Å
17	Q	83.6	Confident	78.6	Confident	115 Å²	115	71.2 Å²	71.2	54%	0.537	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	152	-165.4	-69.4	178	-2.6	0	0	111.7	D517 E518	Q17-D517 CarbonylContact C-O 3.53Å; Q17-D517 WeakPolarHBondContact CA-O 3.43Å; Q17-E518 HydrophobicContact CG-CB 4.19Å; Q17-E518 HydrophobicContact CG-CG 3.71Å; Q17-E518 VanDerWaalsContact NE2-CD 3.33Å; Q17-E518 PolarHBondContact NE2-OE1 3.39Å
18	G	87	Confident	79.9	Confident	34 Å²	34	66 Å²	66	35%	0.351	38%	0.376	S	S	.	.	S	Bend	trans	73.8	-149.1	169.4	0	0	0	0	0	114.5	Q21 L22 D517	G18-Q21 WeakPolarHBondContact O-CB 3.44Å; G18-Q21 PolarHBondContact O-N 2.97Å; G18-Q21 VanDerWaalsContact O-N 3.13Å; G18-L22 PolarHBondContact O-N 3.26Å; G18-D517 PolarHBondContact N-O 3.36Å
19	I	87.9	Confident	81.3	Confident	78 Å²	78	58.4 Å²	58.4	40%	0.4	34%	0.336	S	S	.	.	H	α-helix	trans	-57.9	-43.2	-176.7	-63.6	172.8	0	0	0	112.9	Q21 L22 I23 V112	I19-Q21 PolarHBondContact O-N 3.45Å; I19-L22 PolarHBondContact O-N 3.13Å; I19-I23 HydrophobicContact CG2-CD1 3.7Å; I19-I23 HydrophobicContact CG2-CG1 4.27Å; I19-I23 WeakPolarHBondContact O-CG1 3.27Å; I19-I23 PolarHBondContact O-N 3.26Å; I19-V112 HydrophobicContact CG2-CG1 4.26Å
20	P	88.8	Confident	82.6	Confident	96 Å²	96	56.3 Å²	56.3	62%	0.623	33%	0.325	S	S	*	.	H	α-helix	trans	-58.1	-35.6	176.5	-26.3	35.9	0	0	0	113.3	I23 S24	P20-I23 PolarHBondContact O-N 3.39Å; P20-S24 WeakPolarHBondContact O-CB 3.33Å; P20-S24 PolarHBondContact O-N 2.9Å
21	Q	89.6	Confident	83.7	Confident	9 Å²	9	54.5 Å²	54.5	4%	0.042	32%	0.324	C	S	.	.	H	α-helix	trans	-67.1	-44	177.1	-178	55.1	29	0	0	111.7	S16 G18 I19 I23 S24 N25 T519	S16-Q21 WeakPolarHBondContact O-CG 3.48Å; G18-Q21 WeakPolarHBondContact O-CB 3.44Å; G18-Q21 PolarHBondContact O-N 2.97Å; G18-Q21 VanDerWaalsContact O-N 3.13Å; I19-Q21 PolarHBondContact O-N 3.45Å; Q21-I23 VanDerWaalsContact C-N 3.35Å; Q21-I23 PolarHBondContact O-N 3.16Å; Q21-S24 WeakPolarHBondContact O-CB 3.48Å; Q21-S24 PolarHBondContact O-N 3.08Å; Q21-N25 PolarHBondContact NE2-OD1 3.41Å; Q21-N25 WeakPolarHBondContact O-CB 3.49Å; Q21-N25 VanDerWaalsContact O-CG 3.28Å; Q21-N25 PolarHBondContact O-N 3.07Å; Q21-T519 PolarHBondContact NE2-OG1 3.13Å
22	L	90.9	Very high	85.2	Confident	6 Å²	6	46.7 Å²	46.7	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-60.6	-44.9	175.9	-67.8	171.1	0	0	0	111.4	G18 I19 S24 N25 I26 V112 P118 L514 V516	G18-L22 PolarHBondContact O-N 3.26Å; I19-L22 PolarHBondContact O-N 3.13Å; L22-S24 VanDerWaalsContact C-N 3.35Å; L22-S24 PolarHBondContact O-N 2.95Å; L22-N25 WeakPolarHBondContact O-CB 3.49Å; L22-N25 PolarHBondContact O-N 3.08Å; L22-I26 WeakPolarHBondContact O-CG1 3.28Å; L22-I26 PolarHBondContact O-N 2.99Å; L22-V112 HydrophobicContact CB-CG1 4.26Å; L22-V112 HydrophobicContact CD1-CG1 3.98Å; L22-P118 HydrophobicContact CD1-CG 3.67Å; L22-L514 WeakPolarHBondContact CD2-O 3.48Å; L22-V516 VanDerWaalsContact CD2-O 3.24Å; L22-V516 WeakPolarHBondContact CD2-O 3.47Å
23	I	91.9	Very high	86.8	Confident	34 Å²	34	43.9 Å²	43.9	17%	0.174	26%	0.259	C	S	.	.	H	α-helix	trans	-63.7	-42.2	177.8	-66.4	169.4	0	0	0	110.9	I19 P20 Q21 I26 N27 E113	I19-I23 HydrophobicContact CG2-CD1 3.7Å; I19-I23 HydrophobicContact CG2-CG1 4.27Å; I19-I23 WeakPolarHBondContact O-CG1 3.27Å; I19-I23 PolarHBondContact O-N 3.26Å; P20-I23 PolarHBondContact O-N 3.39Å; Q21-I23 VanDerWaalsContact C-N 3.35Å; Q21-I23 PolarHBondContact O-N 3.16Å; I23-I26 PolarHBondContact O-N 2.9Å; I23-N27 WeakPolarHBondContact O-CB 3.27Å; I23-N27 PolarHBondContact O-N 2.69Å; I23-N27 PolarHBondContact O-ND2 2.57Å; I23-E113 HydrophobicContact CD1-CG 3.7Å; I23-E113 HydrophobicContact CG1-CG 4.38Å
24	S	92.3	Very high	88.1	Confident	53 Å²	53	48.6 Å²	48.6	37%	0.371	28%	0.279	S	S	.	.	H	α-helix	trans	-58	-48.5	174.8	-174.7	0	0	0	0	111.5	P20 Q21 L22 I26 N27 A28	P20-S24 WeakPolarHBondContact O-CB 3.33Å; P20-S24 PolarHBondContact O-N 2.9Å; Q21-S24 WeakPolarHBondContact O-CB 3.48Å; Q21-S24 PolarHBondContact O-N 3.08Å; L22-S24 VanDerWaalsContact C-N 3.35Å; L22-S24 PolarHBondContact O-N 2.95Å; S24-I26 PolarHBondContact O-N 3.14Å; S24-N27 PolarHBondContact O-N 3.44Å; S24-A28 WeakPolarHBondContact O-CB 3.21Å; S24-A28 PolarHBondContact O-N 2.95Å
25	N	93.2	Very high	89.4	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-58.4	-45.2	176.3	-72.9	-17.3	0	0	0	112.2	Q21 L22 A28 C29 H73 A75 I513 V516	Q21-N25 PolarHBondContact NE2-OD1 3.41Å; Q21-N25 WeakPolarHBondContact O-CB 3.49Å; Q21-N25 VanDerWaalsContact O-CG 3.28Å; Q21-N25 PolarHBondContact O-N 3.07Å; L22-N25 WeakPolarHBondContact O-CB 3.49Å; L22-N25 PolarHBondContact O-N 3.08Å; N25-A28 PolarHBondContact O-N 3.4Å; N25-C29 PolarHBondContact O-N 3.16Å; N25-C29 VanDerWaalsContact O-N 3.15Å; N25-C29 PolarHBondContact O-SG 3.29Å; N25-H73 PolarHBondContact OD1-CE1 3.5Å; N25-A75 HydrophobicContact CB-CB 3.76Å; N25-I513 HydrophobicContact CB-CG2 3.79Å; N25-V516 PolarHBondContact ND2-O 3.42Å
26	I	94	Very high	90.6	Very high	1 Å²	1	42 Å²	42	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-48.3	178.5	-68.6	165.9	0	0	0	110.7	L22 I23 S24 A28 C29 Q30 L105 K109 L514	L22-I26 WeakPolarHBondContact O-CG1 3.28Å; L22-I26 PolarHBondContact O-N 2.99Å; I23-I26 PolarHBondContact O-N 2.9Å; S24-I26 PolarHBondContact O-N 3.14Å; I26-A28 VanDerWaalsContact C-N 3.34Å; I26-A28 PolarHBondContact O-N 2.99Å; I26-C29 WeakPolarHBondContact O-CB 3.31Å; I26-C29 PolarHBondContact O-N 3.17Å; I26-Q30 WeakPolarHBondContact O-CG 3.47Å; I26-Q30 PolarHBondContact O-N 3.06Å; I26-L105 HydrophobicContact CG1-CB 4.15Å; I26-L105 HydrophobicContact CG1-CD2 4.21Å; I26-L105 HydrophobicContact CG2-CB 4.04Å; I26-K109 HydrophobicContact CD1-CB 4.38Å; I26-K109 HydrophobicContact CG2-CB 4.4Å; I26-K109 HydrophobicContact CG2-CD 4.39Å; I26-L514 HydrophobicContact CD1-CD2 4.27Å
27	N	93.9	Very high	91.5	Very high	58 Å²	58	41.3 Å²	41.3	31%	0.31	24%	0.236	S	C	.	.	H	α-helix	trans	-63.4	-41.1	-179.3	-65.2	-23.7	0	0	0	111.1	I23 S24 C29 Q30 V31 K109	I23-N27 WeakPolarHBondContact O-CB 3.27Å; I23-N27 PolarHBondContact O-N 2.69Å; I23-N27 PolarHBondContact O-ND2 2.57Å; S24-N27 PolarHBondContact O-N 3.44Å; N27-C29 VanDerWaalsContact C-N 3.28Å; N27-C29 PolarHBondContact O-N 3.28Å; N27-Q30 WeakPolarHBondContact O-CB 3.44Å; N27-Q30 PolarHBondContact O-N 3.47Å; N27-Q30 VanDerWaalsContact O-N 3.16Å; N27-V31 WeakPolarHBondContact O-CG2 3.36Å; N27-V31 PolarHBondContact O-N 3.43Å; N27-V31 VanDerWaalsContact O-N 3.11Å; N27-K109 PolarHBondContact OD1-NZ 3.05Å
28	A	93.1	Very high	92	Very high	18 Å²	18	37.8 Å²	37.8	15%	0.149	22%	0.222	C	C	.	.	H	α-helix	trans	-59.6	-39.6	176	0	0	0	0	0	112.2	S24 N25 I26 I32 H73	S24-A28 WeakPolarHBondContact O-CB 3.21Å; S24-A28 PolarHBondContact O-N 2.95Å; N25-A28 PolarHBondContact O-N 3.4Å; I26-A28 VanDerWaalsContact C-N 3.34Å; I26-A28 PolarHBondContact O-N 2.99Å; A28-I32 PolarHBondContact O-N 2.86Å; A28-H73 HydrophobicContact CB-CB 4.32Å
29	C	94.1	Very high	92.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68.6	-35.8	176.4	-68	0	0	0	0	112.7	N25 I26 N27 I32 S33 L79 L105 I513	N25-C29 PolarHBondContact O-N 3.16Å; N25-C29 VanDerWaalsContact O-N 3.15Å; N25-C29 PolarHBondContact O-SG 3.29Å; I26-C29 WeakPolarHBondContact O-CB 3.31Å; I26-C29 PolarHBondContact O-N 3.17Å; N27-C29 VanDerWaalsContact C-N 3.28Å; N27-C29 PolarHBondContact O-N 3.28Å; C29-I32 PolarHBondContact O-N 3.22Å; C29-S33 PolarHBondContact O-N 3.01Å; C29-L79 HydrophobicContact CB-CD1 3.69Å; C29-L79 HydrophobicContact CB-CG 4.45Å; C29-L105 HydrophobicContact CB-CD1 3.91Å; C29-I513 VanDerWaalsContact SG-CD1 3.52Å
30	Q	94	Very high	92.3	Very high	37 Å²	37	33 Å²	33	17%	0.173	19%	0.19	C	C	.	.	H	α-helix	trans	-63.2	-43.7	175.3	-72.5	175.4	1.5	0	0	111.8	I26 N27 I32 S33 E34 K106	I26-Q30 WeakPolarHBondContact O-CG 3.47Å; I26-Q30 PolarHBondContact O-N 3.06Å; N27-Q30 WeakPolarHBondContact O-CB 3.44Å; N27-Q30 PolarHBondContact O-N 3.47Å; N27-Q30 VanDerWaalsContact O-N 3.16Å; Q30-I32 VanDerWaalsContact C-N 3.34Å; Q30-I32 PolarHBondContact O-N 2.92Å; Q30-S33 WeakPolarHBondContact O-CB 3.42Å; Q30-S33 PolarHBondContact O-N 3.36Å; Q30-S33 VanDerWaalsContact O-N 3.14Å; Q30-E34 WeakPolarHBondContact O-CG 3.5Å; Q30-E34 PolarHBondContact O-N 3.06Å; Q30-K106 VanDerWaalsContact NE2-CB 3.28Å
31	V	92.9	Very high	92.3	Very high	95 Å²	95	29 Å²	29	58%	0.576	17%	0.166	S	C	*	.	H	α-helix	trans	-60.1	-43.6	178.7	174.8	0	0	0	0	111.7	N27 S33 E34 A35	N27-V31 WeakPolarHBondContact O-CG2 3.36Å; N27-V31 PolarHBondContact O-N 3.43Å; N27-V31 VanDerWaalsContact O-N 3.11Å; V31-S33 VanDerWaalsContact C-N 3.34Å; V31-S33 PolarHBondContact O-N 3.13Å; V31-E34 PolarHBondContact O-N 2.97Å; V31-A35 PolarHBondContact O-N 3.02Å
32	I	91.9	Very high	91.7	Very high	22 Å²	22	31.2 Å²	31.2	11%	0.113	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-42.4	175.7	-68.3	-58.2	0	0	0	111.5	A28 C29 Q30 E34 A35 V36 L66 V71 A76 L79	A28-I32 PolarHBondContact O-N 2.86Å; C29-I32 PolarHBondContact O-N 3.22Å; Q30-I32 VanDerWaalsContact C-N 3.34Å; Q30-I32 PolarHBondContact O-N 2.92Å; I32-E34 VanDerWaalsContact C-N 3.34Å; I32-E34 PolarHBondContact O-N 2.93Å; I32-A35 WeakPolarHBondContact O-CB 3.25Å; I32-A35 PolarHBondContact O-N 3.13Å; I32-V36 PolarHBondContact O-N 3.25Å; I32-L66 HydrophobicContact CG2-CD2 3.38Å; I32-V71 HydrophobicContact CD1-CG1 4.31Å; I32-V71 HydrophobicContact CD1-CG2 3.87Å; I32-A76 HydrophobicContact CD1-CB 4.39Å; I32-A76 HydrophobicContact CG1-CB 3.65Å; I32-L79 HydrophobicContact CB-CD1 4.4Å; I32-L79 HydrophobicContact CG2-CD1 4.32Å
33	S	93	Very high	91.3	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.014	20%	0.198	C	C	.	.	H	α-helix	trans	-63.2	-40.8	177.8	177.6	0	0	0	0	112	C29 Q30 V31 A35 V36 R37 L99	C29-S33 PolarHBondContact O-N 3.01Å; Q30-S33 WeakPolarHBondContact O-CB 3.42Å; Q30-S33 PolarHBondContact O-N 3.36Å; Q30-S33 VanDerWaalsContact O-N 3.14Å; V31-S33 VanDerWaalsContact C-N 3.34Å; V31-S33 PolarHBondContact O-N 3.13Å; S33-A35 PolarHBondContact O-N 3.14Å; S33-V36 WeakPolarHBondContact O-CG2 3.46Å; S33-V36 PolarHBondContact O-N 3.15Å; S33-R37 WeakPolarHBondContact O-CA 3.2Å; S33-R37 WeakPolarHBondContact O-CB 3.3Å; S33-R37 PolarHBondContact O-N 3.4Å; S33-L99 VanDerWaalsContact OG-CD1 3.24Å; S33-L99 WeakPolarHBondContact OG-CD1 2.99Å
34	E	91.6	Very high	90.9	Very high	119 Å²	119	35.2 Å²	35.2	56%	0.556	20%	0.198	S	C	*	.	H	α-helix	trans	-60.5	-34.3	175.5	-74.8	178.3	-179.9	0	0	112.5	Q30 V31 I32 V36	Q30-E34 WeakPolarHBondContact O-CG 3.5Å; Q30-E34 PolarHBondContact O-N 3.06Å; V31-E34 PolarHBondContact O-N 2.97Å; I32-E34 VanDerWaalsContact C-N 3.34Å; I32-E34 PolarHBondContact O-N 2.93Å; E34-V36 PolarHBondContact O-N 3.39Å
35	A	90.9	Very high	90.7	Very high	40 Å²	40	38.6 Å²	38.6	33%	0.331	21%	0.209	S	C	.	.	H	α-helix	trans	-63.9	-37.9	177.4	0	0	0	0	0	112.9	V31 I32 S33 K47	V31-A35 PolarHBondContact O-N 3.02Å; I32-A35 WeakPolarHBondContact O-CB 3.25Å; I32-A35 PolarHBondContact O-N 3.13Å; S33-A35 PolarHBondContact O-N 3.14Å; A35-K47 WeakPolarHBondContact O-CE 3.43Å; A35-K47 PolarHBondContact O-NZ 3.29Å
36	V	93	Very high	90.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-98.3	-17.7	-177.7	-61.9	0	0	0	0	113.9	I32 S33 E34 T38 T39 I65 L66 T95	I32-V36 PolarHBondContact O-N 3.25Å; S33-V36 WeakPolarHBondContact O-CG2 3.46Å; S33-V36 PolarHBondContact O-N 3.15Å; E34-V36 PolarHBondContact O-N 3.39Å; V36-T38 PolarHBondContact O-N 3.03Å; V36-T38 VanDerWaalsContact O-N 3.08Å; V36-T39 PolarHBondContact O-N 3.11Å; V36-T39 PolarHBondContact O-OG1 2.93Å; V36-I65 HydrophobicContact CG1-CB 4.47Å; V36-I65 HydrophobicContact CG1-CG2 4.06Å; V36-L66 HydrophobicContact CG1-CD1 4.32Å; V36-L66 HydrophobicContact CG1-CD2 3.87Å; V36-L66 HydrophobicContact CG1-CG 3.88Å; V36-T95 HydrophobicContact CB-CG2 4.38Å; V36-T95 HydrophobicContact CG2-CG2 4.42Å; V36-T95 VanDerWaalsContact O-CG2 3.3Å; V36-T95 WeakPolarHBondContact O-CG2 3.28Å
37	R	93.8	Very high	90.3	Very high	48 Å²	48	43.9 Å²	43.9	18%	0.181	24%	0.235	C	C	.	.	H	α-helix	trans	-50.8	-37.7	-175.9	167.9	-178.3	-78.6	-122.7	4.7	114	S33 T39 L40 L99 E103 Q448 N452	S33-R37 WeakPolarHBondContact O-CA 3.2Å; S33-R37 WeakPolarHBondContact O-CB 3.3Å; S33-R37 PolarHBondContact O-N 3.4Å; R37-T39 PolarHBondContact O-N 2.89Å; R37-L40 PolarHBondContact O-N 3.06Å; R37-L99 HydrophobicContact CB-CD1 4.23Å; R37-L99 HydrophobicContact CG-CD1 4.19Å; R37-E103 IonicContact NH2-OE2 3.98Å; R37-Q448 HydrophobicContact CG-CG 3.63Å; R37-Q448 WeakPolarHBondContact O-CG 3.36Å; R37-N452 PolarHBondContact O-ND2 3.25Å; R37-N452 VanDerWaalsContact O-ND2 3.08Å
38	T	93.6	Very high	90.1	Very high	40 Å²	40	46.5 Å²	46.5	25%	0.245	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-11.2	-178.4	68.7	0	0	0	0	113.4	V36 L40 G44 M45 K47 N452	V36-T38 PolarHBondContact O-N 3.03Å; V36-T38 VanDerWaalsContact O-N 3.08Å; T38-L40 VanDerWaalsContact C-N 3.32Å; T38-G44 CarbonylContact O-C 3.56Å; T38-G44 WeakPolarHBondContact O-CA 3.32Å; T38-M45 PolarHBondContact O-N 2.88Å; T38-K47 WeakPolarHBondContact OG1-CE 3.4Å; T38-K47 PolarHBondContact OG1-NZ 2.89Å; T38-N452 PolarHBondContact O-ND2 3.21Å
39	T	91.3	Very high	89.9	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.006	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-8.4	178.6	79.4	0	0	0	0	112.5	V36 R37 G41 M45 K47 N60 I65 T95	V36-T39 PolarHBondContact O-N 3.11Å; V36-T39 PolarHBondContact O-OG1 2.93Å; R37-T39 PolarHBondContact O-N 2.89Å; T39-G41 PolarHBondContact O-N 3.31Å; T39-M45 WeakPolarHBondContact CG2-O 3.37Å; T39-K47 HydrophobicContact CG2-CG 3.97Å; T39-N60 WeakPolarHBondContact CB-O 3.24Å; T39-N60 PolarHBondContact O-OD1 3.22Å; T39-N60 VanDerWaalsContact O-OD1 3.05Å; T39-N60 PolarHBondContact OG1-O 3.34Å; T39-N60 VanDerWaalsContact OG1-O 3.08Å; T39-I65 HydrophobicContact CG2-CD1 3.63Å; T39-T95 WeakPolarHBondContact OG1-CG2 3.31Å; T39-T95 PolarHBondContact OG1-OG1 2.97Å
40	L	91.3	Very high	89.7	Confident	12 Å²	12	52.2 Å²	52.2	6%	0.063	28%	0.279	C	S	.	.			trans	-70.8	130.4	-178.7	-175	73.9	0	0	0	112.3	R37 T38 T95 S96 L99 I445 Q448 L449 N452	R37-L40 PolarHBondContact O-N 3.06Å; T38-L40 VanDerWaalsContact C-N 3.32Å; L40-T95 HydrophobicContact CB-CG2 3.97Å; L40-T95 HydrophobicContact CD1-CG2 4.38Å; L40-S96 VanDerWaalsContact CD1-OG 3.31Å; L40-S96 WeakPolarHBondContact CD1-OG 3.47Å; L40-L99 HydrophobicContact CD2-CD2 3.86Å; L40-I445 HydrophobicContact CD2-CD1 4.19Å; L40-I445 HydrophobicContact CD2-CG2 4.49Å; L40-Q448 HydrophobicContact CB-CG 4.41Å; L40-Q448 HydrophobicContact CD2-CB 3.87Å; L40-Q448 HydrophobicContact CD2-CG 4.04Å; L40-L449 HydrophobicContact CD2-CD2 4.33Å; L40-L449 HydrophobicContact CD2-CG 4.35Å; L40-L449 HydrophobicContact CG-CD2 4.09Å; L40-N452 PolarHBondContact O-ND2 2.82Å
41	G	87.3	Confident	89.4	Confident	12 Å²	12	53.9 Å²	53.9	12%	0.124	29%	0.289	C	S	.	.	S	Bend	trans	92	170.6	168.4	0	0	0	0	0	114.9	T39 R43 G44 S165	T39-G41 PolarHBondContact O-N 3.31Å; G41-R43 VanDerWaalsContact C-N 3.27Å; G41-R43 PolarHBondContact O-N 2.89Å; G41-G44 WeakPolarHBondContact O-CA 3.37Å; G41-G44 PolarHBondContact O-N 3.25Å; G41-S165 WeakPolarHBondContact O-CB 3.39Å
42	P	78.1	Confident	89.1	Confident	54 Å²	54	53.9 Å²	53.9	35%	0.351	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-29.5	-170.2	21.3	-33.1	0	0	0	115.5	N164 S165 I479	P42-N164 WeakPolarHBondContact CA-O 3.19Å; P42-N164 HydrophobicContact CB-CB 4.14Å; P42-N164 WeakPolarHBondContact CB-O 3.28Å; P42-S165 VanDerWaalsContact CA-CA 3.43Å; P42-S165 VanDerWaalsContact CA-CB 3.48Å; P42-I479 HydrophobicContact CG-CB 3.89Å; P42-I479 HydrophobicContact CG-CD1 3.14Å; P42-I479 HydrophobicContact CG-CG1 4.05Å; P42-I479 HydrophobicContact CG-CG2 4Å
43	R	81.9	Confident	88.9	Confident	109 Å²	109	64 Å²	64	41%	0.411	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	29.8	173.5	-65.1	-178.9	-178.8	171	3.1	111.6	G41 I479 E482	G41-R43 VanDerWaalsContact C-N 3.27Å; G41-R43 PolarHBondContact O-N 2.89Å; R43-I479 HydrophobicContact CG-CG2 3.75Å; R43-I479 PolarHBondContact NH2-O 3.27Å; R43-E482 IonicContact CZ-OE1 2.82Å; R43-E482 IonicContact NH1-OE1 2.68Å; R43-E482 PolarHBondContact NH1-OE1 3.45Å; R43-E482 VanDerWaalsContact NH1-OE1 3.13Å; R43-E482 IonicContact NH2-OE1 2.71Å
44	G	84.9	Confident	88.6	Confident	15 Å²	15	66.6 Å²	66.6	16%	0.155	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-63.8	142.5	177	0	0	0	0	0	111.6	T38 G41	T38-G44 CarbonylContact O-C 3.56Å; T38-G44 WeakPolarHBondContact O-CA 3.32Å; G41-G44 WeakPolarHBondContact O-CA 3.37Å; G41-G44 PolarHBondContact O-N 3.25Å
45	M	87.3	Confident	88.4	Confident	124 Å²	124	65.7 Å²	65.7	61%	0.611	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-86.3	125.4	179.1	-62.8	-66	-69	0	0	110.6	T38 T39	T38-M45 PolarHBondContact O-N 2.88Å; T39-M45 WeakPolarHBondContact CG2-O 3.37Å
46	D	88.1	Confident	88.3	Confident	61 Å²	61	65.4 Å²	65.4	33%	0.326	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-68.8	155.8	177.3	-59.9	-36.8	0	0	0	112.8	I58 N60 L167	D46-I58 HydrophobicContact CB-CG2 3.93Å; D46-N60 VanDerWaalsContact OD1-CB 3.29Å; D46-N60 WeakPolarHBondContact OD1-CB 3.44Å; D46-N60 PolarHBondContact OD1-ND2 2.77Å; D46-L167 VanDerWaalsContact OD2-CD2 3.23Å; D46-L167 WeakPolarHBondContact OD2-CD2 3.21Å
47	K	90	Very high	88	Confident	54 Å²	54	66.1 Å²	66.1	24%	0.235	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	126.3	174.4	-56.8	-59.8	175.2	173.2	0	110.4	A35 T38 T39 I58 S59 I65	A35-K47 WeakPolarHBondContact O-CE 3.43Å; A35-K47 PolarHBondContact O-NZ 3.29Å; T38-K47 WeakPolarHBondContact OG1-CE 3.4Å; T38-K47 PolarHBondContact OG1-NZ 2.89Å; T39-K47 HydrophobicContact CG2-CG 3.97Å; K47-I58 WeakPolarHBondContact O-CA 3.47Å; K47-S59 PolarHBondContact N-O 2.9Å; K47-S59 PolarHBondContact O-N 2.9Å; K47-S59 VanDerWaalsContact O-N 3.07Å; K47-I65 HydrophobicContact CB-CD1 3.98Å; K47-I65 HydrophobicContact CB-CG1 4.16Å; K47-I65 HydrophobicContact CG-CD1 3.65Å; K47-I65 HydrophobicContact CG-CG1 4.28Å
48	L	90.4	Very high	87.7	Confident	114 Å²	114	66.1 Å²	66.1	60%	0.597	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	111.5	169	177.1	66.2	0	0	0	108.9	A56 I58	L48-A56 HydrophobicContact CD1-CB 4.08Å; L48-I58 HydrophobicContact CD1-CD1 4.26Å; L48-I58 HydrophobicContact CD1-CG1 3.57Å
49	M	88.9	Confident	87.4	Confident	44 Å²	44	64.2 Å²	64.2	22%	0.217	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	134.7	178.2	-62.2	-61.7	-65.8	0	0	109.3	A56 T57 L68 L69	M49-A56 CarbonylContact O-C 3.39Å; M49-A56 WeakPolarHBondContact O-CA 3.41Å; M49-T57 PolarHBondContact N-O 3.36Å; M49-T57 PolarHBondContact O-N 2.71Å; M49-L68 HydrophobicContact CB-CD1 4.24Å; M49-L68 HydrophobicContact CE-CB 4.47Å; M49-L68 HydrophobicContact CG-CD1 4.46Å; M49-L69 HydrophobicContact CE-CD2 3.53Å; M49-L69 HydrophobicContact CE-CG 3.96Å; M49-L69 HydrophobicContact SD-CD2 4.5Å
50	V	89.2	Confident	87.1	Confident	94 Å²	94	64.6 Å²	64.6	57%	0.57	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.8	124.3	175.6	-176	0	0	0	0	108.2	A56	V50-A56 HydrophobicContact CG2-CB 4.4Å
51	D	88.1	Confident	86.8	Confident	71 Å²	71	64.6 Å²	64.6	38%	0.38	36%	0.361	S	S	.	.			trans	-75.3	169.5	175.5	77.6	5.7	0	0	0	111.7	R53 G54 K55	D51-R53 PolarHBondContact O-N 3.24Å; D51-R53 VanDerWaalsContact OD1-C 3.23Å; D51-R53 VanDerWaalsContact OD1-CA 3.27Å; D51-R53 WeakPolarHBondContact OD1-CA 3.36Å; D51-R53 WeakPolarHBondContact OD1-CB 3.42Å; D51-R53 PolarHBondContact OD1-N 3.42Å; D51-G54 PolarHBondContact O-N 3.22Å; D51-G54 PolarHBondContact OD1-N 2.82Å; D51-K55 PolarHBondContact N-O 2.85Å; D51-K55 VanDerWaalsContact N-O 3.09Å; D51-K55 PolarHBondContact OD1-N 3.26Å; D51-K55 WeakPolarHBondContact OD2-CB 3.39Å
52	G	86.4	Confident	86.8	Confident	95 Å²	95	64 Å²	64	98%	0.979	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-7.5	177.7	0	0	0	0	0	114.8
53	R	88.8	Confident	87.3	Confident	236 Å²	236	61.5 Å²	61.5	89%	0.891	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	0.8	177.2	-59.5	-179.5	-177.9	-176.3	1	112.4	D51	D51-R53 PolarHBondContact O-N 3.24Å; D51-R53 VanDerWaalsContact OD1-C 3.23Å; D51-R53 VanDerWaalsContact OD1-CA 3.27Å; D51-R53 WeakPolarHBondContact OD1-CA 3.36Å; D51-R53 WeakPolarHBondContact OD1-CB 3.42Å; D51-R53 PolarHBondContact OD1-N 3.42Å
54	G	86.9	Confident	87.6	Confident	56 Å²	56	57.3 Å²	57.3	58%	0.577	33%	0.326	S	S	*	.			trans	83.6	8.5	-178.5	0	0	0	0	0	115.2	D51 A56	D51-G54 PolarHBondContact O-N 3.22Å; D51-G54 PolarHBondContact OD1-N 2.82Å; G54-A56 PolarHBondContact O-N 3.29Å
55	K	86.6	Confident	87.9	Confident	100 Å²	100	56.8 Å²	56.8	44%	0.435	32%	0.319	S	S	.	.			trans	-72.2	113.1	171.9	-171.3	-180	176.8	178	0	109.1	D51 E383	D51-K55 PolarHBondContact N-O 2.85Å; D51-K55 VanDerWaalsContact N-O 3.09Å; D51-K55 PolarHBondContact OD1-N 3.26Å; D51-K55 WeakPolarHBondContact OD2-CB 3.39Å; K55-E383 IonicContact NZ-OE1 2.73Å; K55-E383 PolarHBondContact NZ-OE1 3.1Å; K55-E383 IonicContact NZ-OE2 3.16Å
56	A	88.5	Confident	88	Confident	34 Å²	34	51 Å²	51	28%	0.281	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	128.6	172.9	0	0	0	0	0	110.8	L48 M49 V50 G54	L48-A56 HydrophobicContact CD1-CB 4.08Å; M49-A56 CarbonylContact O-C 3.39Å; M49-A56 WeakPolarHBondContact O-CA 3.41Å; V50-A56 HydrophobicContact CG2-CB 4.4Å; G54-A56 PolarHBondContact O-N 3.29Å
57	T	86.1	Confident	88.1	Confident	14 Å²	14	52 Å²	52	9%	0.086	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126	173.8	-53.3	0	0	0	0	108.7	M49 L68 R387	M49-T57 PolarHBondContact N-O 3.36Å; M49-T57 PolarHBondContact O-N 2.71Å; T57-L68 HydrophobicContact CG2-CD1 3.95Å; T57-R387 VanDerWaalsContact CG2-NH2 3.3Å
58	I	88.7	Confident	88.1	Confident	48 Å²	48	53.4 Å²	53.4	25%	0.246	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	135.6	170.9	-60	169.3	0	0	0	106.8	D46 K47 L48 Q380 R387	D46-I58 HydrophobicContact CB-CG2 3.93Å; K47-I58 WeakPolarHBondContact O-CA 3.47Å; L48-I58 HydrophobicContact CD1-CD1 4.26Å; L48-I58 HydrophobicContact CD1-CG1 3.57Å; I58-Q380 HydrophobicContact CD1-CB 4.49Å; I58-R387 PolarHBondContact O-NH1 3.48Å
59	S	86.3	Confident	88	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.007	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	144.6	179.8	-164.1	0	0	0	0	111.6	K47 D61 E384 R387	K47-S59 PolarHBondContact N-O 2.9Å; K47-S59 PolarHBondContact O-N 2.9Å; K47-S59 VanDerWaalsContact O-N 3.07Å; S59-D61 PolarHBondContact OG-N 3.3Å; S59-E384 WeakPolarHBondContact CA-OE2 3.42Å; S59-E384 PolarHBondContact OG-OE2 2.61Å; S59-R387 PolarHBondContact OG-NH1 2.62Å
60	N	85.7	Confident	88	Confident	8 Å²	8	55.5 Å²	55.5	4%	0.043	31%	0.314	C	S	.	.			trans	-99.5	-29.4	165.5	-161.7	-90.5	0	0	0	112	T39 D46 G62 S165 E384	T39-N60 WeakPolarHBondContact CB-O 3.24Å; T39-N60 PolarHBondContact O-OD1 3.22Å; T39-N60 VanDerWaalsContact O-OD1 3.05Å; T39-N60 PolarHBondContact OG1-O 3.34Å; T39-N60 VanDerWaalsContact OG1-O 3.08Å; D46-N60 VanDerWaalsContact OD1-CB 3.29Å; D46-N60 WeakPolarHBondContact OD1-CB 3.44Å; D46-N60 PolarHBondContact OD1-ND2 2.77Å; N60-G62 PolarHBondContact O-N 3.2Å; N60-S165 PolarHBondContact OD1-O 2.82Å; N60-E384 PolarHBondContact N-OE1 3.01Å
61	D	85.3	Confident	88	Confident	13 Å²	13	52.3 Å²	52.3	7%	0.07	30%	0.295	C	S	.	.			trans	-62.2	121.7	-178.8	169.6	42.5	0	0	0	112.8	S59 A63 T64 I65 T94	S59-D61 PolarHBondContact OG-N 3.3Å; D61-A63 VanDerWaalsContact C-N 3.33Å; D61-A63 PolarHBondContact O-N 3.14Å; D61-A63 PolarHBondContact OD1-N 3.2Å; D61-A63 VanDerWaalsContact OD1-N 3.14Å; D61-T64 PolarHBondContact O-N 3.49Å; D61-T64 VanDerWaalsContact OD2-CB 3.28Å; D61-T64 WeakPolarHBondContact OD2-CB 3.25Å; D61-T64 PolarHBondContact OD2-N 3.38Å; D61-T64 PolarHBondContact OD2-OG1 2.98Å; D61-I65 WeakPolarHBondContact O-CD1 3.27Å; D61-I65 VanDerWaalsContact O-CG1 3.3Å; D61-I65 WeakPolarHBondContact O-CG1 3.31Å; D61-I65 PolarHBondContact O-N 3.1Å; D61-T94 PolarHBondContact OD1-OG1 3.29Å
62	G	87.6	Confident	87.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-37.2	180	0	0	0	0	0	113.1	N60 I65 L66 T94	N60-G62 PolarHBondContact O-N 3.2Å; G62-I65 PolarHBondContact O-N 3.47Å; G62-L66 WeakPolarHBondContact O-CB 3.48Å; G62-L66 WeakPolarHBondContact O-CD1 3.45Å; G62-L66 WeakPolarHBondContact O-CG 3.38Å; G62-L66 PolarHBondContact O-N 3.14Å; G62-T94 PolarHBondContact N-OG1 2.93Å
63	A	88.3	Confident	88.1	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-67.1	-41	179.5	0	0	0	0	0	111.4	D61 L66 K67 A83 D87 T94	D61-A63 VanDerWaalsContact C-N 3.33Å; D61-A63 PolarHBondContact O-N 3.14Å; D61-A63 PolarHBondContact OD1-N 3.2Å; D61-A63 VanDerWaalsContact OD1-N 3.14Å; A63-L66 PolarHBondContact O-N 2.98Å; A63-K67 WeakPolarHBondContact O-CB 3.17Å; A63-K67 WeakPolarHBondContact O-CD 3.28Å; A63-K67 WeakPolarHBondContact O-CG 3.38Å; A63-K67 PolarHBondContact O-N 3.47Å; A63-A83 HydrophobicContact CB-CB 4.38Å; A63-D87 HydrophobicContact CB-CB 3.71Å; A63-T94 HydrophobicContact CB-CG2 3.67Å; A63-T94 PolarHBondContact N-OG1 2.99Å
64	T	87.8	Confident	88.1	Confident	21 Å²	21	44 Å²	44	13%	0.129	25%	0.251	C	S	.	.	H	α-helix	trans	-65.8	-44.3	176.5	-59.9	0	0	0	0	112	D61 L66 K67 L68	D61-T64 PolarHBondContact O-N 3.49Å; D61-T64 VanDerWaalsContact OD2-CB 3.28Å; D61-T64 WeakPolarHBondContact OD2-CB 3.25Å; D61-T64 PolarHBondContact OD2-N 3.38Å; D61-T64 PolarHBondContact OD2-OG1 2.98Å; T64-L66 VanDerWaalsContact C-N 3.35Å; T64-L66 PolarHBondContact O-N 3.22Å; T64-K67 PolarHBondContact O-N 2.85Å; T64-L68 HydrophobicContact CG2-CD1 4.23Å; T64-L68 WeakPolarHBondContact O-CG 3.47Å; T64-L68 PolarHBondContact O-N 3.34Å; T64-L68 VanDerWaalsContact O-N 3.15Å
65	I	90.9	Very high	88.2	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-47.6	175.7	-66.2	160.7	0	0	0	110.6	V36 T39 K47 D61 G62 K67 L68 L69	V36-I65 HydrophobicContact CG1-CB 4.47Å; V36-I65 HydrophobicContact CG1-CG2 4.06Å; T39-I65 HydrophobicContact CG2-CD1 3.63Å; K47-I65 HydrophobicContact CB-CD1 3.98Å; K47-I65 HydrophobicContact CB-CG1 4.16Å; K47-I65 HydrophobicContact CG-CD1 3.65Å; K47-I65 HydrophobicContact CG-CG1 4.28Å; D61-I65 WeakPolarHBondContact O-CD1 3.27Å; D61-I65 VanDerWaalsContact O-CG1 3.3Å; D61-I65 WeakPolarHBondContact O-CG1 3.31Å; D61-I65 PolarHBondContact O-N 3.1Å; G62-I65 PolarHBondContact O-N 3.47Å; I65-K67 VanDerWaalsContact C-N 3.29Å; I65-K67 PolarHBondContact O-N 3.48Å; I65-L68 PolarHBondContact O-N 3.49Å; I65-L68 VanDerWaalsContact O-N 3.15Å; I65-L69 HydrophobicContact CG2-CD1 3.94Å; I65-L69 HydrophobicContact CG2-CG 4.44Å; I65-L69 WeakPolarHBondContact O-CG 3.37Å; I65-L69 PolarHBondContact O-N 2.94Å
66	L	90.6	Very high	88.4	Confident	2 Å²	2	37 Å²	37	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-68.5	-25.4	-179.9	-68.8	170.5	0	0	0	113.5	I32 V36 G62 A63 T64 L69 V80 A83 T98	I32-L66 HydrophobicContact CG2-CD2 3.38Å; V36-L66 HydrophobicContact CG1-CD1 4.32Å; V36-L66 HydrophobicContact CG1-CD2 3.87Å; V36-L66 HydrophobicContact CG1-CG 3.88Å; G62-L66 WeakPolarHBondContact O-CB 3.48Å; G62-L66 WeakPolarHBondContact O-CD1 3.45Å; G62-L66 WeakPolarHBondContact O-CG 3.38Å; G62-L66 PolarHBondContact O-N 3.14Å; A63-L66 PolarHBondContact O-N 2.98Å; T64-L66 VanDerWaalsContact C-N 3.35Å; T64-L66 PolarHBondContact O-N 3.22Å; L66-L69 HydrophobicContact CD2-CD1 4.19Å; L66-V80 HydrophobicContact CB-CG1 4.15Å; L66-V80 HydrophobicContact CB-CG2 4.2Å; L66-V80 HydrophobicContact CD2-CG2 4.39Å; L66-V80 WeakPolarHBondContact O-CG1 3.08Å; L66-A83 HydrophobicContact CD1-CB 3.58Å; L66-T98 HydrophobicContact CD1-CG2 3.73Å
67	K	89.3	Confident	88.6	Confident	84 Å²	84	41 Å²	41	37%	0.365	22%	0.218	S	C	.	.	H	α-helix	trans	-71.2	-33.9	172.1	-76.1	162.8	-168.1	167.5	0	112.1	A63 T64 I65 R84 D87	A63-K67 WeakPolarHBondContact O-CB 3.17Å; A63-K67 WeakPolarHBondContact O-CD 3.28Å; A63-K67 WeakPolarHBondContact O-CG 3.38Å; A63-K67 PolarHBondContact O-N 3.47Å; T64-K67 PolarHBondContact O-N 2.85Å; I65-K67 VanDerWaalsContact C-N 3.29Å; I65-K67 PolarHBondContact O-N 3.48Å; K67-R84 HydrophobicContact CG-CG 4.2Å; K67-D87 IonicContact NZ-OD2 3.92Å; K67-D87 PolarHBondContact NZ-OD2 3.31Å
68	L	89.4	Confident	88.8	Confident	83 Å²	83	41.8 Å²	41.8	44%	0.435	22%	0.222	S	C	.	.	H	α-helix	trans	-84.9	-22.5	-178.3	-66.4	173.8	0	0	0	113	M49 T57 T64 I65	M49-L68 HydrophobicContact CB-CD1 4.24Å; M49-L68 HydrophobicContact CE-CB 4.47Å; M49-L68 HydrophobicContact CG-CD1 4.46Å; T57-L68 HydrophobicContact CG2-CD1 3.95Å; T64-L68 HydrophobicContact CG2-CD1 4.23Å; T64-L68 WeakPolarHBondContact O-CG 3.47Å; T64-L68 PolarHBondContact O-N 3.34Å; T64-L68 VanDerWaalsContact O-N 3.15Å; I65-L68 PolarHBondContact O-N 3.49Å; I65-L68 VanDerWaalsContact O-N 3.15Å
69	L	88.9	Confident	88.8	Confident	52 Å²	52	39.6 Å²	39.6	27%	0.272	21%	0.211	S	C	.	.	S	Bend	trans	-71.9	133.6	174.5	-74.2	168.2	0	0	0	111.6	M49 I65 L66 V71	M49-L69 HydrophobicContact CE-CD2 3.53Å; M49-L69 HydrophobicContact CE-CG 3.96Å; M49-L69 HydrophobicContact SD-CD2 4.5Å; I65-L69 HydrophobicContact CG2-CD1 3.94Å; I65-L69 HydrophobicContact CG2-CG 4.44Å; I65-L69 WeakPolarHBondContact O-CG 3.37Å; I65-L69 PolarHBondContact O-N 2.94Å; L66-L69 HydrophobicContact CD2-CD1 4.19Å; L69-V71 HydrophobicContact CB-CG2 4.05Å; L69-V71 PolarHBondContact O-N 3.49Å; L69-V71 VanDerWaalsContact O-N 3.08Å
70	D	88.3	Confident	89.1	Confident	150 Å²	150	39.8 Å²	39.8	80%	0.802	21%	0.212	S	C	*	.			trans	-81.3	85.8	174.1	-171	21.5	0	0	0	110.8	V72	D70-V72 PolarHBondContact O-N 3.11Å
71	V	88.9	Confident	89.4	Confident	27 Å²	27	43.1 Å²	43.1	16%	0.164	23%	0.23	C	C	.	.			trans	-88.8	103.5	-176.7	-176.4	0	0	0	0	110.9	I32 L69 A76 V80	I32-V71 HydrophobicContact CD1-CG1 4.31Å; I32-V71 HydrophobicContact CD1-CG2 3.87Å; L69-V71 HydrophobicContact CB-CG2 4.05Å; L69-V71 PolarHBondContact O-N 3.49Å; L69-V71 VanDerWaalsContact O-N 3.08Å; V71-A76 HydrophobicContact CG1-CB 3.42Å; V71-A76 VanDerWaalsContact CG1-CB 3.42Å; V71-V80 HydrophobicContact CB-CG2 4.24Å; V71-V80 HydrophobicContact CG1-CG2 4.41Å; V71-V80 HydrophobicContact CG2-CG2 3.84Å
72	V	87.6	Confident	89.7	Confident	113 Å²	113	43.8 Å²	43.8	69%	0.685	23%	0.233	S	C	*	.			trans	-84	-32	-179.3	-177.4	0	0	0	0	112.8	D70	D70-V72 PolarHBondContact O-N 3.11Å
73	H	89.1	Confident	89.9	Confident	55 Å²	55	43.8 Å²	43.8	26%	0.255	23%	0.233	S	C	.	.	S	Bend	trans	-74.7	127.2	-173.3	-168.6	-71.4	0	0	0	111.6	N25 A28 A75 A76 K77	N25-H73 PolarHBondContact OD1-CE1 3.5Å; A28-H73 HydrophobicContact CB-CB 4.32Å; H73-A75 PolarHBondContact ND1-N 3.23Å; H73-A75 PolarHBondContact O-N 2.79Å; H73-A76 HydrophobicContact CB-CB 3.97Å; H73-A76 WeakPolarHBondContact O-CB 3.46Å; H73-A76 PolarHBondContact O-N 3.49Å; H73-A76 VanDerWaalsContact O-N 3.15Å; H73-K77 PolarHBondContact O-N 3.45Å
74	P	88.9	Confident	90	Very high	58 Å²	58	48.9 Å²	48.9	38%	0.377	25%	0.252	S	S	.	.	H	α-helix	trans	-57.5	-46.6	-175.3	-27.6	35.3	0	0	0	114.4	A76 K77 T78 T519	P74-A76 VanDerWaalsContact C-N 3.34Å; P74-A76 PolarHBondContact O-N 3.31Å; P74-K77 WeakPolarHBondContact O-CB 3.33Å; P74-K77 PolarHBondContact O-N 2.89Å; P74-K77 VanDerWaalsContact O-N 3.16Å; P74-T78 PolarHBondContact O-N 3.43Å; P74-T519 HydrophobicContact CG-CG2 4.39Å
75	A	90.1	Very high	90.1	Very high	7 Å²	7	51 Å²	51	6%	0.058	27%	0.268	C	S	.	.	H	α-helix	trans	-60.8	-42	177.6	0	0	0	0	0	112.3	N25 H73 K77 T78 I513	N25-A75 HydrophobicContact CB-CB 3.76Å; H73-A75 PolarHBondContact ND1-N 3.23Å; H73-A75 PolarHBondContact O-N 2.79Å; A75-K77 VanDerWaalsContact C-N 3.3Å; A75-K77 PolarHBondContact O-N 3.33Å; A75-T78 WeakPolarHBondContact O-CB 3.46Å; A75-T78 PolarHBondContact O-N 2.92Å; A75-T78 PolarHBondContact O-OG1 3.1Å; A75-I513 HydrophobicContact CB-CG2 4.36Å
76	A	90.8	Very high	90.1	Very high	3 Å²	3	51.1 Å²	51.1	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-36.1	176.4	0	0	0	0	0	112.1	I32 V71 H73 P74 T78 L79 V80	I32-A76 HydrophobicContact CD1-CB 4.39Å; I32-A76 HydrophobicContact CG1-CB 3.65Å; V71-A76 HydrophobicContact CG1-CB 3.42Å; V71-A76 VanDerWaalsContact CG1-CB 3.42Å; H73-A76 HydrophobicContact CB-CB 3.97Å; H73-A76 WeakPolarHBondContact O-CB 3.46Å; H73-A76 PolarHBondContact O-N 3.49Å; H73-A76 VanDerWaalsContact O-N 3.15Å; P74-A76 VanDerWaalsContact C-N 3.34Å; P74-A76 PolarHBondContact O-N 3.31Å; A76-T78 VanDerWaalsContact C-N 3.26Å; A76-T78 PolarHBondContact O-N 2.92Å; A76-L79 WeakPolarHBondContact O-CB 3.2Å; A76-L79 PolarHBondContact O-N 2.91Å; A76-L79 VanDerWaalsContact O-N 3.1Å; A76-V80 PolarHBondContact O-N 3.22Å
77	K	91.4	Very high	89.9	Confident	119 Å²	119	52.1 Å²	52.1	52%	0.517	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-33.8	176.2	-167.7	170.9	-177.3	173.1	0	112.5	H73 P74 A75 L79 V80 D81	H73-K77 PolarHBondContact O-N 3.45Å; P74-K77 WeakPolarHBondContact O-CB 3.33Å; P74-K77 PolarHBondContact O-N 2.89Å; P74-K77 VanDerWaalsContact O-N 3.16Å; A75-K77 VanDerWaalsContact C-N 3.3Å; A75-K77 PolarHBondContact O-N 3.33Å; K77-L79 VanDerWaalsContact C-N 3.27Å; K77-L79 PolarHBondContact O-N 3.4Å; K77-V80 WeakPolarHBondContact O-CB 3.21Å; K77-V80 PolarHBondContact O-N 2.97Å; K77-D81 PolarHBondContact O-N 3.33Å
78	T	90.9	Very high	89.8	Confident	30 Å²	30	51.4 Å²	51.4	18%	0.184	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-34.8	174.6	70.9	0	0	0	0	112.6	P74 A75 A76 V80 D81 I82 L512 I513	P74-T78 PolarHBondContact O-N 3.43Å; A75-T78 WeakPolarHBondContact O-CB 3.46Å; A75-T78 PolarHBondContact O-N 2.92Å; A75-T78 PolarHBondContact O-OG1 3.1Å; A76-T78 VanDerWaalsContact C-N 3.26Å; A76-T78 PolarHBondContact O-N 2.92Å; T78-V80 VanDerWaalsContact C-N 3.35Å; T78-D81 PolarHBondContact O-N 3.38Å; T78-I82 VanDerWaalsContact O-CG1 3.26Å; T78-I82 WeakPolarHBondContact O-CG1 3.09Å; T78-I82 PolarHBondContact O-N 3.13Å; T78-I82 VanDerWaalsContact O-N 3.09Å; T78-L512 HydrophobicContact CG2-CD2 4.16Å; T78-I513 WeakPolarHBondContact OG1-CD1 3.49Å
79	L	89.8	Confident	89.4	Confident	1 Å²	1	52 Å²	52	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-66.8	-37.3	173.5	-66.8	-176	0	0	0	112	C29 I32 A76 K77 I82 A83 A101 A509 I513	C29-L79 HydrophobicContact CB-CD1 3.69Å; C29-L79 HydrophobicContact CB-CG 4.45Å; I32-L79 HydrophobicContact CB-CD1 4.4Å; I32-L79 HydrophobicContact CG2-CD1 4.32Å; A76-L79 WeakPolarHBondContact O-CB 3.2Å; A76-L79 PolarHBondContact O-N 2.91Å; A76-L79 VanDerWaalsContact O-N 3.1Å; K77-L79 VanDerWaalsContact C-N 3.27Å; K77-L79 PolarHBondContact O-N 3.4Å; L79-I82 PolarHBondContact O-N 3.2Å; L79-A83 PolarHBondContact O-N 2.83Å; L79-A101 HydrophobicContact CD2-CB 3.59Å; L79-A509 HydrophobicContact CD2-CB 4.4Å; L79-I513 HydrophobicContact CD2-CD1 4.41Å
80	V	91.9	Very high	89	Confident	6 Å²	6	49.7 Å²	49.7	4%	0.036	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-44.9	175.2	-178.7	0	0	0	0	110.6	L66 V71 A76 K77 T78 I82 A83 R84	L66-V80 HydrophobicContact CB-CG1 4.15Å; L66-V80 HydrophobicContact CB-CG2 4.2Å; L66-V80 HydrophobicContact CD2-CG2 4.39Å; L66-V80 WeakPolarHBondContact O-CG1 3.08Å; V71-V80 HydrophobicContact CB-CG2 4.24Å; V71-V80 HydrophobicContact CG1-CG2 4.41Å; V71-V80 HydrophobicContact CG2-CG2 3.84Å; A76-V80 PolarHBondContact O-N 3.22Å; K77-V80 WeakPolarHBondContact O-CB 3.21Å; K77-V80 PolarHBondContact O-N 2.97Å; T78-V80 VanDerWaalsContact C-N 3.35Å; V80-I82 VanDerWaalsContact C-N 3.27Å; V80-I82 PolarHBondContact O-N 3.34Å; V80-A83 PolarHBondContact O-N 3.47Å; V80-R84 VanDerWaalsContact O-CG 3.29Å; V80-R84 WeakPolarHBondContact O-CG 3.42Å; V80-R84 PolarHBondContact O-N 2.88Å
81	D	91.6	Very high	88.5	Confident	77 Å²	77	42.5 Å²	42.5	41%	0.412	23%	0.234	S	C	.	.	H	α-helix	trans	-64.6	-33.8	179.6	-66.4	-29.7	0	0	0	111.9	K77 T78 R84 S85	K77-D81 PolarHBondContact O-N 3.33Å; T78-D81 PolarHBondContact O-N 3.38Å; D81-R84 WeakPolarHBondContact O-CB 3.17Å; D81-R84 PolarHBondContact O-N 2.94Å; D81-S85 PolarHBondContact O-N 3.35Å
82	I	91.8	Very high	88.2	Confident	28 Å²	28	42.9 Å²	42.9	14%	0.144	24%	0.235	C	C	.	.	H	α-helix	trans	-75	-39.5	177.8	-69.6	171.6	0	0	0	111.9	T78 L79 V80 R84 S85 Q86 V97 A505 A509	T78-I82 VanDerWaalsContact O-CG1 3.26Å; T78-I82 WeakPolarHBondContact O-CG1 3.09Å; T78-I82 PolarHBondContact O-N 3.13Å; T78-I82 VanDerWaalsContact O-N 3.09Å; L79-I82 PolarHBondContact O-N 3.2Å; V80-I82 VanDerWaalsContact C-N 3.27Å; V80-I82 PolarHBondContact O-N 3.34Å; I82-R84 VanDerWaalsContact C-N 3.27Å; I82-R84 PolarHBondContact O-N 2.78Å; I82-S85 PolarHBondContact O-N 3.36Å; I82-Q86 PolarHBondContact O-N 3.39Å; I82-V97 HydrophobicContact CG2-CG1 4.36Å; I82-V97 HydrophobicContact CG2-CG2 3.6Å; I82-A505 HydrophobicContact CG2-CB 4.05Å; I82-A509 VanDerWaalsContact CD1-CA 3.48Å; I82-A509 HydrophobicContact CD1-CB 3.07Å; I82-A509 HydrophobicContact CG1-CB 4.49Å
83	A	91.7	Very high	88.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59	-41.4	170.6	0	0	0	0	0	111.4	A63 L66 L79 V80 Q86 D87 T98	A63-A83 HydrophobicContact CB-CB 4.38Å; L66-A83 HydrophobicContact CD1-CB 3.58Å; L79-A83 PolarHBondContact O-N 2.83Å; V80-A83 PolarHBondContact O-N 3.47Å; A83-Q86 PolarHBondContact O-N 3.27Å; A83-D87 WeakPolarHBondContact O-CB 3.45Å; A83-D87 PolarHBondContact O-N 3.13Å; A83-T98 HydrophobicContact CB-CG2 3.73Å
84	R	90.1	Very high	88.3	Confident	107 Å²	107	35.4 Å²	35.4	40%	0.404	19%	0.194	S	C	.	.	H	α-helix	trans	-64.5	-39.7	175.3	-71.5	172.6	178.3	-167.3	-2.1	112.7	K67 V80 D81 I82 A88	K67-R84 HydrophobicContact CG-CG 4.2Å; V80-R84 VanDerWaalsContact O-CG 3.29Å; V80-R84 WeakPolarHBondContact O-CG 3.42Å; V80-R84 PolarHBondContact O-N 2.88Å; D81-R84 WeakPolarHBondContact O-CB 3.17Å; D81-R84 PolarHBondContact O-N 2.94Å; I82-R84 VanDerWaalsContact C-N 3.27Å; I82-R84 PolarHBondContact O-N 2.78Å; R84-A88 WeakPolarHBondContact O-CB 3.4Å; R84-A88 PolarHBondContact O-N 3.27Å
85	S	90.9	Very high	88.4	Confident	67 Å²	67	33 Å²	33	47%	0.469	18%	0.179	S	C	.	.	H	α-helix	trans	-64.3	-43.5	176.3	-172.9	0	0	0	0	111.4	D81 I82 A88 E89	D81-S85 PolarHBondContact O-N 3.35Å; I82-S85 PolarHBondContact O-N 3.36Å; S85-A88 PolarHBondContact O-N 3.24Å; S85-E89 WeakPolarHBondContact O-CB 3.33Å; S85-E89 PolarHBondContact O-N 3.46Å
86	Q	89.8	Confident	88.6	Confident	5 Å²	5	33.7 Å²	33.7	2%	0.023	18%	0.183	C	C	.	.	H	α-helix	trans	-63.1	-43.7	177	-176.2	66	21.1	0	0	112.1	I82 A83 E89 V90 G91 D92 T94 V97	I82-Q86 PolarHBondContact O-N 3.39Å; A83-Q86 PolarHBondContact O-N 3.27Å; Q86-E89 PolarHBondContact O-N 3.26Å; Q86-V90 PolarHBondContact O-N 3.43Å; Q86-G91 PolarHBondContact O-N 2.99Å; Q86-G91 VanDerWaalsContact O-N 3.13Å; Q86-D92 PolarHBondContact NE2-O 2.99Å; Q86-T94 HydrophobicContact CG-CG2 4.41Å; Q86-V97 HydrophobicContact CB-CG1 3.92Å; Q86-V97 HydrophobicContact CG-CB 4.49Å; Q86-V97 HydrophobicContact CG-CG1 4.03Å
87	D	87.6	Confident	88.8	Confident	23 Å²	23	33.5 Å²	33.5	12%	0.123	18%	0.182	C	C	.	.	H	α-helix	trans	-59.1	-45.2	174	178.1	41	0	0	0	111.6	A63 K67 A83 G91 T94	A63-D87 HydrophobicContact CB-CB 3.71Å; K67-D87 IonicContact NZ-OD2 3.92Å; K67-D87 PolarHBondContact NZ-OD2 3.31Å; A83-D87 WeakPolarHBondContact O-CB 3.45Å; A83-D87 PolarHBondContact O-N 3.13Å; D87-G91 VanDerWaalsContact O-CA 3.24Å; D87-G91 WeakPolarHBondContact O-CA 3.3Å; D87-G91 PolarHBondContact O-N 3.36Å; D87-T94 HydrophobicContact CB-CG2 3.78Å
88	A	85.8	Confident	88.9	Confident	68 Å²	68	27.9 Å²	27.9	56%	0.562	16%	0.157	S	C	*	.	H	α-helix	trans	-69.6	-37.3	180	0	0	0	0	0	113.8	R84 S85	R84-A88 WeakPolarHBondContact O-CB 3.4Å; R84-A88 PolarHBondContact O-N 3.27Å; S85-A88 PolarHBondContact O-N 3.24Å
89	E	81.9	Confident	89.2	Confident	97 Å²	97	26.4 Å²	26.4	45%	0.453	15%	0.148	S	C	.	.	H	α-helix	trans	-83.6	-48.8	-178.4	-77.7	-61.9	155.9	0	0	112.5	S85 Q86 R398	S85-E89 WeakPolarHBondContact O-CB 3.33Å; S85-E89 PolarHBondContact O-N 3.46Å; Q86-E89 PolarHBondContact O-N 3.26Å; E89-R398 PolarHBondContact O-NE 3.15Å; E89-R398 PolarHBondContact O-NH2 3.35Å; E89-R398 IonicContact OE2-CZ 3.25Å; E89-R398 IonicContact OE2-NH2 2.71Å; E89-R398 PolarHBondContact OE2-NH2 2.55Å
90	V	80	Confident	89.5	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.012	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-26.5	-168.6	-174.1	0	0	0	0	112.3	Q86 D92 M394 V498 N501	Q86-V90 PolarHBondContact O-N 3.43Å; V90-D92 PolarHBondContact O-N 3.44Å; V90-M394 WeakPolarHBondContact O-CB 3.42Å; V90-V498 HydrophobicContact CG1-CB 3.81Å; V90-V498 HydrophobicContact CG1-CG1 3.87Å; V90-V498 HydrophobicContact CG1-CG2 3.23Å; V90-N501 HydrophobicContact CG2-CB 4.06Å; V90-N501 VanDerWaalsContact CG2-ND2 3.28Å; V90-N501 WeakPolarHBondContact CG2-ND2 3.33Å
91	G	78.7	Confident	89.7	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	85.6	-60.5	-172.5	0	0	0	0	0	111.5	Q86 D87 T94 M394	Q86-G91 PolarHBondContact O-N 2.99Å; Q86-G91 VanDerWaalsContact O-N 3.13Å; D87-G91 VanDerWaalsContact O-CA 3.24Å; D87-G91 WeakPolarHBondContact O-CA 3.3Å; D87-G91 PolarHBondContact O-N 3.36Å; G91-T94 WeakPolarHBondContact O-CG2 3.28Å; G91-M394 WeakPolarHBondContact CA-SD 3.11Å
92	D	82.6	Confident	89.9	Confident	35 Å²	35	22.7 Å²	22.7	19%	0.187	13%	0.129	C	C	.	.	S	Bend	trans	-94.5	166.3	-176.2	-163.7	19.9	0	0	0	114.2	Q86 V90 I395	Q86-D92 PolarHBondContact NE2-O 2.99Å; V90-D92 PolarHBondContact O-N 3.44Å; D92-I395 HydrophobicContact CB-CD1 3.4Å; D92-I395 HydrophobicContact CB-CG1 4.01Å; D92-I395 WeakPolarHBondContact OD2-CD1 3.41Å
93	G	86.4	Confident	90.1	Very high	7 Å²	7	21.6 Å²	21.6	7%	0.072	12%	0.123	C	C	.	.			trans	83	15.6	178.9	0	0	0	0	0	114	T95 S96 V97	G93-T95 VanDerWaalsContact C-N 3.33Å; G93-T95 PolarHBondContact O-N 2.93Å; G93-S96 PolarHBondContact O-N 2.93Å; G93-S96 VanDerWaalsContact O-N 3.15Å; G93-V97 PolarHBondContact O-N 3.28Å
94	T	90.5	Very high	90.4	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-60.6	-40.1	178.8	59.1	0	0	0	0	111.9	D61 G62 A63 Q86 D87 G91 V97 T98	D61-T94 PolarHBondContact OD1-OG1 3.29Å; G62-T94 PolarHBondContact N-OG1 2.93Å; A63-T94 HydrophobicContact CB-CG2 3.67Å; A63-T94 PolarHBondContact N-OG1 2.99Å; Q86-T94 HydrophobicContact CG-CG2 4.41Å; D87-T94 HydrophobicContact CB-CG2 3.78Å; G91-T94 WeakPolarHBondContact O-CG2 3.28Å; T94-V97 VanDerWaalsContact O-CG1 3.25Å; T94-V97 WeakPolarHBondContact O-CG1 3.5Å; T94-T98 WeakPolarHBondContact O-CG2 3.15Å; T94-T98 PolarHBondContact O-OG1 3Å; T94-T98 VanDerWaalsContact O-OG1 3.08Å
95	T	92.2	Very high	90.6	Very high	9 Å²	9	16.5 Å²	16.5	6%	0.055	10%	0.104	C	C	.	.	H	α-helix	trans	-71.7	-38	173.3	-54.1	0	0	0	0	111.7	V36 T39 L40 G93 T98 L99	V36-T95 HydrophobicContact CB-CG2 4.38Å; V36-T95 HydrophobicContact CG2-CG2 4.42Å; V36-T95 VanDerWaalsContact O-CG2 3.3Å; V36-T95 WeakPolarHBondContact O-CG2 3.28Å; T39-T95 WeakPolarHBondContact OG1-CG2 3.31Å; T39-T95 PolarHBondContact OG1-OG1 2.97Å; L40-T95 HydrophobicContact CB-CG2 3.97Å; L40-T95 HydrophobicContact CD1-CG2 4.38Å; G93-T95 VanDerWaalsContact C-N 3.33Å; G93-T95 PolarHBondContact O-N 2.93Å; T95-T98 PolarHBondContact O-OG1 2.65Å; T95-L99 VanDerWaalsContact O-CB 3.3Å; T95-L99 WeakPolarHBondContact O-CB 3.33Å; T95-L99 PolarHBondContact O-N 3.46Å
96	S	93.5	Very high	90.9	Very high	20 Å²	20	17.6 Å²	17.6	14%	0.14	10%	0.1	C	C	.	.	H	α-helix	trans	-65.5	-44.9	-179.4	-51.7	0	0	0	0	112.3	L40 G93 T98 L99 L100	L40-S96 VanDerWaalsContact CD1-OG 3.31Å; L40-S96 WeakPolarHBondContact CD1-OG 3.47Å; G93-S96 PolarHBondContact O-N 2.93Å; G93-S96 VanDerWaalsContact O-N 3.15Å; S96-T98 VanDerWaalsContact C-N 3.33Å; S96-T98 PolarHBondContact O-N 3.2Å; S96-L99 PolarHBondContact O-N 3.13Å; S96-L100 WeakPolarHBondContact O-CB 3.41Å; S96-L100 VanDerWaalsContact O-CG 3.3Å; S96-L100 WeakPolarHBondContact O-CG 3.49Å; S96-L100 PolarHBondContact O-N 3.32Å
97	V	95.1	Very high	91.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.1	-40.2	-179.9	67.2	0	0	0	0	111.7	I82 Q86 G93 T94 A101 A502 A505 A506	I82-V97 HydrophobicContact CG2-CG1 4.36Å; I82-V97 HydrophobicContact CG2-CG2 3.6Å; Q86-V97 HydrophobicContact CB-CG1 3.92Å; Q86-V97 HydrophobicContact CG-CB 4.49Å; Q86-V97 HydrophobicContact CG-CG1 4.03Å; G93-V97 PolarHBondContact O-N 3.28Å; T94-V97 VanDerWaalsContact O-CG1 3.25Å; T94-V97 WeakPolarHBondContact O-CG1 3.5Å; V97-A101 VanDerWaalsContact O-CB 3.31Å; V97-A101 WeakPolarHBondContact O-CB 3.46Å; V97-A101 PolarHBondContact O-N 3.19Å; V97-A502 HydrophobicContact CB-CB 4.49Å; V97-A505 HydrophobicContact CG2-CB 3.89Å; V97-A506 HydrophobicContact CG2-CB 3.97Å
98	T	94.9	Very high	91.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-72	-39.4	179.8	50.6	0	0	0	0	112.2	L66 A83 T94 T95 S96 A102	L66-T98 HydrophobicContact CD1-CG2 3.73Å; A83-T98 HydrophobicContact CB-CG2 3.73Å; T94-T98 WeakPolarHBondContact O-CG2 3.15Å; T94-T98 PolarHBondContact O-OG1 3Å; T94-T98 VanDerWaalsContact O-OG1 3.08Å; T95-T98 PolarHBondContact O-OG1 2.65Å; S96-T98 VanDerWaalsContact C-N 3.33Å; S96-T98 PolarHBondContact O-N 3.2Å; T98-A102 WeakPolarHBondContact O-CB 3.48Å; T98-A102 PolarHBondContact O-N 3.3Å; T98-A102 VanDerWaalsContact O-N 3.08Å
99	L	95.8	Very high	91.9	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-65.5	-44.3	175	-173.9	62.7	0	0	0	112.1	S33 R37 L40 T95 S96 A102 E103 V444 I445 Q448	S33-L99 VanDerWaalsContact OG-CD1 3.24Å; S33-L99 WeakPolarHBondContact OG-CD1 2.99Å; R37-L99 HydrophobicContact CB-CD1 4.23Å; R37-L99 HydrophobicContact CG-CD1 4.19Å; L40-L99 HydrophobicContact CD2-CD2 3.86Å; T95-L99 VanDerWaalsContact O-CB 3.3Å; T95-L99 WeakPolarHBondContact O-CB 3.33Å; T95-L99 PolarHBondContact O-N 3.46Å; S96-L99 PolarHBondContact O-N 3.13Å; L99-A102 PolarHBondContact O-N 3.22Å; L99-E103 WeakPolarHBondContact O-CB 3.5Å; L99-E103 PolarHBondContact O-N 3.25Å; L99-V444 HydrophobicContact CD1-CG2 4.15Å; L99-V444 HydrophobicContact CD2-CG1 4.46Å; L99-V444 HydrophobicContact CD2-CG2 4.17Å; L99-V444 HydrophobicContact CG-CG1 4.18Å; L99-V444 HydrophobicContact CG-CG2 4.03Å; L99-I445 HydrophobicContact CD2-CD1 4.13Å; L99-Q448 HydrophobicContact CD2-CB 3.91Å; L99-Q448 HydrophobicContact CD2-CG 3.96Å
100	L	96.4	Very high	92.5	Very high	3 Å²	3	15.1 Å²	15.1	2%	0.016	8%	0.081	C	C	.	.	H	α-helix	trans	-62.7	-46.4	176.3	-76.4	168.7	0	0	0	111.7	S96 A102 E103 F104 L442 V444 I445 L503 A506	S96-L100 WeakPolarHBondContact O-CB 3.41Å; S96-L100 VanDerWaalsContact O-CG 3.3Å; S96-L100 WeakPolarHBondContact O-CG 3.49Å; S96-L100 PolarHBondContact O-N 3.32Å; L100-A102 VanDerWaalsContact C-N 3.34Å; L100-A102 PolarHBondContact O-N 3.32Å; L100-E103 PolarHBondContact O-N 3.18Å; L100-F104 HydrophobicContact CB-CE2 4.22Å; L100-F104 HydrophobicContact CD2-CZ 4.48Å; L100-F104 WeakPolarHBondContact O-CB 3.49Å; L100-F104 WeakPolarHBondContact O-CD2 3.48Å; L100-F104 WeakPolarHBondContact O-CG 3.32Å; L100-F104 PolarHBondContact O-N 3.27Å; L100-L442 HydrophobicContact CD2-CD2 4.15Å; L100-V444 HydrophobicContact CD2-CG1 4Å; L100-I445 HydrophobicContact CD1-CD1 4.37Å; L100-I445 HydrophobicContact CD1-CG1 4.33Å; L100-I445 HydrophobicContact CD2-CD1 4.24Å; L100-I445 HydrophobicContact CD2-CG1 3.89Å; L100-I445 HydrophobicContact CG-CD1 3.93Å; L100-I445 HydrophobicContact CG-CG1 4.06Å; L100-L503 HydrophobicContact CD1-CD2 4.18Å; L100-A506 HydrophobicContact CB-CB 3.83Å
101	A	95.9	Very high	93.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-58.5	-45.5	178.3	0	0	0	0	0	112	L79 V97 L105 A506 A509	L79-A101 HydrophobicContact CD2-CB 3.59Å; V97-A101 VanDerWaalsContact O-CB 3.31Å; V97-A101 WeakPolarHBondContact O-CB 3.46Å; V97-A101 PolarHBondContact O-N 3.19Å; A101-L105 WeakPolarHBondContact O-CG 3.31Å; A101-L105 PolarHBondContact O-N 3.37Å; A101-A506 HydrophobicContact CB-CB 4.07Å; A101-A509 HydrophobicContact CB-CB 3.81Å
102	A	96	Very high	93.8	Very high	3 Å²	3	17.5 Å²	17.5	3%	0.025	9%	0.09	C	C	.	.	H	α-helix	trans	-69.6	-37.7	178.2	0	0	0	0	0	112.7	T98 L99 L100 L105 K106	T98-A102 WeakPolarHBondContact O-CB 3.48Å; T98-A102 PolarHBondContact O-N 3.3Å; T98-A102 VanDerWaalsContact O-N 3.08Å; L99-A102 PolarHBondContact O-N 3.22Å; L100-A102 VanDerWaalsContact C-N 3.34Å; L100-A102 PolarHBondContact O-N 3.32Å; A102-L105 PolarHBondContact O-N 3.05Å; A102-K106 WeakPolarHBondContact O-CB 3.04Å; A102-K106 PolarHBondContact O-N 3.43Å
103	E	96.7	Very high	94.3	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.019	10%	0.104	C	C	.	.	H	α-helix	trans	-69.3	-36.8	177.1	-169.3	71.4	-153.4	0	0	111.7	R37 L99 L100 L105 K106 Q107 A441 V444	R37-E103 IonicContact NH2-OE2 3.98Å; L99-E103 WeakPolarHBondContact O-CB 3.5Å; L99-E103 PolarHBondContact O-N 3.25Å; L100-E103 PolarHBondContact O-N 3.18Å; E103-L105 VanDerWaalsContact C-N 3.33Å; E103-L105 PolarHBondContact O-N 3.45Å; E103-K106 WeakPolarHBondContact O-CB 3.14Å; E103-K106 PolarHBondContact O-N 3.43Å; E103-K106 VanDerWaalsContact O-N 3.15Å; E103-Q107 HydrophobicContact CG-CG 4.44Å; E103-Q107 WeakPolarHBondContact O-CG 3.34Å; E103-Q107 PolarHBondContact O-N 2.76Å; E103-Q107 PolarHBondContact OE1-NE2 3.35Å; E103-A441 HydrophobicContact CG-CB 4.01Å; E103-V444 HydrophobicContact CB-CB 4.15Å; E103-V444 HydrophobicContact CB-CG1 3.91Å; E103-V444 HydrophobicContact CB-CG2 4.21Å; E103-V444 HydrophobicContact CG-CB 3.78Å; E103-V444 HydrophobicContact CG-CG1 4.03Å; E103-V444 HydrophobicContact CG-CG2 4Å
104	F	96.8	Very high	94.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-55	-49.8	170.8	-73.5	-31.7	0	0	0	111.2	L100 K106 Q107 L108 F125 Y438 A441 L442 L503 A506 A510	L100-F104 HydrophobicContact CB-CE2 4.22Å; L100-F104 HydrophobicContact CD2-CZ 4.48Å; L100-F104 WeakPolarHBondContact O-CB 3.49Å; L100-F104 WeakPolarHBondContact O-CD2 3.48Å; L100-F104 WeakPolarHBondContact O-CG 3.32Å; L100-F104 PolarHBondContact O-N 3.27Å; F104-K106 VanDerWaalsContact C-N 3.32Å; F104-K106 PolarHBondContact O-N 2.99Å; F104-Q107 PolarHBondContact O-N 3.4Å; F104-L108 WeakPolarHBondContact O-CB 3.47Å; F104-L108 WeakPolarHBondContact O-CG 3.18Å; F104-L108 PolarHBondContact O-N 3.38Å; F104-L108 VanDerWaalsContact O-N 3.12Å; F104-F125 HydrophobicContact CB-CE1 3.73Å; F104-F125 AromaticContact CD1-CE1 3.77Å; F104-F125 HydrophobicContact CD1-CE1 3.77Å; F104-F125 HydrophobicContact CD1-CZ 4.45Å; F104-F125 AromaticContact CG-CE1 3.8Å; F104-F125 HydrophobicContact CG-CE1 3.8Å; F104-Y438 HydrophobicContact CD1-CD2 4.19Å; F104-Y438 HydrophobicContact CD1-CE2 4.24Å; F104-Y438 HydrophobicContact CE1-CD1 4.08Å; F104-Y438 AromaticContact CE1-CD2 3.86Å; F104-Y438 HydrophobicContact CE1-CD2 3.86Å; F104-Y438 AromaticContact CE1-CE1 3.94Å; F104-Y438 HydrophobicContact CE1-CE1 3.94Å; F104-Y438 AromaticContact CE1-CE2 3.68Å; F104-Y438 HydrophobicContact CE1-CE2 3.68Å; F104-Y438 HydrophobicContact CE1-CG 4.05Å; F104-Y438 AromaticContact CE1-CZ 3.72Å; F104-Y438 HydrophobicContact CE2-CE2 4.13Å; F104-Y438 HydrophobicContact CZ-CD2 4.29Å; F104-Y438 AromaticContact CZ-CE1 3.91Å; F104-Y438 HydrophobicContact CZ-CE1 3.91Å; F104-Y438 AromaticContact CZ-CE2 3.63Å; F104-Y438 HydrophobicContact CZ-CE2 3.63Å; F104-Y438 AromaticContact CZ-CZ 3.4Å; F104-Y438 VanDerWaalsContact CZ-CZ 3.4Å; F104-Y438 WeakPolarHBondContact CZ-OH 3.09Å; F104-A441 HydrophobicContact CD1-CB 3.4Å; F104-A441 VanDerWaalsContact CD1-CB 3.4Å; F104-A441 HydrophobicContact CE1-CB 3.71Å; F104-L442 HydrophobicContact CE1-CD2 4.23Å; F104-L442 HydrophobicContact CZ-CD2 4.06Å; F104-L503 HydrophobicContact CZ-CD2 4.4Å; F104-A506 HydrophobicContact CD2-CB 4.23Å; F104-A506 HydrophobicContact CE2-CB 3.87Å; F104-A510 HydrophobicContact CB-CB 3.99Å
105	L	95.8	Very high	94.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-38.5	176.1	-68.7	172.8	0	0	0	112.4	I26 C29 A101 A102 E103 L108 K109 A510 I513 L514	I26-L105 HydrophobicContact CG1-CB 4.15Å; I26-L105 HydrophobicContact CG1-CD2 4.21Å; I26-L105 HydrophobicContact CG2-CB 4.04Å; C29-L105 HydrophobicContact CB-CD1 3.91Å; A101-L105 WeakPolarHBondContact O-CG 3.31Å; A101-L105 PolarHBondContact O-N 3.37Å; A102-L105 PolarHBondContact O-N 3.05Å; E103-L105 VanDerWaalsContact C-N 3.33Å; E103-L105 PolarHBondContact O-N 3.45Å; L105-L108 PolarHBondContact O-N 2.96Å; L105-K109 PolarHBondContact O-N 2.96Å; L105-A510 HydrophobicContact CD2-CB 3.94Å; L105-A510 HydrophobicContact CG-CB 4.02Å; L105-I513 HydrophobicContact CD1-CB 4.24Å; L105-I513 HydrophobicContact CD1-CD1 3.64Å; L105-I513 HydrophobicContact CD1-CG2 4.03Å; L105-I513 HydrophobicContact CD2-CB 4.32Å; L105-I513 HydrophobicContact CD2-CG2 4.22Å; L105-L514 HydrophobicContact CD2-CD1 4.06Å; L105-L514 HydrophobicContact CD2-CD2 4.09Å; L105-L514 HydrophobicContact CD2-CG 3.72Å
106	K	96.3	Very high	94.5	Very high	91 Å²	91	30.9 Å²	30.9	40%	0.396	16%	0.163	S	C	.	.	H	α-helix	trans	-62.7	-45.7	176.5	-176.3	174.6	177.7	178.1	0	112.8	Q30 A102 E103 F104 L108 K109	Q30-K106 VanDerWaalsContact NE2-CB 3.28Å; A102-K106 WeakPolarHBondContact O-CB 3.04Å; A102-K106 PolarHBondContact O-N 3.43Å; E103-K106 WeakPolarHBondContact O-CB 3.14Å; E103-K106 PolarHBondContact O-N 3.43Å; E103-K106 VanDerWaalsContact O-N 3.15Å; F104-K106 VanDerWaalsContact C-N 3.32Å; F104-K106 PolarHBondContact O-N 2.99Å; K106-L108 PolarHBondContact O-N 2.88Å; K106-K109 PolarHBondContact O-N 3.49Å
107	Q	95.6	Very high	94.4	Very high	31 Å²	31	35.9 Å²	35.9	15%	0.145	18%	0.184	C	C	.	.	H	α-helix	trans	-69.2	-22	177.4	-64.5	-56.5	-46.5	0	0	112.2	E103 F104 Y111 A437 A441	E103-Q107 HydrophobicContact CG-CG 4.44Å; E103-Q107 WeakPolarHBondContact O-CG 3.34Å; E103-Q107 PolarHBondContact O-N 2.76Å; E103-Q107 PolarHBondContact OE1-NE2 3.35Å; F104-Q107 PolarHBondContact O-N 3.4Å; Q107-Y111 WeakPolarHBondContact O-CE2 3.29Å; Q107-A437 HydrophobicContact CB-CB 4.26Å; Q107-A441 HydrophobicContact CB-CB 4.5Å; Q107-A441 HydrophobicContact CG-CB 3.81Å
108	L	94.2	Very high	94.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-86.5	-24.3	179.1	-73.3	175.6	0	0	0	114.8	F104 L105 K106 P110 Y111 V112 I121 F125 L434 L514	F104-L108 WeakPolarHBondContact O-CB 3.47Å; F104-L108 WeakPolarHBondContact O-CG 3.18Å; F104-L108 PolarHBondContact O-N 3.38Å; F104-L108 VanDerWaalsContact O-N 3.12Å; L105-L108 PolarHBondContact O-N 2.96Å; K106-L108 PolarHBondContact O-N 2.88Å; L108-P110 VanDerWaalsContact C-CD 3.47Å; L108-Y111 HydrophobicContact CD2-CD2 4.22Å; L108-Y111 PolarHBondContact O-N 3.05Å; L108-Y111 VanDerWaalsContact O-N 3.08Å; L108-V112 PolarHBondContact O-N 2.94Å; L108-I121 HydrophobicContact CD1-CG2 3.47Å; L108-I121 VanDerWaalsContact CD1-CG2 3.47Å; L108-I121 HydrophobicContact CD2-CG2 3.33Å; L108-I121 HydrophobicContact CG-CG2 3.94Å; L108-F125 HydrophobicContact CD1-CD1 4.04Å; L108-F125 HydrophobicContact CD1-CD2 4.08Å; L108-F125 HydrophobicContact CD1-CE1 3.65Å; L108-F125 HydrophobicContact CD1-CE2 3.72Å; L108-F125 HydrophobicContact CD1-CG 4.26Å; L108-F125 HydrophobicContact CD1-CZ 3.47Å; L108-F125 VanDerWaalsContact CD1-CZ 3.47Å; L108-F125 HydrophobicContact CD2-CD2 4.14Å; L108-F125 HydrophobicContact CD2-CE2 3.39Å; L108-F125 HydrophobicContact CD2-CZ 3.7Å; L108-F125 HydrophobicContact CG-CE1 4.21Å; L108-F125 HydrophobicContact CG-CE2 3.79Å; L108-F125 HydrophobicContact CG-CZ 3.57Å; L108-L434 HydrophobicContact CD2-CD2 3.87Å; L108-L514 HydrophobicContact CD1-CD1 3.54Å
109	K	94.2	Very high	94.2	Very high	49 Å²	49	42.7 Å²	42.7	21%	0.213	22%	0.219	C	C	.	.	H	α-helix	trans	-48.8	-47.5	-178.5	-179.5	175.4	176.7	175.8	0	114.2	I26 N27 L105 K106 Y111 V112 E113	I26-K109 HydrophobicContact CD1-CB 4.38Å; I26-K109 HydrophobicContact CG2-CB 4.4Å; I26-K109 HydrophobicContact CG2-CD 4.39Å; N27-K109 PolarHBondContact OD1-NZ 3.05Å; L105-K109 PolarHBondContact O-N 2.96Å; K106-K109 PolarHBondContact O-N 3.49Å; K109-Y111 VanDerWaalsContact C-N 3.3Å; K109-Y111 PolarHBondContact O-N 2.92Å; K109-V112 PolarHBondContact O-N 3.08Å; K109-V112 VanDerWaalsContact O-N 3.17Å; K109-E113 WeakPolarHBondContact CE-OE1 3.36Å; K109-E113 PolarHBondContact O-N 2.9Å
110	P	95.2	Very high	94.1	Very high	61 Å²	61	45.4 Å²	45.4	40%	0.396	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-37.8	-179.8	-22.5	34.4	0	0	0	112.9	L108 V112 E113 E114	L108-P110 VanDerWaalsContact C-CD 3.47Å; P110-V112 VanDerWaalsContact C-N 3.35Å; P110-V112 PolarHBondContact O-N 2.77Å; P110-E113 PolarHBondContact O-N 3.44Å; P110-E114 WeakPolarHBondContact O-CB 3.47Å; P110-E114 VanDerWaalsContact O-CG 3.32Å; P110-E114 WeakPolarHBondContact O-CG 3.23Å; P110-E114 PolarHBondContact O-N 3.05Å
111	Y	93.6	Very high	94	Very high	50 Å²	50	45.2 Å²	45.2	20%	0.196	23%	0.234	C	C	.	.	H	α-helix	trans	-69.9	-33.4	179.5	-57.9	-69	0	0	0	112.4	Q107 L108 K109 G115 L116 L433 L434 A437	Q107-Y111 WeakPolarHBondContact O-CE2 3.29Å; L108-Y111 HydrophobicContact CD2-CD2 4.22Å; L108-Y111 PolarHBondContact O-N 3.05Å; L108-Y111 VanDerWaalsContact O-N 3.08Å; K109-Y111 VanDerWaalsContact C-N 3.3Å; K109-Y111 PolarHBondContact O-N 2.92Å; Y111-G115 PolarHBondContact O-N 3.33Å; Y111-L116 WeakPolarHBondContact O-CB 3.45Å; Y111-L116 PolarHBondContact O-N 3.41Å; Y111-L433 HydrophobicContact CE1-CB 4.06Å; Y111-L433 HydrophobicContact CE1-CD1 4.4Å; Y111-L434 HydrophobicContact CD2-CD2 4.09Å; Y111-L434 HydrophobicContact CE2-CD2 4.49Å; Y111-L434 HydrophobicContact CG-CD2 4.2Å; Y111-A437 HydrophobicContact CE2-CB 3.82Å
112	V	92.6	Very high	94	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-68.6	-41	174.8	177.8	0	0	0	0	110.4	I19 L22 L108 K109 P110 E114 G115 I121 L514	I19-V112 HydrophobicContact CG2-CG1 4.26Å; L22-V112 HydrophobicContact CB-CG1 4.26Å; L22-V112 HydrophobicContact CD1-CG1 3.98Å; L108-V112 PolarHBondContact O-N 2.94Å; K109-V112 PolarHBondContact O-N 3.08Å; K109-V112 VanDerWaalsContact O-N 3.17Å; P110-V112 VanDerWaalsContact C-N 3.35Å; P110-V112 PolarHBondContact O-N 2.77Å; V112-E114 VanDerWaalsContact C-N 3.34Å; V112-G115 PolarHBondContact O-N 3.08Å; V112-I121 HydrophobicContact CG2-CD1 3.72Å; V112-L514 HydrophobicContact CG2-CD2 4.26Å
113	E	92.5	Very high	93.9	Very high	103 Å²	103	53.9 Å²	53.9	48%	0.481	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-36.1	175.7	-72.8	171.6	172.8	0	0	112.3	I23 K109 P110 G115	I23-E113 HydrophobicContact CD1-CG 3.7Å; I23-E113 HydrophobicContact CG1-CG 4.38Å; K109-E113 WeakPolarHBondContact CE-OE1 3.36Å; K109-E113 PolarHBondContact O-N 2.9Å; P110-E113 PolarHBondContact O-N 3.44Å; E113-G115 PolarHBondContact O-N 2.81Å
114	E	92.4	Very high	93.8	Very high	156 Å²	156	53.7 Å²	53.7	73%	0.729	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-0.4	172.5	-72.1	174.3	-171.7	0	0	113.7	P110 V112	P110-E114 WeakPolarHBondContact O-CB 3.47Å; P110-E114 VanDerWaalsContact O-CG 3.32Å; P110-E114 WeakPolarHBondContact O-CG 3.23Å; P110-E114 PolarHBondContact O-N 3.05Å; V112-E114 VanDerWaalsContact C-N 3.34Å
115	G	88.6	Confident	93.7	Very high	52 Å²	52	53.8 Å²	53.8	54%	0.536	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	19.8	175.6	0	0	0	0	0	114.5	Y111 V112 E113 H117	Y111-G115 PolarHBondContact O-N 3.33Å; V112-G115 PolarHBondContact O-N 3.08Å; E113-G115 PolarHBondContact O-N 2.81Å; G115-H117 PolarHBondContact O-N 2.74Å
116	L	92.4	Very high	93.6	Very high	24 Å²	24	59.1 Å²	59.1	13%	0.126	29%	0.287	C	S	.	.			trans	-70.9	126.4	173.1	-172.6	63.5	0	0	0	110.8	Y111 T120 I121 K430 L434	Y111-L116 WeakPolarHBondContact O-CB 3.45Å; Y111-L116 PolarHBondContact O-N 3.41Å; L116-T120 HydrophobicContact CD1-CG2 4.39Å; L116-I121 HydrophobicContact CB-CD1 4.37Å; L116-I121 HydrophobicContact CD2-CD1 4.03Å; L116-I121 HydrophobicContact CD2-CG1 3.59Å; L116-I121 HydrophobicContact CG-CD1 4.25Å; L116-I121 HydrophobicContact CG-CG1 3.99Å; L116-K430 HydrophobicContact CD1-CD 3.66Å; L116-L434 HydrophobicContact CD2-CD1 4.09Å; L116-L434 HydrophobicContact CD2-CD2 3.83Å; L116-L434 HydrophobicContact CD2-CG 4.33Å
117	H	92.3	Very high	93.5	Very high	125 Å²	125	57.1 Å²	57.1	58%	0.579	28%	0.282	S	S	*	.			trans	-60.2	126.9	-178.9	-168.2	-71.3	0	0	0	112	G115 Q119 T120	G115-H117 PolarHBondContact O-N 2.74Å; H117-Q119 VanDerWaalsContact C-N 3.27Å; H117-Q119 VanDerWaalsContact ND1-CB 3.32Å; H117-Q119 WeakPolarHBondContact ND1-CB 3.47Å; H117-Q119 PolarHBondContact ND1-N 3.45Å; H117-Q119 VanDerWaalsContact ND1-N 3.12Å; H117-Q119 PolarHBondContact O-N 3.41Å; H117-Q119 VanDerWaalsContact O-N 3.13Å; H117-T120 WeakPolarHBondContact O-CB 3.12Å; H117-T120 PolarHBondContact O-N 3.36Å
118	P	92.9	Very high	93.5	Very high	30 Å²	30	55.7 Å²	55.7	20%	0.195	28%	0.275	C	S	.	.	H	α-helix	trans	-52.7	-39.5	-176.3	-29.3	34.9	0	0	0	114.3	L22 T120 I121 I122 L514	L22-P118 HydrophobicContact CD1-CG 3.67Å; P118-T120 VanDerWaalsContact C-N 3.26Å; P118-T120 PolarHBondContact O-N 2.9Å; P118-I121 WeakPolarHBondContact O-CA 3.08Å; P118-I121 VanDerWaalsContact O-CB 3.28Å; P118-I121 WeakPolarHBondContact O-CB 3.16Å; P118-I121 PolarHBondContact O-N 3.5Å; P118-I122 WeakPolarHBondContact O-CG1 3.44Å; P118-I122 PolarHBondContact O-N 2.92Å; P118-L514 WeakPolarHBondContact CB-O 3.26Å
119	Q	92.9	Very high	93.6	Very high	113 Å²	113	56 Å²	56	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-59.1	-32.4	177.1	-163.4	64.4	6.1	0	0	114.5	H117 I121 R123	H117-Q119 VanDerWaalsContact C-N 3.27Å; H117-Q119 VanDerWaalsContact ND1-CB 3.32Å; H117-Q119 WeakPolarHBondContact ND1-CB 3.47Å; H117-Q119 PolarHBondContact ND1-N 3.45Å; H117-Q119 VanDerWaalsContact ND1-N 3.12Å; H117-Q119 PolarHBondContact O-N 3.41Å; H117-Q119 VanDerWaalsContact O-N 3.13Å; Q119-I121 VanDerWaalsContact C-N 3.33Å; Q119-R123 PolarHBondContact O-N 3.33Å; Q119-R123 VanDerWaalsContact O-N 3.1Å
120	T	93.3	Very high	93.8	Very high	56 Å²	56	58.8 Å²	58.8	34%	0.344	30%	0.295	S	S	.	.	H	α-helix	trans	-68.6	-39.4	175.6	-57.6	0	0	0	0	110.4	L116 H117 P118 A124 L434	L116-T120 HydrophobicContact CD1-CG2 4.39Å; H117-T120 WeakPolarHBondContact O-CB 3.12Å; H117-T120 PolarHBondContact O-N 3.36Å; P118-T120 VanDerWaalsContact C-N 3.26Å; P118-T120 PolarHBondContact O-N 2.9Å; T120-A124 PolarHBondContact O-N 3.3Å; T120-A124 VanDerWaalsContact O-N 3.16Å; T120-L434 HydrophobicContact CG2-CD1 4.49Å
121	I	94.5	Very high	93.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.9	-51.2	176.3	-59.8	175.4	0	0	0	110.5	L108 V112 L116 P118 Q119 R123 A124 F125 L434 L514	L108-I121 HydrophobicContact CD1-CG2 3.47Å; L108-I121 VanDerWaalsContact CD1-CG2 3.47Å; L108-I121 HydrophobicContact CD2-CG2 3.33Å; L108-I121 HydrophobicContact CG-CG2 3.94Å; V112-I121 HydrophobicContact CG2-CD1 3.72Å; L116-I121 HydrophobicContact CB-CD1 4.37Å; L116-I121 HydrophobicContact CD2-CD1 4.03Å; L116-I121 HydrophobicContact CD2-CG1 3.59Å; L116-I121 HydrophobicContact CG-CD1 4.25Å; L116-I121 HydrophobicContact CG-CG1 3.99Å; P118-I121 WeakPolarHBondContact O-CA 3.08Å; P118-I121 VanDerWaalsContact O-CB 3.28Å; P118-I121 WeakPolarHBondContact O-CB 3.16Å; P118-I121 PolarHBondContact O-N 3.5Å; Q119-I121 VanDerWaalsContact C-N 3.33Å; I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 3.01Å; I121-A124 PolarHBondContact O-N 3.29Å; I121-A124 VanDerWaalsContact O-N 3.13Å; I121-F125 HydrophobicContact CG2-CD2 4.21Å; I121-F125 PolarHBondContact O-N 3.36Å; I121-L434 HydrophobicContact CG1-CD1 4.44Å; I121-L434 HydrophobicContact CG1-CD2 3.99Å; I121-L434 HydrophobicContact CG2-CD2 4.34Å; I121-L514 HydrophobicContact CG2-CD1 4.08Å
122	I	95.1	Very high	93.9	Very high	8 Å²	8	55 Å²	55	4%	0.041	27%	0.274	C	S	.	.	H	α-helix	trans	-56.3	-45.8	179.3	-68.1	167.3	0	0	0	111.1	P118 A124 F125 R126 C511 L514	P118-I122 WeakPolarHBondContact O-CG1 3.44Å; P118-I122 PolarHBondContact O-N 2.92Å; I122-A124 PolarHBondContact O-N 2.96Å; I122-F125 PolarHBondContact O-N 3.25Å; I122-R126 PolarHBondContact O-N 2.94Å; I122-C511 HydrophobicContact CG1-CB 4.21Å; I122-C511 HydrophobicContact CG2-CB 4.03Å; I122-L514 HydrophobicContact CD1-CB 4.3Å; I122-L514 HydrophobicContact CG1-CB 4.31Å
123	R	93.8	Very high	94.1	Very high	176 Å²	176	55.7 Å²	55.7	66%	0.664	28%	0.278	S	S	*	.	H	α-helix	trans	-62.3	-41.7	178.6	-173.7	177.2	178.7	-177.6	0.1	112.3	Q119 I121 T127	Q119-R123 PolarHBondContact O-N 3.33Å; Q119-R123 VanDerWaalsContact O-N 3.1Å; I121-R123 VanDerWaalsContact C-N 3.32Å; I121-R123 PolarHBondContact O-N 3.01Å; R123-T127 PolarHBondContact O-N 3Å; R123-T127 PolarHBondContact O-OG1 2.93Å
124	A	94.3	Very high	94.3	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.008	28%	0.276	C	S	.	.	H	α-helix	trans	-67.3	-42.5	177.6	0	0	0	0	0	111.7	T120 I121 I122 T127 A128 Q431 L434	T120-A124 PolarHBondContact O-N 3.3Å; T120-A124 VanDerWaalsContact O-N 3.16Å; I121-A124 PolarHBondContact O-N 3.29Å; I121-A124 VanDerWaalsContact O-N 3.13Å; I122-A124 PolarHBondContact O-N 2.96Å; A124-T127 WeakPolarHBondContact O-CB 3.44Å; A124-T127 PolarHBondContact O-N 3.44Å; A124-A128 PolarHBondContact O-N 3.2Å; A124-Q431 HydrophobicContact CB-CG 4.32Å; A124-L434 HydrophobicContact CB-CB 3.7Å; A124-L434 HydrophobicContact CB-CD1 3.5Å; A124-L434 VanDerWaalsContact CB-CD1 3.5Å; A124-L434 HydrophobicContact CB-CG 4.28Å
125	F	94.6	Very high	94.4	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-63.2	-46.6	178.8	-97	-119.9	0	0	0	111.9	F104 L108 I121 I122 T127 A128 T129 Y438	F104-F125 HydrophobicContact CB-CE1 3.73Å; F104-F125 AromaticContact CD1-CE1 3.77Å; F104-F125 HydrophobicContact CD1-CE1 3.77Å; F104-F125 HydrophobicContact CD1-CZ 4.45Å; F104-F125 AromaticContact CG-CE1 3.8Å; F104-F125 HydrophobicContact CG-CE1 3.8Å; L108-F125 HydrophobicContact CD1-CD1 4.04Å; L108-F125 HydrophobicContact CD1-CD2 4.08Å; L108-F125 HydrophobicContact CD1-CE1 3.65Å; L108-F125 HydrophobicContact CD1-CE2 3.72Å; L108-F125 HydrophobicContact CD1-CG 4.26Å; L108-F125 HydrophobicContact CD1-CZ 3.47Å; L108-F125 VanDerWaalsContact CD1-CZ 3.47Å; L108-F125 HydrophobicContact CD2-CD2 4.14Å; L108-F125 HydrophobicContact CD2-CE2 3.39Å; L108-F125 HydrophobicContact CD2-CZ 3.7Å; L108-F125 HydrophobicContact CG-CE1 4.21Å; L108-F125 HydrophobicContact CG-CE2 3.79Å; L108-F125 HydrophobicContact CG-CZ 3.57Å; I121-F125 HydrophobicContact CG2-CD2 4.21Å; I121-F125 PolarHBondContact O-N 3.36Å; I122-F125 PolarHBondContact O-N 3.25Å; F125-T127 PolarHBondContact O-N 3.48Å; F125-A128 WeakPolarHBondContact O-CB 3.39Å; F125-A128 PolarHBondContact O-N 3.45Å; F125-A128 VanDerWaalsContact O-N 3.1Å; F125-T129 PolarHBondContact O-N 2.9Å; F125-T129 PolarHBondContact O-OG1 2.91Å; F125-Y438 AromaticContact CD1-CD2 3.52Å; F125-Y438 HydrophobicContact CD1-CD2 3.52Å; F125-Y438 AromaticContact CD1-CE2 3.88Å; F125-Y438 HydrophobicContact CD1-CE2 3.88Å; F125-Y438 HydrophobicContact CD2-CD2 4.34Å; F125-Y438 AromaticContact CE1-CD2 3.46Å; F125-Y438 HydrophobicContact CE1-CD2 3.46Å; F125-Y438 VanDerWaalsContact CE1-CD2 3.46Å; F125-Y438 HydrophobicContact CE1-CE2 4.08Å; F125-Y438 HydrophobicContact CE1-CG 4.39Å; F125-Y438 HydrophobicContact CE2-CD2 4.27Å; F125-Y438 AromaticContact CG-CD2 3.97Å; F125-Y438 HydrophobicContact CG-CD2 3.97Å; F125-Y438 AromaticContact CZ-CD2 3.86Å; F125-Y438 HydrophobicContact CZ-CD2 3.86Å; F125-Y438 HydrophobicContact CZ-CG 4.43Å
126	R	95.1	Very high	94.7	Very high	113 Å²	113	45.7 Å²	45.7	43%	0.426	22%	0.224	S	C	.	.	H	α-helix	trans	-57.7	-38.3	173.5	-76.3	-176.1	168.9	158.7	4.1	113	I122 N130 E508	I122-R126 PolarHBondContact O-N 2.94Å; R126-N130 VanDerWaalsContact O-CG 3.27Å; R126-N130 PolarHBondContact O-N 3.45Å; R126-N130 PolarHBondContact O-ND2 3.31Å; R126-E508 IonicContact CZ-OE1 3.08Å; R126-E508 IonicContact CZ-OE2 2.84Å; R126-E508 IonicContact NE-OE1 2.71Å; R126-E508 PolarHBondContact NE-OE1 2.99Å; R126-E508 VanDerWaalsContact NE-OE1 3.16Å; R126-E508 IonicContact NE-OE2 2.77Å; R126-E508 IonicContact NH2-OE1 3.02Å; R126-E508 IonicContact NH2-OE2 3.67Å; R126-E508 PolarHBondContact NH2-OE2 3.2Å
127	T	94.7	Very high	94.7	Very high	49 Å²	49	51.1 Å²	51.1	30%	0.301	25%	0.246	S	C	.	.	H	α-helix	trans	-65.4	-45.6	176.1	-53	0	0	0	0	110.8	R123 A124 F125 N130 L131	R123-T127 PolarHBondContact O-N 3Å; R123-T127 PolarHBondContact O-OG1 2.93Å; A124-T127 WeakPolarHBondContact O-CB 3.44Å; A124-T127 PolarHBondContact O-N 3.44Å; F125-T127 PolarHBondContact O-N 3.48Å; T127-N130 PolarHBondContact O-N 3.32Å; T127-L131 HydrophobicContact CG2-CD1 4.16Å; T127-L131 VanDerWaalsContact O-CG 3.3Å; T127-L131 WeakPolarHBondContact O-CG 3.49Å; T127-L131 PolarHBondContact O-N 3.14Å; T127-L131 VanDerWaalsContact O-N 3.07Å
128	A	95.6	Very high	94.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-43.1	176.6	0	0	0	0	0	112.3	A124 F125 N130 L131 A132 I435 Y438	A124-A128 PolarHBondContact O-N 3.2Å; F125-A128 WeakPolarHBondContact O-CB 3.39Å; F125-A128 PolarHBondContact O-N 3.45Å; F125-A128 VanDerWaalsContact O-N 3.1Å; A128-N130 PolarHBondContact O-N 2.97Å; A128-L131 PolarHBondContact O-N 3.11Å; A128-A132 WeakPolarHBondContact O-CB 3.44Å; A128-A132 PolarHBondContact O-N 3.44Å; A128-I435 HydrophobicContact CB-CG1 4.38Å; A128-Y438 HydrophobicContact CB-CD1 4.09Å; A128-Y438 HydrophobicContact CB-CD2 3.79Å; A128-Y438 HydrophobicContact CB-CE1 4.49Å; A128-Y438 HydrophobicContact CB-CE2 4.25Å; A128-Y438 HydrophobicContact CB-CG 3.72Å
129	T	96.4	Very high	94.8	Very high	7 Å²	7	50.8 Å²	50.8	4%	0.043	24%	0.243	C	C	.	.	H	α-helix	trans	-60.9	-45.6	176.7	-49.9	0	0	0	0	111.5	F125 L131 A132 V133 Y438 S507	F125-T129 PolarHBondContact O-N 2.9Å; F125-T129 PolarHBondContact O-OG1 2.91Å; T129-L131 VanDerWaalsContact C-N 3.34Å; T129-L131 PolarHBondContact O-N 3.25Å; T129-A132 PolarHBondContact O-N 3.25Å; T129-V133 HydrophobicContact CG2-CG2 4.4Å; T129-V133 WeakPolarHBondContact O-CB 3.42Å; T129-V133 VanDerWaalsContact O-CG2 3.31Å; T129-V133 WeakPolarHBondContact O-CG2 3.31Å; T129-V133 PolarHBondContact O-N 2.71Å; T129-Y438 PolarHBondContact OG1-OH 2.87Å; T129-S507 WeakPolarHBondContact CG2-OG 3.43Å; T129-S507 WeakPolarHBondContact OG1-CB 3.3Å; T129-S507 PolarHBondContact OG1-OG 2.93Å
130	N	96.6	Very high	94.7	Very high	108 Å²	108	46.4 Å²	46.4	58%	0.578	23%	0.226	S	C	*	.	H	α-helix	trans	-62.3	-42.1	178.3	-72.3	-18.7	0	0	0	111.8	R126 T127 A128 V133 S134	R126-N130 VanDerWaalsContact O-CG 3.27Å; R126-N130 PolarHBondContact O-N 3.45Å; R126-N130 PolarHBondContact O-ND2 3.31Å; T127-N130 PolarHBondContact O-N 3.32Å; A128-N130 PolarHBondContact O-N 2.97Å; N130-V133 PolarHBondContact O-N 3.23Å; N130-S134 WeakPolarHBondContact O-CB 3.36Å; N130-S134 PolarHBondContact O-N 2.87Å; N130-S134 PolarHBondContact O-OG 2.9Å; N130-S134 VanDerWaalsContact O-OG 3.05Å
131	L	96.1	Very high	94.5	Very high	31 Å²	31	46.3 Å²	46.3	16%	0.162	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-42.6	175.8	-70.3	166.8	0	0	0	111.8	T127 A128 T129 K135 Y419 L420 Y423	T127-L131 HydrophobicContact CG2-CD1 4.16Å; T127-L131 VanDerWaalsContact O-CG 3.3Å; T127-L131 WeakPolarHBondContact O-CG 3.49Å; T127-L131 PolarHBondContact O-N 3.14Å; T127-L131 VanDerWaalsContact O-N 3.07Å; A128-L131 PolarHBondContact O-N 3.11Å; T129-L131 VanDerWaalsContact C-N 3.34Å; T129-L131 PolarHBondContact O-N 3.25Å; L131-K135 WeakPolarHBondContact O-CB 3.29Å; L131-K135 PolarHBondContact O-N 3.45Å; L131-Y419 HydrophobicContact CB-CE1 4.26Å; L131-L420 HydrophobicContact CB-CD2 3.96Å; L131-Y423 HydrophobicContact CD1-CD1 3.56Å; L131-Y423 HydrophobicContact CD1-CE1 3.15Å; L131-Y423 HydrophobicContact CD1-CE2 4.47Å; L131-Y423 HydrophobicContact CD1-CG 4.34Å; L131-Y423 HydrophobicContact CD2-CE1 4.49Å; L131-Y423 HydrophobicContact CD2-CE2 4.49Å; L131-Y423 HydrophobicContact CG-CE1 4.44Å
132	A	96.1	Very high	94	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-46	177.5	0	0	0	0	0	111.7	A128 T129 K135 I136 L416 L420 L503	A128-A132 WeakPolarHBondContact O-CB 3.44Å; A128-A132 PolarHBondContact O-N 3.44Å; T129-A132 PolarHBondContact O-N 3.25Å; A132-K135 PolarHBondContact O-N 2.9Å; A132-I136 WeakPolarHBondContact O-CG1 3.35Å; A132-I136 PolarHBondContact O-N 3.39Å; A132-L416 HydrophobicContact CB-CD2 4.24Å; A132-L416 WeakPolarHBondContact O-CD2 3.31Å; A132-L420 HydrophobicContact CB-CD1 4.34Å; A132-L503 HydrophobicContact CB-CD1 4.35Å
133	V	95.9	Very high	92.9	Very high	17 Å²	17	51.2 Å²	51.2	10%	0.103	26%	0.26	C	S	.	.	H	α-helix	trans	-62.8	-44.1	178.1	168.8	0	0	0	0	111.5	T129 N130 K135 I136 K137 I500	T129-V133 HydrophobicContact CG2-CG2 4.4Å; T129-V133 WeakPolarHBondContact O-CB 3.42Å; T129-V133 VanDerWaalsContact O-CG2 3.31Å; T129-V133 WeakPolarHBondContact O-CG2 3.31Å; T129-V133 PolarHBondContact O-N 2.71Å; N130-V133 PolarHBondContact O-N 3.23Å; V133-K135 VanDerWaalsContact C-N 3.29Å; V133-K135 PolarHBondContact O-N 3.43Å; V133-I136 PolarHBondContact O-N 2.9Å; V133-K137 WeakPolarHBondContact O-CG 3.47Å; V133-K137 PolarHBondContact O-N 3.3Å; V133-K137 VanDerWaalsContact O-N 3.15Å; V133-I500 HydrophobicContact CG1-CG1 4.33Å; V133-I500 HydrophobicContact CG1-CG2 3.83Å; V133-I500 HydrophobicContact CG2-CG2 4.19Å
134	S	96.2	Very high	91.7	Very high	61 Å²	61	50.3 Å²	50.3	43%	0.427	26%	0.26	S	S	.	.	H	α-helix	trans	-60	-42.9	174.1	-65.1	0	0	0	0	111	N130 I136 K137 E138	N130-S134 WeakPolarHBondContact O-CB 3.36Å; N130-S134 PolarHBondContact O-N 2.87Å; N130-S134 PolarHBondContact O-OG 2.9Å; N130-S134 VanDerWaalsContact O-OG 3.05Å; S134-I136 PolarHBondContact O-N 3.47Å; S134-K137 PolarHBondContact O-N 2.64Å; S134-K137 VanDerWaalsContact O-N 3.16Å; S134-E138 WeakPolarHBondContact O-CG 3.32Å; S134-E138 PolarHBondContact O-N 3.23Å
135	K	95.4	Very high	90.3	Very high	40 Å²	40	55.3 Å²	55.3	17%	0.174	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-40.6	179.1	-171.2	57.5	177.9	174.2	0	112.8	L131 A132 V133 K137 E138 I139 L416 Y419	L131-K135 WeakPolarHBondContact O-CB 3.29Å; L131-K135 PolarHBondContact O-N 3.45Å; A132-K135 PolarHBondContact O-N 2.9Å; V133-K135 VanDerWaalsContact C-N 3.29Å; V133-K135 PolarHBondContact O-N 3.43Å; K135-K137 VanDerWaalsContact C-N 3.31Å; K135-K137 PolarHBondContact O-N 3.32Å; K135-E138 WeakPolarHBondContact CD-OE2 3.32Å; K135-E138 IonicContact NZ-OE2 3.02Å; K135-E138 PolarHBondContact NZ-OE2 3.25Å; K135-E138 VanDerWaalsContact NZ-OE2 3.11Å; K135-E138 PolarHBondContact O-N 2.89Å; K135-I139 HydrophobicContact CD-CG2 4.24Å; K135-I139 HydrophobicContact CG-CD1 4.44Å; K135-I139 VanDerWaalsContact O-CG1 3.29Å; K135-I139 WeakPolarHBondContact O-CG1 3.47Å; K135-I139 PolarHBondContact O-N 3.21Å; K135-I139 VanDerWaalsContact O-N 3.14Å; K135-L416 HydrophobicContact CB-CD2 3.78Å; K135-L416 HydrophobicContact CG-CD2 3.92Å; K135-Y419 HydrophobicContact CB-CD1 3.92Å; K135-Y419 HydrophobicContact CB-CE1 3.95Å; K135-Y419 HydrophobicContact CD-CD1 4.36Å; K135-Y419 HydrophobicContact CD-CD2 4.34Å; K135-Y419 HydrophobicContact CD-CE1 4.47Å; K135-Y419 HydrophobicContact CD-CE2 4.48Å; K135-Y419 HydrophobicContact CD-CG 4.28Å; K135-Y419 HydrophobicContact CG-CD1 3.85Å; K135-Y419 HydrophobicContact CG-CE1 4.23Å; K135-Y419 HydrophobicContact CG-CG 4.04Å
136	I	94.7	Very high	88.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-57.9	-45.9	173.7	-67.2	169.6	0	0	0	110.4	A132 V133 S134 E138 I139 A140 V406 I412 L416 K499 I500 L503	A132-I136 WeakPolarHBondContact O-CG1 3.35Å; A132-I136 PolarHBondContact O-N 3.39Å; V133-I136 PolarHBondContact O-N 2.9Å; S134-I136 PolarHBondContact O-N 3.47Å; I136-E138 VanDerWaalsContact C-N 3.29Å; I136-E138 PolarHBondContact O-N 2.94Å; I136-I139 PolarHBondContact O-N 3.45Å; I136-A140 VanDerWaalsContact O-CB 3.25Å; I136-A140 WeakPolarHBondContact O-CB 3.48Å; I136-A140 PolarHBondContact O-N 3.42Å; I136-V406 HydrophobicContact CG2-CG1 4.34Å; I136-I412 HydrophobicContact CG1-CD1 4.31Å; I136-I412 HydrophobicContact CG1-CG1 4.22Å; I136-L416 HydrophobicContact CD1-CD1 3.81Å; I136-L416 HydrophobicContact CG1-CD1 3.78Å; I136-L416 HydrophobicContact CG1-CD2 3.99Å; I136-L416 HydrophobicContact CG1-CG 4.37Å; I136-K499 HydrophobicContact CD1-CB 4.03Å; I136-I500 HydrophobicContact CB-CG1 4.27Å; I136-I500 HydrophobicContact CD1-CG1 4.21Å; I136-I500 HydrophobicContact CG2-CD1 4.14Å; I136-I500 HydrophobicContact CG2-CG1 3.89Å; I136-L503 HydrophobicContact CD1-CD1 3.55Å
137	K	92.9	Very high	87.7	Confident	138 Å²	138	60.8 Å²	60.8	60%	0.6	32%	0.32	S	S	*	.	H	α-helix	trans	-63.5	-34.3	-179.8	-69.2	175.7	-179.5	179.7	0	112.7	V133 S134 K135 I500	V133-K137 WeakPolarHBondContact O-CG 3.47Å; V133-K137 PolarHBondContact O-N 3.3Å; V133-K137 VanDerWaalsContact O-N 3.15Å; S134-K137 PolarHBondContact O-N 2.64Å; S134-K137 VanDerWaalsContact O-N 3.16Å; K135-K137 VanDerWaalsContact C-N 3.31Å; K135-K137 PolarHBondContact O-N 3.32Å; K137-I500 HydrophobicContact CG-CD1 3.96Å
138	E	93.9	Very high	86.7	Confident	125 Å²	125	66.5 Å²	66.5	58%	0.584	34%	0.34	S	S	*	.	H	α-helix	trans	-68.9	-39.6	176.5	-71	170	-165.5	0	0	113.1	S134 K135 I136	S134-E138 WeakPolarHBondContact O-CG 3.32Å; S134-E138 PolarHBondContact O-N 3.23Å; K135-E138 WeakPolarHBondContact CD-OE2 3.32Å; K135-E138 IonicContact NZ-OE2 3.02Å; K135-E138 PolarHBondContact NZ-OE2 3.25Å; K135-E138 VanDerWaalsContact NZ-OE2 3.11Å; K135-E138 PolarHBondContact O-N 2.89Å; I136-E138 VanDerWaalsContact C-N 3.29Å; I136-E138 PolarHBondContact O-N 2.94Å
139	I	93.4	Very high	85.8	Confident	22 Å²	22	73.5 Å²	73.5	11%	0.113	37%	0.373	C	S	.	.	H	α-helix	trans	-94.4	-11.2	-173.8	68.5	-168.3	0	0	0	113.2	K135 I136 V141 I412 E415 L473 W474	K135-I139 HydrophobicContact CD-CG2 4.24Å; K135-I139 HydrophobicContact CG-CD1 4.44Å; K135-I139 VanDerWaalsContact O-CG1 3.29Å; K135-I139 WeakPolarHBondContact O-CG1 3.47Å; K135-I139 PolarHBondContact O-N 3.21Å; K135-I139 VanDerWaalsContact O-N 3.14Å; I136-I139 PolarHBondContact O-N 3.45Å; I139-V141 PolarHBondContact O-N 3.03Å; I139-I412 HydrophobicContact CD1-CD1 3.35Å; I139-I412 HydrophobicContact CG1-CD1 3.98Å; I139-E415 HydrophobicContact CD1-CG 4.42Å; I139-L473 HydrophobicContact CB-CD1 4.26Å; I139-L473 HydrophobicContact CB-CD2 4.44Å; I139-L473 HydrophobicContact CG2-CD1 3.96Å; I139-W474 VanDerWaalsContact O-CH2 3.28Å; I139-W474 WeakPolarHBondContact O-CH2 2.79Å; I139-W474 WeakPolarHBondContact O-CZ2 3.05Å
140	A	91.1	Very high	84.9	Confident	21 Å²	21	78.3 Å²	78.3	17%	0.174	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-63.4	133	177.9	0	0	0	0	0	110.9	I136 V406	I136-A140 VanDerWaalsContact O-CB 3.25Å; I136-A140 WeakPolarHBondContact O-CB 3.48Å; I136-A140 PolarHBondContact O-N 3.42Å; A140-V406 HydrophobicContact CB-CG1 3.98Å
141	V	87.9	Confident	84	Confident	54 Å²	54	75.1 Å²	75.1	33%	0.327	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	119.4	-179.7	-177.4	0	0	0	0	108.3	I139 S404 I405 W474 F488	I139-V141 PolarHBondContact O-N 3.03Å; V141-S404 WeakPolarHBondContact O-CA 3.4Å; V141-I405 HydrophobicContact CB-CG1 4.4Å; V141-I405 PolarHBondContact N-O 3.07Å; V141-I405 PolarHBondContact O-N 3.45Å; V141-W474 HydrophobicContact CG2-CH2 4.35Å; V141-W474 HydrophobicContact CG2-CZ2 3.68Å; V141-F488 HydrophobicContact CB-CE2 4.11Å; V141-F488 HydrophobicContact CB-CZ 4.06Å; V141-F488 HydrophobicContact CG1-CZ 4.04Å; V141-F488 HydrophobicContact CG2-CE2 3.83Å; V141-F488 HydrophobicContact CG2-CZ 3.91Å
142	S	83.8	Confident	83.5	Confident	89 Å²	89	77.2 Å²	77.2	62%	0.622	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	127.4	175	-168.3	0	0	0	0	110.6	D403	S142-D403 CarbonylContact C-O 3.59Å; S142-D403 WeakPolarHBondContact CA-O 3.46Å
143	V	72.1	Confident	82.9	Confident	23 Å²	23	82.5 Å²	82.5	14%	0.139	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-90.5	131	179.2	-177	0	0	0	0	108.3	L154 D403 I405	V143-L154 HydrophobicContact CB-CD1 4.11Å; V143-L154 HydrophobicContact CG1-CD1 3.76Å; V143-L154 HydrophobicContact CG2-CD1 3.26Å; V143-L154 HydrophobicContact CG2-CD2 4.44Å; V143-L154 HydrophobicContact CG2-CG 4.47Å; V143-D403 WeakPolarHBondContact CG2-O 3.39Å; V143-D403 PolarHBondContact N-O 3.49Å; V143-I405 HydrophobicContact CG2-CD1 4.14Å; V143-I405 HydrophobicContact CG2-CG1 3.94Å
144	K	68.7	Low	82.2	Confident	157 Å²	157	82.3 Å²	82.3	68%	0.683	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-72.1	135.7	178.5	-67.5	-177.2	179.6	178.8	0	110.7	D146	K144-D146 VanDerWaalsContact C-N 3.29Å; K144-D146 PolarHBondContact O-N 3.17Å
145	K	65	Low	81.7	Confident	106 Å²	106	79.6 Å²	79.6	46%	0.461	39%	0.386	S	S	.	.	S	Bend	trans	-77.7	-10.6	177.4	-64.7	-167.3	179.8	-170.8	0	114.6	D147 D403	K145-D147 PolarHBondContact O-N 3.12Å; K145-D403 WeakPolarHBondContact CE-OD1 3.46Å; K145-D403 WeakPolarHBondContact CE-OD2 3.23Å; K145-D403 IonicContact NZ-OD1 3.11Å; K145-D403 IonicContact NZ-OD2 3.59Å; K145-D403 PolarHBondContact NZ-OD2 2.83Å
146	D	63.7	Low	81.4	Confident	152 Å²	152	79.8 Å²	79.8	81%	0.813	39%	0.388	S	S	*	.	S	Bend	trans	-75.6	-25	-166.6	-60.3	-34.1	0	0	0	112.9	K144	K144-D146 VanDerWaalsContact C-N 3.29Å; K144-D146 PolarHBondContact O-N 3.17Å
147	D	72.5	Confident	81	Confident	77 Å²	77	83.3 Å²	83.3	41%	0.412	40%	0.403	S	S	.	.			trans	-103.2	101.8	175.4	-167	-18.3	0	0	0	111.4	K145 Q149 E150 Q151	K145-D147 PolarHBondContact O-N 3.12Å; D147-Q149 PolarHBondContact O-N 2.78Å; D147-Q149 WeakPolarHBondContact OD1-CB 3.47Å; D147-Q149 PolarHBondContact OD1-N 3.16Å; D147-E150 HydrophobicContact CB-CB 3.89Å; D147-E150 PolarHBondContact O-N 3.19Å; D147-E150 PolarHBondContact OD1-N 3.26Å; D147-Q151 WeakPolarHBondContact O-CB 2.77Å; D147-Q151 PolarHBondContact O-N 3.16Å
148	K	72.9	Confident	80.5	Confident	169 Å²	169	76.8 Å²	76.8	74%	0.735	38%	0.375	S	S	*	.	H	α-helix	trans	-62.1	-27.9	178.1	-67.9	-175.7	177.9	-178.8	0	113	R152	K148-R152 WeakPolarHBondContact O-CB 3.4Å; K148-R152 PolarHBondContact O-N 3.15Å; K148-R152 VanDerWaalsContact O-N 3.08Å
149	Q	77.1	Confident	80.2	Confident	147 Å²	147	70.8 Å²	70.8	69%	0.687	35%	0.347	S	S	*	.	H	α-helix	trans	-75.5	-45.1	178.2	-67.7	-170.5	-11.4	0	0	110.8	D147 Q151 R152 Q153	D147-Q149 PolarHBondContact O-N 2.78Å; D147-Q149 WeakPolarHBondContact OD1-CB 3.47Å; D147-Q149 PolarHBondContact OD1-N 3.16Å; Q149-Q151 VanDerWaalsContact C-N 3.33Å; Q149-Q151 PolarHBondContact O-N 2.93Å; Q149-R152 PolarHBondContact O-N 2.78Å; Q149-Q153 WeakPolarHBondContact O-CG 3.31Å; Q149-Q153 PolarHBondContact O-N 2.87Å
150	E	76.1	Confident	79.9	Confident	108 Å²	108	70.8 Å²	70.8	51%	0.505	35%	0.35	S	S	.	.	H	α-helix	trans	-62.5	-42.6	175.6	-167.2	177.1	-167.8	0	0	111	D147 R152 Q153 L154	D147-E150 HydrophobicContact CB-CB 3.89Å; D147-E150 PolarHBondContact O-N 3.19Å; D147-E150 PolarHBondContact OD1-N 3.26Å; E150-R152 PolarHBondContact O-N 3.29Å; E150-Q153 PolarHBondContact O-N 2.94Å; E150-L154 WeakPolarHBondContact O-CB 3.43Å; E150-L154 PolarHBondContact O-N 3.41Å
151	Q	78.3	Confident	79.5	Confident	41 Å²	41	71 Å²	71	19%	0.192	35%	0.349	C	S	.	.	H	α-helix	trans	-59.4	-46.5	175.2	-171.2	-177.9	18.9	0	0	111.5	D147 Q149 Q153 L154 L155	D147-Q151 WeakPolarHBondContact O-CB 2.77Å; D147-Q151 PolarHBondContact O-N 3.16Å; Q149-Q151 VanDerWaalsContact C-N 3.33Å; Q149-Q151 PolarHBondContact O-N 2.93Å; Q151-Q153 PolarHBondContact O-N 3.32Å; Q151-L154 WeakPolarHBondContact O-CB 3.46Å; Q151-L154 PolarHBondContact O-N 3.38Å; Q151-L155 HydrophobicContact CG-CD1 4.42Å; Q151-L155 VanDerWaalsContact O-CG 3.3Å; Q151-L155 WeakPolarHBondContact O-CG 3.44Å; Q151-L155 PolarHBondContact O-N 3.13Å
152	R	85.2	Confident	79.3	Confident	75 Å²	75	68.7 Å²	68.7	28%	0.283	34%	0.335	S	S	.	.	H	α-helix	trans	-61.3	-46.1	178.2	-174.5	-177.9	174.4	109.1	-1.3	111.7	K148 Q149 E150 L154 L155 E156 V180 D181 M184	K148-R152 WeakPolarHBondContact O-CB 3.4Å; K148-R152 PolarHBondContact O-N 3.15Å; K148-R152 VanDerWaalsContact O-N 3.08Å; Q149-R152 PolarHBondContact O-N 2.78Å; E150-R152 PolarHBondContact O-N 3.29Å; R152-L154 VanDerWaalsContact C-N 3.26Å; R152-L154 PolarHBondContact O-N 3.06Å; R152-L155 PolarHBondContact O-N 2.95Å; R152-E156 IonicContact CZ-OE1 3.48Å; R152-E156 IonicContact NE-OE1 3.67Å; R152-E156 PolarHBondContact NE-OE1 3.27Å; R152-E156 IonicContact NH2-OE1 3.62Å; R152-E156 WeakPolarHBondContact O-CG 3.29Å; R152-E156 PolarHBondContact O-N 3.47Å; R152-V180 HydrophobicContact CG-CG1 4.03Å; R152-D181 IonicContact CZ-OD1 2.77Å; R152-D181 IonicContact NH1-OD1 3.3Å; R152-D181 PolarHBondContact NH1-OD1 2.86Å; R152-D181 VanDerWaalsContact NH2-CG 3.3Å; R152-D181 IonicContact NH2-OD1 3.66Å; R152-D181 PolarHBondContact NH2-OD1 3.33Å; R152-D181 IonicContact NH2-OD2 2.62Å; R152-D181 PolarHBondContact NH2-OD2 3.02Å; R152-M184 HydrophobicContact CG-SD 4.34Å
153	Q	84.3	Confident	79.4	Confident	110 Å²	110	64.4 Å²	64.4	51%	0.514	31%	0.306	S	S	.	.	H	α-helix	trans	-60.6	-38.3	177.6	-71.5	179	12.9	0	0	112	Q149 E150 Q151 E156 K157	Q149-Q153 WeakPolarHBondContact O-CG 3.31Å; Q149-Q153 PolarHBondContact O-N 2.87Å; E150-Q153 PolarHBondContact O-N 2.94Å; Q151-Q153 PolarHBondContact O-N 3.32Å; Q153-E156 PolarHBondContact O-N 3.48Å; Q153-K157 VanDerWaalsContact O-CG 3.31Å; Q153-K157 WeakPolarHBondContact O-CG 3.49Å; Q153-K157 PolarHBondContact O-N 3.42Å
154	L	82.2	Confident	79.8	Confident	14 Å²	14	65.3 Å²	65.3	7%	0.073	31%	0.31	C	S	.	.	H	α-helix	trans	-64.5	-45	175.4	-178.4	135.3	0	0	0	112	V143 E150 Q151 R152 E156 K157 C158 I405 W493	V143-L154 HydrophobicContact CB-CD1 4.11Å; V143-L154 HydrophobicContact CG1-CD1 3.76Å; V143-L154 HydrophobicContact CG2-CD1 3.26Å; V143-L154 HydrophobicContact CG2-CD2 4.44Å; V143-L154 HydrophobicContact CG2-CG 4.47Å; E150-L154 WeakPolarHBondContact O-CB 3.43Å; E150-L154 PolarHBondContact O-N 3.41Å; Q151-L154 WeakPolarHBondContact O-CB 3.46Å; Q151-L154 PolarHBondContact O-N 3.38Å; R152-L154 VanDerWaalsContact C-N 3.26Å; R152-L154 PolarHBondContact O-N 3.06Å; L154-E156 VanDerWaalsContact C-N 3.31Å; L154-E156 PolarHBondContact O-N 3.04Å; L154-K157 PolarHBondContact O-N 3.34Å; L154-C158 PolarHBondContact O-N 2.94Å; L154-C158 PolarHBondContact O-SG 2.74Å; L154-I405 HydrophobicContact CD1-CD1 3.84Å; L154-W493 HydrophobicContact CB-CE3 4.46Å; L154-W493 HydrophobicContact CB-CZ3 3.96Å; L154-W493 HydrophobicContact CD1-CE3 3.71Å; L154-W493 HydrophobicContact CD1-CH2 4.36Å; L154-W493 HydrophobicContact CD1-CZ3 3.46Å; L154-W493 VanDerWaalsContact CD1-CZ3 3.46Å; L154-W493 HydrophobicContact CG-CE3 3.77Å; L154-W493 HydrophobicContact CG-CZ3 3.67Å
155	L	85.8	Confident	80	Confident	4 Å²	4	59 Å²	59	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-39.9	176.8	-65.1	175.3	0	0	0	111.7	Q151 R152 K157 C158 A159 V180 V396 A399 I400	Q151-L155 HydrophobicContact CG-CD1 4.42Å; Q151-L155 VanDerWaalsContact O-CG 3.3Å; Q151-L155 WeakPolarHBondContact O-CG 3.44Å; Q151-L155 PolarHBondContact O-N 3.13Å; R152-L155 PolarHBondContact O-N 2.95Å; L155-K157 VanDerWaalsContact C-N 3.35Å; L155-C158 PolarHBondContact O-N 3.1Å; L155-A159 WeakPolarHBondContact O-CB 3.36Å; L155-A159 PolarHBondContact O-N 3.15Å; L155-V180 HydrophobicContact CB-CG1 4.11Å; L155-V180 HydrophobicContact CB-CG2 3.74Å; L155-V180 HydrophobicContact CD1-CG1 4.36Å; L155-V396 HydrophobicContact CB-CG1 4.21Å; L155-V396 HydrophobicContact CD1-CG1 4.38Å; L155-V396 HydrophobicContact CD2-CG1 4.1Å; L155-V396 HydrophobicContact CG-CG1 4.45Å; L155-A399 HydrophobicContact CD2-CB 3.68Å; L155-I400 HydrophobicContact CD1-CD1 3.89Å; L155-I400 HydrophobicContact CD1-CG1 3.64Å; L155-I400 HydrophobicContact CD2-CG1 3.71Å; L155-I400 HydrophobicContact CG-CG1 4.33Å
156	E	88.9	Confident	80.7	Confident	44 Å²	44	54.8 Å²	54.8	21%	0.206	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-40.7	175.6	-72.7	179.5	-168.6	0	0	111.3	R152 Q153 L154 A159 A160 V180	R152-E156 IonicContact CZ-OE1 3.48Å; R152-E156 IonicContact NE-OE1 3.67Å; R152-E156 PolarHBondContact NE-OE1 3.27Å; R152-E156 IonicContact NH2-OE1 3.62Å; R152-E156 WeakPolarHBondContact O-CG 3.29Å; R152-E156 PolarHBondContact O-N 3.47Å; Q153-E156 PolarHBondContact O-N 3.48Å; L154-E156 VanDerWaalsContact C-N 3.31Å; L154-E156 PolarHBondContact O-N 3.04Å; E156-A159 PolarHBondContact O-N 2.96Å; E156-A160 WeakPolarHBondContact O-CB 3.46Å; E156-A160 PolarHBondContact O-N 3.18Å; E156-V180 HydrophobicContact CB-CG2 4.47Å; E156-V180 HydrophobicContact CG-CB 4.22Å; E156-V180 HydrophobicContact CG-CG1 4.42Å; E156-V180 HydrophobicContact CG-CG2 3.84Å
157	K	85.4	Confident	81.4	Confident	73 Å²	73	50.1 Å²	50.1	32%	0.317	24%	0.242	S	C	.	.	H	α-helix	trans	-67.3	-43	175.8	-74.1	169.7	173.9	-174.6	0	113	Q153 L154 L155 A160 T161 C491 W493	Q153-K157 VanDerWaalsContact O-CG 3.31Å; Q153-K157 WeakPolarHBondContact O-CG 3.49Å; Q153-K157 PolarHBondContact O-N 3.42Å; L154-K157 PolarHBondContact O-N 3.34Å; L155-K157 VanDerWaalsContact C-N 3.35Å; K157-A160 PolarHBondContact O-N 2.69Å; K157-T161 PolarHBondContact O-N 3.44Å; K157-T161 PolarHBondContact O-OG1 3.28Å; K157-C491 HydrophobicContact CD-CB 3.85Å; K157-C491 HydrophobicContact CG-CB 4.34Å; K157-C491 PolarHBondContact NZ-SG 2.82Å; K157-W493 HydrophobicContact CB-CE3 4.21Å; K157-W493 HydrophobicContact CB-CZ3 4.46Å; K157-W493 HydrophobicContact CD-CE3 4.17Å; K157-W493 HydrophobicContact CD-CH2 4Å; K157-W493 HydrophobicContact CD-CZ3 3.69Å
158	C	83.6	Confident	81.8	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-44.1	174.6	-70.4	0	0	0	0	111	L154 L155 T161 A162 I395	L154-C158 PolarHBondContact O-N 2.94Å; L154-C158 PolarHBondContact O-SG 2.74Å; L155-C158 PolarHBondContact O-N 3.1Å; C158-T161 PolarHBondContact O-N 3.41Å; C158-A162 PolarHBondContact O-N 3.38Å; C158-A162 VanDerWaalsContact O-N 3.15Å; C158-I395 HydrophobicContact CB-CG2 4.22Å
159	A	86.4	Confident	82.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-45	174.7	0	0	0	0	0	111.6	L155 E156 T161 A162 L163 V396	L155-A159 WeakPolarHBondContact O-CB 3.36Å; L155-A159 PolarHBondContact O-N 3.15Å; E156-A159 PolarHBondContact O-N 2.96Å; A159-T161 VanDerWaalsContact C-N 3.28Å; A159-T161 PolarHBondContact O-N 2.86Å; A159-A162 WeakPolarHBondContact O-CB 3.25Å; A159-A162 PolarHBondContact O-N 2.75Å; A159-L163 VanDerWaalsContact O-CG 3.31Å; A159-L163 WeakPolarHBondContact O-CG 3.47Å; A159-L163 PolarHBondContact O-N 3.15Å; A159-L163 VanDerWaalsContact O-N 3.16Å; A159-V396 HydrophobicContact CB-CG2 3.64Å
160	A	86.7	Confident	82.5	Confident	22 Å²	22	36.3 Å²	36.3	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-62.3	-38.1	179.2	0	0	0	0	0	111.8	E156 K157 L163 N164 S176	E156-A160 WeakPolarHBondContact O-CB 3.46Å; E156-A160 PolarHBondContact O-N 3.18Å; K157-A160 PolarHBondContact O-N 2.69Å; A160-L163 PolarHBondContact O-N 2.96Å; A160-N164 PolarHBondContact O-N 3.02Å; A160-N164 VanDerWaalsContact O-N 3.13Å; A160-N164 PolarHBondContact O-ND2 3.39Å; A160-N164 PolarHBondContact O-OD1 2.91Å; A160-S176 WeakPolarHBondContact CA-OG 3.19Å; A160-S176 PolarHBondContact N-OG 3.49Å; A160-S176 VanDerWaalsContact N-OG 3.12Å
161	T	83.9	Confident	83	Confident	26 Å²	26	34.3 Å²	34.3	16%	0.16	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-44.3	176.7	-57.4	0	0	0	0	111.3	K157 C158 A159 L163 N164 V492	K157-T161 PolarHBondContact O-N 3.44Å; K157-T161 PolarHBondContact O-OG1 3.28Å; C158-T161 PolarHBondContact O-N 3.41Å; A159-T161 VanDerWaalsContact C-N 3.28Å; A159-T161 PolarHBondContact O-N 2.86Å; T161-L163 VanDerWaalsContact C-N 3.25Å; T161-L163 PolarHBondContact O-N 3.42Å; T161-N164 WeakPolarHBondContact O-CB 3.24Å; T161-N164 PolarHBondContact O-N 3.49Å; T161-V492 HydrophobicContact CG2-CG1 3.96Å
162	A	83	Confident	83.4	Confident	4 Å²	4	36.2 Å²	36.2	3%	0.033	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-30.8	176.5	0	0	0	0	0	113.9	C158 A159 K166 A392 I395	C158-A162 PolarHBondContact O-N 3.38Å; C158-A162 VanDerWaalsContact O-N 3.15Å; A159-A162 WeakPolarHBondContact O-CB 3.25Å; A159-A162 PolarHBondContact O-N 2.75Å; A162-K166 WeakPolarHBondContact O-CE 3.16Å; A162-A392 HydrophobicContact CB-CB 4.35Å; A162-I395 HydrophobicContact CB-CD1 3.36Å
163	L	84.9	Confident	83.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-89.8	-12.7	-176.7	-65.6	-178.8	0	0	0	113.3	A159 A160 T161 S165 K166 I168 K172 F175 S388 A392	A159-L163 VanDerWaalsContact O-CG 3.31Å; A159-L163 WeakPolarHBondContact O-CG 3.47Å; A159-L163 PolarHBondContact O-N 3.15Å; A159-L163 VanDerWaalsContact O-N 3.16Å; A160-L163 PolarHBondContact O-N 2.96Å; T161-L163 VanDerWaalsContact C-N 3.25Å; T161-L163 PolarHBondContact O-N 3.42Å; L163-S165 PolarHBondContact O-N 3.43Å; L163-K166 PolarHBondContact O-N 3.12Å; L163-I168 HydrophobicContact CD1-CD1 4.04Å; L163-I168 HydrophobicContact CD2-CD1 3.47Å; L163-I168 VanDerWaalsContact CD2-CD1 3.47Å; L163-I168 HydrophobicContact CD2-CG1 4.01Å; L163-I168 HydrophobicContact CG-CD1 4.23Å; L163-K172 HydrophobicContact CB-CB 4.15Å; L163-F175 HydrophobicContact CD1-CB 3.83Å; L163-S388 WeakPolarHBondContact CD2-O 3.38Å; L163-A392 HydrophobicContact CD1-CB 4.42Å; L163-A392 HydrophobicContact CD2-CB 3.78Å; L163-A392 HydrophobicContact CG-CB 4.02Å
164	N	80.8	Confident	83.8	Confident	41 Å²	41	33.1 Å²	33.1	22%	0.219	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.2	-175.6	-81.5	-27.7	0	0	0	114	P42 A160 T161 A169 K172	P42-N164 WeakPolarHBondContact CA-O 3.19Å; P42-N164 HydrophobicContact CB-CB 4.14Å; P42-N164 WeakPolarHBondContact CB-O 3.28Å; A160-N164 PolarHBondContact O-N 3.02Å; A160-N164 VanDerWaalsContact O-N 3.13Å; A160-N164 PolarHBondContact O-ND2 3.39Å; A160-N164 PolarHBondContact O-OD1 2.91Å; T161-N164 WeakPolarHBondContact O-CB 3.24Å; T161-N164 PolarHBondContact O-N 3.49Å; N164-A169 WeakPolarHBondContact O-CB 3.44Å; N164-K172 WeakPolarHBondContact OD1-CD 3.45Å; N164-K172 WeakPolarHBondContact OD1-CE 3.29Å; N164-K172 PolarHBondContact OD1-NZ 3.08Å
165	S	73.5	Confident	84.3	Confident	25 Å²	25	32.4 Å²	32.4	18%	0.175	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	13.1	-178.5	60.1	0	0	0	0	115.9	G41 P42 N60 L163	G41-S165 WeakPolarHBondContact O-CB 3.39Å; P42-S165 VanDerWaalsContact CA-CA 3.43Å; P42-S165 VanDerWaalsContact CA-CB 3.48Å; N60-S165 PolarHBondContact OD1-O 2.82Å; L163-S165 PolarHBondContact O-N 3.43Å
166	K	79.3	Confident	84.5	Confident	18 Å²	18	32.4 Å²	32.4	8%	0.078	20%	0.196	C	C	.	.	S	Bend	trans	-120.9	166.2	-171.7	-53.5	-169.9	-175.2	176.8	0	110.2	A162 L163 I168 A169 S388 D391	A162-K166 WeakPolarHBondContact O-CE 3.16Å; L163-K166 PolarHBondContact O-N 3.12Å; K166-I168 HydrophobicContact CB-CG1 4.43Å; K166-I168 PolarHBondContact O-N 3.31Å; K166-A169 VanDerWaalsContact O-CB 3.31Å; K166-A169 WeakPolarHBondContact O-CB 3.43Å; K166-A169 PolarHBondContact O-N 3.13Å; K166-S388 WeakPolarHBondContact CB-OG 3.27Å; K166-S388 VanDerWaalsContact CD-CB 3.41Å; K166-S388 VanDerWaalsContact CD-OG 3.26Å; K166-S388 WeakPolarHBondContact CD-OG 3.31Å; K166-D391 VanDerWaalsContact NZ-CG 3.34Å; K166-D391 IonicContact NZ-OD2 3.9Å; K166-D391 PolarHBondContact NZ-OD2 2.96Å
167	L	77.9	Confident	84.7	Confident	54 Å²	54	35.8 Å²	35.8	28%	0.283	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-24.1	179.3	-70	179	0	0	0	113.5	D46 F381 E384	D46-L167 VanDerWaalsContact OD2-CD2 3.23Å; D46-L167 WeakPolarHBondContact OD2-CD2 3.21Å; L167-F381 HydrophobicContact CD1-CD1 4Å; L167-F381 HydrophobicContact CD1-CE1 4.11Å; L167-F381 HydrophobicContact CD2-CE1 4.33Å; L167-E384 HydrophobicContact CD1-CB 3.86Å; L167-E384 HydrophobicContact CD1-CG 3.62Å; L167-E384 HydrophobicContact CG-CG 4.14Å
168	I	82.8	Confident	85	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	13.9	179.4	61.4	165.5	0	0	0	114.9	L163 K166 G170 E171 K172 F175 L205 T385 L389	L163-I168 HydrophobicContact CD1-CD1 4.04Å; L163-I168 HydrophobicContact CD2-CD1 3.47Å; L163-I168 VanDerWaalsContact CD2-CD1 3.47Å; L163-I168 HydrophobicContact CD2-CG1 4.01Å; L163-I168 HydrophobicContact CG-CD1 4.23Å; K166-I168 HydrophobicContact CB-CG1 4.43Å; K166-I168 PolarHBondContact O-N 3.31Å; I168-G170 PolarHBondContact O-N 3.19Å; I168-E171 CarbonylContact O-C 3.56Å; I168-E171 PolarHBondContact O-N 2.87Å; I168-E171 VanDerWaalsContact O-N 3.13Å; I168-K172 PolarHBondContact O-N 3.42Å; I168-F175 HydrophobicContact CB-CD2 4.19Å; I168-F175 HydrophobicContact CB-CE2 4.29Å; I168-F175 HydrophobicContact CD1-CB 4.35Å; I168-F175 HydrophobicContact CD1-CD2 3.95Å; I168-F175 HydrophobicContact CD1-CG 4.18Å; I168-F175 HydrophobicContact CG2-CE2 4.21Å; I168-L205 HydrophobicContact CG2-CD1 4.31Å; I168-T385 HydrophobicContact CD1-CG2 4.27Å; I168-T385 HydrophobicContact CG2-CG2 3.53Å; I168-T385 VanDerWaalsContact CG2-OG1 3.23Å; I168-T385 WeakPolarHBondContact CG2-OG1 3.37Å; I168-L389 HydrophobicContact CD1-CD2 4.01Å; I168-L389 HydrophobicContact CD1-CG 4.28Å
169	A	80.9	Confident	85.4	Confident	33 Å²	33	32.9 Å²	32.9	27%	0.273	20%	0.198	S	C	.	.	S	Bend	trans	-57.8	-31.3	179.8	0	0	0	0	0	113.5	N164 K166 K172	N164-A169 WeakPolarHBondContact O-CB 3.44Å; K166-A169 VanDerWaalsContact O-CB 3.31Å; K166-A169 WeakPolarHBondContact O-CB 3.43Å; K166-A169 PolarHBondContact O-N 3.13Å; A169-K172 WeakPolarHBondContact O-CD 3.33Å; A169-K172 WeakPolarHBondContact O-CG 3.47Å
170	G	82.8	Confident	85.6	Confident	68 Å²	68	32.9 Å²	32.9	70%	0.701	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-44.5	175.7	0	0	0	0	0	112.8	I168	I168-G170 PolarHBondContact O-N 3.19Å
171	E	86.4	Confident	85.8	Confident	65 Å²	65	34.5 Å²	34.5	30%	0.304	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	23.6	-177.3	-60.1	-47.9	129.7	0	0	113.4	I168 G173 F174 F175 E206	I168-E171 CarbonylContact O-C 3.56Å; I168-E171 PolarHBondContact O-N 2.87Å; I168-E171 VanDerWaalsContact O-N 3.13Å; E171-G173 VanDerWaalsContact C-N 3.25Å; E171-G173 PolarHBondContact O-N 3.26Å; E171-F174 WeakPolarHBondContact O-CB 3.39Å; E171-F174 PolarHBondContact O-N 3.04Å; E171-F174 VanDerWaalsContact O-N 3.13Å; E171-F175 HydrophobicContact CB-CD2 4.04Å; E171-F175 HydrophobicContact CB-CE2 4.03Å; E171-F175 WeakPolarHBondContact O-CD2 3.44Å; E171-F175 PolarHBondContact O-N 2.9Å; E171-F175 VanDerWaalsContact O-N 3.17Å; E171-E206 HydrophobicContact CG-CG 4.14Å
172	K	85.8	Confident	86	Confident	81 Å²	81	33.3 Å²	33.3	35%	0.352	20%	0.196	S	C	.	.	H	α-helix	trans	-57.2	-37.7	-176.2	69	-173.4	-179.9	-168.2	0	112.7	L163 N164 I168 A169 F174 F175 S176	L163-K172 HydrophobicContact CB-CB 4.15Å; N164-K172 WeakPolarHBondContact OD1-CD 3.45Å; N164-K172 WeakPolarHBondContact OD1-CE 3.29Å; N164-K172 PolarHBondContact OD1-NZ 3.08Å; I168-K172 PolarHBondContact O-N 3.42Å; A169-K172 WeakPolarHBondContact O-CD 3.33Å; A169-K172 WeakPolarHBondContact O-CG 3.47Å; K172-F174 VanDerWaalsContact C-N 3.27Å; K172-F174 PolarHBondContact O-N 2.81Å; K172-F175 PolarHBondContact O-N 3.01Å; K172-S176 WeakPolarHBondContact O-CB 3.46Å; K172-S176 PolarHBondContact O-N 3.41Å; K172-S176 PolarHBondContact O-OG 3Å
173	G	87.6	Confident	86.3	Confident	46 Å²	46	33.6 Å²	33.6	47%	0.474	20%	0.197	S	C	.	.	H	α-helix	trans	-63.6	-34.2	-178.6	0	0	0	0	0	113	E171 K177	E171-G173 VanDerWaalsContact C-N 3.25Å; E171-G173 PolarHBondContact O-N 3.26Å; G173-K177 WeakPolarHBondContact O-CG 3.44Å
174	F	91.4	Very high	86.3	Confident	74 Å²	74	38 Å²	38	33%	0.325	22%	0.219	S	C	.	.	H	α-helix	trans	-71.7	-52.2	175.7	177.6	-108.6	0	0	0	111.2	E171 K172 S176 K177 M178 E206 S208	E171-F174 WeakPolarHBondContact O-CB 3.39Å; E171-F174 PolarHBondContact O-N 3.04Å; E171-F174 VanDerWaalsContact O-N 3.13Å; K172-F174 VanDerWaalsContact C-N 3.27Å; K172-F174 PolarHBondContact O-N 2.81Å; F174-S176 PolarHBondContact O-N 2.91Å; F174-K177 PolarHBondContact O-N 3.37Å; F174-M178 HydrophobicContact CD1-CE 4.19Å; F174-M178 HydrophobicContact CE1-CE 3.38Å; F174-M178 HydrophobicContact CE2-CE 4.42Å; F174-M178 HydrophobicContact CZ-CE 3.53Å; F174-M178 PolarHBondContact O-N 3.44Å; F174-E206 WeakPolarHBondContact CZ-O 3.43Å; F174-S208 WeakPolarHBondContact CZ-O 3.43Å
175	F	91.6	Very high	86.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-69	-33.6	-178.4	-75.1	-62.7	0	0	0	113.5	L163 I168 E171 K172 K177 M178 V179 L205 L374 T385 L389	L163-F175 HydrophobicContact CD1-CB 3.83Å; I168-F175 HydrophobicContact CB-CD2 4.19Å; I168-F175 HydrophobicContact CB-CE2 4.29Å; I168-F175 HydrophobicContact CD1-CB 4.35Å; I168-F175 HydrophobicContact CD1-CD2 3.95Å; I168-F175 HydrophobicContact CD1-CG 4.18Å; I168-F175 HydrophobicContact CG2-CE2 4.21Å; E171-F175 HydrophobicContact CB-CD2 4.04Å; E171-F175 HydrophobicContact CB-CE2 4.03Å; E171-F175 WeakPolarHBondContact O-CD2 3.44Å; E171-F175 PolarHBondContact O-N 2.9Å; E171-F175 VanDerWaalsContact O-N 3.17Å; K172-F175 PolarHBondContact O-N 3.01Å; F175-K177 PolarHBondContact O-N 3.15Å; F175-M178 HydrophobicContact CD1-SD 4.3Å; F175-M178 WeakPolarHBondContact O-CB 3.43Å; F175-M178 PolarHBondContact O-N 3.23Å; F175-V179 WeakPolarHBondContact O-CB 3.23Å; F175-V179 VanDerWaalsContact O-CG2 3.23Å; F175-V179 WeakPolarHBondContact O-CG2 3.29Å; F175-V179 PolarHBondContact O-N 3.35Å; F175-L205 HydrophobicContact CE2-CB 4.21Å; F175-L205 HydrophobicContact CZ-CB 4.21Å; F175-L205 HydrophobicContact CZ-CD2 4.49Å; F175-L374 HydrophobicContact CE1-CD1 3.93Å; F175-L374 HydrophobicContact CZ-CD1 4.05Å; F175-T385 HydrophobicContact CZ-CG2 4.26Å; F175-L389 HydrophobicContact CB-CD2 3.78Å; F175-L389 HydrophobicContact CD1-CD1 4.06Å; F175-L389 HydrophobicContact CD1-CD2 3.57Å; F175-L389 HydrophobicContact CD1-CG 4.36Å; F175-L389 HydrophobicContact CE1-CD1 4.09Å; F175-L389 HydrophobicContact CE1-CD2 4.36Å; F175-L389 HydrophobicContact CG-CD2 3.84Å
176	S	91.3	Very high	86.6	Confident	4 Å²	4	38.1 Å²	38.1	3%	0.028	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-44	176.2	-66.1	0	0	0	0	111.8	A160 K172 F174 V179 V180	A160-S176 WeakPolarHBondContact CA-OG 3.19Å; A160-S176 PolarHBondContact N-OG 3.49Å; A160-S176 VanDerWaalsContact N-OG 3.12Å; K172-S176 WeakPolarHBondContact O-CB 3.46Å; K172-S176 PolarHBondContact O-N 3.41Å; K172-S176 PolarHBondContact O-OG 3Å; F174-S176 PolarHBondContact O-N 2.91Å; S176-V179 PolarHBondContact O-N 3.46Å; S176-V180 VanDerWaalsContact O-CG2 3.28Å; S176-V180 WeakPolarHBondContact O-CG2 3.36Å; S176-V180 PolarHBondContact O-N 2.88Å
177	K	92.3	Very high	86.1	Confident	115 Å²	115	40.9 Å²	40.9	50%	0.5	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-46.7	175	-69.4	176.3	-177.9	178.6	0	111	G173 F174 F175 V179 V180 D181	G173-K177 WeakPolarHBondContact O-CG 3.44Å; F174-K177 PolarHBondContact O-N 3.37Å; F175-K177 PolarHBondContact O-N 3.15Å; K177-V179 VanDerWaalsContact C-N 3.34Å; K177-V179 PolarHBondContact O-N 3.03Å; K177-V180 PolarHBondContact O-N 3.24Å; K177-D181 WeakPolarHBondContact O-CB 3.31Å; K177-D181 PolarHBondContact O-N 3.28Å
178	M	92.2	Very high	85.3	Confident	12 Å²	12	45.4 Å²	45.4	6%	0.059	26%	0.257	C	S	.	.	H	α-helix	trans	-58.7	-44	178.7	-166	-174.6	-69.9	0	0	112.6	F174 F175 A182 S208 L210 I372	F174-M178 HydrophobicContact CD1-CE 4.19Å; F174-M178 HydrophobicContact CE1-CE 3.38Å; F174-M178 HydrophobicContact CE2-CE 4.42Å; F174-M178 HydrophobicContact CZ-CE 3.53Å; F174-M178 PolarHBondContact O-N 3.44Å; F175-M178 HydrophobicContact CD1-SD 4.3Å; F175-M178 WeakPolarHBondContact O-CB 3.43Å; F175-M178 PolarHBondContact O-N 3.23Å; M178-A182 VanDerWaalsContact O-CB 3.29Å; M178-A182 WeakPolarHBondContact O-CB 3.26Å; M178-A182 PolarHBondContact O-N 3.08Å; M178-S208 WeakPolarHBondContact CE-O 3.24Å; M178-L210 HydrophobicContact CG-CB 3.77Å; M178-L210 HydrophobicContact SD-CB 4.48Å; M178-I372 HydrophobicContact SD-CG1 4.34Å; M178-I372 HydrophobicContact SD-CG2 3.69Å
179	V	91.9	Very high	84.2	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65	-44.7	178.1	167.3	0	0	0	0	110.7	F175 S176 K177 A182 V183 L389 A392 I393 V396	F175-V179 WeakPolarHBondContact O-CB 3.23Å; F175-V179 VanDerWaalsContact O-CG2 3.23Å; F175-V179 WeakPolarHBondContact O-CG2 3.29Å; F175-V179 PolarHBondContact O-N 3.35Å; S176-V179 PolarHBondContact O-N 3.46Å; K177-V179 VanDerWaalsContact C-N 3.34Å; K177-V179 PolarHBondContact O-N 3.03Å; V179-A182 PolarHBondContact O-N 3.31Å; V179-V183 WeakPolarHBondContact O-CG2 3.45Å; V179-V183 PolarHBondContact O-N 3.11Å; V179-L389 HydrophobicContact CG2-CD2 3.75Å; V179-A392 HydrophobicContact CG1-CB 4.18Å; V179-A392 HydrophobicContact CG2-CB 4.2Å; V179-I393 HydrophobicContact CB-CG1 4.44Å; V179-I393 HydrophobicContact CG1-CB 4.37Å; V179-I393 HydrophobicContact CG1-CG1 3.77Å; V179-I393 HydrophobicContact CG2-CG1 4.14Å; V179-V396 HydrophobicContact CG1-CB 4.29Å; V179-V396 HydrophobicContact CG1-CG2 3.91Å
180	V	90.8	Very high	83.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-44.1	178.4	173.7	0	0	0	0	111	R152 L155 E156 S176 K177 A182 V183 M184 V396	R152-V180 HydrophobicContact CG-CG1 4.03Å; L155-V180 HydrophobicContact CB-CG1 4.11Å; L155-V180 HydrophobicContact CB-CG2 3.74Å; L155-V180 HydrophobicContact CD1-CG1 4.36Å; E156-V180 HydrophobicContact CB-CG2 4.47Å; E156-V180 HydrophobicContact CG-CB 4.22Å; E156-V180 HydrophobicContact CG-CG1 4.42Å; E156-V180 HydrophobicContact CG-CG2 3.84Å; S176-V180 VanDerWaalsContact O-CG2 3.28Å; S176-V180 WeakPolarHBondContact O-CG2 3.36Å; S176-V180 PolarHBondContact O-N 2.88Å; K177-V180 PolarHBondContact O-N 3.24Å; V180-A182 VanDerWaalsContact C-N 3.34Å; V180-A182 PolarHBondContact O-N 3.48Å; V180-V183 PolarHBondContact O-N 2.95Å; V180-M184 HydrophobicContact CG1-CG 4.15Å; V180-M184 HydrophobicContact CG1-SD 3.75Å; V180-M184 WeakPolarHBondContact O-CB 3.36Å; V180-M184 VanDerWaalsContact O-CG 3.27Å; V180-M184 WeakPolarHBondContact O-CG 3.35Å; V180-M184 PolarHBondContact O-N 3.33Å; V180-V396 HydrophobicContact CG2-CG1 4.22Å; V180-V396 HydrophobicContact CG2-CG2 4.26Å
181	D	90	Very high	82.7	Confident	57 Å²	57	52.2 Å²	52.2	31%	0.305	28%	0.275	S	S	.	.	H	α-helix	trans	-61.6	-42.1	175.1	-72.3	-35	0	0	0	112	R152 K177 V183 M184 S185 L210	R152-D181 IonicContact CZ-OD1 2.77Å; R152-D181 IonicContact NH1-OD1 3.3Å; R152-D181 PolarHBondContact NH1-OD1 2.86Å; R152-D181 VanDerWaalsContact NH2-CG 3.3Å; R152-D181 IonicContact NH2-OD1 3.66Å; R152-D181 PolarHBondContact NH2-OD1 3.33Å; R152-D181 IonicContact NH2-OD2 2.62Å; R152-D181 PolarHBondContact NH2-OD2 3.02Å; K177-D181 WeakPolarHBondContact O-CB 3.31Å; K177-D181 PolarHBondContact O-N 3.28Å; D181-V183 PolarHBondContact O-N 3.39Å; D181-M184 PolarHBondContact O-N 2.95Å; D181-S185 WeakPolarHBondContact O-CB 3.19Å; D181-S185 PolarHBondContact O-N 3.23Å; D181-L210 HydrophobicContact CB-CD2 3.5Å
182	A	89.8	Confident	82.1	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-44.9	176.2	0	0	0	0	0	111.6	M178 V179 V180 S185 L186 I195 L210 I372	M178-A182 VanDerWaalsContact O-CB 3.29Å; M178-A182 WeakPolarHBondContact O-CB 3.26Å; M178-A182 PolarHBondContact O-N 3.08Å; V179-A182 PolarHBondContact O-N 3.31Å; V180-A182 VanDerWaalsContact C-N 3.34Å; V180-A182 PolarHBondContact O-N 3.48Å; A182-S185 PolarHBondContact O-N 3.45Å; A182-S185 PolarHBondContact O-OG 3.34Å; A182-L186 WeakPolarHBondContact O-CD1 3.3Å; A182-I195 HydrophobicContact CB-CD1 4.39Å; A182-I195 HydrophobicContact CB-CG2 4.48Å; A182-L210 HydrophobicContact CB-CD1 3.84Å; A182-L210 HydrophobicContact CB-CD2 4.29Å; A182-I372 HydrophobicContact CB-CD1 4.24Å
183	V	88.3	Confident	81.9	Confident	10 Å²	10	55.3 Å²	55.3	6%	0.061	29%	0.29	C	S	.	.	H	α-helix	trans	-72.2	-40	-179.9	-179.5	0	0	0	0	111.8	V179 V180 D181 S185 L186 I195 I393 V396 R397 I400	V179-V183 WeakPolarHBondContact O-CG2 3.45Å; V179-V183 PolarHBondContact O-N 3.11Å; V180-V183 PolarHBondContact O-N 2.95Å; D181-V183 PolarHBondContact O-N 3.39Å; V183-S185 PolarHBondContact O-N 3.2Å; V183-L186 WeakPolarHBondContact O-CB 3.3Å; V183-L186 PolarHBondContact O-N 3.41Å; V183-L186 VanDerWaalsContact O-N 3.12Å; V183-I195 HydrophobicContact CG2-CD1 4.23Å; V183-I393 HydrophobicContact CG2-CB 4.43Å; V183-I393 HydrophobicContact CG2-CG2 3.91Å; V183-V396 HydrophobicContact CB-CG1 3.86Å; V183-V396 HydrophobicContact CG1-CG1 4.01Å; V183-V396 HydrophobicContact CG2-CB 4.25Å; V183-V396 HydrophobicContact CG2-CG1 3.93Å; V183-R397 HydrophobicContact CG1-CB 4.22Å; V183-I400 HydrophobicContact CB-CD1 4.45Å; V183-I400 HydrophobicContact CG1-CD1 3.45Å; V183-I400 VanDerWaalsContact CG1-CD1 3.45Å
184	M	85.4	Confident	81.7	Confident	93 Å²	93	53.9 Å²	53.9	46%	0.458	27%	0.271	S	S	.	.	H	α-helix	trans	-68.2	-24	177	-71.3	-174.6	76.1	0	0	112.9	R152 V180 D181 L186	R152-M184 HydrophobicContact CG-SD 4.34Å; V180-M184 HydrophobicContact CG1-CG 4.15Å; V180-M184 HydrophobicContact CG1-SD 3.75Å; V180-M184 WeakPolarHBondContact O-CB 3.36Å; V180-M184 VanDerWaalsContact O-CG 3.27Å; V180-M184 WeakPolarHBondContact O-CG 3.35Å; V180-M184 PolarHBondContact O-N 3.33Å; D181-M184 PolarHBondContact O-N 2.95Å; M184-L186 PolarHBondContact O-N 3.07Å
185	S	82.1	Confident	81.6	Confident	43 Å²	43	51.1 Å²	51.1	30%	0.301	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-16.2	172.7	75.7	0	0	0	0	113.6	D181 A182 V183 C370	D181-S185 WeakPolarHBondContact O-CB 3.19Å; D181-S185 PolarHBondContact O-N 3.23Å; A182-S185 PolarHBondContact O-N 3.45Å; A182-S185 PolarHBondContact O-OG 3.34Å; V183-S185 PolarHBondContact O-N 3.2Å; S185-C370 PolarHBondContact OG-SG 3.23Å; S185-C370 VanDerWaalsContact OG-SG 3.35Å
186	L	78	Confident	81.6	Confident	25 Å²	25	51.6 Å²	51.6	13%	0.131	26%	0.264	C	S	.	.	S	Bend	trans	-90	146.8	177.3	-63.4	148.1	0	0	0	110.5	A182 V183 M184 L190 M194 I195 K368	A182-L186 WeakPolarHBondContact O-CD1 3.3Å; V183-L186 WeakPolarHBondContact O-CB 3.3Å; V183-L186 PolarHBondContact O-N 3.41Å; V183-L186 VanDerWaalsContact O-N 3.12Å; M184-L186 PolarHBondContact O-N 3.07Å; L186-L190 HydrophobicContact CD2-CB 4.39Å; L186-M194 HydrophobicContact CD2-CB 3.49Å; L186-M194 VanDerWaalsContact CD2-CB 3.49Å; L186-M194 HydrophobicContact CD2-CG 4.44Å; L186-I195 HydrophobicContact CD1-CD1 3.35Å; L186-I195 HydrophobicContact CD1-CG1 3.34Å; L186-I195 HydrophobicContact CD2-CG1 4.41Å; L186-I195 HydrophobicContact CG-CG1 4.28Å; L186-K368 VanDerWaalsContact CD2-O 3.31Å; L186-K368 WeakPolarHBondContact CD2-O 3.47Å
187	D	68.8	Low	81.6	Confident	77 Å²	77	52.7 Å²	52.7	41%	0.412	27%	0.27	S	S	.	.			trans	-70.1	150.6	167.6	-151	-13	0	0	0	110.6	L189 L190 K368	D187-L189 PolarHBondContact O-N 3.49Å; D187-L190 HydrophobicContact CB-CD1 3.44Å; D187-L190 VanDerWaalsContact CB-CD1 3.44Å; D187-L190 PolarHBondContact O-N 2.88Å; D187-K368 HydrophobicContact CB-CD 4.17Å; D187-K368 IonicContact OD2-NZ 2.63Å; D187-K368 PolarHBondContact OD2-NZ 2.95Å
188	E	60.7	Low	81.6	Confident	149 Å²	149	48.7 Å²	48.7	70%	0.696	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-24.6	-169.8	-68.3	-173.9	163.8	0	0	114.1
189	L	60.3	Low	81.6	Confident	161 Å²	161	52 Å²	52	84%	0.843	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-10.1	-177.2	-65.7	170.1	0	0	0	114.2	D187	D187-L189 PolarHBondContact O-N 3.49Å
190	L	61.2	Low	81.6	Confident	29 Å²	29	52 Å²	52	15%	0.152	27%	0.266	C	S	.	.			trans	-77	153.9	-173.2	-94.7	110.9	0	0	0	113.8	L186 D187 M194 M324 K368 R397	L186-L190 HydrophobicContact CD2-CB 4.39Å; D187-L190 HydrophobicContact CB-CD1 3.44Å; D187-L190 VanDerWaalsContact CB-CD1 3.44Å; D187-L190 PolarHBondContact O-N 2.88Å; L190-M194 HydrophobicContact CB-CG 4.49Å; L190-M194 HydrophobicContact CD2-CB 4.4Å; L190-M194 HydrophobicContact CD2-CE 3.4Å; L190-M194 VanDerWaalsContact CD2-CE 3.4Å; L190-M194 HydrophobicContact CD2-CG 3.51Å; L190-M194 HydrophobicContact CD2-SD 3.98Å; L190-M324 HydrophobicContact CD2-CE 4.03Å; L190-K368 HydrophobicContact CD1-CB 4.09Å; L190-K368 HydrophobicContact CD1-CD 3.58Å; L190-K368 HydrophobicContact CD1-CG 4.43Å; L190-K368 HydrophobicContact CD2-CB 4.3Å; L190-R397 PolarHBondContact O-NH2 2.94Å
191	S	70.3	Confident	81.6	Confident	55 Å²	55	57.5 Å²	57.5	39%	0.385	29%	0.292	S	S	.	.			trans	-81.4	153	-175.5	76.5	0	0	0	0	112.4	K193 M194	S191-K193 PolarHBondContact O-N 3.37Å; S191-K193 VanDerWaalsContact O-N 3.14Å; S191-M194 WeakPolarHBondContact O-CB 3.19Å; S191-M194 VanDerWaalsContact O-CG 3.29Å; S191-M194 WeakPolarHBondContact O-CG 3.21Å; S191-M194 PolarHBondContact O-N 3.14Å; S191-M194 VanDerWaalsContact O-N 3.13Å
192	L	74.5	Confident	81.5	Confident	39 Å²	39	56.2 Å²	56.2	20%	0.204	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-57.7	-26.6	176.5	-69.9	165.9	0	0	0	113.3	M194 I195 I393 M394	L192-M194 PolarHBondContact O-N 3.5Å; L192-I195 PolarHBondContact O-N 3.41Å; L192-I393 HydrophobicContact CD2-CG2 3.54Å; L192-M394 HydrophobicContact CD1-CE 3.46Å; L192-M394 VanDerWaalsContact CD1-CE 3.46Å; L192-M394 HydrophobicContact CD1-CG 3.74Å; L192-M394 HydrophobicContact CD1-SD 4.42Å; L192-M394 HydrophobicContact CD2-CG 4.45Å
193	K	81.1	Confident	81.4	Confident	173 Å²	173	58.1 Å²	58.1	75%	0.752	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-59.1	-12.3	177.3	-59.3	-174.6	177.4	-173.9	0	113.8	S191	S191-K193 PolarHBondContact O-N 3.37Å; S191-K193 VanDerWaalsContact O-N 3.14Å
194	M	84.6	Confident	81.4	Confident	16 Å²	16	60 Å²	60	8%	0.079	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-85.4	-21.3	178.8	-58.4	-63.9	-74.6	0	0	112.5	L186 L190 S191 L192 R321 M324 T369	L186-M194 HydrophobicContact CD2-CB 3.49Å; L186-M194 VanDerWaalsContact CD2-CB 3.49Å; L186-M194 HydrophobicContact CD2-CG 4.44Å; L190-M194 HydrophobicContact CB-CG 4.49Å; L190-M194 HydrophobicContact CD2-CB 4.4Å; L190-M194 HydrophobicContact CD2-CE 3.4Å; L190-M194 VanDerWaalsContact CD2-CE 3.4Å; L190-M194 HydrophobicContact CD2-CG 3.51Å; L190-M194 HydrophobicContact CD2-SD 3.98Å; S191-M194 WeakPolarHBondContact O-CB 3.19Å; S191-M194 VanDerWaalsContact O-CG 3.29Å; S191-M194 WeakPolarHBondContact O-CG 3.21Å; S191-M194 PolarHBondContact O-N 3.14Å; S191-M194 VanDerWaalsContact O-N 3.13Å; L192-M194 PolarHBondContact O-N 3.5Å; M194-R321 PolarHBondContact O-NE 3.05Å; M194-M324 HydrophobicContact CE-CB 3.41Å; M194-M324 VanDerWaalsContact CE-CB 3.41Å; M194-M324 HydrophobicContact CE-CE 3.89Å; M194-M324 HydrophobicContact CE-CG 3.57Å; M194-M324 HydrophobicContact SD-CG 4.45Å; M194-T369 WeakPolarHBondContact O-CB 3.42Å; M194-T369 PolarHBondContact O-OG1 3.46Å
195	I	89.5	Confident	81.4	Confident	16 Å²	16	57.6 Å²	57.6	8%	0.082	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	111.6	165.3	-56.1	164.4	0	0	0	106.4	A182 V183 L186 L192 C370 I372 I393	A182-I195 HydrophobicContact CB-CD1 4.39Å; A182-I195 HydrophobicContact CB-CG2 4.48Å; V183-I195 HydrophobicContact CG2-CD1 4.23Å; L186-I195 HydrophobicContact CD1-CD1 3.35Å; L186-I195 HydrophobicContact CD1-CG1 3.34Å; L186-I195 HydrophobicContact CD2-CG1 4.41Å; L186-I195 HydrophobicContact CG-CG1 4.28Å; L192-I195 PolarHBondContact O-N 3.41Å; I195-C370 WeakPolarHBondContact CA-O 3.43Å; I195-I372 HydrophobicContact CG2-CD1 3.95Å; I195-I372 HydrophobicContact CG2-CG1 4.34Å; I195-I393 HydrophobicContact CD1-CB 4.47Å; I195-I393 HydrophobicContact CD1-CD1 4.19Å; I195-I393 HydrophobicContact CD1-CG1 4.28Å; I195-I393 HydrophobicContact CD1-CG2 3.34Å; I195-I393 HydrophobicContact CG2-CD1 4.04Å
196	G	89.6	Confident	81.7	Confident	10 Å²	10	61 Å²	61	10%	0.103	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	135.8	173	0	0	0	0	0	110.1	R321 C370 T371 I372	G196-R321 VanDerWaalsContact N-CZ 3.32Å; G196-C370 PolarHBondContact N-O 3Å; G196-C370 VanDerWaalsContact N-O 3.12Å; G196-T371 CarbonylContact O-C 3.56Å; G196-T371 VanDerWaalsContact O-CA 3.25Å; G196-T371 WeakPolarHBondContact O-CA 3.22Å; G196-I372 PolarHBondContact O-N 3.31Å
197	I	92.5	Very high	82.3	Confident	27 Å²	27	63.7 Å²	63.7	14%	0.138	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.6	171.8	-56.2	175.4	0	0	0	106.9	I372 L374 E386 L389 I393	I197-I372 CarbonylContact C-O 3.52Å; I197-I372 WeakPolarHBondContact CA-O 3.42Å; I197-I372 HydrophobicContact CG1-CB 4.31Å; I197-I372 HydrophobicContact CG1-CD1 4.44Å; I197-L374 HydrophobicContact CG2-CB 4.05Å; I197-L374 HydrophobicContact CG2-CD2 4.33Å; I197-E386 HydrophobicContact CB-CG 4.22Å; I197-E386 HydrophobicContact CD1-CG 4.1Å; I197-E386 HydrophobicContact CG2-CB 4.3Å; I197-E386 HydrophobicContact CG2-CG 3.99Å; I197-L389 HydrophobicContact CD1-CB 4.23Å; I197-I393 HydrophobicContact CD1-CD1 4.32Å
198	K	92.6	Very high	83.4	Confident	30 Å²	30	60.3 Å²	60.3	13%	0.13	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	115.5	177.7	-64.1	-62	179.6	-178.3	0	109.1	D318 Y358 T371 I372 I373 L374	K198-D318 WeakPolarHBondContact CE-OD1 3.42Å; K198-D318 IonicContact NZ-OD1 2.78Å; K198-D318 PolarHBondContact NZ-OD1 3.11Å; K198-D318 IonicContact NZ-OD2 2.78Å; K198-D318 PolarHBondContact NZ-OD2 3.05Å; K198-Y358 HydrophobicContact CB-CE1 3.87Å; K198-Y358 HydrophobicContact CG-CE1 4.33Å; K198-T371 HydrophobicContact CB-CG2 4.18Å; K198-T371 HydrophobicContact CG-CG2 3.63Å; K198-I372 PolarHBondContact N-O 2.82Å; K198-I373 CarbonylContact O-C 3.48Å; K198-I373 WeakPolarHBondContact O-CA 3.34Å; K198-L374 PolarHBondContact O-N 2.71Å
199	K	92.3	Very high	84.9	Confident	81 Å²	81	56.7 Å²	56.7	35%	0.352	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	128.8	-178.9	-61.2	-175.4	-75.4	-154.4	0	110.5	Y358 L374 T382 E386	K199-Y358 PolarHBondContact O-OH 2.94Å; K199-L374 CarbonylContact C-O 3.55Å; K199-L374 WeakPolarHBondContact CA-O 3.47Å; K199-L374 HydrophobicContact CG-CD2 4.48Å; K199-T382 HydrophobicContact CB-CG2 3.66Å; K199-T382 HydrophobicContact CD-CG2 3.88Å; K199-T382 HydrophobicContact CG-CG2 3.66Å; K199-E386 HydrophobicContact CD-CB 4.39Å; K199-E386 WeakPolarHBondContact CD-OE2 3.4Å; K199-E386 WeakPolarHBondContact CE-OE2 3.27Å; K199-E386 IonicContact NZ-OE2 2.89Å; K199-E386 PolarHBondContact NZ-OE2 2.95Å
200	V	91.4	Very high	86.4	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	122.7	176.1	-177.5	0	0	0	0	108.3	V353 Y358 I373 L374 R375 G376	V200-V353 HydrophobicContact CB-CG1 4.49Å; V200-V353 HydrophobicContact CG1-CB 4.47Å; V200-V353 HydrophobicContact CG1-CG1 4.06Å; V200-V353 VanDerWaalsContact CG1-O 3.24Å; V200-V353 WeakPolarHBondContact CG1-O 3.44Å; V200-V353 HydrophobicContact CG2-CG1 4.29Å; V200-Y358 HydrophobicContact CG2-CD2 4.36Å; V200-Y358 HydrophobicContact CG2-CE1 4.24Å; V200-Y358 HydrophobicContact CG2-CE2 3.55Å; V200-Y358 VanDerWaalsContact CG2-CZ 3.47Å; V200-Y358 WeakPolarHBondContact CG2-OH 3.39Å; V200-I373 HydrophobicContact CG2-CG2 3.75Å; V200-L374 PolarHBondContact N-O 2.95Å; V200-R375 WeakPolarHBondContact O-CA 3.4Å; V200-G376 PolarHBondContact O-N 3Å
201	Q	90.2	Very high	87.9	Confident	116 Å²	116	50 Å²	50	54%	0.542	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	143.7	177.6	-66.2	-176.9	-5.3	0	0	111.3
202	G	87.5	Confident	88.6	Confident	29 Å²	29	51.3 Å²	51.3	30%	0.299	28%	0.282	S	S	.	.	B	Isolated β-bridge	trans	89.6	156.3	-178.9	0	0	0	0	0	113.6	R375 G376	G202-R375 PolarHBondContact O-NE 3.47Å; G202-R375 VanDerWaalsContact O-NE 3.15Å; G202-R375 PolarHBondContact O-NH1 2.82Å; G202-G376 PolarHBondContact N-O 3.2Å
203	G	87.7	Confident	89.3	Confident	40 Å²	40	49.5 Å²	49.5	41%	0.412	27%	0.273	S	S	.	.	S	Bend	trans	89.5	-177.8	-174.5	0	0	0	0	0	114.1	D207 R375 G377	G203-D207 VanDerWaalsContact CA-OD2 3.29Å; G203-D207 WeakPolarHBondContact CA-OD2 3.21Å; G203-R375 VanDerWaalsContact CA-NH2 3.32Å; G203-G377 PolarHBondContact O-N 2.87Å
204	A	88.8	Confident	89.8	Confident	50 Å²	50	41.2 Å²	41.2	41%	0.413	24%	0.237	S	C	.	.			trans	-89.4	162.3	172.5	0	0	0	0	0	110.9	E206 D207 R375	A204-E206 PolarHBondContact O-N 3.25Å; A204-D207 PolarHBondContact N-OD2 3.08Å; A204-D207 WeakPolarHBondContact O-CB 3.5Å; A204-D207 PolarHBondContact O-N 3.46Å; A204-R375 WeakPolarHBondContact O-CB 3.47Å
205	L	86.1	Confident	90.2	Very high	42 Å²	42	40.5 Å²	40.5	22%	0.22	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-62.3	-33	173.9	-71.8	165.4	0	0	0	111.7	I168 F175 D207 S208 R375 T385	I168-L205 HydrophobicContact CG2-CD1 4.31Å; F175-L205 HydrophobicContact CE2-CB 4.21Å; F175-L205 HydrophobicContact CZ-CB 4.21Å; F175-L205 HydrophobicContact CZ-CD2 4.49Å; L205-D207 PolarHBondContact O-N 3.48Å; L205-S208 WeakPolarHBondContact O-CB 3.43Å; L205-S208 PolarHBondContact O-N 2.7Å; L205-S208 VanDerWaalsContact O-N 3.16Å; L205-S208 PolarHBondContact O-OG 2.68Å; L205-R375 WeakPolarHBondContact CD2-O 3.35Å; L205-T385 HydrophobicContact CD2-CG2 4.31Å
206	E	88.1	Confident	90.4	Very high	116 Å²	116	39.8 Å²	39.8	54%	0.542	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-65.5	-21.4	176.3	-65.7	174.1	-148.1	0	0	113.6	E171 F174 A204 S208	E171-E206 HydrophobicContact CG-CG 4.14Å; F174-E206 WeakPolarHBondContact CZ-O 3.43Å; A204-E206 PolarHBondContact O-N 3.25Å; E206-S208 PolarHBondContact O-N 3.16Å
207	D	90.3	Very high	90.5	Very high	81 Å²	81	43.8 Å²	43.8	43%	0.433	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-71.1	-7.1	174.8	-64	-20.5	0	0	0	112.3	G203 A204 L205 R375	G203-D207 VanDerWaalsContact CA-OD2 3.29Å; G203-D207 WeakPolarHBondContact CA-OD2 3.21Å; A204-D207 PolarHBondContact N-OD2 3.08Å; A204-D207 WeakPolarHBondContact O-CB 3.5Å; A204-D207 PolarHBondContact O-N 3.46Å; L205-D207 PolarHBondContact O-N 3.48Å; D207-R375 HydrophobicContact CB-CB 3.92Å; D207-R375 HydrophobicContact CB-CG 3.89Å; D207-R375 IonicContact OD2-CZ 3Å; D207-R375 IonicContact OD2-NE 3.86Å; D207-R375 IonicContact OD2-NH2 3.75Å; D207-R375 PolarHBondContact OD2-NH2 2.81Å
208	S	92.2	Very high	90.4	Very high	5 Å²	5	44.9 Å²	44.9	4%	0.035	25%	0.248	C	C	.	.			trans	-65.6	146.7	179.8	-56.6	0	0	0	0	110.6	F174 M178 L205 E206 I373 R375	F174-S208 WeakPolarHBondContact CZ-O 3.43Å; M178-S208 WeakPolarHBondContact CE-O 3.24Å; L205-S208 WeakPolarHBondContact O-CB 3.43Å; L205-S208 PolarHBondContact O-N 2.7Å; L205-S208 VanDerWaalsContact O-N 3.16Å; L205-S208 PolarHBondContact O-OG 2.68Å; E206-S208 PolarHBondContact O-N 3.16Å; S208-I373 CarbonylContact C-O 3.55Å; S208-I373 WeakPolarHBondContact CA-O 3.49Å; S208-I373 VanDerWaalsContact CB-O 3.24Å; S208-I373 WeakPolarHBondContact CB-O 3.3Å; S208-R375 PolarHBondContact OG-N 3.15Å
209	Q	92.2	Very high	90	Very high	74 Å²	74	44.7 Å²	44.7	35%	0.346	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	146.3	-177.1	59.7	176.8	-17.5	0	0	112.5	V211 I373	Q209-V211 HydrophobicContact CG-CG2 4.49Å; Q209-I373 HydrophobicContact CG-CB 4Å; Q209-I373 HydrophobicContact CG-CD1 4.43Å; Q209-I373 PolarHBondContact N-O 3.16Å; Q209-I373 PolarHBondContact O-N 3.38Å
210	L	92.7	Very high	89.4	Confident	45 Å²	45	46.4 Å²	46.4	24%	0.236	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.5	168.4	-179.3	66.4	0	0	0	109.5	M178 D181 A182 C370 I372	M178-L210 HydrophobicContact CG-CB 3.77Å; M178-L210 HydrophobicContact SD-CB 4.48Å; D181-L210 HydrophobicContact CB-CD2 3.5Å; A182-L210 HydrophobicContact CB-CD1 3.84Å; A182-L210 HydrophobicContact CB-CD2 4.29Å; L210-C370 HydrophobicContact CD1-CB 3.85Å; L210-I372 HydrophobicContact CD1-CG1 3.67Å
211	V	90.8	Very high	88.7	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.024	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	118.4	174.1	-176.7	0	0	0	0	108.7	Q209 G213 A215 F360 K362 C370 T371 I373	Q209-V211 HydrophobicContact CG-CG2 4.49Å; V211-G213 PolarHBondContact O-N 3.44Å; V211-A215 HydrophobicContact CG2-CB 4.33Å; V211-F360 HydrophobicContact CG1-CD1 4.08Å; V211-F360 HydrophobicContact CG2-CD1 3.84Å; V211-F360 HydrophobicContact CG2-CE1 3.67Å; V211-K362 HydrophobicContact CG1-CG 4.25Å; V211-C370 WeakPolarHBondContact O-CA 3.45Å; V211-C370 WeakPolarHBondContact O-CB 3.35Å; V211-T371 WeakPolarHBondContact CB-O 3.45Å; V211-T371 PolarHBondContact N-O 3.06Å; V211-T371 PolarHBondContact O-N 2.88Å; V211-T371 VanDerWaalsContact O-N 3.08Å; V211-I373 HydrophobicContact CG2-CD1 3.93Å; V211-I373 HydrophobicContact CG2-CG1 4.17Å
212	S	86.9	Confident	88.2	Confident	83 Å²	83	45 Å²	45	58%	0.58	25%	0.252	S	S	*	.	S	Bend	trans	-72.1	75.5	170.6	-56.4	0	0	0	0	110.7
213	G	88.7	Confident	87.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.6	-142.8	-176.8	0	0	0	0	0	110.9	V211 F361 C370 T371	V211-G213 PolarHBondContact O-N 3.44Å; G213-F361 WeakPolarHBondContact CA-O 3.41Å; G213-C370 CarbonylContact O-C 3.48Å; G213-C370 VanDerWaalsContact O-CA 3.24Å; G213-C370 WeakPolarHBondContact O-CA 3.46Å; G213-T371 PolarHBondContact O-N 2.83Å; G213-T371 VanDerWaalsContact O-N 3.15Å
214	V	91.6	Very high	86.5	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	134.6	-177.7	-176.8	0	0	0	0	109.7	F216 R321 A325 F361 T369	V214-F216 HydrophobicContact CG1-CD1 4.17Å; V214-R321 HydrophobicContact CG1-CB 4.33Å; V214-R321 HydrophobicContact CG2-CB 3.97Å; V214-A325 HydrophobicContact CG2-CB 3.65Å; V214-F361 HydrophobicContact CB-CB 4.48Å; V214-F361 PolarHBondContact N-O 3.15Å; V214-F361 VanDerWaalsContact N-O 3.15Å; V214-F361 PolarHBondContact O-N 3.49Å; V214-T369 HydrophobicContact CG2-CG2 3.76Å
215	A	93	Very high	86.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138.3	168	0	0	0	0	0	110.3	V211 N359 F360 T371 I373	V211-A215 HydrophobicContact CG2-CB 4.33Å; A215-N359 VanDerWaalsContact CA-O 3.24Å; A215-N359 WeakPolarHBondContact CA-O 3.13Å; A215-F360 HydrophobicContact CB-CD1 3.89Å; A215-F360 HydrophobicContact CB-CE1 4.13Å; A215-F360 HydrophobicContact CB-CG 4.42Å; A215-T371 HydrophobicContact CB-CG2 3.94Å; A215-T371 PolarHBondContact N-OG1 3.29Å; A215-T371 PolarHBondContact O-OG1 2.92Å; A215-I373 HydrophobicContact CB-CD1 3.98Å; A215-I373 HydrophobicContact CB-CG1 4.39Å
216	F	93.3	Very high	86	Confident	2 Å²	2	47 Å²	47	1%	0.009	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154.8	173.2	60.5	-93.3	0	0	0	110.6	V214 L290 V314 D318 N359 F361	V214-F216 HydrophobicContact CG1-CD1 4.17Å; F216-L290 HydrophobicContact CE1-CD1 4.11Å; F216-L290 HydrophobicContact CZ-CD1 3.93Å; F216-L290 HydrophobicContact CZ-CD2 3.89Å; F216-V314 HydrophobicContact CE2-CG1 4.28Å; F216-V314 HydrophobicContact CE2-CG2 4.22Å; F216-V314 HydrophobicContact CZ-CG1 4.32Å; F216-V314 HydrophobicContact CZ-CG2 4.46Å; F216-D318 HydrophobicContact CB-CB 4.15Å; F216-D318 WeakPolarHBondContact CB-OD2 3.42Å; F216-D318 HydrophobicContact CD1-CB 4.16Å; F216-D318 HydrophobicContact CG-CB 4.23Å; F216-N359 HydrophobicContact CE2-CB 4.2Å; F216-N359 WeakPolarHBondContact CE2-ND2 2.93Å; F216-N359 HydrophobicContact CZ-CB 4.21Å; F216-N359 PolarHBondContact N-O 3.42Å; F216-N359 VanDerWaalsContact N-O 3.16Å; F216-N359 PolarHBondContact O-N 3.22Å; F216-F361 HydrophobicContact CD1-CE2 4.27Å; F216-F361 HydrophobicContact CE1-CD2 4.12Å; F216-F361 AromaticContact CE1-CE2 3.38Å; F216-F361 HydrophobicContact CE1-CE2 3.38Å; F216-F361 HydrophobicContact CE1-CZ 4.18Å; F216-F361 AromaticContact CZ-CE2 3.85Å; F216-F361 HydrophobicContact CZ-CE2 3.85Å; F216-F361 HydrophobicContact CZ-CZ 4.35Å
217	K	91.9	Very high	85.7	Confident	93 Å²	93	49.1 Å²	49.1	40%	0.404	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	142	-179.8	-177.5	-178.4	173.7	161	0	110.4	T219 E356 Y358	K217-T219 PolarHBondContact O-N 3.46Å; K217-T219 VanDerWaalsContact O-N 3.15Å; K217-E356 WeakPolarHBondContact CD-OE2 3.49Å; K217-E356 WeakPolarHBondContact CE-OE1 3.3Å; K217-E356 WeakPolarHBondContact CE-OE2 3.39Å; K217-E356 IonicContact NZ-OE1 2.76Å; K217-E356 PolarHBondContact NZ-OE1 3.42Å; K217-E356 IonicContact NZ-OE2 3.75Å; K217-E356 PolarHBondContact NZ-OE2 2.83Å; K217-Y358 HydrophobicContact CB-CE1 4.08Å; K217-Y358 HydrophobicContact CB-CE2 4.07Å; K217-Y358 HydrophobicContact CG-CE2 4.17Å
218	K	89.3	Confident	85.5	Confident	51 Å²	51	45.4 Å²	45.4	22%	0.222	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-49.2	122.6	169.2	174.2	179.6	172.4	177.6	0	109.1	S221 F225 E226 R357	K218-S221 WeakPolarHBondContact CE-OG 3.49Å; K218-F225 HydrophobicContact CD-CE1 3.75Å; K218-F225 HydrophobicContact CD-CZ 4.17Å; K218-F225 VanDerWaalsContact CE-CD1 3.48Å; K218-F225 HydrophobicContact CG-CE1 4.42Å; K218-F225 HydrophobicContact CG-CZ 4.36Å; K218-E226 IonicContact NZ-OE1 2.71Å; K218-E226 PolarHBondContact NZ-OE1 3.34Å; K218-R357 HydrophobicContact CB-CB 4.02Å; K218-R357 VanDerWaalsContact CB-O 3.28Å; K218-R357 WeakPolarHBondContact CB-O 3.39Å; K218-R357 HydrophobicContact CD-CB 4.12Å; K218-R357 PolarHBondContact N-O 2.86Å
219	T	85.6	Confident	85.3	Confident	25 Å²	25	46.8 Å²	46.8	15%	0.153	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-79.6	172.7	177.4	57.6	0	0	0	0	110.3	K217 S221 G312 V314	K217-T219 PolarHBondContact O-N 3.46Å; K217-T219 VanDerWaalsContact O-N 3.15Å; T219-S221 PolarHBondContact O-N 3.24Å; T219-S221 PolarHBondContact O-OG 3.09Å; T219-S221 VanDerWaalsContact O-OG 3.08Å; T219-G312 WeakPolarHBondContact CB-O 3.32Å; T219-G312 PolarHBondContact OG1-O 3.4Å; T219-V314 HydrophobicContact CG2-CG2 4.15Å
220	F	79.8	Confident	85.2	Confident	117 Å²	117	45.4 Å²	45.4	51%	0.513	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-55.5	129.1	175	-176.4	-91.4	0	0	0	110.2	Y222	F220-Y222 HydrophobicContact CD1-CD2 4.41Å; F220-Y222 HydrophobicContact CD1-CE2 4.18Å; F220-Y222 AromaticContact CE1-CD1 3.76Å; F220-Y222 HydrophobicContact CE1-CD1 3.76Å; F220-Y222 HydrophobicContact CE1-CD2 4.05Å; F220-Y222 AromaticContact CE1-CE1 3.55Å; F220-Y222 HydrophobicContact CE1-CE1 3.55Å; F220-Y222 AromaticContact CE1-CE2 3.85Å; F220-Y222 HydrophobicContact CE1-CE2 3.85Å; F220-Y222 HydrophobicContact CE1-CG 4.05Å; F220-Y222 AromaticContact CE1-CZ 3.64Å; F220-Y222 HydrophobicContact CZ-CD1 4.32Å; F220-Y222 HydrophobicContact CZ-CE1 4.2Å
221	S	76.6	Confident	85.3	Confident	32 Å²	32	50.2 Å²	50.2	22%	0.224	26%	0.259	C	S	.	.			trans	-132.5	143.4	-179.4	-41.5	0	0	0	0	109.5	K218 T219	K218-S221 WeakPolarHBondContact CE-OG 3.49Å; T219-S221 PolarHBondContact O-N 3.24Å; T219-S221 PolarHBondContact O-OG 3.09Å; T219-S221 VanDerWaalsContact O-OG 3.08Å
222	Y	78.7	Confident	85.5	Confident	57 Å²	57	51.1 Å²	51.1	22%	0.224	26%	0.262	C	S	.	.			trans	-89.8	-178.5	179.7	-66	-87.6	0	0	0	112.2	F220 F225 E245 I295 D297	F220-Y222 HydrophobicContact CD1-CD2 4.41Å; F220-Y222 HydrophobicContact CD1-CE2 4.18Å; F220-Y222 AromaticContact CE1-CD1 3.76Å; F220-Y222 HydrophobicContact CE1-CD1 3.76Å; F220-Y222 HydrophobicContact CE1-CD2 4.05Å; F220-Y222 AromaticContact CE1-CE1 3.55Å; F220-Y222 HydrophobicContact CE1-CE1 3.55Å; F220-Y222 AromaticContact CE1-CE2 3.85Å; F220-Y222 HydrophobicContact CE1-CE2 3.85Å; F220-Y222 HydrophobicContact CE1-CG 4.05Å; F220-Y222 AromaticContact CE1-CZ 3.64Å; F220-Y222 HydrophobicContact CZ-CD1 4.32Å; F220-Y222 HydrophobicContact CZ-CE1 4.2Å; Y222-F225 WeakPolarHBondContact O-CB 3.47Å; Y222-F225 PolarHBondContact O-N 3.36Å; Y222-E245 WeakPolarHBondContact CE2-OE1 3.47Å; Y222-E245 PolarHBondContact OH-OE1 2.9Å; Y222-I295 WeakPolarHBondContact CD2-O 3.48Å; Y222-I295 WeakPolarHBondContact CE2-O 3.04Å; Y222-D297 WeakPolarHBondContact CB-OD1 3.39Å; Y222-D297 WeakPolarHBondContact CD1-OD1 3.4Å; Y222-D297 VanDerWaalsContact CE1-OD1 3.26Å; Y222-D297 WeakPolarHBondContact CE1-OD1 3.43Å
223	A	69.8	Low	85.8	Confident	62 Å²	62	53.7 Å²	53.7	51%	0.512	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	140	178	0	0	0	0	0	111.5
224	G	70.8	Confident	86	Confident	27 Å²	27	59.5 Å²	59.5	28%	0.278	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.3	-16.8	-175.3	0	0	0	0	0	114.4	E226 M227	G224-E226 VanDerWaalsContact C-N 3.29Å; G224-E226 PolarHBondContact O-N 3.16Å; G224-M227 PolarHBondContact O-N 2.99Å; G224-M227 VanDerWaalsContact O-N 3.11Å
225	F	81.4	Confident	86.1	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.018	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-59	-36.3	178.7	-178.5	-93.8	0	0	0	113.8	K218 Y222 M227 Q228 K230 T300 F309 C310 E350	K218-F225 HydrophobicContact CD-CE1 3.75Å; K218-F225 HydrophobicContact CD-CZ 4.17Å; K218-F225 VanDerWaalsContact CE-CD1 3.48Å; K218-F225 HydrophobicContact CG-CE1 4.42Å; K218-F225 HydrophobicContact CG-CZ 4.36Å; Y222-F225 WeakPolarHBondContact O-CB 3.47Å; Y222-F225 PolarHBondContact O-N 3.36Å; F225-M227 PolarHBondContact O-N 3.01Å; F225-Q228 WeakPolarHBondContact O-CB 3.39Å; F225-Q228 PolarHBondContact O-N 3.36Å; F225-Q228 VanDerWaalsContact O-N 3.11Å; F225-K230 VanDerWaalsContact CD1-NZ 3.32Å; F225-K230 VanDerWaalsContact CZ-NZ 3.35Å; F225-K230 PolarHBondContact O-NZ 3.18Å; F225-T300 HydrophobicContact CB-CG2 4.13Å; F225-F309 HydrophobicContact CE2-CD2 4.29Å; F225-F309 AromaticContact CE2-CE2 3.63Å; F225-F309 HydrophobicContact CE2-CE2 3.63Å; F225-F309 AromaticContact CE2-CZ 3.82Å; F225-F309 HydrophobicContact CE2-CZ 3.82Å; F225-F309 HydrophobicContact CZ-CD2 4.38Å; F225-F309 AromaticContact CZ-CE2 3.42Å; F225-F309 HydrophobicContact CZ-CE2 3.42Å; F225-F309 VanDerWaalsContact CZ-CE2 3.42Å; F225-F309 AromaticContact CZ-CZ 3.72Å; F225-F309 HydrophobicContact CZ-CZ 3.72Å; F225-C310 WeakPolarHBondContact CE2-O 3.48Å; F225-E350 WeakPolarHBondContact CE1-OE2 3.38Å; F225-E350 WeakPolarHBondContact CZ-OE2 3.26Å
226	E	82.9	Confident	86.2	Confident	108 Å²	108	62.2 Å²	62.2	51%	0.505	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-66.8	-20.7	-179.5	-66	-58.9	137	0	0	113.1	K218 G224 Q228 R357	K218-E226 IonicContact NZ-OE1 2.71Å; K218-E226 PolarHBondContact NZ-OE1 3.34Å; G224-E226 VanDerWaalsContact C-N 3.29Å; G224-E226 PolarHBondContact O-N 3.16Å; E226-Q228 VanDerWaalsContact C-N 3.33Å; E226-R357 VanDerWaalsContact CD-NH1 3.32Å; E226-R357 IonicContact OE1-CZ 3.74Å; E226-R357 IonicContact OE1-NH1 2.7Å; E226-R357 PolarHBondContact OE1-NH1 2.68Å; E226-R357 VanDerWaalsContact OE1-NH1 3.08Å; E226-R357 IonicContact OE1-NH2 3.68Å; E226-R357 IonicContact OE2-CZ 3.63Å; E226-R357 VanDerWaalsContact OE2-CZ 3.26Å; E226-R357 IonicContact OE2-NH1 3.13Å; E226-R357 PolarHBondContact OE2-NH1 3Å; E226-R357 IonicContact OE2-NH2 2.96Å; E226-R357 PolarHBondContact OE2-NH2 3.39Å
227	M	81.7	Confident	86.2	Confident	161 Å²	161	62.1 Å²	62.1	79%	0.793	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-80.9	-14.4	175.3	-60.2	-60.5	-172.3	0	0	112.8	G224 F225 A304	G224-M227 PolarHBondContact O-N 2.99Å; G224-M227 VanDerWaalsContact O-N 3.11Å; F225-M227 PolarHBondContact O-N 3.01Å; M227-A304 HydrophobicContact CB-CB 4.33Å
228	Q	85.7	Confident	86.4	Confident	3 Å²	3	57.7 Å²	57.7	1%	0.014	29%	0.289	C	S	.	.	S	Bend	trans	-71.7	137.3	178.7	-64.5	177.8	-1.5	0	0	110.7	F225 E226 K230 T300 A304 L308 C310	F225-Q228 WeakPolarHBondContact O-CB 3.39Å; F225-Q228 PolarHBondContact O-N 3.36Å; F225-Q228 VanDerWaalsContact O-N 3.11Å; E226-Q228 VanDerWaalsContact C-N 3.33Å; Q228-K230 WeakPolarHBondContact O-CD 3.45Å; Q228-K230 WeakPolarHBondContact O-CE 3.47Å; Q228-K230 PolarHBondContact O-N 3.46Å; Q228-K230 PolarHBondContact O-NZ 2.95Å; Q228-T300 PolarHBondContact NE2-O 3.21Å; Q228-T300 VanDerWaalsContact NE2-O 3.08Å; Q228-A304 HydrophobicContact CG-CB 3.72Å; Q228-L308 WeakPolarHBondContact CG-O 3.39Å; Q228-C310 PolarHBondContact NE2-SG 2.93Å
229	P	87.1	Confident	86.6	Confident	35 Å²	35	55.4 Å²	55.4	23%	0.227	28%	0.279	C	S	.	.			trans	-57.5	136.8	175	-12.8	18.5	0	0	0	111.3	Y232 D307	P229-Y232 HydrophobicContact CB-CE1 3.98Å; P229-Y232 HydrophobicContact CB-CE2 4.17Å; P229-Y232 WeakPolarHBondContact CB-OH 3.39Å; P229-Y232 VanDerWaalsContact CD-OH 3.26Å; P229-Y232 WeakPolarHBondContact CD-OH 3.38Å; P229-Y232 HydrophobicContact CG-CE1 4.08Å; P229-Y232 WeakPolarHBondContact CG-OH 3.46Å; P229-Y232 VanDerWaalsContact O-CE2 3.32Å; P229-Y232 WeakPolarHBondContact O-CE2 3.4Å; P229-D307 HydrophobicContact CG-CB 4.47Å; P229-D307 WeakPolarHBondContact CG-OD1 3.25Å
230	K	91	Very high	87	Confident	45 Å²	45	54.2 Å²	54.2	20%	0.196	27%	0.272	C	S	.	.	S	Bend	trans	-99	-2	-175	-58.9	-49.9	178.3	-162.3	0	113.6	F225 Q228 F309 E349 E350	F225-K230 VanDerWaalsContact CD1-NZ 3.32Å; F225-K230 VanDerWaalsContact CZ-NZ 3.35Å; F225-K230 PolarHBondContact O-NZ 3.18Å; Q228-K230 WeakPolarHBondContact O-CD 3.45Å; Q228-K230 WeakPolarHBondContact O-CE 3.47Å; Q228-K230 PolarHBondContact O-N 3.46Å; Q228-K230 PolarHBondContact O-NZ 2.95Å; K230-F309 HydrophobicContact CD-CE2 4.45Å; K230-E349 CarbonylContact O-C 3.35Å; K230-E349 VanDerWaalsContact O-CA 3.23Å; K230-E349 WeakPolarHBondContact O-CA 3.5Å; K230-E350 HydrophobicContact CB-CB 4.16Å; K230-E350 HydrophobicContact CD-CB 4.1Å; K230-E350 WeakPolarHBondContact CD-OE1 3.45Å; K230-E350 WeakPolarHBondContact CE-OE1 3.28Å; K230-E350 IonicContact NZ-OE1 2.85Å; K230-E350 PolarHBondContact O-N 3.41Å
231	R	94.6	Very high	87.6	Confident	146 Å²	146	51.5 Å²	51.5	55%	0.551	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.3	131.6	179.7	-179.4	173.9	164.2	175.1	-6.3	110.2	E233 L347 F348	R231-E233 IonicContact CZ-OE1 3.26Å; R231-E233 IonicContact NH2-OE1 3.65Å; R231-E233 PolarHBondContact NH2-OE1 2.87Å; R231-L347 HydrophobicContact CG-CD1 4Å; R231-F348 CarbonylContact C-O 3.6Å; R231-F348 VanDerWaalsContact CA-O 3.27Å; R231-F348 WeakPolarHBondContact CA-O 3.33Å
232	Y	94.4	Very high	88.2	Confident	22 Å²	22	50.9 Å²	50.9	9%	0.086	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	140	173.2	-59.2	-88.6	0	0	0	110.3	P229 P235 K287 V288 F309 F348	P229-Y232 HydrophobicContact CB-CE1 3.98Å; P229-Y232 HydrophobicContact CB-CE2 4.17Å; P229-Y232 WeakPolarHBondContact CB-OH 3.39Å; P229-Y232 VanDerWaalsContact CD-OH 3.26Å; P229-Y232 WeakPolarHBondContact CD-OH 3.38Å; P229-Y232 HydrophobicContact CG-CE1 4.08Å; P229-Y232 WeakPolarHBondContact CG-OH 3.46Å; P229-Y232 VanDerWaalsContact O-CE2 3.32Å; P229-Y232 WeakPolarHBondContact O-CE2 3.4Å; Y232-P235 HydrophobicContact CG-CB 4.47Å; Y232-K287 HydrophobicContact CD1-CB 4.29Å; Y232-K287 HydrophobicContact CD1-CD 4.47Å; Y232-K287 HydrophobicContact CE1-CB 4.42Å; Y232-K287 HydrophobicContact CE1-CD 4.23Å; Y232-V288 HydrophobicContact CD2-CG2 4.19Å; Y232-F309 HydrophobicContact CE2-CB 3.66Å; Y232-F309 PolarHBondContact OH-N 2.98Å; Y232-F348 AromaticContact CD2-CD1 3.64Å; Y232-F348 HydrophobicContact CD2-CD1 3.64Å; Y232-F348 HydrophobicContact CD2-CE1 4.21Å; Y232-F348 HydrophobicContact CD2-CG 4.48Å; Y232-F348 HydrophobicContact CE2-CD1 4.24Å; Y232-F348 HydrophobicContact CE2-CE1 4.37Å; Y232-F348 PolarHBondContact N-O 3.13Å; Y232-F348 PolarHBondContact O-N 3.07Å
233	E	94.1	Very high	88.6	Confident	138 Å²	138	50.8 Å²	50.8	65%	0.645	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.4	171.4	-63.6	-176.5	175.3	0	0	108.8	R231 P235 L347	R231-E233 IonicContact CZ-OE1 3.26Å; R231-E233 IonicContact NH2-OE1 3.65Å; R231-E233 PolarHBondContact NH2-OE1 2.87Å; E233-P235 VanDerWaalsContact C-CD 3.46Å; E233-L347 HydrophobicContact CG-CD1 4.16Å
234	N	92.1	Very high	89.5	Confident	121 Å²	121	47.8 Å²	47.8	65%	0.647	23%	0.234	S	C	*	.	S	Bend	trans	50.6	47.8	-174.8	-59.6	-61.7	0	0	0	115.5	C345 E346	N234-C345 VanDerWaalsContact CA-O 3.24Å; N234-C345 WeakPolarHBondContact CA-O 3.29Å; N234-E346 PolarHBondContact N-O 2.8Å
235	P	94.5	Very high	90.2	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.019	23%	0.234	C	C	.	.			trans	-71	143.5	-179.7	29.9	-36.8	0	0	0	112.9	Y232 E233 K287 V288 C345 F348	Y232-P235 HydrophobicContact CG-CB 4.47Å; E233-P235 VanDerWaalsContact C-CD 3.46Å; P235-K287 HydrophobicContact CB-CB 4.02Å; P235-V288 HydrophobicContact CB-CG2 3.95Å; P235-V288 HydrophobicContact CG-CG2 4.35Å; P235-C345 VanDerWaalsContact CD-O 3.31Å; P235-C345 WeakPolarHBondContact CD-O 3.38Å; P235-F348 HydrophobicContact CG-CB 3.75Å
236	K	94.1	Very high	90.1	Very high	55 Å²	55	52.7 Å²	52.7	24%	0.239	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	132.2	161.1	-72.1	-178.5	173.7	-174	0	110	K287 V288 D339 L342 G343	K236-K287 PolarHBondContact O-N 3.31Å; K236-V288 PolarHBondContact O-N 3.49Å; K236-V288 VanDerWaalsContact O-N 3.12Å; K236-D339 IonicContact NZ-OD1 3.68Å; K236-D339 PolarHBondContact NZ-OD1 2.88Å; K236-D339 IonicContact NZ-OD2 3.04Å; K236-D339 PolarHBondContact NZ-OD2 3.26Å; K236-L342 HydrophobicContact CB-CB 4.48Å; K236-L342 HydrophobicContact CB-CD1 4.22Å; K236-L342 HydrophobicContact CD-CD1 3.97Å; K236-G343 CarbonylContact C-O 3.56Å; K236-G343 WeakPolarHBondContact CA-O 3.45Å
237	I	94.6	Very high	89.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	119.3	-172.6	-55	161.1	0	0	0	109.8	L239 V288 L290 C326 L342 G343 C345 F361	I237-L239 HydrophobicContact CG2-CD2 3.83Å; I237-L239 HydrophobicContact CG2-CG 4.43Å; I237-V288 CarbonylContact C-O 3.53Å; I237-V288 VanDerWaalsContact CA-O 3.31Å; I237-V288 WeakPolarHBondContact CA-O 3.3Å; I237-V288 HydrophobicContact CG1-CB 4.13Å; I237-V288 HydrophobicContact CG2-CB 4.39Å; I237-V288 HydrophobicContact CG2-CG1 4.26Å; I237-L290 HydrophobicContact CG2-CD1 4.4Å; I237-L290 HydrophobicContact CG2-CG 4.49Å; I237-C326 HydrophobicContact CD1-CB 3.77Å; I237-C326 WeakPolarHBondContact CD1-SG 3.46Å; I237-L342 WeakPolarHBondContact O-CA 3.29Å; I237-G343 PolarHBondContact N-O 3.27Å; I237-G343 PolarHBondContact O-N 3.2Å; I237-C345 HydrophobicContact CD1-CB 4.21Å; I237-F361 HydrophobicContact CD1-CD1 3.59Å; I237-F361 HydrophobicContact CD1-CE1 3.71Å; I237-F361 HydrophobicContact CG1-CD1 4.49Å; I237-F361 HydrophobicContact CG1-CE1 4.17Å; I237-F361 HydrophobicContact CG2-CE1 4.36Å
238	A	95.1	Very high	88.7	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.9	171.4	0	0	0	0	0	110.2	A286 V288 L290 L337 L342	A238-A286 HydrophobicContact CB-CB 3.76Å; A238-V288 PolarHBondContact N-O 3.17Å; A238-L290 PolarHBondContact O-N 3.32Å; A238-L337 HydrophobicContact CB-CD2 4.3Å; A238-L342 HydrophobicContact CB-CD2 3.77Å
239	L	94.5	Very high	87.6	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	115.4	175.9	-56.5	178.3	0	0	0	109	I237 L290 L319 T322 M323 I330 Q331	I237-L239 HydrophobicContact CG2-CD2 3.83Å; I237-L239 HydrophobicContact CG2-CG 4.43Å; L239-L290 HydrophobicContact CD2-CB 4.03Å; L239-L290 HydrophobicContact CD2-CD1 3.8Å; L239-L290 HydrophobicContact CD2-CG 4.27Å; L239-L319 HydrophobicContact CB-CD1 4.27Å; L239-L319 HydrophobicContact CD2-CD1 3.83Å; L239-T322 HydrophobicContact CD2-CG2 3.92Å; L239-M323 VanDerWaalsContact CD1-CA 3.42Å; L239-M323 HydrophobicContact CD1-CB 3.63Å; L239-M323 HydrophobicContact CD1-CG 4.13Å; L239-I330 HydrophobicContact CB-CG1 4.21Å; L239-I330 HydrophobicContact CD1-CG1 4.49Å; L239-I330 WeakPolarHBondContact O-CA 3.48Å; L239-Q331 PolarHBondContact O-N 3.07Å
240	L	93.6	Very high	86.5	Confident	0 Å²	0	59 Å²	59	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146.7	-171.3	-57.3	179	0	0	0	111.6	L244 I281 V289 L290 S291 K292 Q331 L337	L240-L244 HydrophobicContact CD1-CD1 4.34Å; L240-I281 HydrophobicContact CD1-CD1 3.78Å; L240-I281 HydrophobicContact CD1-CG1 4.42Å; L240-V289 HydrophobicContact CD1-CG1 3.67Å; L240-V289 HydrophobicContact CG-CG1 4.47Å; L240-L290 PolarHBondContact N-O 3.44Å; L240-S291 WeakPolarHBondContact O-CA 3.28Å; L240-K292 PolarHBondContact O-N 3.44Å; L240-Q331 CarbonylContact C-O 3.55Å; L240-Q331 WeakPolarHBondContact CA-O 3.33Å; L240-Q331 HydrophobicContact CD2-CB 4.15Å; L240-L337 HydrophobicContact CD2-CD1 4.42Å; L240-L337 HydrophobicContact CD2-CD2 4.11Å
241	N	92.5	Very high	84.9	Confident	60 Å²	60	62.8 Å²	62.8	32%	0.321	30%	0.303	S	S	.	.			trans	-119.7	48.8	165.9	-172.9	37.9	0	0	0	109.3	I330 Q331 T332	N241-I330 HydrophobicContact CB-CG2 3.96Å; N241-Q331 PolarHBondContact N-O 2.93Å; N241-T332 HydrophobicContact CB-CG2 4.26Å
242	V	88.5	Confident	83.3	Confident	19 Å²	19	63.6 Å²	63.6	12%	0.115	32%	0.318	C	S	.	.	S	Bend	trans	-133.3	137.9	-176	-175.7	0	0	0	0	108.9	S291 T332 V334	V242-S291 PolarHBondContact O-OG 3.42Å; V242-T332 WeakPolarHBondContact CG2-O 3.29Å; V242-V334 HydrophobicContact CG1-CG2 4.29Å
243	E	88.4	Confident	82	Confident	55 Å²	55	65.3 Å²	65.3	26%	0.257	34%	0.337	S	S	.	.			trans	-75.3	134.5	172.1	57.9	-171.9	-179	0	0	110.4	L293	E243-L293 HydrophobicContact CB-CB 4Å; E243-L293 HydrophobicContact CB-CD1 4.06Å
244	L	87.9	Confident	80.8	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-113.3	51	176	-61.2	177.9	0	0	0	109.3	L240 L278 I281 V289 P294 I295 G296 A299 F303	L240-L244 HydrophobicContact CD1-CD1 4.34Å; L244-L278 HydrophobicContact CD1-CD2 4.43Å; L244-I281 HydrophobicContact CD1-CD1 3.85Å; L244-I281 HydrophobicContact CD2-CD1 4.07Å; L244-V289 HydrophobicContact CD1-CG1 4.49Å; L244-P294 PolarHBondContact N-O 3.05Å; L244-I295 HydrophobicContact CB-CB 4.37Å; L244-I295 HydrophobicContact CB-CG1 4.24Å; L244-I295 HydrophobicContact CB-CG2 4.12Å; L244-I295 HydrophobicContact CD1-CD1 4.25Å; L244-I295 HydrophobicContact CD1-CG1 4.14Å; L244-I295 HydrophobicContact CD1-CG2 4.39Å; L244-G296 PolarHBondContact O-N 3.05Å; L244-A299 HydrophobicContact CB-CB 4.13Å; L244-A299 WeakPolarHBondContact O-CB 3.24Å; L244-F303 HydrophobicContact CD1-CE2 3.92Å; L244-F303 HydrophobicContact CD1-CZ 4.08Å
245	E	86.3	Confident	79.8	Confident	56 Å²	56	65.3 Å²	65.3	26%	0.262	34%	0.339	S	S	.	.	S	Bend	trans	-123	157.3	175.5	-76.5	-177.7	171.7	0	0	109.3	Y222 K247 P294 G296	Y222-E245 WeakPolarHBondContact CE2-OE1 3.47Å; Y222-E245 PolarHBondContact OH-OE1 2.9Å; E245-K247 PolarHBondContact O-N 3.33Å; E245-P294 VanDerWaalsContact CD-CB 3.47Å; E245-P294 HydrophobicContact CG-CB 4.28Å; E245-P294 WeakPolarHBondContact OE1-CB 3.35Å; E245-G296 VanDerWaalsContact CG-N 3.33Å
246	L	79.1	Confident	78.9	Confident	78 Å²	78	75.2 Å²	75.2	41%	0.408	38%	0.376	S	S	.	.	S	Bend	trans	-74	93.2	174.4	-167.4	116.5	0	0	0	108.4	E270 W271 L274	L246-E270 HydrophobicContact CD1-CB 4.37Å; L246-W271 HydrophobicContact CD1-CD2 3.68Å; L246-W271 HydrophobicContact CD1-CE3 4.1Å; L246-W271 HydrophobicContact CD1-CG 4.01Å; L246-W271 HydrophobicContact CD1-CZ2 4.17Å; L246-L274 HydrophobicContact CB-CD2 4.48Å; L246-L274 HydrophobicContact CD1-CD2 4.43Å
247	K	70.9	Confident	78.2	Confident	103 Å²	103	75.4 Å²	75.4	45%	0.448	38%	0.382	S	S	.	.			trans	-141.5	149.6	178.7	-160.5	-168.4	-177.2	-148.9	0	109.8	E245 E249 D251	E245-K247 PolarHBondContact O-N 3.33Å; K247-E249 PolarHBondContact O-N 3.46Å; K247-D251 IonicContact NZ-OD1 2.76Å; K247-D251 PolarHBondContact NZ-OD1 3.41Å
248	A	64.1	Low	77.6	Confident	46 Å²	46	84.9 Å²	84.9	38%	0.38	42%	0.423	S	S	.	.			trans	-62.4	130.4	173.2	0	0	0	0	0	111.2	K250	A248-K250 PolarHBondContact O-N 2.93Å; A248-K250 VanDerWaalsContact O-N 3.09Å
249	E	62.8	Low	77.1	Confident	131 Å²	131	86.8 Å²	86.8	61%	0.612	44%	0.436	S	S	*	.	S	Bend	trans	-65.2	-14.1	-175.8	-66.3	-162.4	143.1	0	0	114.8	K247 K277	K247-E249 PolarHBondContact O-N 3.46Å; E249-K277 WeakPolarHBondContact OE1-CE 3.46Å; E249-K277 IonicContact OE1-NZ 3.56Å; E249-K277 PolarHBondContact OE1-NZ 2.7Å
250	K	63.3	Low	76.5	Confident	159 Å²	159	92.4 Å²	92.4	69%	0.691	47%	0.47	S	S	*	.	S	Bend	trans	-128.2	118.3	178.6	-74.1	-177.4	179.5	176	0	109.8	A248 N252 A253	A248-K250 PolarHBondContact O-N 2.93Å; A248-K250 VanDerWaalsContact O-N 3.09Å; K250-N252 PolarHBondContact O-N 3.33Å; K250-A253 HydrophobicContact CB-CB 4.01Å; K250-A253 PolarHBondContact O-N 2.9Å
251	D	57.8	Low	76	Confident	125 Å²	125	99.2 Å²	99.2	67%	0.668	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	8	-179.2	-76.8	-35	0	0	0	115	K247	K247-D251 IonicContact NZ-OD1 2.76Å; K247-D251 PolarHBondContact NZ-OD1 3.41Å
252	N	61.1	Low	75.6	Confident	162 Å²	162	100.2 Å²	100.2	87%	0.866	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.8	27	176.2	-72.9	-53.7	0	0	0	113.2	K250 E254	K250-N252 PolarHBondContact O-N 3.33Å; N252-E254 PolarHBondContact O-N 2.93Å
253	A	65.9	Low	75.2	Confident	59 Å²	59	106.3 Å²	106.3	49%	0.488	53%	0.53	S	S	.	.			trans	-82.6	105.9	174.7	0	0	0	0	0	110.5	K250 V255	K250-A253 HydrophobicContact CB-CB 4.01Å; K250-A253 PolarHBondContact O-N 2.9Å; A253-V255 PolarHBondContact O-N 3.46Å
254	E	69.8	Low	75	Confident	165 Å²	165	108.4 Å²	108.4	77%	0.771	54%	0.54	S	S	*	.			trans	-80.2	108.8	168.4	-70.3	-175.3	-178.5	0	0	109.8	N252	N252-E254 PolarHBondContact O-N 2.93Å
255	V	71	Confident	74.8	Confident	94 Å²	94	111.1 Å²	111.1	57%	0.57	56%	0.562	S	S	*	*			trans	-90.8	111.4	173.8	-170.4	0	0	0	0	109	A253 V257 I266	A253-V255 PolarHBondContact O-N 3.46Å; V255-V257 HydrophobicContact CG1-CG2 4.16Å; V255-V257 PolarHBondContact O-N 3Å; V255-I266 HydrophobicContact CG1-CD1 3.41Å; V255-I266 VanDerWaalsContact CG1-CD1 3.41Å; V255-I266 HydrophobicContact CG1-CG1 4.21Å
256	R	76.6	Confident	74.6	Confident	210 Å²	210	110.9 Å²	110.9	79%	0.792	56%	0.562	S	S	*	*			trans	-87.9	99.2	177.5	-68.8	-173.9	-178.1	-172.5	0.5	110.3
257	V	79.4	Confident	74.8	Confident	60 Å²	60	108.9 Å²	108.9	36%	0.364	55%	0.553	S	S	.	*			trans	-87.9	131	179.3	-168	0	0	0	0	110	V255 S259 D262 I266	V255-V257 HydrophobicContact CG1-CG2 4.16Å; V255-V257 PolarHBondContact O-N 3Å; V257-S259 WeakPolarHBondContact CG1-O 3.31Å; V257-D262 HydrophobicContact CG1-CB 3.75Å; V257-I266 HydrophobicContact CG2-CD1 3.55Å
258	K	81.4	Confident	75.6	Confident	199 Å²	199	107.6 Å²	107.6	87%	0.865	55%	0.551	S	S	*	*			trans	-110.9	-20.9	-179.9	-68.6	-178.7	-178.5	175.8	0	113.7
259	S	83.6	Confident	76.6	Confident	39 Å²	39	107.6 Å²	107.6	27%	0.273	55%	0.551	S	S	.	*	S	Bend	trans	-131	163.3	-179.5	72	0	0	0	0	111.2	V257 E261 D262	V257-S259 WeakPolarHBondContact CG1-O 3.31Å; S259-E261 VanDerWaalsContact C-N 3.32Å; S259-E261 VanDerWaalsContact CB-OE2 3.31Å; S259-E261 WeakPolarHBondContact CB-OE2 3.47Å; S259-E261 PolarHBondContact OG-OE2 2.87Å; S259-D262 WeakPolarHBondContact OG-CB 3.25Å; S259-D262 PolarHBondContact OG-N 3.49Å; S259-D262 VanDerWaalsContact OG-N 3.07Å; S259-D262 PolarHBondContact OG-OD1 3.36Å; S259-D262 PolarHBondContact OG-OD2 3.48Å
260	V	82.6	Confident	77.6	Confident	120 Å²	120	104.4 Å²	104.4	73%	0.727	54%	0.536	S	S	*	.	H	α-helix	trans	-72	-32	176.3	180	0	0	0	0	110.4	Y263 Q264	V260-Y263 WeakPolarHBondContact O-CB 3.38Å; V260-Y263 PolarHBondContact O-N 2.92Å; V260-Q264 PolarHBondContact O-N 3.1Å
261	E	83.4	Confident	78.8	Confident	143 Å²	143	101 Å²	101	67%	0.668	52%	0.519	S	S	*	.	H	α-helix	trans	-64.9	-39.3	176.3	-59.5	84.2	-174.4	0	0	112	S259 Y263 Q264 A265	S259-E261 VanDerWaalsContact C-N 3.32Å; S259-E261 VanDerWaalsContact CB-OE2 3.31Å; S259-E261 WeakPolarHBondContact CB-OE2 3.47Å; S259-E261 PolarHBondContact OG-OE2 2.87Å; E261-Y263 VanDerWaalsContact C-N 3.26Å; E261-Y263 PolarHBondContact O-N 2.98Å; E261-Q264 PolarHBondContact O-N 3.47Å; E261-A265 PolarHBondContact O-N 2.94Å
262	D	82.9	Confident	80.3	Confident	82 Å²	82	99.6 Å²	99.6	44%	0.439	51%	0.511	S	S	.	.	H	α-helix	trans	-63	-35.7	176.9	-69.4	-11.7	0	0	0	111.1	V257 S259 A265 I266	V257-D262 HydrophobicContact CG1-CB 3.75Å; S259-D262 WeakPolarHBondContact OG-CB 3.25Å; S259-D262 PolarHBondContact OG-N 3.49Å; S259-D262 VanDerWaalsContact OG-N 3.07Å; S259-D262 PolarHBondContact OG-OD1 3.36Å; S259-D262 PolarHBondContact OG-OD2 3.48Å; D262-A265 PolarHBondContact O-N 2.82Å; D262-I266 VanDerWaalsContact O-CD1 3.26Å; D262-I266 WeakPolarHBondContact O-CD1 3.47Å; D262-I266 VanDerWaalsContact O-CG1 3.24Å; D262-I266 WeakPolarHBondContact O-CG1 3.37Å; D262-I266 PolarHBondContact O-N 3.32Å; D262-I266 VanDerWaalsContact O-N 3.17Å
263	Y	80.1	Confident	81.6	Confident	147 Å²	147	94.9 Å²	94.9	58%	0.576	49%	0.485	S	S	*	.	H	α-helix	trans	-63.8	-47.7	176.6	-172.5	-102.8	0	0	0	111.6	V260 E261 A265 I266 V267	V260-Y263 WeakPolarHBondContact O-CB 3.38Å; V260-Y263 PolarHBondContact O-N 2.92Å; E261-Y263 VanDerWaalsContact C-N 3.26Å; E261-Y263 PolarHBondContact O-N 2.98Å; Y263-A265 VanDerWaalsContact C-N 3.34Å; Y263-A265 PolarHBondContact O-N 2.84Å; Y263-I266 PolarHBondContact O-N 3.1Å; Y263-V267 HydrophobicContact CD1-CG2 4.37Å; Y263-V267 HydrophobicContact CE1-CG2 4.04Å; Y263-V267 WeakPolarHBondContact O-CG2 3.31Å; Y263-V267 PolarHBondContact O-N 3.23Å; Y263-V267 VanDerWaalsContact O-N 3.15Å
264	Q	83.9	Confident	82.7	Confident	99 Å²	99	92.5 Å²	92.5	46%	0.463	46%	0.464	S	S	.	.	H	α-helix	trans	-63.4	-41	178.8	-171.8	62.4	44.7	0	0	111.4	V260 E261 I266 V267 D268	V260-Q264 PolarHBondContact O-N 3.1Å; E261-Q264 PolarHBondContact O-N 3.47Å; Q264-I266 VanDerWaalsContact C-N 3.27Å; Q264-I266 PolarHBondContact O-N 2.95Å; Q264-V267 PolarHBondContact O-N 3.41Å; Q264-D268 PolarHBondContact NE2-OD1 3.22Å; Q264-D268 VanDerWaalsContact O-CG 3.24Å; Q264-D268 PolarHBondContact O-N 3.06Å
265	A	84.8	Confident	83.7	Confident	57 Å²	57	89.5 Å²	89.5	47%	0.471	45%	0.447	S	S	.	.	H	α-helix	trans	-61.1	-34.4	177.3	0	0	0	0	0	112.9	E261 D262 Y263 A269	E261-A265 PolarHBondContact O-N 2.94Å; D262-A265 PolarHBondContact O-N 2.82Å; Y263-A265 VanDerWaalsContact C-N 3.34Å; Y263-A265 PolarHBondContact O-N 2.84Å; A265-A269 VanDerWaalsContact O-CB 3.27Å; A265-A269 WeakPolarHBondContact O-CB 3.39Å; A265-A269 PolarHBondContact O-N 3.45Å
266	I	82.8	Confident	84.7	Confident	50 Å²	50	90.4 Å²	90.4	26%	0.256	45%	0.445	S	S	.	.	H	α-helix	trans	-67.9	-47.2	174.6	-67	155.7	0	0	0	110.6	V255 V257 D262 Y263 Q264 D268 A269 E270	V255-I266 HydrophobicContact CG1-CD1 3.41Å; V255-I266 VanDerWaalsContact CG1-CD1 3.41Å; V255-I266 HydrophobicContact CG1-CG1 4.21Å; V257-I266 HydrophobicContact CG2-CD1 3.55Å; D262-I266 VanDerWaalsContact O-CD1 3.26Å; D262-I266 WeakPolarHBondContact O-CD1 3.47Å; D262-I266 VanDerWaalsContact O-CG1 3.24Å; D262-I266 WeakPolarHBondContact O-CG1 3.37Å; D262-I266 PolarHBondContact O-N 3.32Å; D262-I266 VanDerWaalsContact O-N 3.17Å; Y263-I266 PolarHBondContact O-N 3.1Å; Q264-I266 VanDerWaalsContact C-N 3.27Å; Q264-I266 PolarHBondContact O-N 2.95Å; I266-D268 VanDerWaalsContact C-N 3.34Å; I266-D268 PolarHBondContact O-N 2.98Å; I266-A269 WeakPolarHBondContact O-CB 3.48Å; I266-A269 PolarHBondContact O-N 2.9Å; I266-E270 PolarHBondContact O-N 2.92Å
267	V	83.3	Confident	85.4	Confident	37 Å²	37	82.6 Å²	82.6	22%	0.224	42%	0.417	C	S	.	.	H	α-helix	trans	-59	-48.3	178.1	173.4	0	0	0	0	110.3	Y263 Q264 A269 E270 W271	Y263-V267 HydrophobicContact CD1-CG2 4.37Å; Y263-V267 HydrophobicContact CE1-CG2 4.04Å; Y263-V267 WeakPolarHBondContact O-CG2 3.31Å; Y263-V267 PolarHBondContact O-N 3.23Å; Y263-V267 VanDerWaalsContact O-N 3.15Å; Q264-V267 PolarHBondContact O-N 3.41Å; V267-A269 VanDerWaalsContact C-N 3.29Å; V267-A269 PolarHBondContact O-N 2.63Å; V267-E270 PolarHBondContact O-N 3.21Å; V267-W271 PolarHBondContact O-N 2.79Å
268	D	86.9	Confident	86	Confident	75 Å²	75	79.8 Å²	79.8	40%	0.401	40%	0.399	S	S	.	.	H	α-helix	trans	-61.8	-38	178.4	-64.6	-15.3	0	0	0	111.6	Q264 I266 W271 N272	Q264-D268 PolarHBondContact NE2-OD1 3.22Å; Q264-D268 VanDerWaalsContact O-CG 3.24Å; Q264-D268 PolarHBondContact O-N 3.06Å; I266-D268 VanDerWaalsContact C-N 3.34Å; I266-D268 PolarHBondContact O-N 2.98Å; D268-W271 PolarHBondContact O-N 2.95Å; D268-N272 WeakPolarHBondContact O-CB 3.27Å; D268-N272 PolarHBondContact O-N 2.89Å; D268-N272 PolarHBondContact O-ND2 2.8Å
269	A	85.6	Confident	86.5	Confident	46 Å²	46	73.3 Å²	73.3	38%	0.38	37%	0.372	S	S	.	.	H	α-helix	trans	-64.9	-42.2	174.9	0	0	0	0	0	112.6	A265 I266 V267 W271 N272 I273	A265-A269 VanDerWaalsContact O-CB 3.27Å; A265-A269 WeakPolarHBondContact O-CB 3.39Å; A265-A269 PolarHBondContact O-N 3.45Å; I266-A269 WeakPolarHBondContact O-CB 3.48Å; I266-A269 PolarHBondContact O-N 2.9Å; V267-A269 VanDerWaalsContact C-N 3.29Å; V267-A269 PolarHBondContact O-N 2.63Å; A269-W271 VanDerWaalsContact C-N 3.35Å; A269-W271 PolarHBondContact O-N 3.4Å; A269-N272 PolarHBondContact O-N 2.78Å; A269-I273 VanDerWaalsContact O-CG1 3.26Å; A269-I273 WeakPolarHBondContact O-CG1 3.44Å; A269-I273 PolarHBondContact O-N 2.98Å
270	E	84.2	Confident	86.9	Confident	65 Å²	65	75.1 Å²	75.1	30%	0.304	38%	0.375	S	S	.	.	H	α-helix	trans	-62	-42.5	175.9	-72.9	-175.9	167.6	0	0	111.8	L246 I266 V267 I273 L274	L246-E270 HydrophobicContact CD1-CB 4.37Å; I266-E270 PolarHBondContact O-N 2.92Å; V267-E270 PolarHBondContact O-N 3.21Å; E270-I273 PolarHBondContact O-N 3.43Å; E270-L274 PolarHBondContact O-N 3.31Å; E270-L274 VanDerWaalsContact O-N 3.09Å
271	W	87.9	Confident	87.4	Confident	87 Å²	87	69.4 Å²	69.4	33%	0.33	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-45.9	173.7	-80.6	107.5	0	0	0	112.1	L246 V267 D268 A269 I273 L274 Y275 V298	L246-W271 HydrophobicContact CD1-CD2 3.68Å; L246-W271 HydrophobicContact CD1-CE3 4.1Å; L246-W271 HydrophobicContact CD1-CG 4.01Å; L246-W271 HydrophobicContact CD1-CZ2 4.17Å; V267-W271 PolarHBondContact O-N 2.79Å; D268-W271 PolarHBondContact O-N 2.95Å; A269-W271 VanDerWaalsContact C-N 3.35Å; A269-W271 PolarHBondContact O-N 3.4Å; W271-I273 PolarHBondContact O-N 2.92Å; W271-L274 PolarHBondContact O-N 3.33Å; W271-Y275 HydrophobicContact CE3-CD2 4.34Å; W271-Y275 AromaticContact CE3-CE2 3.62Å; W271-Y275 HydrophobicContact CE3-CE2 3.62Å; W271-Y275 HydrophobicContact CZ3-CE2 4.19Å; W271-Y275 WeakPolarHBondContact O-CD2 3.43Å; W271-Y275 PolarHBondContact O-N 2.89Å; W271-V298 HydrophobicContact CH2-CG1 4.39Å; W271-V298 HydrophobicContact CH2-CG2 3.61Å; W271-V298 HydrophobicContact CZ3-CB 4.26Å; W271-V298 HydrophobicContact CZ3-CG1 3.63Å; W271-V298 HydrophobicContact CZ3-CG2 3.71Å
272	N	89.7	Confident	87.9	Confident	95 Å²	95	67.5 Å²	67.5	51%	0.508	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-43.2	178.4	-73.1	-26.8	0	0	0	111.7	D268 A269 L274 Y275 E276	D268-N272 WeakPolarHBondContact O-CB 3.27Å; D268-N272 PolarHBondContact O-N 2.89Å; D268-N272 PolarHBondContact O-ND2 2.8Å; A269-N272 PolarHBondContact O-N 2.78Å; N272-L274 VanDerWaalsContact C-N 3.31Å; N272-L274 PolarHBondContact O-N 3.47Å; N272-Y275 PolarHBondContact O-N 3.24Å; N272-E276 WeakPolarHBondContact O-CB 3.18Å; N272-E276 VanDerWaalsContact O-CG 3.3Å; N272-E276 WeakPolarHBondContact O-CG 3.42Å; N272-E276 PolarHBondContact O-N 3.41Å
273	I	87.8	Confident	88.3	Confident	63 Å²	63	70.1 Å²	70.1	32%	0.323	34%	0.338	S	S	.	.	H	α-helix	trans	-60.1	-42.4	176.6	-69.3	164.5	0	0	0	111	A269 E270 W271 K277	A269-I273 VanDerWaalsContact O-CG1 3.26Å; A269-I273 WeakPolarHBondContact O-CG1 3.44Å; A269-I273 PolarHBondContact O-N 2.98Å; E270-I273 PolarHBondContact O-N 3.43Å; W271-I273 PolarHBondContact O-N 2.92Å; I273-K277 HydrophobicContact CG2-CD 4.32Å; I273-K277 WeakPolarHBondContact O-CG 3.25Å; I273-K277 PolarHBondContact O-N 3.25Å; I273-K277 VanDerWaalsContact O-N 3.11Å
274	L	89.2	Confident	88.8	Confident	9 Å²	9	63.6 Å²	63.6	5%	0.047	31%	0.314	C	S	.	.	H	α-helix	trans	-63.9	-50.7	177.1	-179.5	62.5	0	0	0	111	L246 E270 W271 N272 E276 K277 L278 V298	L246-L274 HydrophobicContact CB-CD2 4.48Å; L246-L274 HydrophobicContact CD1-CD2 4.43Å; E270-L274 PolarHBondContact O-N 3.31Å; E270-L274 VanDerWaalsContact O-N 3.09Å; W271-L274 PolarHBondContact O-N 3.33Å; N272-L274 VanDerWaalsContact C-N 3.31Å; N272-L274 PolarHBondContact O-N 3.47Å; L274-E276 VanDerWaalsContact C-N 3.33Å; L274-E276 PolarHBondContact O-N 3.35Å; L274-K277 WeakPolarHBondContact O-CB 3.48Å; L274-K277 PolarHBondContact O-N 2.63Å; L274-K277 VanDerWaalsContact O-N 3.15Å; L274-L278 HydrophobicContact CD1-CD1 4.42Å; L274-L278 HydrophobicContact CD1-CG 4.44Å; L274-L278 HydrophobicContact CG-CD1 4.15Å; L274-L278 WeakPolarHBondContact O-CG 3.11Å; L274-L278 PolarHBondContact O-N 3.42Å; L274-V298 HydrophobicContact CD2-CB 4.42Å; L274-V298 HydrophobicContact CD2-CG1 4.18Å
275	Y	91.3	Very high	89.1	Confident	102 Å²	102	60.6 Å²	60.6	40%	0.4	31%	0.309	S	S	.	.	H	α-helix	trans	-62.5	-38	179.1	-79.6	-64.6	0	0	0	112.7	W271 N272 K277 L278 E279 Y302	W271-Y275 HydrophobicContact CE3-CD2 4.34Å; W271-Y275 AromaticContact CE3-CE2 3.62Å; W271-Y275 HydrophobicContact CE3-CE2 3.62Å; W271-Y275 HydrophobicContact CZ3-CE2 4.19Å; W271-Y275 WeakPolarHBondContact O-CD2 3.43Å; W271-Y275 PolarHBondContact O-N 2.89Å; N272-Y275 PolarHBondContact O-N 3.24Å; Y275-K277 VanDerWaalsContact C-N 3.33Å; Y275-K277 PolarHBondContact O-N 2.87Å; Y275-L278 HydrophobicContact CD1-CD1 4.44Å; Y275-L278 PolarHBondContact O-N 3.34Å; Y275-E279 VanDerWaalsContact O-CB 3.22Å; Y275-E279 WeakPolarHBondContact O-CB 3.47Å; Y275-E279 PolarHBondContact O-N 3.14Å; Y275-Y302 AromaticContact CD1-CD2 3.94Å; Y275-Y302 HydrophobicContact CD1-CD2 3.94Å; Y275-Y302 HydrophobicContact CD1-CE2 4.02Å; Y275-Y302 AromaticContact CE1-CD2 3.88Å; Y275-Y302 HydrophobicContact CE1-CD2 3.88Å; Y275-Y302 HydrophobicContact CE1-CE2 4.35Å
276	E	91.2	Very high	89.5	Confident	114 Å²	114	58 Å²	58	53%	0.533	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-40.7	173.9	-78.7	-177.8	-166.9	0	0	112.1	N272 L274 K280	N272-E276 WeakPolarHBondContact O-CB 3.18Å; N272-E276 VanDerWaalsContact O-CG 3.3Å; N272-E276 WeakPolarHBondContact O-CG 3.42Å; N272-E276 PolarHBondContact O-N 3.41Å; L274-E276 VanDerWaalsContact C-N 3.33Å; L274-E276 PolarHBondContact O-N 3.35Å; E276-K280 WeakPolarHBondContact O-CB 3.46Å; E276-K280 VanDerWaalsContact O-CG 3.24Å; E276-K280 WeakPolarHBondContact O-CG 3.32Å; E276-K280 PolarHBondContact O-N 3Å
277	K	90.9	Very high	90.1	Very high	46 Å²	46	59 Å²	59	20%	0.2	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-48	174.2	-72.6	169.8	-175.9	172.8	0	110.5	E249 I273 L274 Y275 E279 K280 I281 V334	E249-K277 WeakPolarHBondContact OE1-CE 3.46Å; E249-K277 IonicContact OE1-NZ 3.56Å; E249-K277 PolarHBondContact OE1-NZ 2.7Å; I273-K277 HydrophobicContact CG2-CD 4.32Å; I273-K277 WeakPolarHBondContact O-CG 3.25Å; I273-K277 PolarHBondContact O-N 3.25Å; I273-K277 VanDerWaalsContact O-N 3.11Å; L274-K277 WeakPolarHBondContact O-CB 3.48Å; L274-K277 PolarHBondContact O-N 2.63Å; L274-K277 VanDerWaalsContact O-N 3.15Å; Y275-K277 VanDerWaalsContact C-N 3.33Å; Y275-K277 PolarHBondContact O-N 2.87Å; K277-E279 PolarHBondContact O-N 3.45Å; K277-K280 PolarHBondContact O-N 3.03Å; K277-I281 WeakPolarHBondContact O-CG1 3.39Å; K277-I281 PolarHBondContact O-N 3.37Å; K277-I281 VanDerWaalsContact O-N 3.15Å; K277-V334 HydrophobicContact CB-CG2 4.29Å; K277-V334 HydrophobicContact CG-CB 4.49Å; K277-V334 HydrophobicContact CG-CG2 4.25Å; K277-V334 VanDerWaalsContact O-CG1 3.3Å; K277-V334 WeakPolarHBondContact O-CG1 3.13Å
278	L	92.3	Very high	90.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.2	-42.2	-179.4	-62.6	174.1	0	0	0	112.2	L244 L274 Y275 I281 Y282 A299 Y302 F303	L244-L278 HydrophobicContact CD1-CD2 4.43Å; L274-L278 HydrophobicContact CD1-CD1 4.42Å; L274-L278 HydrophobicContact CD1-CG 4.44Å; L274-L278 HydrophobicContact CG-CD1 4.15Å; L274-L278 WeakPolarHBondContact O-CG 3.11Å; L274-L278 PolarHBondContact O-N 3.42Å; Y275-L278 HydrophobicContact CD1-CD1 4.44Å; Y275-L278 PolarHBondContact O-N 3.34Å; L278-I281 PolarHBondContact O-N 3.17Å; L278-Y282 PolarHBondContact O-N 3.49Å; L278-A299 HydrophobicContact CD1-CB 4.16Å; L278-A299 HydrophobicContact CD2-CB 3.61Å; L278-Y302 HydrophobicContact CB-CD1 3.72Å; L278-Y302 HydrophobicContact CB-CE1 3.67Å; L278-Y302 HydrophobicContact CB-CG 4.23Å; L278-Y302 HydrophobicContact CD1-CD1 4.16Å; L278-Y302 HydrophobicContact CD1-CD2 4.38Å; L278-Y302 HydrophobicContact CD1-CG 3.94Å; L278-Y302 HydrophobicContact CG-CD1 4.41Å; L278-F303 HydrophobicContact CD2-CE1 3.94Å; L278-F303 HydrophobicContact CD2-CE2 3.83Å; L278-F303 HydrophobicContact CD2-CZ 3.39Å
279	E	92.8	Very high	91	Very high	64 Å²	64	53.7 Å²	53.7	30%	0.299	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-41.9	177.6	-176.2	63	-140.8	0	0	111.3	Y275 K277 I281 Y282 Q283 Y302	Y275-E279 VanDerWaalsContact O-CB 3.22Å; Y275-E279 WeakPolarHBondContact O-CB 3.47Å; Y275-E279 PolarHBondContact O-N 3.14Å; K277-E279 PolarHBondContact O-N 3.45Å; E279-I281 VanDerWaalsContact C-N 3.3Å; E279-I281 PolarHBondContact O-N 3.08Å; E279-Y282 WeakPolarHBondContact O-CB 3.39Å; E279-Y282 PolarHBondContact O-N 2.83Å; E279-Y282 VanDerWaalsContact O-N 3.16Å; E279-Q283 HydrophobicContact CG-CG 4.4Å; E279-Q283 WeakPolarHBondContact O-CB 3.46Å; E279-Q283 VanDerWaalsContact O-CG 3.29Å; E279-Q283 WeakPolarHBondContact O-CG 3.49Å; E279-Q283 PolarHBondContact O-N 3.06Å; E279-Q283 PolarHBondContact OE1-NE2 2.93Å; E279-Y302 PolarHBondContact OE2-OH 3.3Å
280	K	92	Very high	91.4	Very high	77 Å²	77	51.5 Å²	51.5	34%	0.335	24%	0.242	S	C	.	.	H	α-helix	trans	-60.4	-38.3	174.1	-76.8	171	-178.7	172.8	0	112.6	E276 K277 S284 V334 S335	E276-K280 WeakPolarHBondContact O-CB 3.46Å; E276-K280 VanDerWaalsContact O-CG 3.24Å; E276-K280 WeakPolarHBondContact O-CG 3.32Å; E276-K280 PolarHBondContact O-N 3Å; K277-K280 PolarHBondContact O-N 3.03Å; K280-S284 PolarHBondContact O-N 2.82Å; K280-S284 VanDerWaalsContact O-N 3.08Å; K280-V334 HydrophobicContact CB-CG1 3.82Å; K280-S335 PolarHBondContact NZ-OG 3.46Å
281	I	93.1	Very high	91.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-44.8	175.1	-64.1	166.2	0	0	0	110	L240 L244 K277 L278 E279 S284 V289 F303 L308 V334 L337	L240-I281 HydrophobicContact CD1-CD1 3.78Å; L240-I281 HydrophobicContact CD1-CG1 4.42Å; L244-I281 HydrophobicContact CD1-CD1 3.85Å; L244-I281 HydrophobicContact CD2-CD1 4.07Å; K277-I281 WeakPolarHBondContact O-CG1 3.39Å; K277-I281 PolarHBondContact O-N 3.37Å; K277-I281 VanDerWaalsContact O-N 3.15Å; L278-I281 PolarHBondContact O-N 3.17Å; E279-I281 VanDerWaalsContact C-N 3.3Å; E279-I281 PolarHBondContact O-N 3.08Å; I281-S284 WeakPolarHBondContact O-CB 3.25Å; I281-S284 PolarHBondContact O-N 3.17Å; I281-S284 PolarHBondContact O-OG 3.4Å; I281-V289 HydrophobicContact CG2-CG1 4.36Å; I281-V289 HydrophobicContact CG2-CG2 3.52Å; I281-F303 HydrophobicContact CB-CE1 4.28Å; I281-F303 HydrophobicContact CB-CZ 4.43Å; I281-F303 HydrophobicContact CD1-CZ 3.9Å; I281-F303 HydrophobicContact CG2-CE1 4.07Å; I281-F303 HydrophobicContact CG2-CZ 4.22Å; I281-L308 HydrophobicContact CG2-CD2 4.41Å; I281-V334 HydrophobicContact CD1-CG1 4.02Å; I281-V334 HydrophobicContact CG1-CG1 3.43Å; I281-V334 VanDerWaalsContact CG1-CG1 3.43Å; I281-L337 HydrophobicContact CB-CD1 4.38Å; I281-L337 HydrophobicContact CG1-CD1 3.76Å
282	Y	92.7	Very high	92.1	Very high	103 Å²	103	48 Å²	48	40%	0.404	23%	0.228	S	C	.	.	H	α-helix	trans	-61.6	-45.8	177.4	178.4	-113.8	0	0	0	112.2	L278 E279 S284 G285 R306 L308	L278-Y282 PolarHBondContact O-N 3.49Å; E279-Y282 WeakPolarHBondContact O-CB 3.39Å; E279-Y282 PolarHBondContact O-N 2.83Å; E279-Y282 VanDerWaalsContact O-N 3.16Å; Y282-S284 PolarHBondContact O-N 3.04Å; Y282-G285 PolarHBondContact O-N 3.46Å; Y282-R306 HydrophobicContact CD2-CB 4.05Å; Y282-R306 HydrophobicContact CD2-CG 4.41Å; Y282-R306 HydrophobicContact CE2-CB 3.89Å; Y282-R306 HydrophobicContact CE2-CG 4.21Å; Y282-L308 HydrophobicContact CD2-CD1 3.63Å; Y282-L308 HydrophobicContact CE2-CD1 4.12Å
283	Q	91.9	Very high	92.2	Very high	136 Å²	136	46.3 Å²	46.3	64%	0.636	22%	0.219	S	C	*	.	H	α-helix	trans	-63.8	-27.5	178.4	-72.4	177.1	5.4	0	0	113.4	E279 G285	E279-Q283 HydrophobicContact CG-CG 4.4Å; E279-Q283 WeakPolarHBondContact O-CB 3.46Å; E279-Q283 VanDerWaalsContact O-CG 3.29Å; E279-Q283 WeakPolarHBondContact O-CG 3.49Å; E279-Q283 PolarHBondContact O-N 3.06Å; E279-Q283 PolarHBondContact OE1-NE2 2.93Å; Q283-G285 PolarHBondContact O-N 2.66Å
284	S	90.6	Very high	92.4	Very high	11 Å²	11	44.6 Å²	44.6	8%	0.077	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.1	173	78.6	0	0	0	0	113.3	K280 I281 Y282 A286 L342	K280-S284 PolarHBondContact O-N 2.82Å; K280-S284 VanDerWaalsContact O-N 3.08Å; I281-S284 WeakPolarHBondContact O-CB 3.25Å; I281-S284 PolarHBondContact O-N 3.17Å; I281-S284 PolarHBondContact O-OG 3.4Å; Y282-S284 PolarHBondContact O-N 3.04Å; S284-A286 VanDerWaalsContact C-N 3.26Å; S284-A286 PolarHBondContact O-N 2.97Å; S284-A286 PolarHBondContact OG-N 3.47Å; S284-L342 VanDerWaalsContact O-CD1 3.29Å; S284-L342 WeakPolarHBondContact O-CD1 3.44Å
285	G	90.8	Very high	92.4	Very high	36 Å²	36	44.5 Å²	44.5	37%	0.371	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	12.3	-178.7	0	0	0	0	0	114	Y282 Q283	Y282-G285 PolarHBondContact O-N 3.46Å; Q283-G285 PolarHBondContact O-N 2.66Å
286	A	93.4	Very high	92.4	Very high	2 Å²	2	40 Å²	40	2%	0.017	20%	0.196	C	C	.	.			trans	-64.4	134.7	171.9	0	0	0	0	0	110.7	A238 S284 L308 L342	A238-A286 HydrophobicContact CB-CB 3.76Å; S284-A286 VanDerWaalsContact C-N 3.26Å; S284-A286 PolarHBondContact O-N 2.97Å; S284-A286 PolarHBondContact OG-N 3.47Å; A286-L308 WeakPolarHBondContact O-CD2 3.48Å; A286-L342 HydrophobicContact CB-CD1 4.43Å; A286-L342 HydrophobicContact CB-CD2 4.06Å
287	K	94.3	Very high	92.3	Very high	71 Å²	71	37.9 Å²	37.9	31%	0.309	19%	0.189	S	C	.	.	S	Bend	trans	-102.4	-24.9	175.5	-73.8	-68.1	-176.3	173.7	0	112.9	Y232 P235 K236 D307 L308 F309	Y232-K287 HydrophobicContact CD1-CB 4.29Å; Y232-K287 HydrophobicContact CD1-CD 4.47Å; Y232-K287 HydrophobicContact CE1-CB 4.42Å; Y232-K287 HydrophobicContact CE1-CD 4.23Å; P235-K287 HydrophobicContact CB-CB 4.02Å; K236-K287 PolarHBondContact O-N 3.31Å; K287-D307 WeakPolarHBondContact CD-O 3.49Å; K287-D307 PolarHBondContact NZ-O 3.08Å; K287-D307 VanDerWaalsContact NZ-O 3.14Å; K287-D307 IonicContact NZ-OD2 3.83Å; K287-D307 PolarHBondContact NZ-OD2 3.24Å; K287-L308 WeakPolarHBondContact O-CA 3.48Å; K287-F309 PolarHBondContact O-N 3.05Å
288	V	94.8	Very high	92.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	121.8	177.7	177.9	0	0	0	0	108.8	Y232 P235 K236 I237 A238 L290 F309 F348 F361	Y232-V288 HydrophobicContact CD2-CG2 4.19Å; P235-V288 HydrophobicContact CB-CG2 3.95Å; P235-V288 HydrophobicContact CG-CG2 4.35Å; K236-V288 PolarHBondContact O-N 3.49Å; K236-V288 VanDerWaalsContact O-N 3.12Å; I237-V288 CarbonylContact C-O 3.53Å; I237-V288 VanDerWaalsContact CA-O 3.31Å; I237-V288 WeakPolarHBondContact CA-O 3.3Å; I237-V288 HydrophobicContact CG1-CB 4.13Å; I237-V288 HydrophobicContact CG2-CB 4.39Å; I237-V288 HydrophobicContact CG2-CG1 4.26Å; A238-V288 PolarHBondContact N-O 3.17Å; V288-L290 HydrophobicContact CG1-CD2 4.06Å; V288-L290 HydrophobicContact CG1-CG 4.23Å; V288-F309 CarbonylContact C-O 3.54Å; V288-F309 WeakPolarHBondContact CA-O 3.31Å; V288-F309 HydrophobicContact CG1-CD1 4.03Å; V288-F309 HydrophobicContact CG2-CB 4.47Å; V288-F348 HydrophobicContact CG1-CD2 4.4Å; V288-F348 HydrophobicContact CG1-CE2 4.23Å; V288-F348 HydrophobicContact CG2-CB 4.39Å; V288-F348 HydrophobicContact CG2-CD1 4.18Å; V288-F348 HydrophobicContact CG2-CD2 4.21Å; V288-F348 HydrophobicContact CG2-CG 3.98Å; V288-F361 HydrophobicContact CG1-CE1 3.94Å; V288-F361 HydrophobicContact CG1-CZ 4.02Å
289	V	94.6	Very high	92.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114.6	-178.1	-175	0	0	0	0	109.1	L240 L244 I281 F303 L308 F309 C310 A311	L240-V289 HydrophobicContact CD1-CG1 3.67Å; L240-V289 HydrophobicContact CG-CG1 4.47Å; L244-V289 HydrophobicContact CD1-CG1 4.49Å; I281-V289 HydrophobicContact CG2-CG1 4.36Å; I281-V289 HydrophobicContact CG2-CG2 3.52Å; V289-F303 HydrophobicContact CG2-CZ 4.48Å; V289-L308 HydrophobicContact CG2-CD2 4.12Å; V289-F309 PolarHBondContact N-O 3.45Å; V289-C310 HydrophobicContact CB-CB 4.28Å; V289-C310 CarbonylContact O-C 3.46Å; V289-C310 VanDerWaalsContact O-CA 3.25Å; V289-C310 WeakPolarHBondContact O-CA 3.21Å; V289-A311 PolarHBondContact O-N 3.17Å
290	L	94.9	Very high	92.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.4	177.2	-56.2	-175.6	0	0	0	109.4	F216 I237 A238 L239 L240 V288 A311 V314 L319 T322 F361	F216-L290 HydrophobicContact CE1-CD1 4.11Å; F216-L290 HydrophobicContact CZ-CD1 3.93Å; F216-L290 HydrophobicContact CZ-CD2 3.89Å; I237-L290 HydrophobicContact CG2-CD1 4.4Å; I237-L290 HydrophobicContact CG2-CG 4.49Å; A238-L290 PolarHBondContact O-N 3.32Å; L239-L290 HydrophobicContact CD2-CB 4.03Å; L239-L290 HydrophobicContact CD2-CD1 3.8Å; L239-L290 HydrophobicContact CD2-CG 4.27Å; L240-L290 PolarHBondContact N-O 3.44Å; V288-L290 HydrophobicContact CG1-CD2 4.06Å; V288-L290 HydrophobicContact CG1-CG 4.23Å; L290-A311 HydrophobicContact CD2-CB 3.79Å; L290-V314 HydrophobicContact CB-CG2 4.34Å; L290-V314 HydrophobicContact CD2-CG2 4.49Å; L290-L319 HydrophobicContact CB-CD1 3.91Å; L290-T322 HydrophobicContact CD1-CG2 3.95Å; L290-F361 HydrophobicContact CD1-CE1 4.41Å; L290-F361 HydrophobicContact CD1-CE2 4.38Å; L290-F361 HydrophobicContact CD1-CZ 3.77Å; L290-F361 HydrophobicContact CD2-CZ 4.33Å; L290-F361 HydrophobicContact CG-CZ 4.47Å
291	S	93.4	Very high	92	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.4	172.4	-171.6	0	0	0	0	112.1	L240 V242 L293 A311 G312 R313 V314	L240-S291 WeakPolarHBondContact O-CA 3.28Å; V242-S291 PolarHBondContact O-OG 3.42Å; S291-L293 WeakPolarHBondContact CB-O 3.42Å; S291-L293 PolarHBondContact O-N 2.95Å; S291-L293 PolarHBondContact OG-N 3.15Å; S291-L293 VanDerWaalsContact OG-N 3.1Å; S291-L293 PolarHBondContact OG-O 3.37Å; S291-A311 PolarHBondContact N-O 3.27Å; S291-G312 CarbonylContact O-C 3.51Å; S291-R313 PolarHBondContact O-N 3.09Å; S291-R313 VanDerWaalsContact O-N 3.1Å; S291-V314 PolarHBondContact O-N 3.43Å
292	K	93.4	Very high	91.9	Very high	78 Å²	78	36.4 Å²	36.4	34%	0.339	19%	0.186	S	C	.	.	S	Bend	trans	-62.4	-32.4	166.3	179.9	174.1	171.8	-179.1	0	111.4	L240 R313 E316 L319	L240-K292 PolarHBondContact O-N 3.44Å; K292-R313 WeakPolarHBondContact O-CA 3.47Å; K292-E316 HydrophobicContact CD-CB 4.4Å; K292-E316 IonicContact NZ-OE2 2.74Å; K292-E316 PolarHBondContact NZ-OE2 3.41Å; K292-L319 HydrophobicContact CB-CD2 4.21Å
293	L	91.6	Very high	91.9	Very high	60 Å²	60	31.5 Å²	31.5	31%	0.314	17%	0.167	S	C	.	.	S	Bend	trans	-93.6	167.9	-178.9	-66	177.9	0	0	0	111	E243 S291 G312 R313	E243-L293 HydrophobicContact CB-CB 4Å; E243-L293 HydrophobicContact CB-CD1 4.06Å; S291-L293 WeakPolarHBondContact CB-O 3.42Å; S291-L293 PolarHBondContact O-N 2.95Å; S291-L293 PolarHBondContact OG-N 3.15Å; S291-L293 VanDerWaalsContact OG-N 3.1Å; S291-L293 PolarHBondContact OG-O 3.37Å; L293-G312 WeakPolarHBondContact O-CA 3.46Å; L293-R313 PolarHBondContact O-N 2.76Å
294	P	90.7	Very high	91.8	Very high	27 Å²	27	25.8 Å²	25.8	18%	0.175	14%	0.143	C	C	.	.			trans	-61.3	151	177.9	-22.2	34.8	0	0	0	113.1	L244 E245 R313	L244-P294 PolarHBondContact N-O 3.05Å; E245-P294 VanDerWaalsContact CD-CB 3.47Å; E245-P294 HydrophobicContact CG-CB 4.28Å; E245-P294 WeakPolarHBondContact OE1-CB 3.35Å; P294-R313 HydrophobicContact CB-CG 4.28Å; P294-R313 HydrophobicContact CG-CG 4.05Å
295	I	90.9	Very high	91.8	Very high	7 Å²	7	31.6 Å²	31.6	4%	0.036	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-122	118.9	171.8	-59.8	-179.5	0	0	0	106	Y222 L244 A299 F303 C310	Y222-I295 WeakPolarHBondContact CD2-O 3.48Å; Y222-I295 WeakPolarHBondContact CE2-O 3.04Å; L244-I295 HydrophobicContact CB-CB 4.37Å; L244-I295 HydrophobicContact CB-CG1 4.24Å; L244-I295 HydrophobicContact CB-CG2 4.12Å; L244-I295 HydrophobicContact CD1-CD1 4.25Å; L244-I295 HydrophobicContact CD1-CG1 4.14Å; L244-I295 HydrophobicContact CD1-CG2 4.39Å; I295-A299 HydrophobicContact CG2-CB 3.69Å; I295-F303 HydrophobicContact CG2-CE2 4.42Å; I295-C310 HydrophobicContact CD1-CB 3.88Å
296	G	90.1	Very high	91.8	Very high	7 Å²	7	33.8 Å²	33.8	7%	0.072	17%	0.17	C	C	.	.			trans	-77.6	174.4	-173.1	0	0	0	0	0	114.7	L244 E245 V298 A299 T300	L244-G296 PolarHBondContact O-N 3.05Å; E245-G296 VanDerWaalsContact CG-N 3.33Å; G296-V298 PolarHBondContact O-N 3.38Å; G296-A299 PolarHBondContact O-N 3.47Å; G296-T300 WeakPolarHBondContact O-CB 3.5Å; G296-T300 PolarHBondContact O-N 3.16Å; G296-T300 PolarHBondContact O-OG1 3.35Å
297	D	88.7	Confident	91.7	Very high	71 Å²	71	37.1 Å²	37.1	38%	0.38	19%	0.188	S	C	.	.	H	α-helix	trans	-57.2	-48.4	-178.7	-56.9	44	0	0	0	111.9	Y222 A299 T300 Q301	Y222-D297 WeakPolarHBondContact CB-OD1 3.39Å; Y222-D297 WeakPolarHBondContact CD1-OD1 3.4Å; Y222-D297 VanDerWaalsContact CE1-OD1 3.26Å; Y222-D297 WeakPolarHBondContact CE1-OD1 3.43Å; D297-A299 VanDerWaalsContact C-N 3.35Å; D297-A299 PolarHBondContact O-N 3.01Å; D297-T300 WeakPolarHBondContact O-CB 3.47Å; D297-T300 PolarHBondContact O-N 3.18Å; D297-Q301 WeakPolarHBondContact O-CG 3.28Å; D297-Q301 PolarHBondContact O-N 3.15Å
298	V	89.8	Confident	91.6	Very high	40 Å²	40	33.8 Å²	33.8	24%	0.242	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-47.8	178.9	176.7	0	0	0	0	110.7	W271 L274 G296 T300 Q301 Y302	W271-V298 HydrophobicContact CH2-CG1 4.39Å; W271-V298 HydrophobicContact CH2-CG2 3.61Å; W271-V298 HydrophobicContact CZ3-CB 4.26Å; W271-V298 HydrophobicContact CZ3-CG1 3.63Å; W271-V298 HydrophobicContact CZ3-CG2 3.71Å; L274-V298 HydrophobicContact CD2-CB 4.42Å; L274-V298 HydrophobicContact CD2-CG1 4.18Å; G296-V298 PolarHBondContact O-N 3.38Å; V298-T300 VanDerWaalsContact C-N 3.34Å; V298-Q301 PolarHBondContact O-N 3.45Å; V298-Y302 WeakPolarHBondContact O-CB 3.32Å; V298-Y302 PolarHBondContact O-N 2.92Å
299	A	91.1	Very high	91.6	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-64.1	-42.1	179.1	0	0	0	0	0	111.1	L244 L278 I295 G296 D297 Q301 Y302 F303	L244-A299 HydrophobicContact CB-CB 4.13Å; L244-A299 WeakPolarHBondContact O-CB 3.24Å; L278-A299 HydrophobicContact CD1-CB 4.16Å; L278-A299 HydrophobicContact CD2-CB 3.61Å; I295-A299 HydrophobicContact CG2-CB 3.69Å; G296-A299 PolarHBondContact O-N 3.47Å; D297-A299 VanDerWaalsContact C-N 3.35Å; D297-A299 PolarHBondContact O-N 3.01Å; A299-Q301 PolarHBondContact O-N 3.32Å; A299-Y302 PolarHBondContact O-N 2.93Å; A299-F303 HydrophobicContact CB-CE2 4.4Å; A299-F303 WeakPolarHBondContact O-CB 3.15Å; A299-F303 WeakPolarHBondContact O-CD2 3.3Å; A299-F303 VanDerWaalsContact O-CG 3.29Å; A299-F303 WeakPolarHBondContact O-CG 3.43Å; A299-F303 PolarHBondContact O-N 3.46Å
300	T	90.9	Very high	91.5	Very high	3 Å²	3	34 Å²	34	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-43.3	178.1	-56.3	0	0	0	0	111.5	F225 Q228 G296 D297 V298 A304	F225-T300 HydrophobicContact CB-CG2 4.13Å; Q228-T300 PolarHBondContact NE2-O 3.21Å; Q228-T300 VanDerWaalsContact NE2-O 3.08Å; G296-T300 WeakPolarHBondContact O-CB 3.5Å; G296-T300 PolarHBondContact O-N 3.16Å; G296-T300 PolarHBondContact O-OG1 3.35Å; D297-T300 WeakPolarHBondContact O-CB 3.47Å; D297-T300 PolarHBondContact O-N 3.18Å; V298-T300 VanDerWaalsContact C-N 3.34Å; T300-A304 WeakPolarHBondContact O-CB 3.43Å; T300-A304 PolarHBondContact O-N 3.47Å
301	Q	90	Very high	91.4	Very high	98 Å²	98	34.1 Å²	34.1	46%	0.458	18%	0.175	S	C	.	.	H	α-helix	trans	-66.7	-48.2	176	-72.3	175.9	-7.8	0	0	111.8	D297 V298 A299 F303 A304 D305	D297-Q301 WeakPolarHBondContact O-CG 3.28Å; D297-Q301 PolarHBondContact O-N 3.15Å; V298-Q301 PolarHBondContact O-N 3.45Å; A299-Q301 PolarHBondContact O-N 3.32Å; Q301-F303 PolarHBondContact O-N 3.31Å; Q301-A304 WeakPolarHBondContact O-CB 3.42Å; Q301-A304 PolarHBondContact O-N 3.47Å; Q301-D305 PolarHBondContact O-N 3.07Å
302	Y	91.8	Very high	91.4	Very high	14 Å²	14	34.3 Å²	34.3	6%	0.055	18%	0.178	C	C	.	.	H	α-helix	trans	-56.2	-39.7	178.4	178.9	-81	0	0	0	112.2	Y275 L278 E279 V298 A299 R306	Y275-Y302 AromaticContact CD1-CD2 3.94Å; Y275-Y302 HydrophobicContact CD1-CD2 3.94Å; Y275-Y302 HydrophobicContact CD1-CE2 4.02Å; Y275-Y302 AromaticContact CE1-CD2 3.88Å; Y275-Y302 HydrophobicContact CE1-CD2 3.88Å; Y275-Y302 HydrophobicContact CE1-CE2 4.35Å; L278-Y302 HydrophobicContact CB-CD1 3.72Å; L278-Y302 HydrophobicContact CB-CE1 3.67Å; L278-Y302 HydrophobicContact CB-CG 4.23Å; L278-Y302 HydrophobicContact CD1-CD1 4.16Å; L278-Y302 HydrophobicContact CD1-CD2 4.38Å; L278-Y302 HydrophobicContact CD1-CG 3.94Å; L278-Y302 HydrophobicContact CG-CD1 4.41Å; E279-Y302 PolarHBondContact OE2-OH 3.3Å; V298-Y302 WeakPolarHBondContact O-CB 3.32Å; V298-Y302 PolarHBondContact O-N 2.92Å; A299-Y302 PolarHBondContact O-N 2.93Å; Y302-R306 VanDerWaalsContact CD2-NH1 3.33Å; Y302-R306 VanDerWaalsContact CE2-NH1 3.34Å; Y302-R306 VanDerWaalsContact CE2-NH2 3.32Å; Y302-R306 PolarHBondContact O-NH1 3.42Å; Y302-R306 PolarHBondContact OH-NE 2.78Å; Y302-R306 VanDerWaalsContact OH-NE 3.17Å
303	F	92.4	Very high	91.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-71.4	-37.2	174.8	-69.8	-36.6	0	0	0	113.1	L244 L278 I281 V289 I295 A299 Q301 R306 D307 L308 C310	L244-F303 HydrophobicContact CD1-CE2 3.92Å; L244-F303 HydrophobicContact CD1-CZ 4.08Å; L278-F303 HydrophobicContact CD2-CE1 3.94Å; L278-F303 HydrophobicContact CD2-CE2 3.83Å; L278-F303 HydrophobicContact CD2-CZ 3.39Å; I281-F303 HydrophobicContact CB-CE1 4.28Å; I281-F303 HydrophobicContact CB-CZ 4.43Å; I281-F303 HydrophobicContact CD1-CZ 3.9Å; I281-F303 HydrophobicContact CG2-CE1 4.07Å; I281-F303 HydrophobicContact CG2-CZ 4.22Å; V289-F303 HydrophobicContact CG2-CZ 4.48Å; I295-F303 HydrophobicContact CG2-CE2 4.42Å; A299-F303 HydrophobicContact CB-CE2 4.4Å; A299-F303 WeakPolarHBondContact O-CB 3.15Å; A299-F303 WeakPolarHBondContact O-CD2 3.3Å; A299-F303 VanDerWaalsContact O-CG 3.29Å; A299-F303 WeakPolarHBondContact O-CG 3.43Å; A299-F303 PolarHBondContact O-N 3.46Å; Q301-F303 PolarHBondContact O-N 3.31Å; F303-R306 PolarHBondContact O-N 3.49Å; F303-D307 PolarHBondContact O-N 2.95Å; F303-L308 HydrophobicContact CB-CB 3.88Å; F303-L308 HydrophobicContact CD1-CB 4.09Å; F303-L308 HydrophobicContact CD1-CD1 4.48Å; F303-L308 HydrophobicContact CD1-CD2 3.9Å; F303-L308 HydrophobicContact CD1-CG 4.4Å; F303-L308 HydrophobicContact CE1-CD2 4.21Å; F303-L308 HydrophobicContact CG-CB 4.21Å; F303-L308 PolarHBondContact O-N 2.93Å; F303-C310 HydrophobicContact CD2-CB 3.59Å; F303-C310 HydrophobicContact CE2-CB 4.09Å; F303-C310 HydrophobicContact CG-CB 4.44Å
304	A	89.9	Confident	91.4	Very high	15 Å²	15	33.7 Å²	33.7	12%	0.124	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-43.4	176.3	0	0	0	0	0	112.2	M227 Q228 T300 Q301 R306 D307	M227-A304 HydrophobicContact CB-CB 4.33Å; Q228-A304 HydrophobicContact CG-CB 3.72Å; T300-A304 WeakPolarHBondContact O-CB 3.43Å; T300-A304 PolarHBondContact O-N 3.47Å; Q301-A304 WeakPolarHBondContact O-CB 3.42Å; Q301-A304 PolarHBondContact O-N 3.47Å; A304-R306 PolarHBondContact O-N 2.99Å; A304-R306 VanDerWaalsContact O-N 3.15Å; A304-D307 PolarHBondContact O-N 3.29Å
305	D	90.6	Very high	91.4	Very high	134 Å²	134	38 Å²	38	72%	0.717	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.7	178.8	-66.3	-21.3	0	0	0	113.4	Q301	Q301-D305 PolarHBondContact O-N 3.07Å
306	R	91.5	Very high	91.5	Very high	81 Å²	81	41.8 Å²	41.8	31%	0.306	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	12.7	-174.1	-73.2	173.2	179.6	67.7	1.8	114	Y282 Y302 F303 A304 L308	Y282-R306 HydrophobicContact CD2-CB 4.05Å; Y282-R306 HydrophobicContact CD2-CG 4.41Å; Y282-R306 HydrophobicContact CE2-CB 3.89Å; Y282-R306 HydrophobicContact CE2-CG 4.21Å; Y302-R306 VanDerWaalsContact CD2-NH1 3.33Å; Y302-R306 VanDerWaalsContact CE2-NH1 3.34Å; Y302-R306 VanDerWaalsContact CE2-NH2 3.32Å; Y302-R306 PolarHBondContact O-NH1 3.42Å; Y302-R306 PolarHBondContact OH-NE 2.78Å; Y302-R306 VanDerWaalsContact OH-NE 3.17Å; F303-R306 PolarHBondContact O-N 3.49Å; A304-R306 PolarHBondContact O-N 2.99Å; A304-R306 VanDerWaalsContact O-N 3.15Å; R306-L308 HydrophobicContact CB-CD1 3.45Å; R306-L308 VanDerWaalsContact CB-CD1 3.45Å; R306-L308 WeakPolarHBondContact O-CD1 3.09Å
307	D	91	Very high	91.5	Very high	73 Å²	73	47.9 Å²	47.9	39%	0.39	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	46.3	177.8	-173	72.6	0	0	0	111.6	P229 K287 F303 A304	P229-D307 HydrophobicContact CG-CB 4.47Å; P229-D307 WeakPolarHBondContact CG-OD1 3.25Å; K287-D307 WeakPolarHBondContact CD-O 3.49Å; K287-D307 PolarHBondContact NZ-O 3.08Å; K287-D307 VanDerWaalsContact NZ-O 3.14Å; K287-D307 IonicContact NZ-OD2 3.83Å; K287-D307 PolarHBondContact NZ-OD2 3.24Å; F303-D307 PolarHBondContact O-N 2.95Å; A304-D307 PolarHBondContact O-N 3.29Å
308	L	92.5	Very high	91.6	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	22%	0.215	C	C	.	.			trans	-118.2	138.5	171	-69.5	88.6	0	0	0	110.5	Q228 I281 Y282 A286 K287 V289 F303 R306	Q228-L308 WeakPolarHBondContact CG-O 3.39Å; I281-L308 HydrophobicContact CG2-CD2 4.41Å; Y282-L308 HydrophobicContact CD2-CD1 3.63Å; Y282-L308 HydrophobicContact CE2-CD1 4.12Å; A286-L308 WeakPolarHBondContact O-CD2 3.48Å; K287-L308 WeakPolarHBondContact O-CA 3.48Å; V289-L308 HydrophobicContact CG2-CD2 4.12Å; F303-L308 HydrophobicContact CB-CB 3.88Å; F303-L308 HydrophobicContact CD1-CB 4.09Å; F303-L308 HydrophobicContact CD1-CD1 4.48Å; F303-L308 HydrophobicContact CD1-CD2 3.9Å; F303-L308 HydrophobicContact CD1-CG 4.4Å; F303-L308 HydrophobicContact CE1-CD2 4.21Å; F303-L308 HydrophobicContact CG-CB 4.21Å; F303-L308 PolarHBondContact O-N 2.93Å; R306-L308 HydrophobicContact CB-CD1 3.45Å; R306-L308 VanDerWaalsContact CB-CD1 3.45Å; R306-L308 WeakPolarHBondContact O-CD1 3.09Å
309	F	94.3	Very high	91.7	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	136.2	168.4	178.4	-82.4	0	0	0	110.4	F225 K230 Y232 K287 V288 V289 A311 F348 N359	F225-F309 HydrophobicContact CE2-CD2 4.29Å; F225-F309 AromaticContact CE2-CE2 3.63Å; F225-F309 HydrophobicContact CE2-CE2 3.63Å; F225-F309 AromaticContact CE2-CZ 3.82Å; F225-F309 HydrophobicContact CE2-CZ 3.82Å; F225-F309 HydrophobicContact CZ-CD2 4.38Å; F225-F309 AromaticContact CZ-CE2 3.42Å; F225-F309 HydrophobicContact CZ-CE2 3.42Å; F225-F309 VanDerWaalsContact CZ-CE2 3.42Å; F225-F309 AromaticContact CZ-CZ 3.72Å; F225-F309 HydrophobicContact CZ-CZ 3.72Å; K230-F309 HydrophobicContact CD-CE2 4.45Å; Y232-F309 HydrophobicContact CE2-CB 3.66Å; Y232-F309 PolarHBondContact OH-N 2.98Å; K287-F309 PolarHBondContact O-N 3.05Å; V288-F309 CarbonylContact C-O 3.54Å; V288-F309 WeakPolarHBondContact CA-O 3.31Å; V288-F309 HydrophobicContact CG1-CD1 4.03Å; V288-F309 HydrophobicContact CG2-CB 4.47Å; V289-F309 PolarHBondContact N-O 3.45Å; F309-A311 HydrophobicContact CE1-CB 3.97Å; F309-F348 HydrophobicContact CB-CE1 4.38Å; F309-F348 HydrophobicContact CD1-CE1 4.09Å; F309-F348 HydrophobicContact CD1-CE2 4.37Å; F309-F348 AromaticContact CD1-CZ 3.59Å; F309-F348 HydrophobicContact CD1-CZ 3.59Å; F309-F348 AromaticContact CD2-CE1 3.84Å; F309-F348 HydrophobicContact CD2-CE1 3.84Å; F309-F348 AromaticContact CD2-CZ 3.92Å; F309-F348 HydrophobicContact CD2-CZ 3.92Å; F309-F348 HydrophobicContact CE1-CE1 4.34Å; F309-F348 HydrophobicContact CE1-CE2 4.21Å; F309-F348 AromaticContact CE1-CZ 3.49Å; F309-F348 HydrophobicContact CE1-CZ 3.49Å; F309-F348 VanDerWaalsContact CE1-CZ 3.49Å; F309-F348 HydrophobicContact CE2-CE1 4.09Å; F309-F348 AromaticContact CE2-CZ 3.82Å; F309-F348 HydrophobicContact CE2-CZ 3.82Å; F309-F348 AromaticContact CG-CE1 3.84Å; F309-F348 HydrophobicContact CG-CE1 3.84Å; F309-F348 AromaticContact CG-CZ 3.81Å; F309-F348 HydrophobicContact CG-CZ 3.81Å; F309-F348 HydrophobicContact CZ-CE1 4.34Å; F309-F348 AromaticContact CZ-CZ 3.62Å; F309-F348 HydrophobicContact CZ-CZ 3.62Å; F309-N359 WeakPolarHBondContact CZ-OD1 3.18Å
310	C	92.9	Very high	91.7	Very high	4 Å²	4	47.6 Å²	47.6	3%	0.027	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.7	174.8	70.8	0	0	0	0	113.1	F225 Q228 V289 I295 F303	F225-C310 WeakPolarHBondContact CE2-O 3.48Å; Q228-C310 PolarHBondContact NE2-SG 2.93Å; V289-C310 HydrophobicContact CB-CB 4.28Å; V289-C310 CarbonylContact O-C 3.46Å; V289-C310 VanDerWaalsContact O-CA 3.25Å; V289-C310 WeakPolarHBondContact O-CA 3.21Å; I295-C310 HydrophobicContact CD1-CB 3.88Å; F303-C310 HydrophobicContact CD2-CB 3.59Å; F303-C310 HydrophobicContact CE2-CB 4.09Å; F303-C310 HydrophobicContact CG-CB 4.44Å
311	A	92.7	Very high	91.7	Very high	2 Å²	2	47.9 Å²	47.9	2%	0.017	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	118.9	170.6	0	0	0	0	0	110.4	V289 L290 S291 F309 V314	V289-A311 PolarHBondContact O-N 3.17Å; L290-A311 HydrophobicContact CD2-CB 3.79Å; S291-A311 PolarHBondContact N-O 3.27Å; F309-A311 HydrophobicContact CE1-CB 3.97Å; A311-V314 HydrophobicContact CB-CG2 4.16Å; A311-V314 WeakPolarHBondContact O-CG2 3.41Å
312	G	91.9	Very high	91.7	Very high	5 Å²	5	43.2 Å²	43.2	5%	0.052	20%	0.202	C	C	.	.			trans	-95	166.5	174.5	0	0	0	0	0	112.1	T219 S291 L293 V314	T219-G312 WeakPolarHBondContact CB-O 3.32Å; T219-G312 PolarHBondContact OG1-O 3.4Å; S291-G312 CarbonylContact O-C 3.51Å; L293-G312 WeakPolarHBondContact O-CA 3.46Å; G312-V314 PolarHBondContact O-N 3.24Å
313	R	91.8	Very high	91.7	Very high	122 Å²	122	45 Å²	45	46%	0.46	21%	0.212	S	C	.	.	S	Bend	trans	58	34	179.6	-52.1	-176.3	-175.7	179.8	1.8	113.7	S291 K292 L293 P294	S291-R313 PolarHBondContact O-N 3.09Å; S291-R313 VanDerWaalsContact O-N 3.1Å; K292-R313 WeakPolarHBondContact O-CA 3.47Å; L293-R313 PolarHBondContact O-N 2.76Å; P294-R313 HydrophobicContact CB-CG 4.28Å; P294-R313 HydrophobicContact CG-CG 4.05Å
314	V	93.4	Very high	91.5	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.018	23%	0.231	C	C	.	.			trans	-69.1	134	175.7	-177.5	0	0	0	0	109.4	F216 T219 L290 S291 A311 G312 D318 L319	F216-V314 HydrophobicContact CE2-CG1 4.28Å; F216-V314 HydrophobicContact CE2-CG2 4.22Å; F216-V314 HydrophobicContact CZ-CG1 4.32Å; F216-V314 HydrophobicContact CZ-CG2 4.46Å; T219-V314 HydrophobicContact CG2-CG2 4.15Å; L290-V314 HydrophobicContact CB-CG2 4.34Å; L290-V314 HydrophobicContact CD2-CG2 4.49Å; S291-V314 PolarHBondContact O-N 3.43Å; A311-V314 HydrophobicContact CB-CG2 4.16Å; A311-V314 WeakPolarHBondContact O-CG2 3.41Å; G312-V314 PolarHBondContact O-N 3.24Å; V314-D318 HydrophobicContact CG1-CB 4.08Å; V314-L319 HydrophobicContact CG1-CB 4.41Å; V314-L319 HydrophobicContact CG1-CD1 4.38Å
315	Q	92.3	Very high	91.4	Very high	118 Å²	118	48.1 Å²	48.1	55%	0.551	23%	0.225	S	C	*	.			trans	-60.6	141.9	177.6	-68.2	-174.8	-11.4	0	0	110.6	E317 D318 L319	Q315-E317 PolarHBondContact O-N 2.87Å; Q315-D318 HydrophobicContact CB-CB 4.47Å; Q315-D318 PolarHBondContact O-N 3.38Å; Q315-D318 VanDerWaalsContact O-N 3.08Å; Q315-L319 PolarHBondContact O-N 2.96Å
316	E	91.3	Very high	91.4	Very high	85 Å²	85	42 Å²	42	40%	0.397	19%	0.192	S	C	.	.	H	α-helix	trans	-59.7	-35.2	-177.4	-176.3	175.7	153	0	0	112.5	K292 L319 K320	K292-E316 HydrophobicContact CD-CB 4.4Å; K292-E316 IonicContact NZ-OE2 2.74Å; K292-E316 PolarHBondContact NZ-OE2 3.41Å; E316-L319 PolarHBondContact O-N 3.49Å; E316-K320 HydrophobicContact CG-CD 4.32Å; E316-K320 WeakPolarHBondContact O-CB 2.89Å; E316-K320 WeakPolarHBondContact O-CG 2.87Å; E316-K320 PolarHBondContact O-N 3.12Å; E316-K320 WeakPolarHBondContact OE1-CE 3.27Å; E316-K320 IonicContact OE1-NZ 3.94Å; E316-K320 PolarHBondContact OE1-NZ 3.49Å
317	E	90.3	Very high	91.2	Very high	135 Å²	135	39.1 Å²	39.1	63%	0.631	19%	0.189	S	C	*	.	H	α-helix	trans	-64.3	-43.8	176.2	-61.6	-173.5	166.2	0	0	111.7	Q315 K320 R321	Q315-E317 PolarHBondContact O-N 2.87Å; E317-K320 PolarHBondContact O-N 2.65Å; E317-R321 WeakPolarHBondContact O-CB 3.33Å; E317-R321 WeakPolarHBondContact O-CG 3.36Å; E317-R321 PolarHBondContact O-N 3.35Å
318	D	91.7	Very high	91	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.032	18%	0.175	C	C	.	.	H	α-helix	trans	-68.9	-36.3	178	-69.2	-31.4	0	0	0	111.8	K198 F216 V314 Q315 R321 T322	K198-D318 WeakPolarHBondContact CE-OD1 3.42Å; K198-D318 IonicContact NZ-OD1 2.78Å; K198-D318 PolarHBondContact NZ-OD1 3.11Å; K198-D318 IonicContact NZ-OD2 2.78Å; K198-D318 PolarHBondContact NZ-OD2 3.05Å; F216-D318 HydrophobicContact CB-CB 4.15Å; F216-D318 WeakPolarHBondContact CB-OD2 3.42Å; F216-D318 HydrophobicContact CD1-CB 4.16Å; F216-D318 HydrophobicContact CG-CB 4.23Å; V314-D318 HydrophobicContact CG1-CB 4.08Å; Q315-D318 HydrophobicContact CB-CB 4.47Å; Q315-D318 PolarHBondContact O-N 3.38Å; Q315-D318 VanDerWaalsContact O-N 3.08Å; D318-R321 PolarHBondContact O-N 3.48Å; D318-R321 IonicContact OD1-NH1 3.68Å; D318-T322 WeakPolarHBondContact O-CB 3.44Å; D318-T322 PolarHBondContact O-N 2.96Å; D318-T322 PolarHBondContact O-OG1 3.39Å
319	L	92	Very high	91	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-44.9	175.5	-161.1	74.2	0	0	0	111.2	L239 L290 K292 V314 Q315 E316 R321 T322 M323 I330	L239-L319 HydrophobicContact CB-CD1 4.27Å; L239-L319 HydrophobicContact CD2-CD1 3.83Å; L290-L319 HydrophobicContact CB-CD1 3.91Å; K292-L319 HydrophobicContact CB-CD2 4.21Å; V314-L319 HydrophobicContact CG1-CB 4.41Å; V314-L319 HydrophobicContact CG1-CD1 4.38Å; Q315-L319 PolarHBondContact O-N 2.96Å; E316-L319 PolarHBondContact O-N 3.49Å; L319-R321 PolarHBondContact O-N 2.93Å; L319-T322 PolarHBondContact O-N 3.22Å; L319-M323 WeakPolarHBondContact O-CB 3.42Å; L319-M323 PolarHBondContact O-N 2.9Å; L319-I330 HydrophobicContact CD2-CD1 3.88Å; L319-I330 HydrophobicContact CD2-CG1 3.95Å; L319-I330 HydrophobicContact CD2-CG2 3.94Å; L319-I330 HydrophobicContact CG-CD1 4.05Å; L319-I330 HydrophobicContact CG-CG1 4.11Å
320	K	90.8	Very high	90.9	Very high	98 Å²	98	40.4 Å²	40.4	43%	0.426	20%	0.2	S	C	.	.	H	α-helix	trans	-63.2	-39.5	174.9	-75.5	176.6	-175.7	169.1	0	112.2	E316 E317 M323 M324 I330	E316-K320 HydrophobicContact CG-CD 4.32Å; E316-K320 WeakPolarHBondContact O-CB 2.89Å; E316-K320 WeakPolarHBondContact O-CG 2.87Å; E316-K320 PolarHBondContact O-N 3.12Å; E316-K320 WeakPolarHBondContact OE1-CE 3.27Å; E316-K320 IonicContact OE1-NZ 3.94Å; E316-K320 PolarHBondContact OE1-NZ 3.49Å; E317-K320 PolarHBondContact O-N 2.65Å; K320-M323 WeakPolarHBondContact O-CB 3.45Å; K320-M323 PolarHBondContact O-N 3.12Å; K320-M324 VanDerWaalsContact O-CG 3.29Å; K320-M324 WeakPolarHBondContact O-CG 3.39Å; K320-M324 PolarHBondContact O-N 2.65Å; K320-I330 HydrophobicContact CG-CD1 4.25Å
321	R	89.9	Confident	90.9	Very high	9 Å²	9	41.8 Å²	41.8	3%	0.034	21%	0.206	C	C	.	.	H	α-helix	trans	-66.5	-42.2	176.2	-70.8	172.9	69.5	-134.1	-3.5	111	M194 G196 V214 E317 D318 L319 M323 M324 A325 T369 C370 T371	M194-R321 PolarHBondContact O-NE 3.05Å; G196-R321 VanDerWaalsContact N-CZ 3.32Å; V214-R321 HydrophobicContact CG1-CB 4.33Å; V214-R321 HydrophobicContact CG2-CB 3.97Å; E317-R321 WeakPolarHBondContact O-CB 3.33Å; E317-R321 WeakPolarHBondContact O-CG 3.36Å; E317-R321 PolarHBondContact O-N 3.35Å; D318-R321 PolarHBondContact O-N 3.48Å; D318-R321 IonicContact OD1-NH1 3.68Å; L319-R321 PolarHBondContact O-N 2.93Å; R321-M323 VanDerWaalsContact C-N 3.33Å; R321-M323 PolarHBondContact O-N 3.27Å; R321-M324 PolarHBondContact O-N 3.28Å; R321-A325 WeakPolarHBondContact O-CB 3.49Å; R321-A325 PolarHBondContact O-N 2.81Å; R321-T369 PolarHBondContact NE-OG1 2.9Å; R321-C370 VanDerWaalsContact NH2-C 3.27Å; R321-C370 PolarHBondContact NH2-O 3.22Å; R321-T371 PolarHBondContact NH1-OG1 3.13Å; R321-T371 PolarHBondContact NH2-OG1 3.12Å
322	T	91.5	Very high	90.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-41	176.2	-51	0	0	0	0	111.4	L239 L290 D318 L319 M324 A325 C326 F361	L239-T322 HydrophobicContact CD2-CG2 3.92Å; L290-T322 HydrophobicContact CD1-CG2 3.95Å; D318-T322 WeakPolarHBondContact O-CB 3.44Å; D318-T322 PolarHBondContact O-N 2.96Å; D318-T322 PolarHBondContact O-OG1 3.39Å; L319-T322 PolarHBondContact O-N 3.22Å; T322-M324 PolarHBondContact O-N 2.8Å; T322-A325 PolarHBondContact O-N 3.08Å; T322-C326 WeakPolarHBondContact O-CB 3.29Å; T322-C326 PolarHBondContact O-N 2.88Å; T322-C326 PolarHBondContact O-SG 3.37Å; T322-F361 HydrophobicContact CG2-CD1 4.41Å; T322-F361 HydrophobicContact CG2-CE1 4.39Å
323	M	91	Very high	90.6	Very high	53 Å²	53	49.1 Å²	49.1	26%	0.261	25%	0.252	S	S	.	.	H	α-helix	trans	-55.7	-48.5	173.1	-171.7	-170.3	67.6	0	0	111.6	L239 L319 K320 R321 G327 G328 I330	L239-M323 VanDerWaalsContact CD1-CA 3.42Å; L239-M323 HydrophobicContact CD1-CB 3.63Å; L239-M323 HydrophobicContact CD1-CG 4.13Å; L319-M323 WeakPolarHBondContact O-CB 3.42Å; L319-M323 PolarHBondContact O-N 2.9Å; K320-M323 WeakPolarHBondContact O-CB 3.45Å; K320-M323 PolarHBondContact O-N 3.12Å; R321-M323 VanDerWaalsContact C-N 3.33Å; R321-M323 PolarHBondContact O-N 3.27Å; M323-G327 VanDerWaalsContact O-CA 3.24Å; M323-G327 WeakPolarHBondContact O-CA 3.33Å; M323-G327 PolarHBondContact O-N 3.23Å; M323-G328 WeakPolarHBondContact CG-O 3.45Å; M323-I330 HydrophobicContact CB-CG1 4.44Å; M323-I330 HydrophobicContact CG-CG1 4.35Å; M323-I330 HydrophobicContact SD-CD1 3.86Å; M323-I330 HydrophobicContact SD-CG1 3.84Å
324	M	87.8	Confident	90.4	Very high	79 Å²	79	43.6 Å²	43.6	39%	0.389	23%	0.232	S	C	.	.	H	α-helix	trans	-71.2	-37.4	-179.5	-66	-68.5	-85.8	0	0	112.7	L190 M194 K320 R321 T322 K366	L190-M324 HydrophobicContact CD2-CE 4.03Å; M194-M324 HydrophobicContact CE-CB 3.41Å; M194-M324 VanDerWaalsContact CE-CB 3.41Å; M194-M324 HydrophobicContact CE-CE 3.89Å; M194-M324 HydrophobicContact CE-CG 3.57Å; M194-M324 HydrophobicContact SD-CG 4.45Å; K320-M324 VanDerWaalsContact O-CG 3.29Å; K320-M324 WeakPolarHBondContact O-CG 3.39Å; K320-M324 PolarHBondContact O-N 2.65Å; R321-M324 PolarHBondContact O-N 3.28Å; T322-M324 PolarHBondContact O-N 2.8Å; M324-K366 VanDerWaalsContact O-O 3.07Å
325	A	88.6	Confident	89.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.3	-56.7	178.2	0	0	0	0	0	112	V214 R321 T322 C364 K366 T369	V214-A325 HydrophobicContact CG2-CB 3.65Å; R321-A325 WeakPolarHBondContact O-CB 3.49Å; R321-A325 PolarHBondContact O-N 2.81Å; T322-A325 PolarHBondContact O-N 3.08Å; A325-C364 VanDerWaalsContact C-CB 3.5Å; A325-C364 HydrophobicContact CB-CB 3.95Å; A325-C364 WeakPolarHBondContact O-CB 3.44Å; A325-K366 CarbonylContact O-C 3.49Å; A325-K366 PolarHBondContact O-N 3.46Å; A325-T369 HydrophobicContact CB-CG2 3.48Å; A325-T369 VanDerWaalsContact CB-CG2 3.48Å
326	C	89.9	Confident	89.2	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.034	25%	0.252	C	S	.	.	H	α-helix	trans	-87.2	-12.3	-170.3	-51.6	0	0	0	0	112.2	I237 T322 G328 G343 Q344	I237-C326 HydrophobicContact CD1-CB 3.77Å; I237-C326 WeakPolarHBondContact CD1-SG 3.46Å; T322-C326 WeakPolarHBondContact O-CB 3.29Å; T322-C326 PolarHBondContact O-N 2.88Å; T322-C326 PolarHBondContact O-SG 3.37Å; C326-G328 PolarHBondContact O-N 2.93Å; C326-G343 WeakPolarHBondContact O-CA 3.5Å; C326-Q344 VanDerWaalsContact CA-O 3.31Å; C326-Q344 WeakPolarHBondContact CA-O 3.45Å; C326-Q344 WeakPolarHBondContact CB-O 3.42Å; C326-Q344 PolarHBondContact O-N 2.8Å
327	G	87.5	Confident	88.9	Confident	22 Å²	22	41.1 Å²	41.1	23%	0.227	24%	0.238	C	C	.	.			trans	79.9	11.2	173.8	0	0	0	0	0	116.1	M323	M323-G327 VanDerWaalsContact O-CA 3.24Å; M323-G327 WeakPolarHBondContact O-CA 3.33Å; M323-G327 PolarHBondContact O-N 3.23Å
328	G	88	Confident	88.7	Confident	9 Å²	9	38.3 Å²	38.3	9%	0.093	23%	0.231	C	C	.	.			trans	-78.6	-178.5	174.5	0	0	0	0	0	112.6	M323 C326 V341	M323-G328 WeakPolarHBondContact CG-O 3.45Å; C326-G328 PolarHBondContact O-N 2.93Å; G328-V341 CarbonylContact C-O 3.57Å; G328-V341 VanDerWaalsContact CA-O 3.27Å; G328-V341 WeakPolarHBondContact CA-O 3.22Å
329	S	91.3	Very high	88.5	Confident	39 Å²	39	42.5 Å²	42.5	27%	0.273	25%	0.253	S	S	.	.			trans	-126.4	144.1	175.4	57.7	0	0	0	0	110.9	Q331 V341	S329-Q331 PolarHBondContact O-N 2.93Å; S329-Q331 PolarHBondContact OG-NE2 3.42Å; S329-V341 PolarHBondContact N-O 3.21Å; S329-V341 WeakPolarHBondContact OG-CB 3.37Å; S329-V341 WeakPolarHBondContact OG-CG1 3.23Å
330	I	93.1	Very high	88.2	Confident	52 Å²	52	49.6 Å²	49.6	27%	0.267	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	117.4	178.9	-61.3	166	0	0	0	108.6	L239 N241 L319 K320 M323	L239-I330 HydrophobicContact CB-CG1 4.21Å; L239-I330 HydrophobicContact CD1-CG1 4.49Å; L239-I330 WeakPolarHBondContact O-CA 3.48Å; N241-I330 HydrophobicContact CB-CG2 3.96Å; L319-I330 HydrophobicContact CD2-CD1 3.88Å; L319-I330 HydrophobicContact CD2-CG1 3.95Å; L319-I330 HydrophobicContact CD2-CG2 3.94Å; L319-I330 HydrophobicContact CG-CD1 4.05Å; L319-I330 HydrophobicContact CG-CG1 4.11Å; K320-I330 HydrophobicContact CG-CD1 4.25Å; M323-I330 HydrophobicContact CB-CG1 4.44Å; M323-I330 HydrophobicContact CG-CG1 4.35Å; M323-I330 HydrophobicContact SD-CD1 3.86Å; M323-I330 HydrophobicContact SD-CG1 3.84Å
331	Q	93.1	Very high	88.2	Confident	34 Å²	34	46 Å²	46	16%	0.159	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.7	-178.3	-64.4	-59.4	-33.2	0	0	111.6	L239 L240 N241 S329 L337 V341	L239-Q331 PolarHBondContact O-N 3.07Å; L240-Q331 CarbonylContact C-O 3.55Å; L240-Q331 WeakPolarHBondContact CA-O 3.33Å; L240-Q331 HydrophobicContact CD2-CB 4.15Å; N241-Q331 PolarHBondContact N-O 2.93Å; S329-Q331 PolarHBondContact O-N 2.93Å; S329-Q331 PolarHBondContact OG-NE2 3.42Å; Q331-L337 HydrophobicContact CG-CD2 4.29Å; Q331-V341 HydrophobicContact CG-CB 4.37Å; Q331-V341 HydrophobicContact CG-CG2 4.34Å; Q331-V341 VanDerWaalsContact NE2-CG1 3.31Å
332	T	90.9	Very high	88.2	Confident	104 Å²	104	46 Å²	46	64%	0.638	28%	0.278	S	S	*	.	S	Bend	trans	-92.3	-3.4	174.7	53.5	0	0	0	0	113	N241 V242	N241-T332 HydrophobicContact CB-CG2 4.26Å; V242-T332 WeakPolarHBondContact CG2-O 3.29Å
333	S	87.3	Confident	88.3	Confident	56 Å²	56	46 Å²	46	39%	0.392	28%	0.278	S	S	.	.			trans	-141.6	149.5	174.8	-177.4	0	0	0	0	109.8	S335	S333-S335 PolarHBondContact OG-N 3.49Å
334	V	86.7	Confident	88.4	Confident	6 Å²	6	48.4 Å²	48.4	4%	0.036	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-84.2	-18.5	-178.1	-170.2	0	0	0	0	111.9	V242 K277 K280 I281 A336 L337	V242-V334 HydrophobicContact CG1-CG2 4.29Å; K277-V334 HydrophobicContact CB-CG2 4.29Å; K277-V334 HydrophobicContact CG-CB 4.49Å; K277-V334 HydrophobicContact CG-CG2 4.25Å; K277-V334 VanDerWaalsContact O-CG1 3.3Å; K277-V334 WeakPolarHBondContact O-CG1 3.13Å; K280-V334 HydrophobicContact CB-CG1 3.82Å; I281-V334 HydrophobicContact CD1-CG1 4.02Å; I281-V334 HydrophobicContact CG1-CG1 3.43Å; I281-V334 VanDerWaalsContact CG1-CG1 3.43Å; V334-A336 PolarHBondContact O-N 3Å; V334-L337 HydrophobicContact CG1-CD1 3.69Å
335	S	83.7	Confident	88.6	Confident	85 Å²	85	44.8 Å²	44.8	59%	0.594	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-71.6	-14.7	-176.8	-59.1	0	0	0	0	114.3	K280 S333	K280-S335 PolarHBondContact NZ-OG 3.46Å; S333-S335 PolarHBondContact OG-N 3.49Å
336	A	77.1	Confident	88.8	Confident	48 Å²	48	50.6 Å²	50.6	40%	0.397	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-108.9	27.6	-176.2	0	0	0	0	0	113.2	V334 T338 V341	V334-A336 PolarHBondContact O-N 3Å; A336-T338 PolarHBondContact O-N 3.1Å; A336-T338 VanDerWaalsContact O-N 3.09Å; A336-V341 WeakPolarHBondContact O-CG2 3.44Å
337	L	85.3	Confident	89	Confident	21 Å²	21	52.1 Å²	52.1	11%	0.11	31%	0.306	C	S	.	.			trans	-82.2	80.7	177.4	-72.5	168.1	0	0	0	111.2	A238 L240 I281 Q331 V334 V341 L342	A238-L337 HydrophobicContact CB-CD2 4.3Å; L240-L337 HydrophobicContact CD2-CD1 4.42Å; L240-L337 HydrophobicContact CD2-CD2 4.11Å; I281-L337 HydrophobicContact CB-CD1 4.38Å; I281-L337 HydrophobicContact CG1-CD1 3.76Å; Q331-L337 HydrophobicContact CG-CD2 4.29Å; V334-L337 HydrophobicContact CG1-CD1 3.69Å; L337-V341 HydrophobicContact CD2-CG2 4.36Å; L337-L342 HydrophobicContact CD2-CD2 4.09Å
338	T	86.6	Confident	89.4	Confident	77 Å²	77	51.1 Å²	51.1	47%	0.472	30%	0.295	S	S	.	.			trans	-92.6	165.9	169.2	59.4	0	0	0	0	111.9	A336 D340 V341	A336-T338 PolarHBondContact O-N 3.1Å; A336-T338 VanDerWaalsContact O-N 3.09Å; T338-D340 PolarHBondContact O-N 3.07Å; T338-V341 WeakPolarHBondContact O-CG2 3.28Å; T338-V341 PolarHBondContact O-N 2.8Å; T338-V341 VanDerWaalsContact O-N 3.12Å
339	D	85.8	Confident	89.7	Confident	94 Å²	94	52.2 Å²	52.2	50%	0.503	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.8	178.9	-87.2	0.6	0	0	0	113.6	K236 V341	K236-D339 IonicContact NZ-OD1 3.68Å; K236-D339 PolarHBondContact NZ-OD1 2.88Å; K236-D339 IonicContact NZ-OD2 3.04Å; K236-D339 PolarHBondContact NZ-OD2 3.26Å; D339-V341 VanDerWaalsContact C-N 3.3Å; D339-V341 PolarHBondContact O-N 3.38Å
340	D	86.8	Confident	89.7	Confident	150 Å²	150	51.2 Å²	51.2	80%	0.802	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-23.5	178.5	-61.7	-40.2	0	0	0	113.5	T338	T338-D340 PolarHBondContact O-N 3.07Å
341	V	89.4	Confident	89.7	Confident	22 Å²	22	51.4 Å²	51.4	13%	0.133	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-17.5	-178.4	-62.9	0	0	0	0	112.8	G328 S329 Q331 A336 L337 T338 D339	G328-V341 CarbonylContact C-O 3.57Å; G328-V341 VanDerWaalsContact CA-O 3.27Å; G328-V341 WeakPolarHBondContact CA-O 3.22Å; S329-V341 PolarHBondContact N-O 3.21Å; S329-V341 WeakPolarHBondContact OG-CB 3.37Å; S329-V341 WeakPolarHBondContact OG-CG1 3.23Å; Q331-V341 HydrophobicContact CG-CB 4.37Å; Q331-V341 HydrophobicContact CG-CG2 4.34Å; Q331-V341 VanDerWaalsContact NE2-CG1 3.31Å; A336-V341 WeakPolarHBondContact O-CG2 3.44Å; L337-V341 HydrophobicContact CD2-CG2 4.36Å; T338-V341 WeakPolarHBondContact O-CG2 3.28Å; T338-V341 PolarHBondContact O-N 2.8Å; T338-V341 VanDerWaalsContact O-N 3.12Å; D339-V341 VanDerWaalsContact C-N 3.3Å; D339-V341 PolarHBondContact O-N 3.38Å
342	L	91.9	Very high	89.6	Confident	10 Å²	10	56.1 Å²	56.1	5%	0.052	31%	0.314	C	S	.	.			trans	-78.3	134.6	-179.7	-63.4	177.1	0	0	0	111	K236 I237 A238 S284 A286 L337	K236-L342 HydrophobicContact CB-CB 4.48Å; K236-L342 HydrophobicContact CB-CD1 4.22Å; K236-L342 HydrophobicContact CD-CD1 3.97Å; I237-L342 WeakPolarHBondContact O-CA 3.29Å; A238-L342 HydrophobicContact CB-CD2 3.77Å; S284-L342 VanDerWaalsContact O-CD1 3.29Å; S284-L342 WeakPolarHBondContact O-CD1 3.44Å; A286-L342 HydrophobicContact CB-CD1 4.43Å; A286-L342 HydrophobicContact CB-CD2 4.06Å; L337-L342 HydrophobicContact CD2-CD2 4.09Å
343	G	91.8	Very high	89.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	162	171.8	0	0	0	0	0	111.7	K236 I237 C326	K236-G343 CarbonylContact C-O 3.56Å; K236-G343 WeakPolarHBondContact CA-O 3.45Å; I237-G343 PolarHBondContact N-O 3.27Å; I237-G343 PolarHBondContact O-N 3.2Å; C326-G343 WeakPolarHBondContact O-CA 3.5Å
344	Q	92.9	Very high	89.5	Confident	104 Å²	104	50.9 Å²	50.9	49%	0.486	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.2	173.7	-64.6	179.2	0.4	0	0	110.2	C326 P365	C326-Q344 VanDerWaalsContact CA-O 3.31Å; C326-Q344 WeakPolarHBondContact CA-O 3.45Å; C326-Q344 WeakPolarHBondContact CB-O 3.42Å; C326-Q344 PolarHBondContact O-N 2.8Å; Q344-P365 VanDerWaalsContact O-CD 3.3Å; Q344-P365 WeakPolarHBondContact O-CD 3.29Å
345	C	92.8	Very high	89.4	Confident	3 Å²	3	54 Å²	54	2%	0.02	32%	0.32	C	S	.	.			trans	-141	157.3	168.8	70.9	0	0	0	0	109.6	N234 P235 I237	N234-C345 VanDerWaalsContact CA-O 3.24Å; N234-C345 WeakPolarHBondContact CA-O 3.29Å; P235-C345 VanDerWaalsContact CD-O 3.31Å; P235-C345 WeakPolarHBondContact CD-O 3.38Å; I237-C345 HydrophobicContact CD1-CB 4.21Å
346	E	93.1	Very high	89.6	Confident	121 Å²	121	53.2 Å²	53.2	57%	0.565	31%	0.307	S	S	*	.	S	Bend	trans	-67.2	-42.4	179.3	-74.6	165.8	-164.7	0	0	112.1	N234 K362 G363	N234-E346 PolarHBondContact N-O 2.8Å; E346-K362 PolarHBondContact N-O 2.94Å; E346-G363 WeakPolarHBondContact CB-O 3.25Å; E346-G363 WeakPolarHBondContact CG-O 3.46Å; E346-G363 PolarHBondContact N-O 2.85Å; E346-G363 WeakPolarHBondContact OE2-CA 3.15Å
347	L	93.8	Very high	90.3	Very high	38 Å²	38	54.8 Å²	54.8	20%	0.199	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	128.8	-176.8	-178.3	70.2	0	0	0	110.6	R231 E233 K362	R231-L347 HydrophobicContact CG-CD1 4Å; E233-L347 HydrophobicContact CG-CD1 4.16Å; L347-K362 HydrophobicContact CB-CB 4.37Å; L347-K362 HydrophobicContact CD2-CD 4.39Å; L347-K362 PolarHBondContact N-O 3.45Å; L347-K362 VanDerWaalsContact N-O 3.15Å; L347-K362 PolarHBondContact O-N 3.33Å
348	F	95.1	Very high	90.7	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.2	163	171.9	-90.5	0	0	0	109.4	R231 Y232 P235 V288 F309 N359 F360 F361	R231-F348 CarbonylContact C-O 3.6Å; R231-F348 VanDerWaalsContact CA-O 3.27Å; R231-F348 WeakPolarHBondContact CA-O 3.33Å; Y232-F348 AromaticContact CD2-CD1 3.64Å; Y232-F348 HydrophobicContact CD2-CD1 3.64Å; Y232-F348 HydrophobicContact CD2-CE1 4.21Å; Y232-F348 HydrophobicContact CD2-CG 4.48Å; Y232-F348 HydrophobicContact CE2-CD1 4.24Å; Y232-F348 HydrophobicContact CE2-CE1 4.37Å; Y232-F348 PolarHBondContact N-O 3.13Å; Y232-F348 PolarHBondContact O-N 3.07Å; P235-F348 HydrophobicContact CG-CB 3.75Å; V288-F348 HydrophobicContact CG1-CD2 4.4Å; V288-F348 HydrophobicContact CG1-CE2 4.23Å; V288-F348 HydrophobicContact CG2-CB 4.39Å; V288-F348 HydrophobicContact CG2-CD1 4.18Å; V288-F348 HydrophobicContact CG2-CD2 4.21Å; V288-F348 HydrophobicContact CG2-CG 3.98Å; F309-F348 HydrophobicContact CB-CE1 4.38Å; F309-F348 HydrophobicContact CD1-CE1 4.09Å; F309-F348 HydrophobicContact CD1-CE2 4.37Å; F309-F348 AromaticContact CD1-CZ 3.59Å; F309-F348 HydrophobicContact CD1-CZ 3.59Å; F309-F348 AromaticContact CD2-CE1 3.84Å; F309-F348 HydrophobicContact CD2-CE1 3.84Å; F309-F348 AromaticContact CD2-CZ 3.92Å; F309-F348 HydrophobicContact CD2-CZ 3.92Å; F309-F348 HydrophobicContact CE1-CE1 4.34Å; F309-F348 HydrophobicContact CE1-CE2 4.21Å; F309-F348 AromaticContact CE1-CZ 3.49Å; F309-F348 HydrophobicContact CE1-CZ 3.49Å; F309-F348 VanDerWaalsContact CE1-CZ 3.49Å; F309-F348 HydrophobicContact CE2-CE1 4.09Å; F309-F348 AromaticContact CE2-CZ 3.82Å; F309-F348 HydrophobicContact CE2-CZ 3.82Å; F309-F348 AromaticContact CG-CE1 3.84Å; F309-F348 HydrophobicContact CG-CE1 3.84Å; F309-F348 AromaticContact CG-CZ 3.81Å; F309-F348 HydrophobicContact CG-CZ 3.81Å; F309-F348 HydrophobicContact CZ-CE1 4.34Å; F309-F348 AromaticContact CZ-CZ 3.62Å; F309-F348 HydrophobicContact CZ-CZ 3.62Å; F348-N359 HydrophobicContact CE2-CB 4.02Å; F348-N359 HydrophobicContact CZ-CB 4.35Å; F348-F360 VanDerWaalsContact CA-O 3.31Å; F348-F360 WeakPolarHBondContact CA-O 3.44Å; F348-F361 AromaticContact CD2-CD1 3.91Å; F348-F361 HydrophobicContact CD2-CD1 3.91Å; F348-F361 HydrophobicContact CD2-CD2 4.41Å; F348-F361 AromaticContact CD2-CE1 3.49Å; F348-F361 HydrophobicContact CD2-CE1 3.49Å; F348-F361 VanDerWaalsContact CD2-CE1 3.49Å; F348-F361 AromaticContact CD2-CE2 4Å; F348-F361 HydrophobicContact CD2-CE2 4Å; F348-F361 HydrophobicContact CD2-CG 4.35Å; F348-F361 AromaticContact CD2-CZ 3.53Å; F348-F361 HydrophobicContact CD2-CZ 3.53Å; F348-F361 AromaticContact CE2-CE1 3.92Å; F348-F361 HydrophobicContact CE2-CE1 3.92Å; F348-F361 AromaticContact CE2-CE2 3.83Å; F348-F361 HydrophobicContact CE2-CE2 3.83Å; F348-F361 AromaticContact CE2-CZ 3.45Å; F348-F361 HydrophobicContact CE2-CZ 3.45Å; F348-F361 VanDerWaalsContact CE2-CZ 3.45Å
349	E	94.5	Very high	91	Very high	33 Å²	33	50.5 Å²	50.5	15%	0.154	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	140.7	171.1	59.3	-178.5	175.8	0	0	112.9	K230 V351 F360 K362	K230-E349 CarbonylContact O-C 3.35Å; K230-E349 VanDerWaalsContact O-CA 3.23Å; K230-E349 WeakPolarHBondContact O-CA 3.5Å; E349-V351 HydrophobicContact CB-CG2 4.11Å; E349-V351 HydrophobicContact CG-CG2 3.72Å; E349-F360 HydrophobicContact CG-CB 3.91Å; E349-F360 HydrophobicContact CG-CG 4.5Å; E349-F360 PolarHBondContact N-O 2.83Å; E349-F360 PolarHBondContact O-N 3.47Å; E349-K362 WeakPolarHBondContact OE1-CE 3.24Å; E349-K362 IonicContact OE1-NZ 3.82Å; E349-K362 PolarHBondContact OE1-NZ 2.85Å
350	E	93.1	Very high	91.4	Very high	18 Å²	18	46.1 Å²	46.1	8%	0.084	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	109.6	165	-178.9	-177.9	91.9	0	0	108.6	F225 K230 R357 Y358 N359	F225-E350 WeakPolarHBondContact CE1-OE2 3.38Å; F225-E350 WeakPolarHBondContact CZ-OE2 3.26Å; K230-E350 HydrophobicContact CB-CB 4.16Å; K230-E350 HydrophobicContact CD-CB 4.1Å; K230-E350 WeakPolarHBondContact CD-OE1 3.45Å; K230-E350 WeakPolarHBondContact CE-OE1 3.28Å; K230-E350 IonicContact NZ-OE1 2.85Å; K230-E350 PolarHBondContact O-N 3.41Å; E350-R357 HydrophobicContact CG-CB 3.93Å; E350-R357 WeakPolarHBondContact OE1-CD 3.45Å; E350-R357 IonicContact OE1-CZ 2.69Å; E350-R357 IonicContact OE1-NE 2.76Å; E350-R357 IonicContact OE1-NH1 2.66Å; E350-R357 PolarHBondContact OE1-NH1 2.98Å; E350-Y358 CarbonylContact C-O 3.54Å; E350-Y358 VanDerWaalsContact CA-O 3.3Å; E350-Y358 WeakPolarHBondContact CA-O 3.16Å; E350-N359 PolarHBondContact OE2-OD1 3.32Å
351	V	91.9	Very high	91.7	Very high	55 Å²	55	39 Å²	39	33%	0.333	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	141.4	-178.8	-179.2	0	0	0	0	109.6	E349 V353 Y358 F360	E349-V351 HydrophobicContact CB-CG2 4.11Å; E349-V351 HydrophobicContact CG-CG2 3.72Å; V351-V353 PolarHBondContact O-N 3.16Å; V351-Y358 PolarHBondContact N-O 2.96Å; V351-Y358 PolarHBondContact O-N 3.44Å; V351-F360 HydrophobicContact CB-CD2 4.14Å; V351-F360 HydrophobicContact CB-CE2 3.83Å; V351-F360 HydrophobicContact CG2-CD2 4.34Å; V351-F360 HydrophobicContact CG2-CE2 4.46Å
352	Q	90.8	Very high	91.8	Very high	133 Å²	133	41.2 Å²	41.2	62%	0.621	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	118.8	171.7	-175.6	173.2	-2.7	0	0	110.1	G354	Q352-G354 WeakPolarHBondContact CG-O 3.29Å; Q352-G354 PolarHBondContact NE2-O 3.13Å
353	V	89	Confident	91.6	Very high	16 Å²	16	41.7 Å²	41.7	10%	0.097	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	103.9	173.4	-171.5	0	0	0	0	107.4	V200 V351 G355 E356 Y358 F360 I373	V200-V353 HydrophobicContact CB-CG1 4.49Å; V200-V353 HydrophobicContact CG1-CB 4.47Å; V200-V353 HydrophobicContact CG1-CG1 4.06Å; V200-V353 VanDerWaalsContact CG1-O 3.24Å; V200-V353 WeakPolarHBondContact CG1-O 3.44Å; V200-V353 HydrophobicContact CG2-CG1 4.29Å; V351-V353 PolarHBondContact O-N 3.16Å; V353-G355 PolarHBondContact O-N 2.91Å; V353-E356 CarbonylContact C-O 3.59Å; V353-E356 PolarHBondContact N-O 3.35Å; V353-E356 PolarHBondContact O-N 3.1Å; V353-E356 VanDerWaalsContact O-O 3.1Å; V353-Y358 HydrophobicContact CB-CD2 4.27Å; V353-Y358 HydrophobicContact CG2-CD2 4.47Å; V353-Y358 HydrophobicContact CG2-CG 4.47Å; V353-F360 HydrophobicContact CG2-CE2 3.95Å; V353-F360 HydrophobicContact CG2-CZ 3.7Å; V353-I373 HydrophobicContact CG1-CG2 4.21Å
354	G	86.9	Confident	91.2	Very high	34 Å²	34	42.2 Å²	42.2	35%	0.351	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-128.5	-173.3	0	0	0	0	0	112.3	Q352 E356 R375	Q352-G354 WeakPolarHBondContact CG-O 3.29Å; Q352-G354 PolarHBondContact NE2-O 3.13Å; G354-E356 VanDerWaalsContact C-N 3.32Å; G354-R375 VanDerWaalsContact N-NH1 3.11Å
355	G	85.4	Confident	90.6	Very high	72 Å²	72	41.9 Å²	41.9	74%	0.742	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-6.9	178.7	0	0	0	0	0	114.6	V353	V353-G355 PolarHBondContact O-N 2.91Å
356	E	87.8	Confident	89.8	Confident	68 Å²	68	47.8 Å²	47.8	32%	0.318	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.6	-169	-55.8	-169.8	156.9	0	0	111.7	K217 V353 G354 Y358	K217-E356 WeakPolarHBondContact CD-OE2 3.49Å; K217-E356 WeakPolarHBondContact CE-OE1 3.3Å; K217-E356 WeakPolarHBondContact CE-OE2 3.39Å; K217-E356 IonicContact NZ-OE1 2.76Å; K217-E356 PolarHBondContact NZ-OE1 3.42Å; K217-E356 IonicContact NZ-OE2 3.75Å; K217-E356 PolarHBondContact NZ-OE2 2.83Å; V353-E356 CarbonylContact C-O 3.59Å; V353-E356 PolarHBondContact N-O 3.35Å; V353-E356 PolarHBondContact O-N 3.1Å; V353-E356 VanDerWaalsContact O-O 3.1Å; G354-E356 VanDerWaalsContact C-N 3.32Å; E356-Y358 HydrophobicContact CB-CD2 4.47Å; E356-Y358 HydrophobicContact CB-CE2 4.14Å
357	R	90.9	Very high	88.5	Confident	81 Å²	81	43.9 Å²	43.9	31%	0.306	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	139.3	173.8	-63	-165.3	-170.9	166.1	3.8	110.7	K218 E226 E350	K218-R357 HydrophobicContact CB-CB 4.02Å; K218-R357 VanDerWaalsContact CB-O 3.28Å; K218-R357 WeakPolarHBondContact CB-O 3.39Å; K218-R357 HydrophobicContact CD-CB 4.12Å; K218-R357 PolarHBondContact N-O 2.86Å; E226-R357 VanDerWaalsContact CD-NH1 3.32Å; E226-R357 IonicContact OE1-CZ 3.74Å; E226-R357 IonicContact OE1-NH1 2.7Å; E226-R357 PolarHBondContact OE1-NH1 2.68Å; E226-R357 VanDerWaalsContact OE1-NH1 3.08Å; E226-R357 IonicContact OE1-NH2 3.68Å; E226-R357 IonicContact OE2-CZ 3.63Å; E226-R357 VanDerWaalsContact OE2-CZ 3.26Å; E226-R357 IonicContact OE2-NH1 3.13Å; E226-R357 PolarHBondContact OE2-NH1 3Å; E226-R357 IonicContact OE2-NH2 2.96Å; E226-R357 PolarHBondContact OE2-NH2 3.39Å; E350-R357 HydrophobicContact CG-CB 3.93Å; E350-R357 WeakPolarHBondContact OE1-CD 3.45Å; E350-R357 IonicContact OE1-CZ 2.69Å; E350-R357 IonicContact OE1-NE 2.76Å; E350-R357 IonicContact OE1-NH1 2.66Å; E350-R357 PolarHBondContact OE1-NH1 2.98Å
358	Y	93.8	Very high	87.7	Confident	7 Å²	7	46.2 Å²	46.2	3%	0.027	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.7	-180	-89.7	-107.3	0	0	0	109.8	K198 K199 V200 K217 E350 V351 V353 E356 F360 I373	K198-Y358 HydrophobicContact CB-CE1 3.87Å; K198-Y358 HydrophobicContact CG-CE1 4.33Å; K199-Y358 PolarHBondContact O-OH 2.94Å; V200-Y358 HydrophobicContact CG2-CD2 4.36Å; V200-Y358 HydrophobicContact CG2-CE1 4.24Å; V200-Y358 HydrophobicContact CG2-CE2 3.55Å; V200-Y358 VanDerWaalsContact CG2-CZ 3.47Å; V200-Y358 WeakPolarHBondContact CG2-OH 3.39Å; K217-Y358 HydrophobicContact CB-CE1 4.08Å; K217-Y358 HydrophobicContact CB-CE2 4.07Å; K217-Y358 HydrophobicContact CG-CE2 4.17Å; E350-Y358 CarbonylContact C-O 3.54Å; E350-Y358 VanDerWaalsContact CA-O 3.3Å; E350-Y358 WeakPolarHBondContact CA-O 3.16Å; V351-Y358 PolarHBondContact N-O 2.96Å; V351-Y358 PolarHBondContact O-N 3.44Å; V353-Y358 HydrophobicContact CB-CD2 4.27Å; V353-Y358 HydrophobicContact CG2-CD2 4.47Å; V353-Y358 HydrophobicContact CG2-CG 4.47Å; E356-Y358 HydrophobicContact CB-CD2 4.47Å; E356-Y358 HydrophobicContact CB-CE2 4.14Å; Y358-F360 VanDerWaalsContact CB-CE2 3.48Å; Y358-F360 VanDerWaalsContact O-CD2 3.29Å; Y358-F360 WeakPolarHBondContact O-CD2 3.2Å; Y358-I373 HydrophobicContact CD1-CD1 4.43Å
359	N	94.1	Very high	87.1	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	125.4	172.5	-62.7	-32.2	0	0	0	108.4	A215 F216 F309 F348 E350 F361	A215-N359 VanDerWaalsContact CA-O 3.24Å; A215-N359 WeakPolarHBondContact CA-O 3.13Å; F216-N359 HydrophobicContact CE2-CB 4.2Å; F216-N359 WeakPolarHBondContact CE2-ND2 2.93Å; F216-N359 HydrophobicContact CZ-CB 4.21Å; F216-N359 PolarHBondContact N-O 3.42Å; F216-N359 VanDerWaalsContact N-O 3.16Å; F216-N359 PolarHBondContact O-N 3.22Å; F309-N359 WeakPolarHBondContact CZ-OD1 3.18Å; F348-N359 HydrophobicContact CE2-CB 4.02Å; F348-N359 HydrophobicContact CZ-CB 4.35Å; E350-N359 PolarHBondContact OE2-OD1 3.32Å; N359-F361 HydrophobicContact CB-CE2 4.21Å
360	F	94.4	Very high	86.9	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.009	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.1	-179.6	-68	-99.5	0	0	0	110.3	V211 A215 F348 E349 V351 V353 Y358 K362 I373	V211-F360 HydrophobicContact CG1-CD1 4.08Å; V211-F360 HydrophobicContact CG2-CD1 3.84Å; V211-F360 HydrophobicContact CG2-CE1 3.67Å; A215-F360 HydrophobicContact CB-CD1 3.89Å; A215-F360 HydrophobicContact CB-CE1 4.13Å; A215-F360 HydrophobicContact CB-CG 4.42Å; F348-F360 VanDerWaalsContact CA-O 3.31Å; F348-F360 WeakPolarHBondContact CA-O 3.44Å; E349-F360 HydrophobicContact CG-CB 3.91Å; E349-F360 HydrophobicContact CG-CG 4.5Å; E349-F360 PolarHBondContact N-O 2.83Å; E349-F360 PolarHBondContact O-N 3.47Å; V351-F360 HydrophobicContact CB-CD2 4.14Å; V351-F360 HydrophobicContact CB-CE2 3.83Å; V351-F360 HydrophobicContact CG2-CD2 4.34Å; V351-F360 HydrophobicContact CG2-CE2 4.46Å; V353-F360 HydrophobicContact CG2-CE2 3.95Å; V353-F360 HydrophobicContact CG2-CZ 3.7Å; Y358-F360 VanDerWaalsContact CB-CE2 3.48Å; Y358-F360 VanDerWaalsContact O-CD2 3.29Å; Y358-F360 WeakPolarHBondContact O-CD2 3.2Å; F360-K362 HydrophobicContact CB-CG 4.44Å; F360-I373 HydrophobicContact CD1-CD1 4.3Å; F360-I373 HydrophobicContact CE1-CD1 3.21Å; F360-I373 HydrophobicContact CZ-CD1 3.36Å
361	F	93.5	Very high	86.8	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	103.4	170.4	-62	-97.1	0	0	0	106.8	G213 V214 F216 I237 V288 L290 T322 F348 N359	G213-F361 WeakPolarHBondContact CA-O 3.41Å; V214-F361 HydrophobicContact CB-CB 4.48Å; V214-F361 PolarHBondContact N-O 3.15Å; V214-F361 VanDerWaalsContact N-O 3.15Å; V214-F361 PolarHBondContact O-N 3.49Å; F216-F361 HydrophobicContact CD1-CE2 4.27Å; F216-F361 HydrophobicContact CE1-CD2 4.12Å; F216-F361 AromaticContact CE1-CE2 3.38Å; F216-F361 HydrophobicContact CE1-CE2 3.38Å; F216-F361 HydrophobicContact CE1-CZ 4.18Å; F216-F361 AromaticContact CZ-CE2 3.85Å; F216-F361 HydrophobicContact CZ-CE2 3.85Å; F216-F361 HydrophobicContact CZ-CZ 4.35Å; I237-F361 HydrophobicContact CD1-CD1 3.59Å; I237-F361 HydrophobicContact CD1-CE1 3.71Å; I237-F361 HydrophobicContact CG1-CD1 4.49Å; I237-F361 HydrophobicContact CG1-CE1 4.17Å; I237-F361 HydrophobicContact CG2-CE1 4.36Å; V288-F361 HydrophobicContact CG1-CE1 3.94Å; V288-F361 HydrophobicContact CG1-CZ 4.02Å; L290-F361 HydrophobicContact CD1-CE1 4.41Å; L290-F361 HydrophobicContact CD1-CE2 4.38Å; L290-F361 HydrophobicContact CD1-CZ 3.77Å; L290-F361 HydrophobicContact CD2-CZ 4.33Å; L290-F361 HydrophobicContact CG-CZ 4.47Å; T322-F361 HydrophobicContact CG2-CD1 4.41Å; T322-F361 HydrophobicContact CG2-CE1 4.39Å; F348-F361 AromaticContact CD2-CD1 3.91Å; F348-F361 HydrophobicContact CD2-CD1 3.91Å; F348-F361 HydrophobicContact CD2-CD2 4.41Å; F348-F361 AromaticContact CD2-CE1 3.49Å; F348-F361 HydrophobicContact CD2-CE1 3.49Å; F348-F361 VanDerWaalsContact CD2-CE1 3.49Å; F348-F361 AromaticContact CD2-CE2 4Å; F348-F361 HydrophobicContact CD2-CE2 4Å; F348-F361 HydrophobicContact CD2-CG 4.35Å; F348-F361 AromaticContact CD2-CZ 3.53Å; F348-F361 HydrophobicContact CD2-CZ 3.53Å; F348-F361 AromaticContact CE2-CE1 3.92Å; F348-F361 HydrophobicContact CE2-CE1 3.92Å; F348-F361 AromaticContact CE2-CE2 3.83Å; F348-F361 HydrophobicContact CE2-CE2 3.83Å; F348-F361 AromaticContact CE2-CZ 3.45Å; F348-F361 HydrophobicContact CE2-CZ 3.45Å; F348-F361 VanDerWaalsContact CE2-CZ 3.45Å; N359-F361 HydrophobicContact CB-CE2 4.21Å
362	K	91.4	Very high	86.9	Confident	69 Å²	69	41.3 Å²	41.3	30%	0.3	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	151.4	-176.4	-66.7	177	177.2	175.5	0	110.5	V211 E346 L347 E349 F360	V211-K362 HydrophobicContact CG1-CG 4.25Å; E346-K362 PolarHBondContact N-O 2.94Å; L347-K362 HydrophobicContact CB-CB 4.37Å; L347-K362 HydrophobicContact CD2-CD 4.39Å; L347-K362 PolarHBondContact N-O 3.45Å; L347-K362 VanDerWaalsContact N-O 3.15Å; L347-K362 PolarHBondContact O-N 3.33Å; E349-K362 WeakPolarHBondContact OE1-CE 3.24Å; E349-K362 IonicContact OE1-NZ 3.82Å; E349-K362 PolarHBondContact OE1-NZ 2.85Å; F360-K362 HydrophobicContact CB-CG 4.44Å
363	G	86	Confident	87	Confident	21 Å²	21	35 Å²	35	22%	0.216	21%	0.207	C	C	.	.	S	Bend	trans	62.4	52.8	176.5	0	0	0	0	0	112	E346	E346-G363 WeakPolarHBondContact CB-O 3.25Å; E346-G363 WeakPolarHBondContact CG-O 3.46Å; E346-G363 PolarHBondContact N-O 2.85Å; E346-G363 WeakPolarHBondContact OE2-CA 3.15Å
364	C	84.8	Confident	87.3	Confident	10 Å²	10	34.2 Å²	34.2	7%	0.068	20%	0.202	C	C	.	.			trans	-85.3	130.8	179.1	-47.1	0	0	0	0	110	A325 K366 A367	A325-C364 VanDerWaalsContact C-CB 3.5Å; A325-C364 HydrophobicContact CB-CB 3.95Å; A325-C364 WeakPolarHBondContact O-CB 3.44Å; C364-K366 PolarHBondContact O-N 3.44Å; C364-A367 HydrophobicContact CB-CB 4.07Å; C364-A367 WeakPolarHBondContact O-CB 3.42Å; C364-A367 PolarHBondContact O-N 3.38Å
365	P	80.1	Confident	87.5	Confident	98 Å²	98	34.2 Å²	34.2	64%	0.636	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-25.4	-172.5	24.2	-33.2	0	0	0	113.3	Q344	Q344-P365 VanDerWaalsContact O-CD 3.3Å; Q344-P365 WeakPolarHBondContact O-CD 3.29Å
366	K	76.4	Confident	87.6	Confident	127 Å²	127	30.9 Å²	30.9	55%	0.552	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.3	28	175.3	-59.5	-177.9	-170.5	166.7	0	111.6	M324 A325 C364 K368	M324-K366 VanDerWaalsContact O-O 3.07Å; A325-K366 CarbonylContact O-C 3.49Å; A325-K366 PolarHBondContact O-N 3.46Å; C364-K366 PolarHBondContact O-N 3.44Å; K366-K368 VanDerWaalsContact C-N 3.28Å; K366-K368 PolarHBondContact O-N 3.14Å
367	A	65.4	Low	87.6	Confident	39 Å²	39	30.6 Å²	30.6	32%	0.322	17%	0.172	S	C	.	.			trans	-59.8	83	-175.8	0	0	0	0	0	113	C364 T369	C364-A367 HydrophobicContact CB-CB 4.07Å; C364-A367 WeakPolarHBondContact O-CB 3.42Å; C364-A367 PolarHBondContact O-N 3.38Å; A367-T369 VanDerWaalsContact C-N 3.32Å
368	K	75.7	Confident	87.3	Confident	87 Å²	87	28.6 Å²	28.6	38%	0.378	17%	0.173	S	C	.	.			trans	-99.7	24.3	167.5	-58.5	-170	-179.4	-161.6	0	111	L186 D187 L190 K366	L186-K368 VanDerWaalsContact CD2-O 3.31Å; L186-K368 WeakPolarHBondContact CD2-O 3.47Å; D187-K368 HydrophobicContact CB-CD 4.17Å; D187-K368 IonicContact OD2-NZ 2.63Å; D187-K368 PolarHBondContact OD2-NZ 2.95Å; L190-K368 HydrophobicContact CD1-CB 4.09Å; L190-K368 HydrophobicContact CD1-CD 3.58Å; L190-K368 HydrophobicContact CD1-CG 4.43Å; L190-K368 HydrophobicContact CD2-CB 4.3Å; K366-K368 VanDerWaalsContact C-N 3.28Å; K366-K368 PolarHBondContact O-N 3.14Å
369	T	83.6	Confident	87	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.012	19%	0.193	C	C	.	.			trans	-149.3	144.6	-178	177.4	0	0	0	0	108.6	M194 V214 R321 A325 A367	M194-T369 WeakPolarHBondContact O-CB 3.42Å; M194-T369 PolarHBondContact O-OG1 3.46Å; V214-T369 HydrophobicContact CG2-CG2 3.76Å; R321-T369 PolarHBondContact NE-OG1 2.9Å; A325-T369 HydrophobicContact CB-CG2 3.48Å; A325-T369 VanDerWaalsContact CB-CG2 3.48Å; A367-T369 VanDerWaalsContact C-N 3.32Å
370	C	89.3	Confident	86.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.007	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	147.4	178.3	56.6	0	0	0	0	109.1	S185 I195 G196 L210 V211 G213 R321	S185-C370 PolarHBondContact OG-SG 3.23Å; S185-C370 VanDerWaalsContact OG-SG 3.35Å; I195-C370 WeakPolarHBondContact CA-O 3.43Å; G196-C370 PolarHBondContact N-O 3Å; G196-C370 VanDerWaalsContact N-O 3.12Å; L210-C370 HydrophobicContact CD1-CB 3.85Å; V211-C370 WeakPolarHBondContact O-CA 3.45Å; V211-C370 WeakPolarHBondContact O-CB 3.35Å; G213-C370 CarbonylContact O-C 3.48Å; G213-C370 VanDerWaalsContact O-CA 3.24Å; G213-C370 WeakPolarHBondContact O-CA 3.46Å; R321-C370 VanDerWaalsContact NH2-C 3.27Å; R321-C370 PolarHBondContact NH2-O 3.22Å
371	T	92.1	Very high	86	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.1	171.8	-68.7	0	0	0	0	109.4	G196 K198 V211 G213 A215 R321 I373	G196-T371 CarbonylContact O-C 3.56Å; G196-T371 VanDerWaalsContact O-CA 3.25Å; G196-T371 WeakPolarHBondContact O-CA 3.22Å; K198-T371 HydrophobicContact CB-CG2 4.18Å; K198-T371 HydrophobicContact CG-CG2 3.63Å; V211-T371 WeakPolarHBondContact CB-O 3.45Å; V211-T371 PolarHBondContact N-O 3.06Å; V211-T371 PolarHBondContact O-N 2.88Å; V211-T371 VanDerWaalsContact O-N 3.08Å; G213-T371 PolarHBondContact O-N 2.83Å; G213-T371 VanDerWaalsContact O-N 3.15Å; A215-T371 HydrophobicContact CB-CG2 3.94Å; A215-T371 PolarHBondContact N-OG1 3.29Å; A215-T371 PolarHBondContact O-OG1 2.92Å; R321-T371 PolarHBondContact NH1-OG1 3.13Å; R321-T371 PolarHBondContact NH2-OG1 3.12Å; T371-I373 HydrophobicContact CG2-CG1 4.16Å
372	I	93.5	Very high	85.7	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	118.9	164.8	-63.2	168.8	0	0	0	107.5	M178 A182 I195 G196 I197 K198 L210 L389 I393	M178-I372 HydrophobicContact SD-CG1 4.34Å; M178-I372 HydrophobicContact SD-CG2 3.69Å; A182-I372 HydrophobicContact CB-CD1 4.24Å; I195-I372 HydrophobicContact CG2-CD1 3.95Å; I195-I372 HydrophobicContact CG2-CG1 4.34Å; G196-I372 PolarHBondContact O-N 3.31Å; I197-I372 CarbonylContact C-O 3.52Å; I197-I372 WeakPolarHBondContact CA-O 3.42Å; I197-I372 HydrophobicContact CG1-CB 4.31Å; I197-I372 HydrophobicContact CG1-CD1 4.44Å; K198-I372 PolarHBondContact N-O 2.82Å; L210-I372 HydrophobicContact CD1-CG1 3.67Å; I372-L389 HydrophobicContact CG2-CD1 4.46Å; I372-I393 HydrophobicContact CD1-CD1 4.12Å
373	I	93.9	Very high	85.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	111.5	169.1	-61.2	-176	0	0	0	107	K198 V200 S208 Q209 V211 A215 V353 Y358 F360 T371	K198-I373 CarbonylContact O-C 3.48Å; K198-I373 WeakPolarHBondContact O-CA 3.34Å; V200-I373 HydrophobicContact CG2-CG2 3.75Å; S208-I373 CarbonylContact C-O 3.55Å; S208-I373 WeakPolarHBondContact CA-O 3.49Å; S208-I373 VanDerWaalsContact CB-O 3.24Å; S208-I373 WeakPolarHBondContact CB-O 3.3Å; Q209-I373 HydrophobicContact CG-CB 4Å; Q209-I373 HydrophobicContact CG-CD1 4.43Å; Q209-I373 PolarHBondContact N-O 3.16Å; Q209-I373 PolarHBondContact O-N 3.38Å; V211-I373 HydrophobicContact CG2-CD1 3.93Å; V211-I373 HydrophobicContact CG2-CG1 4.17Å; A215-I373 HydrophobicContact CB-CD1 3.98Å; A215-I373 HydrophobicContact CB-CG1 4.39Å; V353-I373 HydrophobicContact CG1-CG2 4.21Å; Y358-I373 HydrophobicContact CD1-CD1 4.43Å; F360-I373 HydrophobicContact CD1-CD1 4.3Å; F360-I373 HydrophobicContact CE1-CD1 3.21Å; F360-I373 HydrophobicContact CZ-CD1 3.36Å; T371-I373 HydrophobicContact CG2-CG1 4.16Å
374	L	93.6	Very high	85.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	120.5	-177.1	-177	68.3	0	0	0	110	F175 I197 K198 K199 V200 T382 T385 E386 L389	F175-L374 HydrophobicContact CE1-CD1 3.93Å; F175-L374 HydrophobicContact CZ-CD1 4.05Å; I197-L374 HydrophobicContact CG2-CB 4.05Å; I197-L374 HydrophobicContact CG2-CD2 4.33Å; K198-L374 PolarHBondContact O-N 2.71Å; K199-L374 CarbonylContact C-O 3.55Å; K199-L374 WeakPolarHBondContact CA-O 3.47Å; K199-L374 HydrophobicContact CG-CD2 4.48Å; V200-L374 PolarHBondContact N-O 2.95Å; L374-T382 HydrophobicContact CB-CG2 4.48Å; L374-T382 HydrophobicContact CD2-CG2 3.6Å; L374-T382 WeakPolarHBondContact CD2-O 3.44Å; L374-T382 HydrophobicContact CG-CG2 3.86Å; L374-T385 HydrophobicContact CD1-CG2 3.42Å; L374-T385 VanDerWaalsContact CD1-CG2 3.42Å; L374-T385 HydrophobicContact CD2-CG2 3.76Å; L374-T385 HydrophobicContact CG-CG2 4.17Å; L374-E386 HydrophobicContact CD2-CB 4.16Å; L374-L389 HydrophobicContact CD1-CD1 3.97Å
375	R	91.3	Very high	85.5	Confident	34 Å²	34	37.4 Å²	37.4	13%	0.128	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	143.7	179.5	-70.3	-90.1	-69.6	-175.1	-2	109.7	V200 G202 G203 A204 L205 D207 S208 G354	V200-R375 WeakPolarHBondContact O-CA 3.4Å; G202-R375 PolarHBondContact O-NE 3.47Å; G202-R375 VanDerWaalsContact O-NE 3.15Å; G202-R375 PolarHBondContact O-NH1 2.82Å; G203-R375 VanDerWaalsContact CA-NH2 3.32Å; A204-R375 WeakPolarHBondContact O-CB 3.47Å; L205-R375 WeakPolarHBondContact CD2-O 3.35Å; D207-R375 HydrophobicContact CB-CB 3.92Å; D207-R375 HydrophobicContact CB-CG 3.89Å; D207-R375 IonicContact OD2-CZ 3Å; D207-R375 IonicContact OD2-NE 3.86Å; D207-R375 IonicContact OD2-NH2 3.75Å; D207-R375 PolarHBondContact OD2-NH2 2.81Å; S208-R375 PolarHBondContact OG-N 3.15Å; G354-R375 VanDerWaalsContact N-NH1 3.11Å
376	G	89.1	Confident	85.9	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	146.3	177.6	0	0	0	0	0	112.4	V200 G202	V200-G376 PolarHBondContact O-N 3Å; G202-G376 PolarHBondContact N-O 3.2Å
377	G	86.2	Confident	86.3	Confident	62 Å²	62	31.8 Å²	31.8	64%	0.639	17%	0.173	S	C	*	.	S	Bend	trans	-64.7	-52.5	-177	0	0	0	0	0	113.1	G203	G203-G377 PolarHBondContact O-N 2.87Å
378	A	86.1	Confident	87.4	Confident	39 Å²	39	30 Å²	30	32%	0.322	16%	0.158	S	C	.	.	S	Bend	trans	-108.1	140.1	-178.2	0	0	0	0	0	111.6	Q380 F381 T382	A378-Q380 VanDerWaalsContact C-N 3.28Å; A378-Q380 PolarHBondContact O-N 3.43Å; A378-F381 HydrophobicContact CB-CD2 3.91Å; A378-F381 WeakPolarHBondContact O-CB 3.49Å; A378-F381 PolarHBondContact O-N 3.35Å; A378-F381 VanDerWaalsContact O-N 3.11Å; A378-T382 PolarHBondContact O-N 3.09Å; A378-T382 VanDerWaalsContact O-N 3.13Å; A378-T382 PolarHBondContact O-OG1 3.36Å
379	E	85.9	Confident	88	Confident	95 Å²	95	25.9 Å²	25.9	44%	0.444	14%	0.14	S	C	.	.	H	α-helix	trans	-57.4	-40.4	-177.5	-173.4	177.6	178.9	0	0	112.4	F381 T382 E383	E379-F381 VanDerWaalsContact C-N 3.31Å; E379-F381 PolarHBondContact O-N 2.96Å; E379-T382 PolarHBondContact O-N 3.07Å; E379-E383 HydrophobicContact CG-CG 4.48Å; E379-E383 WeakPolarHBondContact O-CG 3.24Å; E379-E383 PolarHBondContact O-N 3.34Å
380	Q	84.1	Confident	88.2	Confident	74 Å²	74	29 Å²	29	35%	0.346	16%	0.155	S	C	.	.	H	α-helix	trans	-62.3	-38.9	179.6	-60.8	81.7	1.7	0	0	111.7	I58 A378 E384	I58-Q380 HydrophobicContact CD1-CB 4.49Å; A378-Q380 VanDerWaalsContact C-N 3.28Å; A378-Q380 PolarHBondContact O-N 3.43Å; Q380-E384 PolarHBondContact O-N 3.38Å
381	F	84.5	Confident	88	Confident	100 Å²	100	29.3 Å²	29.3	44%	0.439	16%	0.156	S	C	.	.	H	α-helix	trans	-68.7	-39.9	176.4	-83.1	-94.7	0	0	0	111.4	L167 A378 E379 E384 T385	L167-F381 HydrophobicContact CD1-CD1 4Å; L167-F381 HydrophobicContact CD1-CE1 4.11Å; L167-F381 HydrophobicContact CD2-CE1 4.33Å; A378-F381 HydrophobicContact CB-CD2 3.91Å; A378-F381 WeakPolarHBondContact O-CB 3.49Å; A378-F381 PolarHBondContact O-N 3.35Å; A378-F381 VanDerWaalsContact O-N 3.11Å; E379-F381 VanDerWaalsContact C-N 3.31Å; E379-F381 PolarHBondContact O-N 2.96Å; F381-E384 PolarHBondContact O-N 3.38Å; F381-T385 VanDerWaalsContact O-CB 3.29Å; F381-T385 WeakPolarHBondContact O-CB 3.45Å; F381-T385 PolarHBondContact O-N 3.36Å; F381-T385 PolarHBondContact O-OG1 3.41Å
382	T	87.6	Confident	87.9	Confident	3 Å²	3	29.3 Å²	29.3	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-68.5	-38.2	177.7	-47.7	0	0	0	0	111.6	K199 L374 A378 E379 T385 E386	K199-T382 HydrophobicContact CB-CG2 3.66Å; K199-T382 HydrophobicContact CD-CG2 3.88Å; K199-T382 HydrophobicContact CG-CG2 3.66Å; L374-T382 HydrophobicContact CB-CG2 4.48Å; L374-T382 HydrophobicContact CD2-CG2 3.6Å; L374-T382 WeakPolarHBondContact CD2-O 3.44Å; L374-T382 HydrophobicContact CG-CG2 3.86Å; A378-T382 PolarHBondContact O-N 3.09Å; A378-T382 VanDerWaalsContact O-N 3.13Å; A378-T382 PolarHBondContact O-OG1 3.36Å; E379-T382 PolarHBondContact O-N 3.07Å; T382-T385 PolarHBondContact O-N 3.36Å; T382-E386 WeakPolarHBondContact O-CB 3.42Å; T382-E386 PolarHBondContact O-N 3.44Å
383	E	85.4	Confident	87.7	Confident	20 Å²	20	29.5 Å²	29.5	9%	0.093	16%	0.157	C	C	.	.	H	α-helix	trans	-61.6	-45.9	172.4	-76.5	-169	167.1	0	0	111.7	K55 E379 E386 R387	K55-E383 IonicContact NZ-OE1 2.73Å; K55-E383 PolarHBondContact NZ-OE1 3.1Å; K55-E383 IonicContact NZ-OE2 3.16Å; E379-E383 HydrophobicContact CG-CG 4.48Å; E379-E383 WeakPolarHBondContact O-CG 3.24Å; E379-E383 PolarHBondContact O-N 3.34Å; E383-E386 PolarHBondContact O-N 2.6Å; E383-R387 WeakPolarHBondContact O-CG 3.18Å; E383-R387 PolarHBondContact O-N 3.15Å; E383-R387 IonicContact OE2-NH2 2.96Å
384	E	84.1	Confident	87.3	Confident	3 Å²	3	30.4 Å²	30.4	1%	0.014	16%	0.161	C	C	.	.	H	α-helix	trans	-71.4	-33.2	179.5	-175.2	60.7	-174.9	0	0	112.4	S59 N60 L167 Q380 F381 R387 S388	S59-E384 WeakPolarHBondContact CA-OE2 3.42Å; S59-E384 PolarHBondContact OG-OE2 2.61Å; N60-E384 PolarHBondContact N-OE1 3.01Å; L167-E384 HydrophobicContact CD1-CB 3.86Å; L167-E384 HydrophobicContact CD1-CG 3.62Å; L167-E384 HydrophobicContact CG-CG 4.14Å; Q380-E384 PolarHBondContact O-N 3.38Å; F381-E384 PolarHBondContact O-N 3.38Å; E384-R387 PolarHBondContact O-N 3.22Å; E384-R387 IonicContact OE2-CZ 3.56Å; E384-R387 IonicContact OE2-NH1 3.76Å; E384-R387 PolarHBondContact OE2-NH1 3.02Å; E384-S388 WeakPolarHBondContact O-CB 3.43Å; E384-S388 PolarHBondContact O-N 3.16Å; E384-S388 PolarHBondContact O-OG 3.41Å
385	T	88.6	Confident	86.9	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-41.2	174.7	-59.2	0	0	0	0	111.4	I168 F175 L205 L374 F381 T382 R387 S388 L389	I168-T385 HydrophobicContact CD1-CG2 4.27Å; I168-T385 HydrophobicContact CG2-CG2 3.53Å; I168-T385 VanDerWaalsContact CG2-OG1 3.23Å; I168-T385 WeakPolarHBondContact CG2-OG1 3.37Å; F175-T385 HydrophobicContact CZ-CG2 4.26Å; L205-T385 HydrophobicContact CD2-CG2 4.31Å; L374-T385 HydrophobicContact CD1-CG2 3.42Å; L374-T385 VanDerWaalsContact CD1-CG2 3.42Å; L374-T385 HydrophobicContact CD2-CG2 3.76Å; L374-T385 HydrophobicContact CG-CG2 4.17Å; F381-T385 VanDerWaalsContact O-CB 3.29Å; F381-T385 WeakPolarHBondContact O-CB 3.45Å; F381-T385 PolarHBondContact O-N 3.36Å; F381-T385 PolarHBondContact O-OG1 3.41Å; T382-T385 PolarHBondContact O-N 3.36Å; T385-R387 VanDerWaalsContact C-N 3.32Å; T385-R387 PolarHBondContact O-N 2.99Å; T385-S388 WeakPolarHBondContact O-CB 3.13Å; T385-S388 PolarHBondContact O-N 3.39Å; T385-L389 HydrophobicContact CG2-CD1 4.01Å; T385-L389 HydrophobicContact CG2-CG 4.23Å; T385-L389 WeakPolarHBondContact O-CB 3.38Å; T385-L389 VanDerWaalsContact O-CG 3.27Å; T385-L389 WeakPolarHBondContact O-CG 3.24Å; T385-L389 PolarHBondContact O-N 3.15Å
386	E	88.6	Confident	86.7	Confident	57 Å²	57	29.1 Å²	29.1	27%	0.266	16%	0.157	S	C	.	.	H	α-helix	trans	-56.2	-45.7	173.3	175.1	-179.2	-155.8	0	0	111.5	I197 K199 L374 T382 E383 L389 H390	I197-E386 HydrophobicContact CB-CG 4.22Å; I197-E386 HydrophobicContact CD1-CG 4.1Å; I197-E386 HydrophobicContact CG2-CB 4.3Å; I197-E386 HydrophobicContact CG2-CG 3.99Å; K199-E386 HydrophobicContact CD-CB 4.39Å; K199-E386 WeakPolarHBondContact CD-OE2 3.4Å; K199-E386 WeakPolarHBondContact CE-OE2 3.27Å; K199-E386 IonicContact NZ-OE2 2.89Å; K199-E386 PolarHBondContact NZ-OE2 2.95Å; L374-E386 HydrophobicContact CD2-CB 4.16Å; T382-E386 WeakPolarHBondContact O-CB 3.42Å; T382-E386 PolarHBondContact O-N 3.44Å; E383-E386 PolarHBondContact O-N 2.6Å; E386-L389 PolarHBondContact O-N 3.19Å; E386-H390 WeakPolarHBondContact O-CB 3.39Å; E386-H390 PolarHBondContact O-N 3.08Å
387	R	84.8	Confident	86.5	Confident	51 Å²	51	31.6 Å²	31.6	19%	0.192	17%	0.166	C	C	.	.	H	α-helix	trans	-63.5	-46.5	175.7	-64.8	178.8	-155.1	150.8	5.2	111.7	T57 I58 S59 E383 E384 T385 L389 H390 D391	T57-R387 VanDerWaalsContact CG2-NH2 3.3Å; I58-R387 PolarHBondContact O-NH1 3.48Å; S59-R387 PolarHBondContact OG-NH1 2.62Å; E383-R387 WeakPolarHBondContact O-CG 3.18Å; E383-R387 PolarHBondContact O-N 3.15Å; E383-R387 IonicContact OE2-NH2 2.96Å; E384-R387 PolarHBondContact O-N 3.22Å; E384-R387 IonicContact OE2-CZ 3.56Å; E384-R387 IonicContact OE2-NH1 3.76Å; E384-R387 PolarHBondContact OE2-NH1 3.02Å; T385-R387 VanDerWaalsContact C-N 3.32Å; T385-R387 PolarHBondContact O-N 2.99Å; R387-L389 VanDerWaalsContact C-N 3.28Å; R387-L389 PolarHBondContact O-N 3.22Å; R387-H390 WeakPolarHBondContact O-CB 3.37Å; R387-H390 PolarHBondContact O-N 3.42Å; R387-H390 VanDerWaalsContact O-N 3.1Å; R387-D391 PolarHBondContact O-N 3.34Å
388	S	87.1	Confident	86.3	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.007	15%	0.146	C	C	.	.	H	α-helix	trans	-56.2	-44.3	178.8	-60.7	0	0	0	0	112.2	L163 K166 E384 T385 A392	L163-S388 WeakPolarHBondContact CD2-O 3.38Å; K166-S388 WeakPolarHBondContact CB-OG 3.27Å; K166-S388 VanDerWaalsContact CD-CB 3.41Å; K166-S388 VanDerWaalsContact CD-OG 3.26Å; K166-S388 WeakPolarHBondContact CD-OG 3.31Å; E384-S388 WeakPolarHBondContact O-CB 3.43Å; E384-S388 PolarHBondContact O-N 3.16Å; E384-S388 PolarHBondContact O-OG 3.41Å; T385-S388 WeakPolarHBondContact O-CB 3.13Å; T385-S388 PolarHBondContact O-N 3.39Å; S388-A392 PolarHBondContact O-N 3.35Å
389	L	89.6	Confident	86	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.5	-40.7	176.7	-70	175.4	0	0	0	112	I168 F175 V179 I197 I372 L374 T385 E386 R387 D391 A392 I393	I168-L389 HydrophobicContact CD1-CD2 4.01Å; I168-L389 HydrophobicContact CD1-CG 4.28Å; F175-L389 HydrophobicContact CB-CD2 3.78Å; F175-L389 HydrophobicContact CD1-CD1 4.06Å; F175-L389 HydrophobicContact CD1-CD2 3.57Å; F175-L389 HydrophobicContact CD1-CG 4.36Å; F175-L389 HydrophobicContact CE1-CD1 4.09Å; F175-L389 HydrophobicContact CE1-CD2 4.36Å; F175-L389 HydrophobicContact CG-CD2 3.84Å; V179-L389 HydrophobicContact CG2-CD2 3.75Å; I197-L389 HydrophobicContact CD1-CB 4.23Å; I372-L389 HydrophobicContact CG2-CD1 4.46Å; L374-L389 HydrophobicContact CD1-CD1 3.97Å; T385-L389 HydrophobicContact CG2-CD1 4.01Å; T385-L389 HydrophobicContact CG2-CG 4.23Å; T385-L389 WeakPolarHBondContact O-CB 3.38Å; T385-L389 VanDerWaalsContact O-CG 3.27Å; T385-L389 WeakPolarHBondContact O-CG 3.24Å; T385-L389 PolarHBondContact O-N 3.15Å; E386-L389 PolarHBondContact O-N 3.19Å; R387-L389 VanDerWaalsContact C-N 3.28Å; R387-L389 PolarHBondContact O-N 3.22Å; L389-D391 VanDerWaalsContact C-N 3.32Å; L389-D391 PolarHBondContact O-N 3.36Å; L389-A392 PolarHBondContact O-N 3.48Å; L389-I393 WeakPolarHBondContact O-CB 3.24Å; L389-I393 WeakPolarHBondContact O-CD1 3.23Å; L389-I393 WeakPolarHBondContact O-CG1 3.41Å; L389-I393 PolarHBondContact O-N 3.13Å
390	H	87.6	Confident	85.8	Confident	69 Å²	69	26.7 Å²	26.7	32%	0.319	12%	0.119	S	C	.	.	H	α-helix	trans	-57.2	-45.1	176.8	176.2	-91.5	0	0	0	111.9	E386 R387 I393 M394	E386-H390 WeakPolarHBondContact O-CB 3.39Å; E386-H390 PolarHBondContact O-N 3.08Å; R387-H390 WeakPolarHBondContact O-CB 3.37Å; R387-H390 PolarHBondContact O-N 3.42Å; R387-H390 VanDerWaalsContact O-N 3.1Å; H390-I393 WeakPolarHBondContact O-CB 3.49Å; H390-I393 PolarHBondContact O-N 2.87Å; H390-M394 WeakPolarHBondContact CE1-CE 3.22Å; H390-M394 PolarHBondContact CE1-SD 3.03Å; H390-M394 WeakPolarHBondContact O-CG 3.45Å; H390-M394 PolarHBondContact O-N 2.85Å
391	D	85.3	Confident	85.6	Confident	6 Å²	6	27.7 Å²	27.7	3%	0.032	12%	0.122	C	C	.	.	H	α-helix	trans	-67.2	-39.1	178.2	-54.7	-21	0	0	0	111.8	K166 R387 L389 M394 I395	K166-D391 VanDerWaalsContact NZ-CG 3.34Å; K166-D391 IonicContact NZ-OD2 3.9Å; K166-D391 PolarHBondContact NZ-OD2 2.96Å; R387-D391 PolarHBondContact O-N 3.34Å; L389-D391 VanDerWaalsContact C-N 3.32Å; L389-D391 PolarHBondContact O-N 3.36Å; D391-M394 WeakPolarHBondContact O-CB 3.15Å; D391-M394 PolarHBondContact O-N 3Å; D391-I395 PolarHBondContact O-N 3.15Å
392	A	88.3	Confident	85.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.5	-42.5	175.5	0	0	0	0	0	111.4	A162 L163 V179 S388 L389 M394 I395 V396	A162-A392 HydrophobicContact CB-CB 4.35Å; L163-A392 HydrophobicContact CD1-CB 4.42Å; L163-A392 HydrophobicContact CD2-CB 3.78Å; L163-A392 HydrophobicContact CG-CB 4.02Å; V179-A392 HydrophobicContact CG1-CB 4.18Å; V179-A392 HydrophobicContact CG2-CB 4.2Å; S388-A392 PolarHBondContact O-N 3.35Å; L389-A392 PolarHBondContact O-N 3.48Å; A392-M394 VanDerWaalsContact C-N 3.31Å; A392-M394 PolarHBondContact O-N 2.91Å; A392-I395 PolarHBondContact O-N 3.01Å; A392-V396 WeakPolarHBondContact O-CB 3.05Å; A392-V396 VanDerWaalsContact O-CG2 3.31Å; A392-V396 WeakPolarHBondContact O-CG2 3.3Å; A392-V396 PolarHBondContact O-N 3.25Å
393	I	89.8	Confident	84.5	Confident	5 Å²	5	27.5 Å²	27.5	3%	0.026	13%	0.126	C	C	.	.	H	α-helix	trans	-59.1	-44.2	173.5	-70.9	162.7	0	0	0	110.2	V179 V183 L192 I195 I197 I372 L389 H390 R397	V179-I393 HydrophobicContact CB-CG1 4.44Å; V179-I393 HydrophobicContact CG1-CB 4.37Å; V179-I393 HydrophobicContact CG1-CG1 3.77Å; V179-I393 HydrophobicContact CG2-CG1 4.14Å; V183-I393 HydrophobicContact CG2-CB 4.43Å; V183-I393 HydrophobicContact CG2-CG2 3.91Å; L192-I393 HydrophobicContact CD2-CG2 3.54Å; I195-I393 HydrophobicContact CD1-CB 4.47Å; I195-I393 HydrophobicContact CD1-CD1 4.19Å; I195-I393 HydrophobicContact CD1-CG1 4.28Å; I195-I393 HydrophobicContact CD1-CG2 3.34Å; I195-I393 HydrophobicContact CG2-CD1 4.04Å; I197-I393 HydrophobicContact CD1-CD1 4.32Å; I372-I393 HydrophobicContact CD1-CD1 4.12Å; L389-I393 WeakPolarHBondContact O-CB 3.24Å; L389-I393 WeakPolarHBondContact O-CD1 3.23Å; L389-I393 WeakPolarHBondContact O-CG1 3.41Å; L389-I393 PolarHBondContact O-N 3.13Å; H390-I393 WeakPolarHBondContact O-CB 3.49Å; H390-I393 PolarHBondContact O-N 2.87Å; I393-R397 VanDerWaalsContact O-CB 3.22Å; I393-R397 WeakPolarHBondContact O-CB 3.18Å; I393-R397 PolarHBondContact O-N 3.03Å
394	M	86.1	Confident	84.6	Confident	18 Å²	18	28.1 Å²	28.1	9%	0.089	13%	0.132	C	C	.	.	H	α-helix	trans	-62.1	-46.8	177.3	-77	-172.3	157.7	0	0	111.9	V90 G91 L192 H390 D391 A392 R397 R398	V90-M394 WeakPolarHBondContact O-CB 3.42Å; G91-M394 WeakPolarHBondContact CA-SD 3.11Å; L192-M394 HydrophobicContact CD1-CE 3.46Å; L192-M394 VanDerWaalsContact CD1-CE 3.46Å; L192-M394 HydrophobicContact CD1-CG 3.74Å; L192-M394 HydrophobicContact CD1-SD 4.42Å; L192-M394 HydrophobicContact CD2-CG 4.45Å; H390-M394 WeakPolarHBondContact CE1-CE 3.22Å; H390-M394 PolarHBondContact CE1-SD 3.03Å; H390-M394 WeakPolarHBondContact O-CG 3.45Å; H390-M394 PolarHBondContact O-N 2.85Å; D391-M394 WeakPolarHBondContact O-CB 3.15Å; D391-M394 PolarHBondContact O-N 3Å; A392-M394 VanDerWaalsContact C-N 3.31Å; A392-M394 PolarHBondContact O-N 2.91Å; M394-R397 PolarHBondContact O-N 2.97Å; M394-R398 WeakPolarHBondContact O-CB 3.34Å; M394-R398 VanDerWaalsContact O-CG 3.23Å; M394-R398 WeakPolarHBondContact O-CG 3.42Å; M394-R398 PolarHBondContact O-N 2.93Å
395	I	85.4	Confident	84.8	Confident	7 Å²	7	28.1 Å²	28.1	4%	0.036	13%	0.132	C	C	.	.	H	α-helix	trans	-60.2	-50.1	177.5	-75.7	169.5	0	0	0	111.1	D92 C158 A162 D391 A392 R397 R398 A399 P495	D92-I395 HydrophobicContact CB-CD1 3.4Å; D92-I395 HydrophobicContact CB-CG1 4.01Å; D92-I395 WeakPolarHBondContact OD2-CD1 3.41Å; C158-I395 HydrophobicContact CB-CG2 4.22Å; A162-I395 HydrophobicContact CB-CD1 3.36Å; D391-I395 PolarHBondContact O-N 3.15Å; A392-I395 PolarHBondContact O-N 3.01Å; I395-R397 VanDerWaalsContact C-N 3.32Å; I395-R397 PolarHBondContact O-N 3.26Å; I395-R398 CarbonylContact O-C 3.47Å; I395-R398 PolarHBondContact O-N 2.92Å; I395-R398 VanDerWaalsContact O-N 3.12Å; I395-A399 WeakPolarHBondContact O-CB 3.38Å; I395-A399 PolarHBondContact O-N 3.15Å; I395-P495 HydrophobicContact CG2-CG 4.06Å
396	V	86.9	Confident	85	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.7	-44	-179.7	170.3	0	0	0	0	110.5	L155 A159 V179 V180 V183 A392 R398 A399 I400	L155-V396 HydrophobicContact CB-CG1 4.21Å; L155-V396 HydrophobicContact CD1-CG1 4.38Å; L155-V396 HydrophobicContact CD2-CG1 4.1Å; L155-V396 HydrophobicContact CG-CG1 4.45Å; A159-V396 HydrophobicContact CB-CG2 3.64Å; V179-V396 HydrophobicContact CG1-CB 4.29Å; V179-V396 HydrophobicContact CG1-CG2 3.91Å; V180-V396 HydrophobicContact CG2-CG1 4.22Å; V180-V396 HydrophobicContact CG2-CG2 4.26Å; V183-V396 HydrophobicContact CB-CG1 3.86Å; V183-V396 HydrophobicContact CG1-CG1 4.01Å; V183-V396 HydrophobicContact CG2-CB 4.25Å; V183-V396 HydrophobicContact CG2-CG1 3.93Å; A392-V396 WeakPolarHBondContact O-CB 3.05Å; A392-V396 VanDerWaalsContact O-CG2 3.31Å; A392-V396 WeakPolarHBondContact O-CG2 3.3Å; A392-V396 PolarHBondContact O-N 3.25Å; V396-R398 VanDerWaalsContact C-N 3.31Å; V396-R398 PolarHBondContact O-N 2.9Å; V396-A399 PolarHBondContact O-N 3.37Å; V396-I400 HydrophobicContact CG1-CD1 4.33Å; V396-I400 WeakPolarHBondContact O-CG1 3.14Å; V396-I400 PolarHBondContact O-N 2.83Å
397	R	85.1	Confident	85.2	Confident	54 Å²	54	25.4 Å²	25.4	20%	0.204	12%	0.12	C	C	.	.	H	α-helix	trans	-61.2	-39.5	175.7	-176.4	-180	-177.4	-134	3.6	112.3	V183 L190 I393 M394 I395 K401	V183-R397 HydrophobicContact CG1-CB 4.22Å; L190-R397 PolarHBondContact O-NH2 2.94Å; I393-R397 VanDerWaalsContact O-CB 3.22Å; I393-R397 WeakPolarHBondContact O-CB 3.18Å; I393-R397 PolarHBondContact O-N 3.03Å; M394-R397 PolarHBondContact O-N 2.97Å; I395-R397 VanDerWaalsContact C-N 3.32Å; I395-R397 PolarHBondContact O-N 3.26Å; R397-K401 WeakPolarHBondContact O-CG 3.41Å; R397-K401 PolarHBondContact O-N 2.63Å
398	R	81.3	Confident	85.4	Confident	57 Å²	57	23 Å²	23	22%	0.215	11%	0.11	C	C	.	.	H	α-helix	trans	-71.3	-34.9	177.3	-69.1	-68	-175.3	179.4	3.2	111.6	E89 M394 I395 V396 K401 N402	E89-R398 PolarHBondContact O-NE 3.15Å; E89-R398 PolarHBondContact O-NH2 3.35Å; E89-R398 IonicContact OE2-CZ 3.25Å; E89-R398 IonicContact OE2-NH2 2.71Å; E89-R398 PolarHBondContact OE2-NH2 2.55Å; M394-R398 WeakPolarHBondContact O-CB 3.34Å; M394-R398 VanDerWaalsContact O-CG 3.23Å; M394-R398 WeakPolarHBondContact O-CG 3.42Å; M394-R398 PolarHBondContact O-N 2.93Å; I395-R398 CarbonylContact O-C 3.47Å; I395-R398 PolarHBondContact O-N 2.92Å; I395-R398 VanDerWaalsContact O-N 3.12Å; V396-R398 VanDerWaalsContact C-N 3.31Å; V396-R398 PolarHBondContact O-N 2.9Å; R398-K401 PolarHBondContact O-N 3.02Å; R398-N402 WeakPolarHBondContact O-CB 3.42Å; R398-N402 PolarHBondContact O-N 2.86Å
399	A	81.2	Confident	85.5	Confident	6 Å²	6	23.8 Å²	23.8	5%	0.05	12%	0.118	C	C	.	.	H	α-helix	trans	-67.7	-32.5	174.4	0	0	0	0	0	112.6	L155 I395 V396 N402 P495	L155-A399 HydrophobicContact CD2-CB 3.68Å; I395-A399 WeakPolarHBondContact O-CB 3.38Å; I395-A399 PolarHBondContact O-N 3.15Å; V396-A399 PolarHBondContact O-N 3.37Å; A399-N402 CarbonylContact O-C 3.58Å; A399-P495 HydrophobicContact CB-CG 4.21Å
400	I	80.4	Confident	85.7	Confident	30 Å²	30	23.8 Å²	23.8	15%	0.154	12%	0.119	C	C	.	.	H	α-helix	trans	-68.6	-37.1	171.9	-68.2	170.6	0	0	0	111.5	L155 V183 V396	L155-I400 HydrophobicContact CD1-CD1 3.89Å; L155-I400 HydrophobicContact CD1-CG1 3.64Å; L155-I400 HydrophobicContact CD2-CG1 3.71Å; L155-I400 HydrophobicContact CG-CG1 4.33Å; V183-I400 HydrophobicContact CB-CD1 4.45Å; V183-I400 HydrophobicContact CG1-CD1 3.45Å; V183-I400 VanDerWaalsContact CG1-CD1 3.45Å; V396-I400 HydrophobicContact CG1-CD1 4.33Å; V396-I400 WeakPolarHBondContact O-CG1 3.14Å; V396-I400 PolarHBondContact O-N 2.83Å
401	K	79.5	Confident	86	Confident	94 Å²	94	20.5 Å²	20.5	41%	0.409	10%	0.104	S	C	.	.	H	α-helix	trans	-77.1	-36.3	-179.6	-72.4	-173.6	177.4	-166.6	0	113.1	R397 R398	R397-K401 WeakPolarHBondContact O-CG 3.41Å; R397-K401 PolarHBondContact O-N 2.63Å; R398-K401 PolarHBondContact O-N 3.02Å
402	N	76.1	Confident	86.5	Confident	54 Å²	54	20.3 Å²	20.3	29%	0.289	10%	0.103	S	C	.	.			trans	-119.9	113.1	-177.5	-61.2	-53.2	0	0	0	109.5	R398 A399 S404 V497	R398-N402 WeakPolarHBondContact O-CB 3.42Å; R398-N402 PolarHBondContact O-N 2.86Å; A399-N402 CarbonylContact O-C 3.58Å; N402-S404 PolarHBondContact O-N 2.82Å; N402-S404 VanDerWaalsContact O-N 3.16Å; N402-V497 HydrophobicContact CB-CG2 3.99Å; N402-V497 VanDerWaalsContact ND2-CG2 3.29Å; N402-V497 WeakPolarHBondContact ND2-CG2 3.32Å
403	D	74.5	Confident	86.9	Confident	46 Å²	46	20.7 Å²	20.7	25%	0.246	10%	0.104	C	C	.	.			trans	-78.8	0.3	-172.4	-50.4	-45.3	0	0	0	113.7	S142 V143 K145	S142-D403 CarbonylContact C-O 3.59Å; S142-D403 WeakPolarHBondContact CA-O 3.46Å; V143-D403 WeakPolarHBondContact CG2-O 3.39Å; V143-D403 PolarHBondContact N-O 3.49Å; K145-D403 WeakPolarHBondContact CE-OD1 3.46Å; K145-D403 WeakPolarHBondContact CE-OD2 3.23Å; K145-D403 IonicContact NZ-OD1 3.11Å; K145-D403 IonicContact NZ-OD2 3.59Å; K145-D403 PolarHBondContact NZ-OD2 2.83Å
404	S	86.5	Confident	87.2	Confident	32 Å²	32	20.6 Å²	20.6	22%	0.224	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	123.4	-174	64.8	0	0	0	0	112	V141 N402 S496	V141-S404 WeakPolarHBondContact O-CA 3.4Å; N402-S404 PolarHBondContact O-N 2.82Å; N402-S404 VanDerWaalsContact O-N 3.16Å; S404-S496 PolarHBondContact O-N 3Å; S404-S496 PolarHBondContact O-OG 3.27Å; S404-S496 PolarHBondContact OG-OG 2.79Å
405	I	88.6	Confident	87.6	Confident	4 Å²	4	20.5 Å²	20.5	2%	0.021	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	159.1	178.6	57.6	158.4	0	0	0	111.8	V141 V143 L154 F488 W493 E494	V141-I405 HydrophobicContact CB-CG1 4.4Å; V141-I405 PolarHBondContact N-O 3.07Å; V141-I405 PolarHBondContact O-N 3.45Å; V143-I405 HydrophobicContact CG2-CD1 4.14Å; V143-I405 HydrophobicContact CG2-CG1 3.94Å; L154-I405 HydrophobicContact CD1-CD1 3.84Å; I405-F488 HydrophobicContact CD1-CE2 3.93Å; I405-F488 HydrophobicContact CD1-CZ 4.18Å; I405-F488 HydrophobicContact CG1-CE2 4.4Å; I405-W493 HydrophobicContact CD1-CB 4.2Å; I405-W493 HydrophobicContact CD1-CD2 3.65Å; I405-W493 HydrophobicContact CD1-CE3 3.84Å; I405-W493 HydrophobicContact CD1-CG 3.84Å; I405-W493 HydrophobicContact CD1-CZ3 4.44Å; I405-E494 WeakPolarHBondContact CA-O 3.19Å
406	V	92.1	Very high	88.1	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	159.4	173.4	-67.1	0	0	0	0	109.7	I136 A140 I412 W474 E494 K499	I136-V406 HydrophobicContact CG2-CG1 4.34Å; A140-V406 HydrophobicContact CB-CG1 3.98Å; V406-I412 HydrophobicContact CB-CD1 4.2Å; V406-I412 HydrophobicContact CG1-CD1 4.06Å; V406-I412 HydrophobicContact CG2-CG1 4.48Å; V406-W474 HydrophobicContact CB-CH2 4.27Å; V406-W474 HydrophobicContact CB-CZ3 3.94Å; V406-W474 HydrophobicContact CG1-CH2 4.25Å; V406-W474 HydrophobicContact CG1-CZ3 4.33Å; V406-E494 WeakPolarHBondContact CG2-O 3.48Å; V406-E494 PolarHBondContact N-O 2.79Å; V406-E494 PolarHBondContact O-N 3.26Å; V406-K499 HydrophobicContact CG2-CG 4.08Å
407	A	92.2	Very high	88.6	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	134.4	171.6	0	0	0	0	0	111.1	A411 W474 N487 F488 V492	A407-A411 HydrophobicContact CB-CB 4.15Å; A407-W474 HydrophobicContact CB-CB 4.15Å; A407-W474 HydrophobicContact CB-CD2 3.98Å; A407-W474 HydrophobicContact CB-CE3 3.29Å; A407-W474 HydrophobicContact CB-CG 4.38Å; A407-W474 HydrophobicContact CB-CZ3 4Å; A407-N487 HydrophobicContact CB-CB 3.92Å; A407-F488 HydrophobicContact CB-CB 4.16Å; A407-F488 HydrophobicContact CB-CD2 4.44Å; A407-V492 WeakPolarHBondContact CA-O 3.36Å
408	G	90.5	Very high	89.1	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-153.6	177.3	0	0	0	0	0	113.5	G410 A411 N487 V492 E494	G408-G410 VanDerWaalsContact C-N 3.27Å; G408-G410 PolarHBondContact O-N 3.16Å; G408-A411 WeakPolarHBondContact O-CB 3.49Å; G408-A411 PolarHBondContact O-N 2.82Å; G408-N487 PolarHBondContact O-ND2 3.08Å; G408-V492 PolarHBondContact N-O 2.99Å; G408-E494 WeakPolarHBondContact CA-OE2 3.28Å
409	G	89.4	Confident	89.8	Confident	17 Å²	17	20.5 Å²	20.5	18%	0.175	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	30.5	175.8	0	0	0	0	0	114.4	V477 N487	G409-V477 PolarHBondContact O-N 3.2Å; G409-N487 WeakPolarHBondContact CA-ND2 3.43Å
410	G	92.9	Very high	90.5	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.01	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	-5.4	179.5	0	0	0	0	0	115.2	G408 E413 M414	G408-G410 VanDerWaalsContact C-N 3.27Å; G408-G410 PolarHBondContact O-N 3.16Å; G410-E413 VanDerWaalsContact C-OE2 3.26Å; G410-E413 WeakPolarHBondContact CA-OE2 3.36Å; G410-E413 PolarHBondContact O-N 2.99Å; G410-M414 WeakPolarHBondContact O-CB 3.4Å; G410-M414 VanDerWaalsContact O-CG 3.27Å; G410-M414 WeakPolarHBondContact O-CG 3.46Å; G410-M414 PolarHBondContact O-N 3Å
411	A	94.9	Very high	91.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.1	-48.4	-176.3	0	0	0	0	0	112	A407 G408 E413 M414 E415 H468 F475	A407-A411 HydrophobicContact CB-CB 4.15Å; G408-A411 WeakPolarHBondContact O-CB 3.49Å; G408-A411 PolarHBondContact O-N 2.82Å; A411-E413 PolarHBondContact O-N 2.94Å; A411-M414 PolarHBondContact O-N 2.76Å; A411-E415 PolarHBondContact O-N 3.23Å; A411-H468 PolarHBondContact O-CE1 2.85Å; A411-H468 VanDerWaalsContact O-CE1 3.26Å; A411-F475 VanDerWaalsContact CA-O 3.31Å; A411-F475 WeakPolarHBondContact CA-O 3.29Å; A411-F475 VanDerWaalsContact CB-O 3.24Å; A411-F475 WeakPolarHBondContact CB-O 3.48Å
412	I	95.3	Very high	91.9	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-64	-40.8	179.1	-166.9	68.1	0	0	0	111.4	I136 I139 V406 M414 E415 L416 K499	I136-I412 HydrophobicContact CG1-CD1 4.31Å; I136-I412 HydrophobicContact CG1-CG1 4.22Å; I139-I412 HydrophobicContact CD1-CD1 3.35Å; I139-I412 HydrophobicContact CG1-CD1 3.98Å; V406-I412 HydrophobicContact CB-CD1 4.2Å; V406-I412 HydrophobicContact CG1-CD1 4.06Å; V406-I412 HydrophobicContact CG2-CG1 4.48Å; I412-M414 VanDerWaalsContact C-N 3.32Å; I412-M414 PolarHBondContact O-N 3.3Å; I412-E415 PolarHBondContact O-N 2.7Å; I412-L416 HydrophobicContact CG1-CD1 4.23Å; I412-L416 WeakPolarHBondContact O-CB 3.49Å; I412-L416 WeakPolarHBondContact O-CG 3.45Å; I412-L416 PolarHBondContact O-N 3.12Å; I412-K499 HydrophobicContact CG2-CD 3.84Å; I412-K499 HydrophobicContact CG2-CG 4.04Å
413	E	95.6	Very high	92.8	Very high	8 Å²	8	22.2 Å²	22.2	4%	0.037	11%	0.107	C	C	.	.	H	α-helix	trans	-64.7	-37	177.7	-65.6	81.3	-176.4	0	0	111.9	G410 A411 S417 L442 I445 K499	G410-E413 VanDerWaalsContact C-OE2 3.26Å; G410-E413 WeakPolarHBondContact CA-OE2 3.36Å; G410-E413 PolarHBondContact O-N 2.99Å; A411-E413 PolarHBondContact O-N 2.94Å; E413-S417 WeakPolarHBondContact O-CB 3.3Å; E413-S417 PolarHBondContact O-N 2.89Å; E413-L442 HydrophobicContact CB-CB 4.4Å; E413-I445 HydrophobicContact CG-CB 4.06Å; E413-I445 HydrophobicContact CG-CG1 4.05Å; E413-I445 HydrophobicContact CG-CG2 4.37Å; E413-K499 WeakPolarHBondContact OE1-CE 3.29Å; E413-K499 IonicContact OE1-NZ 3.2Å; E413-K499 PolarHBondContact OE1-NZ 3.3Å
414	M	95.9	Very high	93.7	Very high	3 Å²	3	20.4 Å²	20.4	2%	0.015	10%	0.099	C	C	.	.	H	α-helix	trans	-68.6	-42.4	175.3	-73.7	-52.8	-57.3	0	0	112.8	G410 A411 I412 S417 K418 E443 P446 L461 L464 R465 H468	G410-M414 WeakPolarHBondContact O-CB 3.4Å; G410-M414 VanDerWaalsContact O-CG 3.27Å; G410-M414 WeakPolarHBondContact O-CG 3.46Å; G410-M414 PolarHBondContact O-N 3Å; A411-M414 PolarHBondContact O-N 2.76Å; I412-M414 VanDerWaalsContact C-N 3.32Å; I412-M414 PolarHBondContact O-N 3.3Å; M414-S417 WeakPolarHBondContact O-CB 3.09Å; M414-S417 PolarHBondContact O-N 2.87Å; M414-K418 PolarHBondContact O-N 2.96Å; M414-E443 HydrophobicContact CE-CG 4.49Å; M414-E443 HydrophobicContact SD-CB 4.38Å; M414-E443 HydrophobicContact SD-CG 4.02Å; M414-P446 HydrophobicContact CG-CB 4.49Å; M414-P446 HydrophobicContact CG-CG 3.95Å; M414-P446 HydrophobicContact SD-CG 3.68Å; M414-L461 HydrophobicContact SD-CD2 4.07Å; M414-L464 HydrophobicContact CE-CB 4.19Å; M414-L464 HydrophobicContact CG-CB 4.37Å; M414-L464 HydrophobicContact CG-CD1 4.17Å; M414-R465 HydrophobicContact CE-CB 4.41Å; M414-R465 HydrophobicContact CE-CG 3.49Å; M414-R465 VanDerWaalsContact CE-CG 3.49Å; M414-H468 WeakPolarHBondContact CB-NE2 3.02Å
415	E	96	Very high	94	Very high	16 Å²	16	27.2 Å²	27.2	8%	0.075	12%	0.119	C	C	.	.	H	α-helix	trans	-65.8	-40.9	177.1	-173.1	61.2	-156.5	0	0	111.4	I139 A411 I412 S417 K418 Y419 H468 L473	I139-E415 HydrophobicContact CD1-CG 4.42Å; A411-E415 PolarHBondContact O-N 3.23Å; I412-E415 PolarHBondContact O-N 2.7Å; E415-S417 VanDerWaalsContact C-N 3.33Å; E415-S417 PolarHBondContact O-N 3Å; E415-K418 PolarHBondContact O-N 3.16Å; E415-K418 IonicContact OE1-NZ 3.13Å; E415-Y419 WeakPolarHBondContact O-CB 3.41Å; E415-Y419 PolarHBondContact O-N 3.48Å; E415-H468 IonicContact OE2-CE1 3.93Å; E415-H468 IonicContact OE2-CG 3.37Å; E415-H468 IonicContact OE2-ND1 3.71Å; E415-H468 PolarHBondContact OE2-ND1 3.43Å; E415-L473 HydrophobicContact CG-CD1 4.15Å; E415-L473 HydrophobicContact CG-CG 3.97Å
416	L	96.3	Very high	94.2	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-64.6	-38.9	174.7	-66.5	172.9	0	0	0	111.9	A132 K135 I136 I412 Y419 L420 L442 L503	A132-L416 HydrophobicContact CB-CD2 4.24Å; A132-L416 WeakPolarHBondContact O-CD2 3.31Å; K135-L416 HydrophobicContact CB-CD2 3.78Å; K135-L416 HydrophobicContact CG-CD2 3.92Å; I136-L416 HydrophobicContact CD1-CD1 3.81Å; I136-L416 HydrophobicContact CG1-CD1 3.78Å; I136-L416 HydrophobicContact CG1-CD2 3.99Å; I136-L416 HydrophobicContact CG1-CG 4.37Å; I412-L416 HydrophobicContact CG1-CD1 4.23Å; I412-L416 WeakPolarHBondContact O-CB 3.49Å; I412-L416 WeakPolarHBondContact O-CG 3.45Å; I412-L416 PolarHBondContact O-N 3.12Å; L416-Y419 PolarHBondContact O-N 2.77Å; L416-L420 WeakPolarHBondContact O-CB 3.49Å; L416-L420 VanDerWaalsContact O-CG 3.28Å; L416-L420 WeakPolarHBondContact O-CG 3.24Å; L416-L420 PolarHBondContact O-N 3.15Å; L416-L442 HydrophobicContact CB-CD1 3.67Å; L416-L503 HydrophobicContact CD1-CD1 3.77Å
417	S	96.3	Very high	94.2	Very high	1 Å²	1	33 Å²	33	1%	0.007	15%	0.153	C	C	.	.	H	α-helix	trans	-59	-47.3	173.9	-173.4	0	0	0	0	111.5	E413 M414 E415 R421 A439 E443	E413-S417 WeakPolarHBondContact O-CB 3.3Å; E413-S417 PolarHBondContact O-N 2.89Å; M414-S417 WeakPolarHBondContact O-CB 3.09Å; M414-S417 PolarHBondContact O-N 2.87Å; E415-S417 VanDerWaalsContact C-N 3.33Å; E415-S417 PolarHBondContact O-N 3Å; S417-R421 WeakPolarHBondContact O-CB 3.48Å; S417-R421 PolarHBondContact O-N 2.76Å; S417-A439 VanDerWaalsContact CB-O 3.3Å; S417-A439 WeakPolarHBondContact CB-O 3.31Å; S417-A439 WeakPolarHBondContact O-CB 3.43Å; S417-A439 PolarHBondContact OG-O 2.73Å; S417-E443 PolarHBondContact OG-OE1 3Å
418	K	95.6	Very high	94.1	Very high	55 Å²	55	38.4 Å²	38.4	24%	0.239	19%	0.189	C	C	.	.	H	α-helix	trans	-59.4	-54.4	175.4	174.3	-165.2	166.9	-165.8	0	111.2	M414 E415 L420 R421 D422 H468	M414-K418 PolarHBondContact O-N 2.96Å; E415-K418 PolarHBondContact O-N 3.16Å; E415-K418 IonicContact OE1-NZ 3.13Å; K418-L420 PolarHBondContact O-N 3.31Å; K418-R421 PolarHBondContact O-N 2.94Å; K418-R421 VanDerWaalsContact O-N 3.1Å; K418-D422 PolarHBondContact O-N 3.28Å; K418-H468 HydrophobicContact CD-CB 4.28Å; K418-H468 WeakPolarHBondContact CD-O 3.37Å; K418-H468 WeakPolarHBondContact CE-O 3.33Å; K418-H468 PolarHBondContact NZ-O 2.84Å
419	Y	96.3	Very high	94.1	Very high	61 Å²	61	40.8 Å²	40.8	24%	0.239	21%	0.214	C	C	.	.	H	α-helix	trans	-56.5	-48	-178	171.2	-111.2	0	0	0	112.3	L131 K135 E415 L416 R421 D422 Y423	L131-Y419 HydrophobicContact CB-CE1 4.26Å; K135-Y419 HydrophobicContact CB-CD1 3.92Å; K135-Y419 HydrophobicContact CB-CE1 3.95Å; K135-Y419 HydrophobicContact CD-CD1 4.36Å; K135-Y419 HydrophobicContact CD-CD2 4.34Å; K135-Y419 HydrophobicContact CD-CE1 4.47Å; K135-Y419 HydrophobicContact CD-CE2 4.48Å; K135-Y419 HydrophobicContact CD-CG 4.28Å; K135-Y419 HydrophobicContact CG-CD1 3.85Å; K135-Y419 HydrophobicContact CG-CE1 4.23Å; K135-Y419 HydrophobicContact CG-CG 4.04Å; E415-Y419 WeakPolarHBondContact O-CB 3.41Å; E415-Y419 PolarHBondContact O-N 3.48Å; L416-Y419 PolarHBondContact O-N 2.77Å; Y419-R421 VanDerWaalsContact C-N 3.32Å; Y419-R421 PolarHBondContact O-N 3.08Å; Y419-D422 PolarHBondContact O-N 3.02Å; Y419-Y423 WeakPolarHBondContact O-CB 3.29Å; Y419-Y423 PolarHBondContact O-N 2.82Å
420	L	95.8	Very high	94.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.7	-32.5	178.7	-69.8	176.3	0	0	0	112.5	L131 A132 L416 K418 S424 I435 Y438 A439 L442	L131-L420 HydrophobicContact CB-CD2 3.96Å; A132-L420 HydrophobicContact CB-CD1 4.34Å; L416-L420 WeakPolarHBondContact O-CB 3.49Å; L416-L420 VanDerWaalsContact O-CG 3.28Å; L416-L420 WeakPolarHBondContact O-CG 3.24Å; L416-L420 PolarHBondContact O-N 3.15Å; K418-L420 PolarHBondContact O-N 3.31Å; L420-S424 WeakPolarHBondContact O-CB 2.87Å; L420-S424 PolarHBondContact O-N 3.03Å; L420-I435 HydrophobicContact CB-CG2 4.16Å; L420-I435 HydrophobicContact CD2-CG2 4.32Å; L420-I435 WeakPolarHBondContact O-CG2 3.5Å; L420-Y438 HydrophobicContact CD1-CD1 3.43Å; L420-Y438 VanDerWaalsContact CD1-CD1 3.43Å; L420-Y438 HydrophobicContact CD1-CE1 3.84Å; L420-Y438 HydrophobicContact CD1-CG 4.45Å; L420-A439 HydrophobicContact CB-CB 3.84Å; L420-L442 HydrophobicContact CD1-CD1 3.97Å
421	R	94.6	Very high	93.9	Very high	73 Å²	73	49.6 Å²	49.6	28%	0.275	25%	0.248	S	C	.	.	H	α-helix	trans	-70.5	-35.3	175.8	-174.9	173.1	-68.1	158.2	6.6	112.3	S417 K418 Y419 S424 A439 E443	S417-R421 WeakPolarHBondContact O-CB 3.48Å; S417-R421 PolarHBondContact O-N 2.76Å; K418-R421 PolarHBondContact O-N 2.94Å; K418-R421 VanDerWaalsContact O-N 3.1Å; Y419-R421 VanDerWaalsContact C-N 3.32Å; Y419-R421 PolarHBondContact O-N 3.08Å; R421-S424 PolarHBondContact O-OG 3.42Å; R421-A439 HydrophobicContact CB-CB 4.27Å; R421-E443 IonicContact CZ-OE1 2.95Å; R421-E443 IonicContact NH1-OE1 3.03Å; R421-E443 PolarHBondContact NH1-OE1 3.08Å; R421-E443 IonicContact NH2-OE1 3.94Å; R421-E443 PolarHBondContact NH2-OE1 2.65Å
422	D	94.3	Very high	93.8	Very high	72 Å²	72	53.4 Å²	53.4	39%	0.385	27%	0.266	S	S	.	.	H	α-helix	trans	-72.6	-43	173.6	-69.9	-26.4	0	0	0	110.7	K418 Y419 S424 R425	K418-D422 PolarHBondContact O-N 3.28Å; Y419-D422 PolarHBondContact O-N 3.02Å; D422-S424 VanDerWaalsContact C-N 3.33Å; D422-S424 PolarHBondContact O-N 2.99Å; D422-R425 WeakPolarHBondContact O-CB 3.35Å; D422-R425 PolarHBondContact O-N 2.66Å; D422-R425 IonicContact OD1-NH1 3.83Å
423	Y	94.5	Very high	93.7	Very high	74 Å²	74	58 Å²	58	29%	0.29	29%	0.29	S	S	.	.	H	α-helix	trans	-61.6	-39.1	175.8	-174	-100.2	0	0	0	112.3	L131 Y419 R425 T426 I427 I435	L131-Y423 HydrophobicContact CD1-CD1 3.56Å; L131-Y423 HydrophobicContact CD1-CE1 3.15Å; L131-Y423 HydrophobicContact CD1-CE2 4.47Å; L131-Y423 HydrophobicContact CD1-CG 4.34Å; L131-Y423 HydrophobicContact CD2-CE1 4.49Å; L131-Y423 HydrophobicContact CD2-CE2 4.49Å; L131-Y423 HydrophobicContact CG-CE1 4.44Å; Y419-Y423 WeakPolarHBondContact O-CB 3.29Å; Y419-Y423 PolarHBondContact O-N 2.82Å; Y423-R425 PolarHBondContact O-N 3.09Å; Y423-T426 WeakPolarHBondContact O-CB 3.32Å; Y423-T426 PolarHBondContact O-N 3.46Å; Y423-T426 PolarHBondContact O-OG1 3.25Å; Y423-I427 HydrophobicContact CD1-CD1 3.81Å; Y423-I427 HydrophobicContact CE1-CD1 3.1Å; Y423-I427 HydrophobicContact CE1-CG1 4.06Å; Y423-I435 HydrophobicContact CD1-CD1 4.29Å; Y423-I435 HydrophobicContact CE1-CD1 4.25Å
424	S	93.9	Very high	93.6	Very high	9 Å²	9	57.7 Å²	57.7	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-60.6	-32.5	179	75.8	0	0	0	0	112.6	L420 R421 D422 T426 I427 Q432	L420-S424 WeakPolarHBondContact O-CB 2.87Å; L420-S424 PolarHBondContact O-N 3.03Å; R421-S424 PolarHBondContact O-OG 3.42Å; D422-S424 VanDerWaalsContact C-N 3.33Å; D422-S424 PolarHBondContact O-N 2.99Å; S424-T426 PolarHBondContact O-N 3.31Å; S424-I427 PolarHBondContact O-N 2.87Å; S424-Q432 WeakPolarHBondContact CB-O 3.16Å; S424-Q432 VanDerWaalsContact O-CG 3.28Å; S424-Q432 WeakPolarHBondContact O-CG 3.47Å
425	R	92.9	Very high	93.6	Very high	175 Å²	175	57.6 Å²	57.6	66%	0.66	29%	0.288	S	S	*	.	H	α-helix	trans	-68	-21.1	175.8	-65.4	171.1	174.3	171.6	-4.3	113.3	D422 Y423	D422-R425 WeakPolarHBondContact O-CB 3.35Å; D422-R425 PolarHBondContact O-N 2.66Å; D422-R425 IonicContact OD1-NH1 3.83Å; Y423-R425 PolarHBondContact O-N 3.09Å
426	T	94	Very high	93.5	Very high	99 Å²	99	57.8 Å²	57.8	61%	0.607	29%	0.294	S	S	*	.	H	α-helix	trans	-83.8	-19.1	178.4	71.7	0	0	0	0	112.9	Y423 S424	Y423-T426 WeakPolarHBondContact O-CB 3.32Å; Y423-T426 PolarHBondContact O-N 3.46Å; Y423-T426 PolarHBondContact O-OG1 3.25Å; S424-T426 PolarHBondContact O-N 3.31Å
427	I	91.8	Very high	93.5	Very high	25 Å²	25	58 Å²	58	13%	0.128	30%	0.296	C	S	.	.	S	Bend	trans	-98.2	130.3	-177.7	-67.7	176.6	0	0	0	110.2	Y423 S424 Q431 I435	Y423-I427 HydrophobicContact CD1-CD1 3.81Å; Y423-I427 HydrophobicContact CE1-CD1 3.1Å; Y423-I427 HydrophobicContact CE1-CG1 4.06Å; S424-I427 PolarHBondContact O-N 2.87Å; I427-Q431 HydrophobicContact CG2-CB 4.01Å; I427-I435 HydrophobicContact CD1-CD1 3.76Å
428	P	89.6	Confident	93.5	Very high	114 Å²	114	58 Å²	58	74%	0.74	30%	0.296	S	S	*	.			trans	-80.9	151.7	170.4	32.3	-33.7	0	0	0	112.6
429	G	89.6	Confident	93.5	Very high	51 Å²	51	55.3 Å²	55.3	53%	0.526	28%	0.284	S	S	.	.	S	Bend	trans	91.5	-164.6	167.6	0	0	0	0	0	115	Q431 Q432	G429-Q431 PolarHBondContact O-N 3.38Å; G429-Q431 VanDerWaalsContact O-N 3.1Å; G429-Q432 VanDerWaalsContact O-CB 3.25Å; G429-Q432 WeakPolarHBondContact O-CB 3.22Å; G429-Q432 PolarHBondContact O-N 2.71Å
430	K	89.2	Confident	93.5	Very high	140 Å²	140	57.2 Å²	57.2	61%	0.609	29%	0.294	S	S	*	.	H	α-helix	trans	-60	-27	-170.6	-61.1	-176.8	177.7	-174.1	0	113.7	L116 Q432 L433 L434	L116-K430 HydrophobicContact CD1-CD 3.66Å; K430-Q432 VanDerWaalsContact C-N 3.27Å; K430-Q432 PolarHBondContact O-N 2.82Å; K430-L433 PolarHBondContact O-N 2.93Å; K430-L434 WeakPolarHBondContact O-CG 3.39Å; K430-L434 PolarHBondContact O-N 3.38Å
431	Q	89.6	Confident	93.5	Very high	62 Å²	62	57.2 Å²	57.2	29%	0.29	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-30.6	178	-70.4	-176.4	-21.8	0	0	112.8	A124 I427 G429 L433 L434 I435	A124-Q431 HydrophobicContact CB-CG 4.32Å; I427-Q431 HydrophobicContact CG2-CB 4.01Å; G429-Q431 PolarHBondContact O-N 3.38Å; G429-Q431 VanDerWaalsContact O-N 3.1Å; Q431-L433 PolarHBondContact O-N 3.18Å; Q431-L434 PolarHBondContact O-N 3.01Å; Q431-I435 WeakPolarHBondContact O-CB 3.49Å; Q431-I435 VanDerWaalsContact O-CG1 3.29Å; Q431-I435 WeakPolarHBondContact O-CG1 3.42Å; Q431-I435 PolarHBondContact O-N 2.67Å
432	Q	92.7	Very high	93.6	Very high	80 Å²	80	53.7 Å²	53.7	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-55.3	-49.8	176.4	175.5	172.1	16.3	0	0	111.7	S424 G429 K430 G436	S424-Q432 WeakPolarHBondContact CB-O 3.16Å; S424-Q432 VanDerWaalsContact O-CG 3.28Å; S424-Q432 WeakPolarHBondContact O-CG 3.47Å; G429-Q432 VanDerWaalsContact O-CB 3.25Å; G429-Q432 WeakPolarHBondContact O-CB 3.22Å; G429-Q432 PolarHBondContact O-N 2.71Å; K430-Q432 VanDerWaalsContact C-N 3.27Å; K430-Q432 PolarHBondContact O-N 2.82Å; Q432-G436 PolarHBondContact O-N 3.5Å
433	L	92.8	Very high	93.7	Very high	99 Å²	99	50.3 Å²	50.3	52%	0.518	26%	0.262	S	S	.	.	H	α-helix	trans	-65.5	-41.9	-178	-61.5	176	0	0	0	111.2	Y111 K430 Q431 G436 A437	Y111-L433 HydrophobicContact CE1-CB 4.06Å; Y111-L433 HydrophobicContact CE1-CD1 4.4Å; K430-L433 PolarHBondContact O-N 2.93Å; Q431-L433 PolarHBondContact O-N 3.18Å; L433-G436 PolarHBondContact O-N 2.87Å; L433-A437 WeakPolarHBondContact O-CB 3.43Å; L433-A437 PolarHBondContact O-N 3.21Å
434	L	94.6	Very high	93.8	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-69.5	-41.3	-177.6	-62.1	169.5	0	0	0	112.6	L108 Y111 L116 T120 I121 A124 K430 Q431 G436 A437 Y438	L108-L434 HydrophobicContact CD2-CD2 3.87Å; Y111-L434 HydrophobicContact CD2-CD2 4.09Å; Y111-L434 HydrophobicContact CE2-CD2 4.49Å; Y111-L434 HydrophobicContact CG-CD2 4.2Å; L116-L434 HydrophobicContact CD2-CD1 4.09Å; L116-L434 HydrophobicContact CD2-CD2 3.83Å; L116-L434 HydrophobicContact CD2-CG 4.33Å; T120-L434 HydrophobicContact CG2-CD1 4.49Å; I121-L434 HydrophobicContact CG1-CD1 4.44Å; I121-L434 HydrophobicContact CG1-CD2 3.99Å; I121-L434 HydrophobicContact CG2-CD2 4.34Å; A124-L434 HydrophobicContact CB-CB 3.7Å; A124-L434 HydrophobicContact CB-CD1 3.5Å; A124-L434 VanDerWaalsContact CB-CD1 3.5Å; A124-L434 HydrophobicContact CB-CG 4.28Å; K430-L434 WeakPolarHBondContact O-CG 3.39Å; K430-L434 PolarHBondContact O-N 3.38Å; Q431-L434 PolarHBondContact O-N 3.01Å; L434-G436 VanDerWaalsContact C-N 3.32Å; L434-A437 WeakPolarHBondContact O-CB 3.39Å; L434-A437 PolarHBondContact O-N 3.45Å; L434-Y438 PolarHBondContact O-N 3.13Å
435	I	94.9	Very high	93.8	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-67.4	-38.1	174.5	-63.9	170.1	0	0	0	109.9	A128 L420 Y423 I427 Q431 A437 Y438 A439	A128-I435 HydrophobicContact CB-CG1 4.38Å; L420-I435 HydrophobicContact CB-CG2 4.16Å; L420-I435 HydrophobicContact CD2-CG2 4.32Å; L420-I435 WeakPolarHBondContact O-CG2 3.5Å; Y423-I435 HydrophobicContact CD1-CD1 4.29Å; Y423-I435 HydrophobicContact CE1-CD1 4.25Å; I427-I435 HydrophobicContact CD1-CD1 3.76Å; Q431-I435 WeakPolarHBondContact O-CB 3.49Å; Q431-I435 VanDerWaalsContact O-CG1 3.29Å; Q431-I435 WeakPolarHBondContact O-CG1 3.42Å; Q431-I435 PolarHBondContact O-N 2.67Å; I435-A437 VanDerWaalsContact C-N 3.33Å; I435-A437 PolarHBondContact O-N 3.14Å; I435-Y438 WeakPolarHBondContact O-CB 3Å; I435-Y438 PolarHBondContact O-N 3.42Å; I435-A439 PolarHBondContact O-N 3.32Å
436	G	94.8	Very high	93.9	Very high	21 Å²	21	38.2 Å²	38.2	22%	0.216	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-39.8	171.7	0	0	0	0	0	113.2	Q432 L433 L434 A439 K440	Q432-G436 PolarHBondContact O-N 3.5Å; L433-G436 PolarHBondContact O-N 2.87Å; L434-G436 VanDerWaalsContact C-N 3.32Å; G436-A439 WeakPolarHBondContact O-CB 3.33Å; G436-A439 PolarHBondContact O-N 3.37Å; G436-K440 PolarHBondContact O-N 3.38Å
437	A	95.7	Very high	94	Very high	5 Å²	5	36.3 Å²	36.3	4%	0.041	20%	0.197	C	C	.	.	H	α-helix	trans	-65.3	-42	174.6	0	0	0	0	0	112	Q107 Y111 L433 L434 I435 K440 A441	Q107-A437 HydrophobicContact CB-CB 4.26Å; Y111-A437 HydrophobicContact CE2-CB 3.82Å; L433-A437 WeakPolarHBondContact O-CB 3.43Å; L433-A437 PolarHBondContact O-N 3.21Å; L434-A437 WeakPolarHBondContact O-CB 3.39Å; L434-A437 PolarHBondContact O-N 3.45Å; I435-A437 VanDerWaalsContact C-N 3.33Å; I435-A437 PolarHBondContact O-N 3.14Å; A437-K440 PolarHBondContact O-N 2.94Å; A437-A441 PolarHBondContact O-N 3.36Å
438	Y	96.4	Very high	94.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58	-49.2	172.7	-166.5	-75.5	0	0	0	111.1	F104 F125 A128 T129 L420 L434 I435 K440 A441 L442 S507	F104-Y438 HydrophobicContact CD1-CD2 4.19Å; F104-Y438 HydrophobicContact CD1-CE2 4.24Å; F104-Y438 HydrophobicContact CE1-CD1 4.08Å; F104-Y438 AromaticContact CE1-CD2 3.86Å; F104-Y438 HydrophobicContact CE1-CD2 3.86Å; F104-Y438 AromaticContact CE1-CE1 3.94Å; F104-Y438 HydrophobicContact CE1-CE1 3.94Å; F104-Y438 AromaticContact CE1-CE2 3.68Å; F104-Y438 HydrophobicContact CE1-CE2 3.68Å; F104-Y438 HydrophobicContact CE1-CG 4.05Å; F104-Y438 AromaticContact CE1-CZ 3.72Å; F104-Y438 HydrophobicContact CE2-CE2 4.13Å; F104-Y438 HydrophobicContact CZ-CD2 4.29Å; F104-Y438 AromaticContact CZ-CE1 3.91Å; F104-Y438 HydrophobicContact CZ-CE1 3.91Å; F104-Y438 AromaticContact CZ-CE2 3.63Å; F104-Y438 HydrophobicContact CZ-CE2 3.63Å; F104-Y438 AromaticContact CZ-CZ 3.4Å; F104-Y438 VanDerWaalsContact CZ-CZ 3.4Å; F104-Y438 WeakPolarHBondContact CZ-OH 3.09Å; F125-Y438 AromaticContact CD1-CD2 3.52Å; F125-Y438 HydrophobicContact CD1-CD2 3.52Å; F125-Y438 AromaticContact CD1-CE2 3.88Å; F125-Y438 HydrophobicContact CD1-CE2 3.88Å; F125-Y438 HydrophobicContact CD2-CD2 4.34Å; F125-Y438 AromaticContact CE1-CD2 3.46Å; F125-Y438 HydrophobicContact CE1-CD2 3.46Å; F125-Y438 VanDerWaalsContact CE1-CD2 3.46Å; F125-Y438 HydrophobicContact CE1-CE2 4.08Å; F125-Y438 HydrophobicContact CE1-CG 4.39Å; F125-Y438 HydrophobicContact CE2-CD2 4.27Å; F125-Y438 AromaticContact CG-CD2 3.97Å; F125-Y438 HydrophobicContact CG-CD2 3.97Å; F125-Y438 AromaticContact CZ-CD2 3.86Å; F125-Y438 HydrophobicContact CZ-CD2 3.86Å; F125-Y438 HydrophobicContact CZ-CG 4.43Å; A128-Y438 HydrophobicContact CB-CD1 4.09Å; A128-Y438 HydrophobicContact CB-CD2 3.79Å; A128-Y438 HydrophobicContact CB-CE1 4.49Å; A128-Y438 HydrophobicContact CB-CE2 4.25Å; A128-Y438 HydrophobicContact CB-CG 3.72Å; T129-Y438 PolarHBondContact OG1-OH 2.87Å; L420-Y438 HydrophobicContact CD1-CD1 3.43Å; L420-Y438 VanDerWaalsContact CD1-CD1 3.43Å; L420-Y438 HydrophobicContact CD1-CE1 3.84Å; L420-Y438 HydrophobicContact CD1-CG 4.45Å; L434-Y438 PolarHBondContact O-N 3.13Å; I435-Y438 WeakPolarHBondContact O-CB 3Å; I435-Y438 PolarHBondContact O-N 3.42Å; Y438-K440 VanDerWaalsContact C-N 3.3Å; Y438-K440 PolarHBondContact O-N 3.42Å; Y438-A441 WeakPolarHBondContact O-CB 3.45Å; Y438-A441 PolarHBondContact O-N 2.73Å; Y438-A441 VanDerWaalsContact O-N 3.13Å; Y438-L442 HydrophobicContact CD1-CD1 4.19Å; Y438-L442 HydrophobicContact CD1-CG 4.24Å; Y438-L442 HydrophobicContact CE1-CD1 4.11Å; Y438-L442 HydrophobicContact CE1-CD2 4.03Å; Y438-L442 HydrophobicContact CE1-CG 4.18Å; Y438-L442 PolarHBondContact O-N 2.73Å; Y438-S507 PolarHBondContact OH-OG 3.44Å
439	A	96	Very high	94.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-57.4	-43	177.3	0	0	0	0	0	112.1	S417 L420 R421 I435 G436 L442	S417-A439 VanDerWaalsContact CB-O 3.3Å; S417-A439 WeakPolarHBondContact CB-O 3.31Å; S417-A439 WeakPolarHBondContact O-CB 3.43Å; S417-A439 PolarHBondContact OG-O 2.73Å; L420-A439 HydrophobicContact CB-CB 3.84Å; R421-A439 HydrophobicContact CB-CB 4.27Å; I435-A439 PolarHBondContact O-N 3.32Å; G436-A439 WeakPolarHBondContact O-CB 3.33Å; G436-A439 PolarHBondContact O-N 3.37Å; A439-L442 PolarHBondContact O-N 3.11Å
440	K	95.5	Very high	94.5	Very high	100 Å²	100	28.3 Å²	28.3	44%	0.435	14%	0.136	S	C	.	.	H	α-helix	trans	-67.3	-34.6	177.7	-173.6	177.8	174.6	-168.5	0	112.7	G436 A437 Y438 L442 E443	G436-K440 PolarHBondContact O-N 3.38Å; A437-K440 PolarHBondContact O-N 2.94Å; Y438-K440 VanDerWaalsContact C-N 3.3Å; Y438-K440 PolarHBondContact O-N 3.42Å; K440-L442 VanDerWaalsContact C-N 3.33Å; K440-E443 PolarHBondContact O-N 3.27Å
441	A	96.6	Very high	94.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.7	-36.3	177.6	0	0	0	0	0	112.3	E103 F104 Q107 A437 Y438 E443 V444	E103-A441 HydrophobicContact CG-CB 4.01Å; F104-A441 HydrophobicContact CD1-CB 3.4Å; F104-A441 VanDerWaalsContact CD1-CB 3.4Å; F104-A441 HydrophobicContact CE1-CB 3.71Å; Q107-A441 HydrophobicContact CB-CB 4.5Å; Q107-A441 HydrophobicContact CG-CB 3.81Å; A437-A441 PolarHBondContact O-N 3.36Å; Y438-A441 WeakPolarHBondContact O-CB 3.45Å; Y438-A441 PolarHBondContact O-N 2.73Å; Y438-A441 VanDerWaalsContact O-N 3.13Å; A441-E443 PolarHBondContact O-N 3.26Å; A441-V444 WeakPolarHBondContact O-CB 3.4Å; A441-V444 WeakPolarHBondContact O-CG1 3.31Å; A441-V444 PolarHBondContact O-N 3.24Å
442	L	96.6	Very high	94.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.6	-30.1	178.3	-65.2	176.9	0	0	0	113.2	L100 F104 E413 L416 L420 Y438 A439 K440 V444 I445 L503	L100-L442 HydrophobicContact CD2-CD2 4.15Å; F104-L442 HydrophobicContact CE1-CD2 4.23Å; F104-L442 HydrophobicContact CZ-CD2 4.06Å; E413-L442 HydrophobicContact CB-CB 4.4Å; L416-L442 HydrophobicContact CB-CD1 3.67Å; L420-L442 HydrophobicContact CD1-CD1 3.97Å; Y438-L442 HydrophobicContact CD1-CD1 4.19Å; Y438-L442 HydrophobicContact CD1-CG 4.24Å; Y438-L442 HydrophobicContact CE1-CD1 4.11Å; Y438-L442 HydrophobicContact CE1-CD2 4.03Å; Y438-L442 HydrophobicContact CE1-CG 4.18Å; Y438-L442 PolarHBondContact O-N 2.73Å; A439-L442 PolarHBondContact O-N 3.11Å; K440-L442 VanDerWaalsContact C-N 3.33Å; L442-V444 PolarHBondContact O-N 3.08Å; L442-I445 PolarHBondContact O-N 3.11Å; L442-L503 HydrophobicContact CD2-CD2 3.5Å; L442-L503 VanDerWaalsContact CD2-CD2 3.5Å
443	E	96.1	Very high	94.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-5.2	178.9	-54.5	-179.2	-177.8	0	0	113.4	M414 S417 R421 K440 A441 I445 P446 R447 L461 R465	M414-E443 HydrophobicContact CE-CG 4.49Å; M414-E443 HydrophobicContact SD-CB 4.38Å; M414-E443 HydrophobicContact SD-CG 4.02Å; S417-E443 PolarHBondContact OG-OE1 3Å; R421-E443 IonicContact CZ-OE1 2.95Å; R421-E443 IonicContact NH1-OE1 3.03Å; R421-E443 PolarHBondContact NH1-OE1 3.08Å; R421-E443 IonicContact NH2-OE1 3.94Å; R421-E443 PolarHBondContact NH2-OE1 2.65Å; K440-E443 PolarHBondContact O-N 3.27Å; A441-E443 PolarHBondContact O-N 3.26Å; E443-I445 VanDerWaalsContact C-N 3.32Å; E443-I445 PolarHBondContact O-N 3.36Å; E443-P446 WeakPolarHBondContact O-CD 3.35Å; E443-P446 WeakPolarHBondContact O-CG 3.24Å; E443-R447 VanDerWaalsContact O-CB 3.25Å; E443-R447 WeakPolarHBondContact O-CB 3.33Å; E443-R447 PolarHBondContact O-N 2.76Å; E443-R447 VanDerWaalsContact O-N 3.11Å; E443-R447 IonicContact OE2-NH2 2.6Å; E443-L461 HydrophobicContact CB-CD2 4.38Å; E443-R465 IonicContact OE1-CZ 2.86Å; E443-R465 IonicContact OE1-NE 3.81Å; E443-R465 PolarHBondContact OE1-NE 3.45Å; E443-R465 IonicContact OE1-NH2 3.81Å; E443-R465 IonicContact OE2-CZ 2.9Å; E443-R465 IonicContact OE2-NE 2.85Å; E443-R465 PolarHBondContact OE2-NE 3.13Å; E443-R465 IonicContact OE2-NH2 3.58Å; E443-R465 PolarHBondContact OE2-NH2 3.28Å
444	V	96.1	Very high	94.3	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.9	-33	176.1	73.7	0	0	0	0	112.8	L99 L100 E103 A441 L442 R447 Q448	L99-V444 HydrophobicContact CD1-CG2 4.15Å; L99-V444 HydrophobicContact CD2-CG1 4.46Å; L99-V444 HydrophobicContact CD2-CG2 4.17Å; L99-V444 HydrophobicContact CG-CG1 4.18Å; L99-V444 HydrophobicContact CG-CG2 4.03Å; L100-V444 HydrophobicContact CD2-CG1 4Å; E103-V444 HydrophobicContact CB-CB 4.15Å; E103-V444 HydrophobicContact CB-CG1 3.91Å; E103-V444 HydrophobicContact CB-CG2 4.21Å; E103-V444 HydrophobicContact CG-CB 3.78Å; E103-V444 HydrophobicContact CG-CG1 4.03Å; E103-V444 HydrophobicContact CG-CG2 4Å; A441-V444 WeakPolarHBondContact O-CB 3.4Å; A441-V444 WeakPolarHBondContact O-CG1 3.31Å; A441-V444 PolarHBondContact O-N 3.24Å; L442-V444 PolarHBondContact O-N 3.08Å; V444-R447 PolarHBondContact O-N 3.25Å; V444-Q448 WeakPolarHBondContact O-CB 3.39Å; V444-Q448 PolarHBondContact O-N 2.94Å
445	I	95.3	Very high	94.1	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.026	12%	0.122	C	C	.	.	H	α-helix	trans	-63	-59.6	179.2	-62.4	-54.7	0	0	0	110.5	L40 L99 L100 E413 L442 E443 R447 Q448 L449	L40-I445 HydrophobicContact CD2-CD1 4.19Å; L40-I445 HydrophobicContact CD2-CG2 4.49Å; L99-I445 HydrophobicContact CD2-CD1 4.13Å; L100-I445 HydrophobicContact CD1-CD1 4.37Å; L100-I445 HydrophobicContact CD1-CG1 4.33Å; L100-I445 HydrophobicContact CD2-CD1 4.24Å; L100-I445 HydrophobicContact CD2-CG1 3.89Å; L100-I445 HydrophobicContact CG-CD1 3.93Å; L100-I445 HydrophobicContact CG-CG1 4.06Å; E413-I445 HydrophobicContact CG-CB 4.06Å; E413-I445 HydrophobicContact CG-CG1 4.05Å; E413-I445 HydrophobicContact CG-CG2 4.37Å; L442-I445 PolarHBondContact O-N 3.11Å; E443-I445 VanDerWaalsContact C-N 3.32Å; E443-I445 PolarHBondContact O-N 3.36Å; I445-R447 VanDerWaalsContact C-N 3.29Å; I445-R447 PolarHBondContact O-N 3.03Å; I445-Q448 PolarHBondContact O-N 2.9Å; I445-L449 HydrophobicContact CG2-CD1 4.26Å; I445-L449 WeakPolarHBondContact O-CG 3.37Å; I445-L449 PolarHBondContact O-N 2.76Å
446	P	95.1	Very high	94	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.5	-34.4	176.9	21.1	-31.1	0	0	0	112.9	M414 E443 L449 C450 L461 L464 V477	M414-P446 HydrophobicContact CG-CB 4.49Å; M414-P446 HydrophobicContact CG-CG 3.95Å; M414-P446 HydrophobicContact SD-CG 3.68Å; E443-P446 WeakPolarHBondContact O-CD 3.35Å; E443-P446 WeakPolarHBondContact O-CG 3.24Å; P446-L449 PolarHBondContact O-N 2.82Å; P446-C450 PolarHBondContact O-N 2.78Å; P446-C450 VanDerWaalsContact O-N 3.14Å; P446-C450 PolarHBondContact O-SG 3.39Å; P446-L461 HydrophobicContact CB-CD2 4.12Å; P446-L461 HydrophobicContact CG-CD2 3.95Å; P446-L464 HydrophobicContact CB-CD1 4.14Å; P446-V477 HydrophobicContact CB-CG2 3.98Å
447	R	95.3	Very high	93.8	Very high	59 Å²	59	24.2 Å²	24.2	22%	0.223	14%	0.139	C	C	.	.	H	α-helix	trans	-57.7	-51.5	173.9	-169.8	178.1	-61.7	137.6	11.7	111.1	E443 V444 I445 L449 C450 D451 A457 L461	E443-R447 VanDerWaalsContact O-CB 3.25Å; E443-R447 WeakPolarHBondContact O-CB 3.33Å; E443-R447 PolarHBondContact O-N 2.76Å; E443-R447 VanDerWaalsContact O-N 3.11Å; E443-R447 IonicContact OE2-NH2 2.6Å; V444-R447 PolarHBondContact O-N 3.25Å; I445-R447 VanDerWaalsContact C-N 3.29Å; I445-R447 PolarHBondContact O-N 3.03Å; R447-L449 VanDerWaalsContact C-N 3.33Å; R447-L449 PolarHBondContact O-N 3.12Å; R447-C450 WeakPolarHBondContact O-CB 3.4Å; R447-C450 PolarHBondContact O-N 2.88Å; R447-C450 VanDerWaalsContact O-N 3.14Å; R447-D451 PolarHBondContact O-N 3.28Å; R447-A457 HydrophobicContact CG-CB 3.97Å; R447-L461 HydrophobicContact CB-CD1 3.85Å; R447-L461 HydrophobicContact CG-CD1 3.93Å
448	Q	95.1	Very high	93.7	Very high	8 Å²	8	28.4 Å²	28.4	4%	0.037	16%	0.164	C	C	.	.	H	α-helix	trans	-70.3	-33.2	-175	-168.7	60.9	51.4	0	0	112.2	R37 L40 L99 V444 I445 C450 D451 N452	R37-Q448 HydrophobicContact CG-CG 3.63Å; R37-Q448 WeakPolarHBondContact O-CG 3.36Å; L40-Q448 HydrophobicContact CB-CG 4.41Å; L40-Q448 HydrophobicContact CD2-CB 3.87Å; L40-Q448 HydrophobicContact CD2-CG 4.04Å; L99-Q448 HydrophobicContact CD2-CB 3.91Å; L99-Q448 HydrophobicContact CD2-CG 3.96Å; V444-Q448 WeakPolarHBondContact O-CB 3.39Å; V444-Q448 PolarHBondContact O-N 2.94Å; I445-Q448 PolarHBondContact O-N 2.9Å; Q448-C450 VanDerWaalsContact C-N 3.29Å; Q448-C450 PolarHBondContact O-N 3.47Å; Q448-D451 PolarHBondContact O-N 2.95Å; Q448-N452 PolarHBondContact NE2-OD1 2.79Å; Q448-N452 WeakPolarHBondContact O-CB 3.31Å; Q448-N452 VanDerWaalsContact O-CG 3.24Å; Q448-N452 PolarHBondContact O-N 3.49Å; Q448-N452 PolarHBondContact O-ND2 3.14Å
449	L	92.6	Very high	93.5	Very high	13 Å²	13	32.2 Å²	32.2	7%	0.068	18%	0.184	C	C	.	.	H	α-helix	trans	-58.4	-42.3	170.4	-72.2	174.8	0	0	0	111.6	L40 I445 P446 R447 A453 I479	L40-L449 HydrophobicContact CD2-CD2 4.33Å; L40-L449 HydrophobicContact CD2-CG 4.35Å; L40-L449 HydrophobicContact CG-CD2 4.09Å; I445-L449 HydrophobicContact CG2-CD1 4.26Å; I445-L449 WeakPolarHBondContact O-CG 3.37Å; I445-L449 PolarHBondContact O-N 2.76Å; P446-L449 PolarHBondContact O-N 2.82Å; R447-L449 VanDerWaalsContact C-N 3.33Å; R447-L449 PolarHBondContact O-N 3.12Å; L449-A453 VanDerWaalsContact O-CB 3.3Å; L449-A453 WeakPolarHBondContact O-CB 3.29Å; L449-A453 PolarHBondContact O-N 2.88Å; L449-A453 VanDerWaalsContact O-N 3.1Å; L449-I479 HydrophobicContact CD2-CD1 4.36Å
450	C	93.2	Very high	93.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.2	-48.2	176	-62.3	0	0	0	0	111.6	P446 R447 Q448 N452 A453 G454 F455 A457 I460	P446-C450 PolarHBondContact O-N 2.78Å; P446-C450 VanDerWaalsContact O-N 3.14Å; P446-C450 PolarHBondContact O-SG 3.39Å; R447-C450 WeakPolarHBondContact O-CB 3.4Å; R447-C450 PolarHBondContact O-N 2.88Å; R447-C450 VanDerWaalsContact O-N 3.14Å; Q448-C450 VanDerWaalsContact C-N 3.29Å; Q448-C450 PolarHBondContact O-N 3.47Å; C450-N452 VanDerWaalsContact C-N 3.32Å; C450-N452 PolarHBondContact O-N 3.06Å; C450-A453 CarbonylContact O-C 3.56Å; C450-A453 PolarHBondContact O-N 3.43Å; C450-A453 VanDerWaalsContact O-N 3.13Å; C450-G454 PolarHBondContact O-N 2.9Å; C450-F455 HydrophobicContact CB-CB 4.14Å; C450-F455 PolarHBondContact O-N 2.97Å; C450-A457 HydrophobicContact CB-CB 3.66Å; C450-I460 VanDerWaalsContact SG-CG2 3.51Å
451	D	92.6	Very high	93.3	Very high	78 Å²	78	28.2 Å²	28.2	42%	0.417	17%	0.167	S	C	.	.	H	α-helix	trans	-58.6	-44	-179.5	-68.1	-26.1	0	0	0	111.3	R447 Q448 A453 G454 A457	R447-D451 PolarHBondContact O-N 3.28Å; Q448-D451 PolarHBondContact O-N 2.95Å; D451-A453 VanDerWaalsContact C-N 3.33Å; D451-A453 PolarHBondContact O-N 2.8Å; D451-G454 PolarHBondContact O-N 3.49Å; D451-A457 VanDerWaalsContact OD1-CB 3.31Å; D451-A457 WeakPolarHBondContact OD1-CB 3.26Å
452	N	91.6	Very high	93.2	Very high	28 Å²	28	32 Å²	32	15%	0.15	19%	0.188	C	C	.	.	H	α-helix	trans	-70.6	-29.2	178.9	-68	-10.6	0	0	0	112.4	R37 T38 L40 Q448 C450 G454	R37-N452 PolarHBondContact O-ND2 3.25Å; R37-N452 VanDerWaalsContact O-ND2 3.08Å; T38-N452 PolarHBondContact O-ND2 3.21Å; L40-N452 PolarHBondContact O-ND2 2.82Å; Q448-N452 PolarHBondContact NE2-OD1 2.79Å; Q448-N452 WeakPolarHBondContact O-CB 3.31Å; Q448-N452 VanDerWaalsContact O-CG 3.24Å; Q448-N452 PolarHBondContact O-N 3.49Å; Q448-N452 PolarHBondContact O-ND2 3.14Å; C450-N452 VanDerWaalsContact C-N 3.32Å; C450-N452 PolarHBondContact O-N 3.06Å; N452-G454 VanDerWaalsContact C-N 3.31Å
453	A	88.1	Confident	93.1	Very high	14 Å²	14	35.4 Å²	35.4	12%	0.116	20%	0.203	C	C	.	.	H	α-helix	trans	-81.2	-9.9	175.1	0	0	0	0	0	113.8	L449 C450 D451 F455 I479	L449-A453 VanDerWaalsContact O-CB 3.3Å; L449-A453 WeakPolarHBondContact O-CB 3.29Å; L449-A453 PolarHBondContact O-N 2.88Å; L449-A453 VanDerWaalsContact O-N 3.1Å; C450-A453 CarbonylContact O-C 3.56Å; C450-A453 PolarHBondContact O-N 3.43Å; C450-A453 VanDerWaalsContact O-N 3.13Å; D451-A453 VanDerWaalsContact C-N 3.33Å; D451-A453 PolarHBondContact O-N 2.8Å; A453-F455 HydrophobicContact CB-CD1 4.19Å; A453-F455 HydrophobicContact CB-CD2 3.78Å; A453-F455 HydrophobicContact CB-CE1 3.96Å; A453-F455 HydrophobicContact CB-CE2 3.54Å; A453-F455 HydrophobicContact CB-CG 4.09Å; A453-F455 HydrophobicContact CB-CZ 3.62Å; A453-I479 HydrophobicContact CB-CG1 4.21Å; A453-I479 HydrophobicContact CB-CG2 4.09Å
454	G	89.1	Confident	93	Very high	69 Å²	69	35.4 Å²	35.4	71%	0.711	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.9	14.9	-176.7	0	0	0	0	0	114.5	C450 D451 N452	C450-G454 PolarHBondContact O-N 2.9Å; D451-G454 PolarHBondContact O-N 3.49Å; N452-G454 VanDerWaalsContact C-N 3.31Å
455	F	90.3	Very high	92.8	Very high	27 Å²	27	39.4 Å²	39.4	12%	0.118	22%	0.218	C	C	.	.			trans	-84.9	159	179.6	-52.6	-25.2	0	0	0	111.7	C450 A453 A457 I460 V477 I479 E482	C450-F455 HydrophobicContact CB-CB 4.14Å; C450-F455 PolarHBondContact O-N 2.97Å; A453-F455 HydrophobicContact CB-CD1 4.19Å; A453-F455 HydrophobicContact CB-CD2 3.78Å; A453-F455 HydrophobicContact CB-CE1 3.96Å; A453-F455 HydrophobicContact CB-CE2 3.54Å; A453-F455 HydrophobicContact CB-CG 4.09Å; A453-F455 HydrophobicContact CB-CZ 3.62Å; F455-A457 PolarHBondContact O-N 3.01Å; F455-I460 HydrophobicContact CB-CG1 4.49Å; F455-V477 HydrophobicContact CD2-CG1 4.41Å; F455-V477 HydrophobicContact CE2-CG1 4.41Å; F455-I479 HydrophobicContact CE2-CB 4.49Å; F455-I479 HydrophobicContact CE2-CG1 4.14Å; F455-I479 HydrophobicContact CZ-CG2 4.4Å; F455-E482 HydrophobicContact CD1-CB 4.2Å; F455-E482 HydrophobicContact CE1-CB 3.56Å; F455-E482 HydrophobicContact CE1-CG 3.49Å; F455-E482 VanDerWaalsContact CE1-CG 3.49Å; F455-E482 HydrophobicContact CE2-CB 4.33Å; F455-E482 HydrophobicContact CZ-CB 3.64Å; F455-E482 HydrophobicContact CZ-CG 3.57Å
456	D	91.7	Very high	92.8	Very high	95 Å²	95	41.5 Å²	41.5	51%	0.508	24%	0.236	S	C	.	.			trans	-72.3	96.2	167.3	177.6	13.6	0	0	0	110.2	T458 N459 I460	D456-T458 PolarHBondContact O-N 3.15Å; D456-T458 VanDerWaalsContact O-N 3.13Å; D456-T458 WeakPolarHBondContact OD1-CB 3.5Å; D456-T458 PolarHBondContact OD1-N 3Å; D456-N459 HydrophobicContact CB-CB 4.28Å; D456-N459 PolarHBondContact O-N 3.03Å; D456-N459 VanDerWaalsContact OD2-CB 3.27Å; D456-N459 WeakPolarHBondContact OD2-CB 3.34Å; D456-I460 PolarHBondContact O-N 2.9Å; D456-I460 VanDerWaalsContact O-N 3.13Å
457	A	91.5	Very high	92.7	Very high	8 Å²	8	45.5 Å²	45.5	7%	0.066	25%	0.253	C	S	.	.	H	α-helix	trans	-56.4	-28.8	178.9	0	0	0	0	0	112.9	R447 C450 D451 F455 L461	R447-A457 HydrophobicContact CG-CB 3.97Å; C450-A457 HydrophobicContact CB-CB 3.66Å; D451-A457 VanDerWaalsContact OD1-CB 3.31Å; D451-A457 WeakPolarHBondContact OD1-CB 3.26Å; F455-A457 PolarHBondContact O-N 3.01Å; A457-L461 WeakPolarHBondContact O-CB 3.46Å; A457-L461 WeakPolarHBondContact O-CD1 3.44Å; A457-L461 WeakPolarHBondContact O-CG 3.46Å; A457-L461 PolarHBondContact O-N 2.96Å
458	T	92.4	Very high	92.7	Very high	93 Å²	93	42.8 Å²	42.8	57%	0.571	24%	0.243	S	C	*	.	H	α-helix	trans	-70.1	-48.7	-178.8	-53.1	0	0	0	0	110.9	D456 N462	D456-T458 PolarHBondContact O-N 3.15Å; D456-T458 VanDerWaalsContact O-N 3.13Å; D456-T458 WeakPolarHBondContact OD1-CB 3.5Å; D456-T458 PolarHBondContact OD1-N 3Å; T458-N462 WeakPolarHBondContact O-CB 3.37Å; T458-N462 VanDerWaalsContact O-CG 3.24Å; T458-N462 PolarHBondContact O-N 3.22Å; T458-N462 VanDerWaalsContact O-N 3.13Å; T458-N462 PolarHBondContact O-ND2 3.08Å; T458-N462 VanDerWaalsContact O-ND2 3.14Å
459	N	93.4	Very high	92.5	Very high	79 Å²	79	45.9 Å²	45.9	42%	0.422	27%	0.27	S	S	.	.	H	α-helix	trans	-64	-48.6	178.5	-172.5	2.1	0	0	0	111.2	D456 L461 N462 K463	D456-N459 HydrophobicContact CB-CB 4.28Å; D456-N459 PolarHBondContact O-N 3.03Å; D456-N459 VanDerWaalsContact OD2-CB 3.27Å; D456-N459 WeakPolarHBondContact OD2-CB 3.34Å; N459-L461 PolarHBondContact O-N 3.22Å; N459-N462 PolarHBondContact O-N 2.91Å; N459-K463 WeakPolarHBondContact O-CG 3.25Å; N459-K463 PolarHBondContact O-N 3.19Å
460	I	93.2	Very high	92.5	Very high	9 Å²	9	52.4 Å²	52.4	5%	0.046	30%	0.3	C	S	.	.	H	α-helix	trans	-61.7	-45.4	-179.4	-63.6	-63.5	0	0	0	111.5	C450 F455 D456 N462 K463 L464 V477 I484	C450-I460 VanDerWaalsContact SG-CG2 3.51Å; F455-I460 HydrophobicContact CB-CG1 4.49Å; D456-I460 PolarHBondContact O-N 2.9Å; D456-I460 VanDerWaalsContact O-N 3.13Å; I460-N462 VanDerWaalsContact C-N 3.31Å; I460-N462 PolarHBondContact O-N 3.45Å; I460-K463 PolarHBondContact O-N 2.78Å; I460-L464 HydrophobicContact CG2-CD1 4.11Å; I460-L464 HydrophobicContact CG2-CG 4.38Å; I460-L464 WeakPolarHBondContact O-CB 3.48Å; I460-L464 WeakPolarHBondContact O-CG 3.42Å; I460-L464 PolarHBondContact O-N 3.31Å; I460-V477 HydrophobicContact CG2-CG2 3.99Å; I460-I484 HydrophobicContact CG2-CG2 3.93Å
461	L	93.8	Very high	92.3	Very high	7 Å²	7	55 Å²	55	4%	0.037	33%	0.327	C	S	.	.	H	α-helix	trans	-61.3	-38.9	176.5	-78.4	169.4	0	0	0	112.5	M414 E443 P446 R447 A457 N459 L464 R465	M414-L461 HydrophobicContact SD-CD2 4.07Å; E443-L461 HydrophobicContact CB-CD2 4.38Å; P446-L461 HydrophobicContact CB-CD2 4.12Å; P446-L461 HydrophobicContact CG-CD2 3.95Å; R447-L461 HydrophobicContact CB-CD1 3.85Å; R447-L461 HydrophobicContact CG-CD1 3.93Å; A457-L461 WeakPolarHBondContact O-CB 3.46Å; A457-L461 WeakPolarHBondContact O-CD1 3.44Å; A457-L461 WeakPolarHBondContact O-CG 3.46Å; A457-L461 PolarHBondContact O-N 2.96Å; N459-L461 PolarHBondContact O-N 3.22Å; L461-L464 PolarHBondContact O-N 2.97Å; L461-R465 WeakPolarHBondContact O-CB 3.45Å; L461-R465 VanDerWaalsContact O-CG 3.25Å; L461-R465 WeakPolarHBondContact O-CG 3.46Å; L461-R465 PolarHBondContact O-N 3.1Å
462	N	94.1	Very high	92.2	Very high	81 Å²	81	51.9 Å²	51.9	43%	0.433	31%	0.313	S	S	.	.	H	α-helix	trans	-67	-42.4	177.9	-73.1	-26.4	0	0	0	111.6	T458 N459 I460 R465 A466	T458-N462 WeakPolarHBondContact O-CB 3.37Å; T458-N462 VanDerWaalsContact O-CG 3.24Å; T458-N462 PolarHBondContact O-N 3.22Å; T458-N462 VanDerWaalsContact O-N 3.13Å; T458-N462 PolarHBondContact O-ND2 3.08Å; T458-N462 VanDerWaalsContact O-ND2 3.14Å; N459-N462 PolarHBondContact O-N 2.91Å; I460-N462 VanDerWaalsContact C-N 3.31Å; I460-N462 PolarHBondContact O-N 3.45Å; N462-R465 PolarHBondContact O-N 2.93Å; N462-R465 PolarHBondContact OD1-NH1 2.77Å; N462-A466 WeakPolarHBondContact O-CB 3.43Å; N462-A466 PolarHBondContact O-N 3.1Å
463	K	93.9	Very high	92.1	Very high	71 Å²	71	52.8 Å²	52.8	31%	0.309	32%	0.317	S	S	.	.	H	α-helix	trans	-60.1	-46.2	172.6	-71.4	-180	175.7	-177.5	0	111.7	N459 I460 A466 K467 D483 I484	N459-K463 WeakPolarHBondContact O-CG 3.25Å; N459-K463 PolarHBondContact O-N 3.19Å; I460-K463 PolarHBondContact O-N 2.78Å; K463-A466 PolarHBondContact O-N 3.16Å; K463-K467 PolarHBondContact O-N 2.85Å; K463-D483 WeakPolarHBondContact CD-OD1 3.09Å; K463-D483 IonicContact NZ-OD1 2.65Å; K463-D483 PolarHBondContact NZ-OD1 2.79Å; K463-D483 IonicContact NZ-OD2 3.43Å; K463-D483 PolarHBondContact NZ-OD2 3.06Å; K463-I484 HydrophobicContact CB-CD1 3.88Å; K463-I484 HydrophobicContact CB-CG1 4.35Å; K463-I484 HydrophobicContact CB-CG2 4.31Å
464	L	93.8	Very high	92.5	Very high	0 Å²	0	54 Å²	54	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.7	-51.7	176.9	-77.5	174.3	0	0	0	111.4	M414 P446 I460 L461 A466 K467 H468 F475 V477 I484	M414-L464 HydrophobicContact CE-CB 4.19Å; M414-L464 HydrophobicContact CG-CB 4.37Å; M414-L464 HydrophobicContact CG-CD1 4.17Å; P446-L464 HydrophobicContact CB-CD1 4.14Å; I460-L464 HydrophobicContact CG2-CD1 4.11Å; I460-L464 HydrophobicContact CG2-CG 4.38Å; I460-L464 WeakPolarHBondContact O-CB 3.48Å; I460-L464 WeakPolarHBondContact O-CG 3.42Å; I460-L464 PolarHBondContact O-N 3.31Å; L461-L464 PolarHBondContact O-N 2.97Å; L464-A466 VanDerWaalsContact C-N 3.26Å; L464-A466 PolarHBondContact O-N 3.09Å; L464-K467 PolarHBondContact O-N 2.69Å; L464-K467 VanDerWaalsContact O-N 3.14Å; L464-H468 PolarHBondContact O-CD2 3.48Å; L464-H468 VanDerWaalsContact O-CD2 3.29Å; L464-H468 PolarHBondContact O-N 3.43Å; L464-F475 HydrophobicContact CD2-CB 4.39Å; L464-V477 HydrophobicContact CD1-CG2 3.74Å; L464-I484 HydrophobicContact CD1-CG2 4.43Å; L464-I484 HydrophobicContact CD2-CB 3.95Å; L464-I484 HydrophobicContact CD2-CG2 3.42Å; L464-I484 VanDerWaalsContact CD2-CG2 3.42Å; L464-I484 HydrophobicContact CG-CG2 3.5Å
465	R	93.6	Very high	92.8	Very high	84 Å²	84	53 Å²	53	32%	0.317	30%	0.295	S	S	.	.	H	α-helix	trans	-55.6	-42.9	178	-72.9	172.5	-173.8	155.1	-1.7	111.6	M414 E443 L461 N462 A469	M414-R465 HydrophobicContact CE-CB 4.41Å; M414-R465 HydrophobicContact CE-CG 3.49Å; M414-R465 VanDerWaalsContact CE-CG 3.49Å; E443-R465 IonicContact OE1-CZ 2.86Å; E443-R465 IonicContact OE1-NE 3.81Å; E443-R465 PolarHBondContact OE1-NE 3.45Å; E443-R465 IonicContact OE1-NH2 3.81Å; E443-R465 IonicContact OE2-CZ 2.9Å; E443-R465 IonicContact OE2-NE 2.85Å; E443-R465 PolarHBondContact OE2-NE 3.13Å; E443-R465 IonicContact OE2-NH2 3.58Å; E443-R465 PolarHBondContact OE2-NH2 3.28Å; L461-R465 WeakPolarHBondContact O-CB 3.45Å; L461-R465 VanDerWaalsContact O-CG 3.25Å; L461-R465 WeakPolarHBondContact O-CG 3.46Å; L461-R465 PolarHBondContact O-N 3.1Å; N462-R465 PolarHBondContact O-N 2.93Å; N462-R465 PolarHBondContact OD1-NH1 2.77Å; R465-A469 VanDerWaalsContact O-CB 3.27Å; R465-A469 WeakPolarHBondContact O-CB 3.49Å; R465-A469 PolarHBondContact O-N 3.36Å
466	A	94.4	Very high	92.9	Very high	48 Å²	48	51.7 Å²	51.7	40%	0.397	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-44.1	178.2	0	0	0	0	0	112.1	N462 K463 L464 A469 Q470	N462-A466 WeakPolarHBondContact O-CB 3.43Å; N462-A466 PolarHBondContact O-N 3.1Å; K463-A466 PolarHBondContact O-N 3.16Å; L464-A466 VanDerWaalsContact C-N 3.26Å; L464-A466 PolarHBondContact O-N 3.09Å; A466-A469 PolarHBondContact O-N 2.86Å; A466-Q470 VanDerWaalsContact O-CG 3.29Å; A466-Q470 WeakPolarHBondContact O-CG 3.26Å; A466-Q470 PolarHBondContact O-N 2.85Å
467	K	94.1	Very high	93	Very high	85 Å²	85	47.5 Å²	47.5	37%	0.37	27%	0.267	S	S	.	.	H	α-helix	trans	-67.3	-44	178.1	-75.9	-62.7	-169.4	174	0	113.3	K463 L464 A469 Q470 G471 G472 F475 I484	K463-K467 PolarHBondContact O-N 2.85Å; L464-K467 PolarHBondContact O-N 2.69Å; L464-K467 VanDerWaalsContact O-N 3.14Å; K467-A469 VanDerWaalsContact C-N 3.29Å; K467-A469 PolarHBondContact O-N 2.77Å; K467-Q470 CarbonylContact O-C 3.59Å; K467-Q470 WeakPolarHBondContact O-CA 2.98Å; K467-Q470 WeakPolarHBondContact O-CB 3.42Å; K467-Q470 PolarHBondContact O-N 3.3Å; K467-Q470 VanDerWaalsContact O-N 3.08Å; K467-G471 PolarHBondContact O-N 3.23Å; K467-G472 PolarHBondContact O-N 2.71Å; K467-F475 HydrophobicContact CB-CB 4.41Å; K467-F475 HydrophobicContact CB-CG 4.25Å; K467-F475 HydrophobicContact CG-CD1 4.45Å; K467-I484 HydrophobicContact CB-CD1 4.31Å; K467-I484 HydrophobicContact CG-CD1 3.45Å; K467-I484 VanDerWaalsContact CG-CD1 3.45Å
468	H	94.1	Very high	92.8	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.009	27%	0.271	C	S	.	.	H	α-helix	trans	-62.3	-38.7	174.9	-83.7	-91.5	0	0	0	111.7	A411 M414 E415 K418 L464 Q470 G471 G472 L473 F475	A411-H468 PolarHBondContact O-CE1 2.85Å; A411-H468 VanDerWaalsContact O-CE1 3.26Å; M414-H468 WeakPolarHBondContact CB-NE2 3.02Å; E415-H468 IonicContact OE2-CE1 3.93Å; E415-H468 IonicContact OE2-CG 3.37Å; E415-H468 IonicContact OE2-ND1 3.71Å; E415-H468 PolarHBondContact OE2-ND1 3.43Å; K418-H468 HydrophobicContact CD-CB 4.28Å; K418-H468 WeakPolarHBondContact CD-O 3.37Å; K418-H468 WeakPolarHBondContact CE-O 3.33Å; K418-H468 PolarHBondContact NZ-O 2.84Å; L464-H468 PolarHBondContact O-CD2 3.48Å; L464-H468 VanDerWaalsContact O-CD2 3.29Å; L464-H468 PolarHBondContact O-N 3.43Å; H468-Q470 VanDerWaalsContact C-N 3.27Å; H468-Q470 PolarHBondContact O-N 3.01Å; H468-G471 PolarHBondContact O-N 3.03Å; H468-G471 VanDerWaalsContact O-N 3.08Å; H468-G472 PolarHBondContact CE1-O 2.91Å; H468-G472 PolarHBondContact ND1-O 3.39Å; H468-L473 PolarHBondContact CE1-O 3.4Å; H468-L473 VanDerWaalsContact CE1-O 3.24Å; H468-F475 PolarHBondContact NE2-O 2.89Å
469	A	91.9	Very high	92.4	Very high	73 Å²	73	44.7 Å²	44.7	60%	0.603	25%	0.247	S	C	*	.	H	α-helix	trans	-63	-33.2	173.8	0	0	0	0	0	112.6	R465 A466 K467 G471	R465-A469 VanDerWaalsContact O-CB 3.27Å; R465-A469 WeakPolarHBondContact O-CB 3.49Å; R465-A469 PolarHBondContact O-N 3.36Å; A466-A469 PolarHBondContact O-N 2.86Å; K467-A469 VanDerWaalsContact C-N 3.29Å; K467-A469 PolarHBondContact O-N 2.77Å; A469-G471 PolarHBondContact O-N 2.66Å
470	Q	92.4	Very high	91.9	Very high	150 Å²	150	46.7 Å²	46.7	70%	0.701	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-0.2	174.3	-69.1	168.9	10.5	0	0	114	A466 K467 H468	A466-Q470 VanDerWaalsContact O-CG 3.29Å; A466-Q470 WeakPolarHBondContact O-CG 3.26Å; A466-Q470 PolarHBondContact O-N 2.85Å; K467-Q470 CarbonylContact O-C 3.59Å; K467-Q470 WeakPolarHBondContact O-CA 2.98Å; K467-Q470 WeakPolarHBondContact O-CB 3.42Å; K467-Q470 PolarHBondContact O-N 3.3Å; K467-Q470 VanDerWaalsContact O-N 3.08Å; H468-Q470 VanDerWaalsContact C-N 3.27Å; H468-Q470 PolarHBondContact O-N 3.01Å
471	G	88.2	Confident	91.4	Very high	54 Å²	54	49 Å²	49	56%	0.557	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.7	6.7	177.9	0	0	0	0	0	115.2	K467 H468 A469 L473	K467-G471 PolarHBondContact O-N 3.23Å; H468-G471 PolarHBondContact O-N 3.03Å; H468-G471 VanDerWaalsContact O-N 3.08Å; A469-G471 PolarHBondContact O-N 2.66Å; G471-L473 PolarHBondContact O-N 3.47Å
472	G	89.7	Confident	91	Very high	13 Å²	13	53.7 Å²	53.7	13%	0.134	30%	0.302	C	S	.	.			trans	-75.9	88.6	174.9	0	0	0	0	0	112.3	K467 H468 F475	K467-G472 PolarHBondContact O-N 2.71Å; H468-G472 PolarHBondContact CE1-O 2.91Å; H468-G472 PolarHBondContact ND1-O 3.39Å; G472-F475 VanDerWaalsContact CA-CD2 3.45Å
473	L	91.5	Very high	90.8	Very high	46 Å²	46	52.6 Å²	52.6	24%	0.241	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-34.9	-173.6	-171.6	141.7	0	0	0	114	I139 E415 H468 G471	I139-L473 HydrophobicContact CB-CD1 4.26Å; I139-L473 HydrophobicContact CB-CD2 4.44Å; I139-L473 HydrophobicContact CG2-CD1 3.96Å; E415-L473 HydrophobicContact CG-CD1 4.15Å; E415-L473 HydrophobicContact CG-CG 3.97Å; H468-L473 PolarHBondContact CE1-O 3.4Å; H468-L473 VanDerWaalsContact CE1-O 3.24Å; G471-L473 PolarHBondContact O-N 3.47Å
474	W	94.7	Very high	90.7	Very high	39 Å²	39	50.4 Å²	50.4	15%	0.148	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	10.8	-174	-59.4	123.8	0	0	0	114.2	I139 V141 V406 A407 G476 D486 N487 F488	I139-W474 VanDerWaalsContact O-CH2 3.28Å; I139-W474 WeakPolarHBondContact O-CH2 2.79Å; I139-W474 WeakPolarHBondContact O-CZ2 3.05Å; V141-W474 HydrophobicContact CG2-CH2 4.35Å; V141-W474 HydrophobicContact CG2-CZ2 3.68Å; V406-W474 HydrophobicContact CB-CH2 4.27Å; V406-W474 HydrophobicContact CB-CZ3 3.94Å; V406-W474 HydrophobicContact CG1-CH2 4.25Å; V406-W474 HydrophobicContact CG1-CZ3 4.33Å; A407-W474 HydrophobicContact CB-CB 4.15Å; A407-W474 HydrophobicContact CB-CD2 3.98Å; A407-W474 HydrophobicContact CB-CE3 3.29Å; A407-W474 HydrophobicContact CB-CG 4.38Å; A407-W474 HydrophobicContact CB-CZ3 4Å; W474-G476 PolarHBondContact O-N 2.89Å; W474-D486 VanDerWaalsContact CB-OD1 3.32Å; W474-D486 WeakPolarHBondContact CB-OD1 3.08Å; W474-N487 PolarHBondContact O-N 2.6Å; W474-F488 HydrophobicContact CB-CB 3.7Å; W474-F488 HydrophobicContact CD2-CB 4.09Å; W474-F488 HydrophobicContact CD2-CD2 4.12Å; W474-F488 HydrophobicContact CD2-CG 4.34Å; W474-F488 HydrophobicContact CG-CB 3.61Å; W474-F488 HydrophobicContact CG-CD2 4.48Å; W474-F488 HydrophobicContact CG-CG 4.22Å; W474-F488 HydrophobicContact CZ2-CD2 4.41Å
475	F	95.3	Very high	90.6	Very high	49 Å²	49	52.2 Å²	52.2	22%	0.215	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	125	178	-79	-94.9	0	0	0	110.2	A411 L464 K467 H468 G472 T485	A411-F475 VanDerWaalsContact CA-O 3.31Å; A411-F475 WeakPolarHBondContact CA-O 3.29Å; A411-F475 VanDerWaalsContact CB-O 3.24Å; A411-F475 WeakPolarHBondContact CB-O 3.48Å; L464-F475 HydrophobicContact CD2-CB 4.39Å; K467-F475 HydrophobicContact CB-CB 4.41Å; K467-F475 HydrophobicContact CB-CG 4.25Å; K467-F475 HydrophobicContact CG-CD1 4.45Å; H468-F475 PolarHBondContact NE2-O 2.89Å; G472-F475 VanDerWaalsContact CA-CD2 3.45Å; F475-T485 CarbonylContact C-O 3.55Å; F475-T485 VanDerWaalsContact CA-O 3.28Å; F475-T485 WeakPolarHBondContact CA-O 3.19Å
476	G	93.9	Very high	90.5	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	-176.2	176.7	0	0	0	0	0	111.6	W474 I484 T485 N487	W474-G476 PolarHBondContact O-N 2.89Å; G476-I484 WeakPolarHBondContact O-CA 3.49Å; G476-T485 PolarHBondContact N-O 3.18Å; G476-T485 PolarHBondContact O-N 3.19Å; G476-T485 VanDerWaalsContact O-N 3.16Å; G476-N487 WeakPolarHBondContact CA-ND2 3.34Å
477	V	92.3	Very high	90.3	Very high	6 Å²	6	47.8 Å²	47.8	4%	0.036	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	121.7	172.9	-174.2	0	0	0	0	107.6	G409 P446 F455 I460 L464 I479 N487	G409-V477 PolarHBondContact O-N 3.2Å; P446-V477 HydrophobicContact CB-CG2 3.98Å; F455-V477 HydrophobicContact CD2-CG1 4.41Å; F455-V477 HydrophobicContact CE2-CG1 4.41Å; I460-V477 HydrophobicContact CG2-CG2 3.99Å; L464-V477 HydrophobicContact CD1-CG2 3.74Å; V477-I479 HydrophobicContact CG1-CG1 4.26Å; V477-N487 PolarHBondContact O-ND2 3.09Å
478	D	88.9	Confident	90	Very high	26 Å²	26	46 Å²	46	14%	0.139	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.1	165.9	172.2	28.6	0	0	0	109.6	T480 S481 E482 D483 T485	D478-T480 VanDerWaalsContact C-N 3.31Å; D478-T480 WeakPolarHBondContact OD1-CB 3.27Å; D478-T480 PolarHBondContact OD1-N 2.89Å; D478-T480 PolarHBondContact OD1-OG1 3.01Å; D478-S481 WeakPolarHBondContact CB-OG 3.15Å; D478-S481 VanDerWaalsContact CG-OG 3.29Å; D478-S481 WeakPolarHBondContact OD2-CB 2.96Å; D478-S481 PolarHBondContact OD2-N 3.43Å; D478-S481 PolarHBondContact OD2-OG 3.1Å; D478-E482 PolarHBondContact O-N 2.66Å; D478-D483 PolarHBondContact N-O 2.72Å; D478-D483 VanDerWaalsContact N-O 3.17Å; D478-T485 HydrophobicContact CB-CG2 4Å; D478-T485 WeakPolarHBondContact CB-OG1 3.46Å
479	I	84.3	Confident	89.7	Confident	16 Å²	16	52.2 Å²	52.2	8%	0.082	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-13.9	-174.1	-69.1	163.9	0	0	0	111.4	P42 R43 L449 A453 F455 V477	P42-I479 HydrophobicContact CG-CB 3.89Å; P42-I479 HydrophobicContact CG-CD1 3.14Å; P42-I479 HydrophobicContact CG-CG1 4.05Å; P42-I479 HydrophobicContact CG-CG2 4Å; R43-I479 HydrophobicContact CG-CG2 3.75Å; R43-I479 PolarHBondContact NH2-O 3.27Å; L449-I479 HydrophobicContact CD2-CD1 4.36Å; A453-I479 HydrophobicContact CB-CG1 4.21Å; A453-I479 HydrophobicContact CB-CG2 4.09Å; F455-I479 HydrophobicContact CE2-CB 4.49Å; F455-I479 HydrophobicContact CE2-CG1 4.14Å; F455-I479 HydrophobicContact CZ-CG2 4.4Å; V477-I479 HydrophobicContact CG1-CG1 4.26Å
480	T	81.4	Confident	89.4	Confident	121 Å²	121	51.2 Å²	51.2	74%	0.742	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-46.5	177.1	-9.5	0	0	0	0	111.8	D478 E482	D478-T480 VanDerWaalsContact C-N 3.31Å; D478-T480 WeakPolarHBondContact OD1-CB 3.27Å; D478-T480 PolarHBondContact OD1-N 2.89Å; D478-T480 PolarHBondContact OD1-OG1 3.01Å; T480-E482 VanDerWaalsContact C-N 3.34Å
481	S	83.1	Confident	88.9	Confident	58 Å²	58	45.6 Å²	45.6	41%	0.406	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-9.6	177.1	58.6	0	0	0	0	114.4	D478 D483 T485	D478-S481 WeakPolarHBondContact CB-OG 3.15Å; D478-S481 VanDerWaalsContact CG-OG 3.29Å; D478-S481 WeakPolarHBondContact OD2-CB 2.96Å; D478-S481 PolarHBondContact OD2-N 3.43Å; D478-S481 PolarHBondContact OD2-OG 3.1Å; S481-D483 PolarHBondContact O-N 3.41Å; S481-D483 VanDerWaalsContact O-N 3.15Å; S481-T485 VanDerWaalsContact OG-CG2 3.31Å; S481-T485 WeakPolarHBondContact OG-CG2 3.29Å
482	E	84.8	Confident	88.9	Confident	106 Å²	106	44.6 Å²	44.6	50%	0.495	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	23.4	-178.2	-43.6	-163.1	145.4	0	0	113.5	R43 F455 D478 T480	R43-E482 IonicContact CZ-OE1 2.82Å; R43-E482 IonicContact NH1-OE1 2.68Å; R43-E482 PolarHBondContact NH1-OE1 3.45Å; R43-E482 VanDerWaalsContact NH1-OE1 3.13Å; R43-E482 IonicContact NH2-OE1 2.71Å; F455-E482 HydrophobicContact CD1-CB 4.2Å; F455-E482 HydrophobicContact CE1-CB 3.56Å; F455-E482 HydrophobicContact CE1-CG 3.49Å; F455-E482 VanDerWaalsContact CE1-CG 3.49Å; F455-E482 HydrophobicContact CE2-CB 4.33Å; F455-E482 HydrophobicContact CZ-CB 3.64Å; F455-E482 HydrophobicContact CZ-CG 3.57Å; D478-E482 PolarHBondContact O-N 2.66Å; T480-E482 VanDerWaalsContact C-N 3.34Å
483	D	90	Very high	88.7	Confident	57 Å²	57	45.6 Å²	45.6	31%	0.305	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	-175	175	-152.9	-7	0	0	0	110.2	K463 D478 S481	K463-D483 WeakPolarHBondContact CD-OD1 3.09Å; K463-D483 IonicContact NZ-OD1 2.65Å; K463-D483 PolarHBondContact NZ-OD1 2.79Å; K463-D483 IonicContact NZ-OD2 3.43Å; K463-D483 PolarHBondContact NZ-OD2 3.06Å; D478-D483 PolarHBondContact N-O 2.72Å; D478-D483 VanDerWaalsContact N-O 3.17Å; S481-D483 PolarHBondContact O-N 3.41Å; S481-D483 VanDerWaalsContact O-N 3.15Å
484	I	91.8	Very high	88.5	Confident	25 Å²	25	45 Å²	45	13%	0.128	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	131.8	176.9	59	158.4	0	0	0	111.2	I460 K463 L464 K467 G476	I460-I484 HydrophobicContact CG2-CG2 3.93Å; K463-I484 HydrophobicContact CB-CD1 3.88Å; K463-I484 HydrophobicContact CB-CG1 4.35Å; K463-I484 HydrophobicContact CB-CG2 4.31Å; L464-I484 HydrophobicContact CD1-CG2 4.43Å; L464-I484 HydrophobicContact CD2-CB 3.95Å; L464-I484 HydrophobicContact CD2-CG2 3.42Å; L464-I484 VanDerWaalsContact CD2-CG2 3.42Å; L464-I484 HydrophobicContact CG-CG2 3.5Å; K467-I484 HydrophobicContact CB-CD1 4.31Å; K467-I484 HydrophobicContact CG-CD1 3.45Å; K467-I484 VanDerWaalsContact CG-CD1 3.45Å; G476-I484 WeakPolarHBondContact O-CA 3.49Å
485	T	91.8	Very high	88.1	Confident	38 Å²	38	43.3 Å²	43.3	23%	0.233	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	166.3	174.6	68.6	0	0	0	0	110.9	F475 G476 D478 S481 N487	F475-T485 CarbonylContact C-O 3.55Å; F475-T485 VanDerWaalsContact CA-O 3.28Å; F475-T485 WeakPolarHBondContact CA-O 3.19Å; G476-T485 PolarHBondContact N-O 3.18Å; G476-T485 PolarHBondContact O-N 3.19Å; G476-T485 VanDerWaalsContact O-N 3.16Å; D478-T485 HydrophobicContact CB-CG2 4Å; D478-T485 WeakPolarHBondContact CB-OG1 3.46Å; S481-T485 VanDerWaalsContact OG-CG2 3.31Å; S481-T485 WeakPolarHBondContact OG-CG2 3.29Å; T485-N487 PolarHBondContact O-N 3.12Å; T485-N487 VanDerWaalsContact O-N 3.16Å; T485-N487 PolarHBondContact OG1-OD1 3.2Å
486	D	92.4	Very high	87.9	Confident	38 Å²	38	41.1 Å²	41.1	20%	0.203	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	102.9	170.1	-171.5	-42.2	0	0	0	108.8	W474 F488 I489 A490	W474-D486 VanDerWaalsContact CB-OD1 3.32Å; W474-D486 WeakPolarHBondContact CB-OD1 3.08Å; D486-F488 PolarHBondContact O-N 2.98Å; D486-F488 WeakPolarHBondContact OD1-CA 3.47Å; D486-F488 VanDerWaalsContact OD1-CB 3.28Å; D486-F488 WeakPolarHBondContact OD1-CB 3.33Å; D486-F488 PolarHBondContact OD1-N 3.29Å; D486-I489 HydrophobicContact CB-CB 4.21Å; D486-I489 HydrophobicContact CB-CD1 3.98Å; D486-I489 HydrophobicContact CB-CG1 4.14Å; D486-I489 PolarHBondContact O-N 3.16Å; D486-I489 PolarHBondContact OD1-N 3.01Å; D486-I489 VanDerWaalsContact OD1-N 3.11Å; D486-A490 WeakPolarHBondContact O-CB 3.49Å; D486-A490 PolarHBondContact O-N 3.15Å
487	N	90.6	Very high	87.7	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.5	-175.7	-81.4	7	0	0	0	112.3	A407 G408 G409 W474 G476 V477 T485 C491 V492	A407-N487 HydrophobicContact CB-CB 3.92Å; G408-N487 PolarHBondContact O-ND2 3.08Å; G409-N487 WeakPolarHBondContact CA-ND2 3.43Å; W474-N487 PolarHBondContact O-N 2.6Å; G476-N487 WeakPolarHBondContact CA-ND2 3.34Å; V477-N487 PolarHBondContact O-ND2 3.09Å; T485-N487 PolarHBondContact O-N 3.12Å; T485-N487 VanDerWaalsContact O-N 3.16Å; T485-N487 PolarHBondContact OG1-OD1 3.2Å; N487-C491 PolarHBondContact O-N 3.17Å; N487-V492 HydrophobicContact CB-CB 4.14Å; N487-V492 PolarHBondContact O-N 3.3Å
488	F	88.1	Confident	87.5	Confident	48 Å²	48	42.5 Å²	42.5	21%	0.211	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-43.1	174.3	-162.5	-91.8	0	0	0	110.6	V141 I405 A407 W474 D486 C491 W493	V141-F488 HydrophobicContact CB-CE2 4.11Å; V141-F488 HydrophobicContact CB-CZ 4.06Å; V141-F488 HydrophobicContact CG1-CZ 4.04Å; V141-F488 HydrophobicContact CG2-CE2 3.83Å; V141-F488 HydrophobicContact CG2-CZ 3.91Å; I405-F488 HydrophobicContact CD1-CE2 3.93Å; I405-F488 HydrophobicContact CD1-CZ 4.18Å; I405-F488 HydrophobicContact CG1-CE2 4.4Å; A407-F488 HydrophobicContact CB-CB 4.16Å; A407-F488 HydrophobicContact CB-CD2 4.44Å; W474-F488 HydrophobicContact CB-CB 3.7Å; W474-F488 HydrophobicContact CD2-CB 4.09Å; W474-F488 HydrophobicContact CD2-CD2 4.12Å; W474-F488 HydrophobicContact CD2-CG 4.34Å; W474-F488 HydrophobicContact CG-CB 3.61Å; W474-F488 HydrophobicContact CG-CD2 4.48Å; W474-F488 HydrophobicContact CG-CG 4.22Å; W474-F488 HydrophobicContact CZ2-CD2 4.41Å; D486-F488 PolarHBondContact O-N 2.98Å; D486-F488 WeakPolarHBondContact OD1-CA 3.47Å; D486-F488 VanDerWaalsContact OD1-CB 3.28Å; D486-F488 WeakPolarHBondContact OD1-CB 3.33Å; D486-F488 PolarHBondContact OD1-N 3.29Å; F488-C491 PolarHBondContact O-N 2.87Å; F488-W493 AromaticContact CD2-NE1 3.88Å; F488-W493 AromaticContact CG-NE1 3.99Å; F488-W493 PolarHBondContact O-NE1 2.82Å
489	I	87.1	Confident	87.7	Confident	133 Å²	133	42 Å²	42	68%	0.682	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-41	174.3	-61.6	175.4	0	0	0	110.7	D486 C491	D486-I489 HydrophobicContact CB-CB 4.21Å; D486-I489 HydrophobicContact CB-CD1 3.98Å; D486-I489 HydrophobicContact CB-CG1 4.14Å; D486-I489 PolarHBondContact O-N 3.16Å; D486-I489 PolarHBondContact OD1-N 3.01Å; D486-I489 VanDerWaalsContact OD1-N 3.11Å; I489-C491 PolarHBondContact O-N 3.37Å; I489-C491 PolarHBondContact O-SG 3.47Å; I489-C491 VanDerWaalsContact O-SG 3.4Å
490	A	84.3	Confident	88.1	Confident	51 Å²	51	42.4 Å²	42.4	42%	0.421	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	1.2	174.8	0	0	0	0	0	113.6	D486 V492	D486-A490 WeakPolarHBondContact O-CB 3.49Å; D486-A490 PolarHBondContact O-N 3.15Å; A490-V492 VanDerWaalsContact C-N 3.25Å; A490-V492 HydrophobicContact CB-CG2 4.29Å; A490-V492 PolarHBondContact O-N 3.25Å
491	C	83.3	Confident	88.7	Confident	33 Å²	33	39.1 Å²	39.1	22%	0.223	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	28.7	176.5	-61.5	0	0	0	0	114.2	K157 N487 F488 I489 W493	K157-C491 HydrophobicContact CD-CB 3.85Å; K157-C491 HydrophobicContact CG-CB 4.34Å; K157-C491 PolarHBondContact NZ-SG 2.82Å; N487-C491 PolarHBondContact O-N 3.17Å; F488-C491 PolarHBondContact O-N 2.87Å; I489-C491 PolarHBondContact O-N 3.37Å; I489-C491 PolarHBondContact O-SG 3.47Å; I489-C491 VanDerWaalsContact O-SG 3.4Å; C491-W493 PolarHBondContact O-N 2.66Å
492	V	86.9	Confident	89.1	Confident	33 Å²	33	36.6 Å²	36.6	20%	0.2	20%	0.198	C	C	.	.			trans	-88.2	82.7	172.8	-176.1	0	0	0	0	107.7	T161 A407 G408 N487 A490	T161-V492 HydrophobicContact CG2-CG1 3.96Å; A407-V492 WeakPolarHBondContact CA-O 3.36Å; G408-V492 PolarHBondContact N-O 2.99Å; N487-V492 HydrophobicContact CB-CB 4.14Å; N487-V492 PolarHBondContact O-N 3.3Å; A490-V492 VanDerWaalsContact C-N 3.25Å; A490-V492 HydrophobicContact CB-CG2 4.29Å; A490-V492 PolarHBondContact O-N 3.25Å
493	W	86.7	Confident	89.6	Confident	34 Å²	34	31.9 Å²	31.9	13%	0.129	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	138.8	-172.4	-59.1	-18.6	0	0	0	111.7	L154 K157 I405 F488 C491	L154-W493 HydrophobicContact CB-CE3 4.46Å; L154-W493 HydrophobicContact CB-CZ3 3.96Å; L154-W493 HydrophobicContact CD1-CE3 3.71Å; L154-W493 HydrophobicContact CD1-CH2 4.36Å; L154-W493 HydrophobicContact CD1-CZ3 3.46Å; L154-W493 VanDerWaalsContact CD1-CZ3 3.46Å; L154-W493 HydrophobicContact CG-CE3 3.77Å; L154-W493 HydrophobicContact CG-CZ3 3.67Å; K157-W493 HydrophobicContact CB-CE3 4.21Å; K157-W493 HydrophobicContact CB-CZ3 4.46Å; K157-W493 HydrophobicContact CD-CE3 4.17Å; K157-W493 HydrophobicContact CD-CH2 4Å; K157-W493 HydrophobicContact CD-CZ3 3.69Å; I405-W493 HydrophobicContact CD1-CB 4.2Å; I405-W493 HydrophobicContact CD1-CD2 3.65Å; I405-W493 HydrophobicContact CD1-CE3 3.84Å; I405-W493 HydrophobicContact CD1-CG 3.84Å; I405-W493 HydrophobicContact CD1-CZ3 4.44Å; F488-W493 AromaticContact CD2-NE1 3.88Å; F488-W493 AromaticContact CG-NE1 3.99Å; F488-W493 PolarHBondContact O-NE1 2.82Å; C491-W493 PolarHBondContact O-N 2.66Å
494	E	86	Confident	89.9	Confident	34 Å²	34	32 Å²	32	16%	0.159	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	140.8	174.2	-65.7	179.9	118.7	0	0	109.6	I405 V406 G408 S496 K499	I405-E494 WeakPolarHBondContact CA-O 3.19Å; V406-E494 WeakPolarHBondContact CG2-O 3.48Å; V406-E494 PolarHBondContact N-O 2.79Å; V406-E494 PolarHBondContact O-N 3.26Å; G408-E494 WeakPolarHBondContact CA-OE2 3.28Å; E494-S496 PolarHBondContact O-N 2.86Å; E494-K499 IonicContact OE1-NZ 3.83Å; E494-K499 WeakPolarHBondContact OE2-CE 3.4Å; E494-K499 IonicContact OE2-NZ 3.34Å; E494-K499 PolarHBondContact OE2-NZ 3.46Å
495	P	88.1	Confident	90.1	Very high	2 Å²	2	32 Å²	32	1%	0.013	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	132.9	172	-23.5	32	0	0	0	111.4	I395 A399 V497 V498	I395-P495 HydrophobicContact CG2-CG 4.06Å; A399-P495 HydrophobicContact CB-CG 4.21Å; P495-V497 PolarHBondContact O-N 3.49Å; P495-V497 VanDerWaalsContact O-N 3.09Å; P495-V498 HydrophobicContact CB-CG2 3.96Å; P495-V498 HydrophobicContact CG-CG2 4.16Å; P495-V498 WeakPolarHBondContact O-CB 3.42Å; P495-V498 PolarHBondContact O-N 3.41Å
496	S	90.9	Very high	90.2	Very high	4 Å²	4	30.2 Å²	30.2	3%	0.028	17%	0.172	C	C	.	.	H	α-helix	trans	-57.3	-31.8	-178.4	72.7	0	0	0	0	112.6	S404 E494 V498 K499 I500	S404-S496 PolarHBondContact O-N 3Å; S404-S496 PolarHBondContact O-OG 3.27Å; S404-S496 PolarHBondContact OG-OG 2.79Å; E494-S496 PolarHBondContact O-N 2.86Å; S496-V498 VanDerWaalsContact C-N 3.27Å; S496-V498 PolarHBondContact O-N 3.01Å; S496-K499 PolarHBondContact O-N 3.01Å; S496-K499 VanDerWaalsContact O-N 3.16Å; S496-I500 WeakPolarHBondContact O-CG1 2.99Å; S496-I500 PolarHBondContact O-N 3.35Å
497	V	88.6	Confident	90.4	Very high	30 Å²	30	28.4 Å²	28.4	18%	0.182	16%	0.162	C	C	.	.	H	α-helix	trans	-62.7	-32.4	178.9	175.5	0	0	0	0	112.4	N402 P495 K499 I500 N501	N402-V497 HydrophobicContact CB-CG2 3.99Å; N402-V497 VanDerWaalsContact ND2-CG2 3.29Å; N402-V497 WeakPolarHBondContact ND2-CG2 3.32Å; P495-V497 PolarHBondContact O-N 3.49Å; P495-V497 VanDerWaalsContact O-N 3.09Å; V497-K499 VanDerWaalsContact C-N 3.32Å; V497-K499 PolarHBondContact O-N 3.15Å; V497-I500 PolarHBondContact O-N 3.23Å; V497-N501 VanDerWaalsContact O-CB 3.29Å; V497-N501 WeakPolarHBondContact O-CB 3.09Å; V497-N501 VanDerWaalsContact O-CG 3.25Å; V497-N501 PolarHBondContact O-N 2.82Å
498	V	89.4	Confident	90.6	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.03	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-47	175.3	178.4	0	0	0	0	109.9	V90 P495 S496 A502	V90-V498 HydrophobicContact CG1-CB 3.81Å; V90-V498 HydrophobicContact CG1-CG1 3.87Å; V90-V498 HydrophobicContact CG1-CG2 3.23Å; P495-V498 HydrophobicContact CB-CG2 3.96Å; P495-V498 HydrophobicContact CG-CG2 4.16Å; P495-V498 WeakPolarHBondContact O-CB 3.42Å; P495-V498 PolarHBondContact O-N 3.41Å; S496-V498 VanDerWaalsContact C-N 3.27Å; S496-V498 PolarHBondContact O-N 3.01Å; V498-A502 VanDerWaalsContact O-CB 3.25Å; V498-A502 WeakPolarHBondContact O-CB 3.36Å; V498-A502 PolarHBondContact O-N 3.45Å
499	K	91.9	Very high	90.9	Very high	16 Å²	16	29.9 Å²	29.9	7%	0.07	17%	0.17	C	C	.	.	H	α-helix	trans	-70.4	-41.1	-178.9	-61.2	-63.9	-179.1	179.5	0	112.7	I136 V406 I412 E413 E494 S496 V497 A502 L503	I136-K499 HydrophobicContact CD1-CB 4.03Å; V406-K499 HydrophobicContact CG2-CG 4.08Å; I412-K499 HydrophobicContact CG2-CD 3.84Å; I412-K499 HydrophobicContact CG2-CG 4.04Å; E413-K499 WeakPolarHBondContact OE1-CE 3.29Å; E413-K499 IonicContact OE1-NZ 3.2Å; E413-K499 PolarHBondContact OE1-NZ 3.3Å; E494-K499 IonicContact OE1-NZ 3.83Å; E494-K499 WeakPolarHBondContact OE2-CE 3.4Å; E494-K499 IonicContact OE2-NZ 3.34Å; E494-K499 PolarHBondContact OE2-NZ 3.46Å; S496-K499 PolarHBondContact O-N 3.01Å; S496-K499 VanDerWaalsContact O-N 3.16Å; V497-K499 VanDerWaalsContact C-N 3.32Å; V497-K499 PolarHBondContact O-N 3.15Å; K499-A502 PolarHBondContact O-N 3.11Å; K499-L503 WeakPolarHBondContact O-CB 3.21Å; K499-L503 WeakPolarHBondContact O-CG 3.47Å; K499-L503 PolarHBondContact O-N 2.93Å
500	I	93.3	Very high	91.2	Very high	24 Å²	24	23.6 Å²	23.6	12%	0.123	14%	0.137	C	C	.	.	H	α-helix	trans	-60.4	-51	176.2	-67.9	167.5	0	0	0	109.7	V133 I136 K137 S496 V497 A502 L503 T504	V133-I500 HydrophobicContact CG1-CG1 4.33Å; V133-I500 HydrophobicContact CG1-CG2 3.83Å; V133-I500 HydrophobicContact CG2-CG2 4.19Å; I136-I500 HydrophobicContact CB-CG1 4.27Å; I136-I500 HydrophobicContact CD1-CG1 4.21Å; I136-I500 HydrophobicContact CG2-CD1 4.14Å; I136-I500 HydrophobicContact CG2-CG1 3.89Å; K137-I500 HydrophobicContact CG-CD1 3.96Å; S496-I500 WeakPolarHBondContact O-CG1 2.99Å; S496-I500 PolarHBondContact O-N 3.35Å; V497-I500 PolarHBondContact O-N 3.23Å; I500-A502 PolarHBondContact O-N 3.09Å; I500-L503 PolarHBondContact O-N 3.39Å; I500-T504 WeakPolarHBondContact O-CB 3.3Å; I500-T504 PolarHBondContact O-N 2.74Å; I500-T504 PolarHBondContact O-OG1 3.46Å; I500-T504 VanDerWaalsContact O-OG1 3.1Å
501	N	92.7	Very high	91.7	Very high	51 Å²	51	21.3 Å²	21.3	27%	0.273	12%	0.118	S	C	.	.	H	α-helix	trans	-62.6	-44.9	179.7	-72.5	-3.2	0	0	0	111.6	V90 V497 L503 T504 A505	V90-N501 HydrophobicContact CG2-CB 4.06Å; V90-N501 VanDerWaalsContact CG2-ND2 3.28Å; V90-N501 WeakPolarHBondContact CG2-ND2 3.33Å; V497-N501 VanDerWaalsContact O-CB 3.29Å; V497-N501 WeakPolarHBondContact O-CB 3.09Å; V497-N501 VanDerWaalsContact O-CG 3.25Å; V497-N501 PolarHBondContact O-N 2.82Å; N501-L503 PolarHBondContact O-N 3.17Å; N501-T504 PolarHBondContact O-N 3.09Å; N501-A505 WeakPolarHBondContact O-CB 3.42Å; N501-A505 PolarHBondContact O-N 2.93Å
502	A	93.3	Very high	92.3	Very high	5 Å²	5	24 Å²	24	4%	0.041	13%	0.13	C	C	.	.	H	α-helix	trans	-60.1	-46	178.9	0	0	0	0	0	112.1	V97 V498 K499 I500 A506	V97-A502 HydrophobicContact CB-CB 4.49Å; V498-A502 VanDerWaalsContact O-CB 3.25Å; V498-A502 WeakPolarHBondContact O-CB 3.36Å; V498-A502 PolarHBondContact O-N 3.45Å; K499-A502 PolarHBondContact O-N 3.11Å; I500-A502 PolarHBondContact O-N 3.09Å; A502-A506 WeakPolarHBondContact O-CB 3.43Å; A502-A506 PolarHBondContact O-N 2.76Å
503	L	95.1	Very high	92.6	Very high	7 Å²	7	22.7 Å²	22.7	4%	0.037	12%	0.122	C	C	.	.	H	α-helix	trans	-67.6	-43.5	179.3	-72.4	172.5	0	0	0	112.3	L100 F104 A132 I136 L416 L442 K499 I500 N501 S507	L100-L503 HydrophobicContact CD1-CD2 4.18Å; F104-L503 HydrophobicContact CZ-CD2 4.4Å; A132-L503 HydrophobicContact CB-CD1 4.35Å; I136-L503 HydrophobicContact CD1-CD1 3.55Å; L416-L503 HydrophobicContact CD1-CD1 3.77Å; L442-L503 HydrophobicContact CD2-CD2 3.5Å; L442-L503 VanDerWaalsContact CD2-CD2 3.5Å; K499-L503 WeakPolarHBondContact O-CB 3.21Å; K499-L503 WeakPolarHBondContact O-CG 3.47Å; K499-L503 PolarHBondContact O-N 2.93Å; I500-L503 PolarHBondContact O-N 3.39Å; N501-L503 PolarHBondContact O-N 3.17Å; L503-S507 VanDerWaalsContact O-CB 3.25Å; L503-S507 WeakPolarHBondContact O-CB 3.24Å; L503-S507 PolarHBondContact O-N 3.1Å; L503-S507 PolarHBondContact O-OG 3.45Å
504	T	95.4	Very high	92.9	Very high	59 Å²	59	21.2 Å²	21.2	36%	0.362	12%	0.117	S	C	.	.	H	α-helix	trans	-63.1	-49.1	177.9	-62.4	0	0	0	0	110.9	I500 N501 S507 E508	I500-T504 WeakPolarHBondContact O-CB 3.3Å; I500-T504 PolarHBondContact O-N 2.74Å; I500-T504 PolarHBondContact O-OG1 3.46Å; I500-T504 VanDerWaalsContact O-OG1 3.1Å; N501-T504 PolarHBondContact O-N 3.09Å; T504-S507 PolarHBondContact O-N 3.32Å; T504-E508 PolarHBondContact O-N 3.18Å
505	A	95.1	Very high	93.2	Very high	26 Å²	26	22.6 Å²	22.6	22%	0.215	13%	0.13	C	C	.	.	H	α-helix	trans	-63.7	-45	179.9	0	0	0	0	0	112	I82 V97 N501 S507 E508 A509	I82-A505 HydrophobicContact CG2-CB 4.05Å; V97-A505 HydrophobicContact CG2-CB 3.89Å; N501-A505 WeakPolarHBondContact O-CB 3.42Å; N501-A505 PolarHBondContact O-N 2.93Å; A505-S507 VanDerWaalsContact C-N 3.33Å; A505-S507 PolarHBondContact O-N 3.29Å; A505-E508 PolarHBondContact O-N 3.05Å; A505-A509 WeakPolarHBondContact O-CB 3.34Å; A505-A509 PolarHBondContact O-N 3.2Å
506	A	95.6	Very high	93.3	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.3	-38.2	176.6	0	0	0	0	0	112.7	V97 L100 A101 F104 A502 A509 A510	V97-A506 HydrophobicContact CG2-CB 3.97Å; L100-A506 HydrophobicContact CB-CB 3.83Å; A101-A506 HydrophobicContact CB-CB 4.07Å; F104-A506 HydrophobicContact CD2-CB 4.23Å; F104-A506 HydrophobicContact CE2-CB 3.87Å; A502-A506 WeakPolarHBondContact O-CB 3.43Å; A502-A506 PolarHBondContact O-N 2.76Å; A506-A509 VanDerWaalsContact O-CB 3.29Å; A506-A509 WeakPolarHBondContact O-CB 3.45Å; A506-A510 PolarHBondContact O-N 2.87Å; A506-A510 VanDerWaalsContact O-N 3.15Å
507	S	95.5	Very high	93.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.2	-43	179.6	-55.3	0	0	0	0	111.5	T129 Y438 L503 T504 A505 A509 A510 C511	T129-S507 WeakPolarHBondContact CG2-OG 3.43Å; T129-S507 WeakPolarHBondContact OG1-CB 3.3Å; T129-S507 PolarHBondContact OG1-OG 2.93Å; Y438-S507 PolarHBondContact OH-OG 3.44Å; L503-S507 VanDerWaalsContact O-CB 3.25Å; L503-S507 WeakPolarHBondContact O-CB 3.24Å; L503-S507 PolarHBondContact O-N 3.1Å; L503-S507 PolarHBondContact O-OG 3.45Å; T504-S507 PolarHBondContact O-N 3.32Å; A505-S507 VanDerWaalsContact C-N 3.33Å; A505-S507 PolarHBondContact O-N 3.29Å; S507-A509 VanDerWaalsContact C-N 3.33Å; S507-A510 PolarHBondContact O-N 2.88Å; S507-C511 WeakPolarHBondContact O-CB 3.36Å; S507-C511 PolarHBondContact O-N 3.18Å; S507-C511 PolarHBondContact O-SG 2.82Å
508	E	94.4	Very high	92.9	Very high	80 Å²	80	31.7 Å²	31.7	37%	0.374	18%	0.177	S	C	.	.	H	α-helix	trans	-67.9	-33.9	176	-71.3	-60.2	140.6	0	0	111.6	R126 T504 A505 A510 C511 L512	R126-E508 IonicContact CZ-OE1 3.08Å; R126-E508 IonicContact CZ-OE2 2.84Å; R126-E508 IonicContact NE-OE1 2.71Å; R126-E508 PolarHBondContact NE-OE1 2.99Å; R126-E508 VanDerWaalsContact NE-OE1 3.16Å; R126-E508 IonicContact NE-OE2 2.77Å; R126-E508 IonicContact NH2-OE1 3.02Å; R126-E508 IonicContact NH2-OE2 3.67Å; R126-E508 PolarHBondContact NH2-OE2 3.2Å; T504-E508 PolarHBondContact O-N 3.18Å; A505-E508 PolarHBondContact O-N 3.05Å; E508-A510 PolarHBondContact O-N 3.46Å; E508-C511 PolarHBondContact O-N 3.5Å; E508-L512 VanDerWaalsContact O-CB 3.3Å; E508-L512 WeakPolarHBondContact O-CB 3.22Å; E508-L512 PolarHBondContact O-N 3.37Å
509	A	94.5	Very high	92.7	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-52.4	-55.5	169	0	0	0	0	0	111.5	L79 I82 A101 A505 A506 S507 C511 L512 I513	L79-A509 HydrophobicContact CD2-CB 4.4Å; I82-A509 VanDerWaalsContact CD1-CA 3.48Å; I82-A509 HydrophobicContact CD1-CB 3.07Å; I82-A509 HydrophobicContact CG1-CB 4.49Å; A101-A509 HydrophobicContact CB-CB 3.81Å; A505-A509 WeakPolarHBondContact O-CB 3.34Å; A505-A509 PolarHBondContact O-N 3.2Å; A506-A509 VanDerWaalsContact O-CB 3.29Å; A506-A509 WeakPolarHBondContact O-CB 3.45Å; S507-A509 VanDerWaalsContact C-N 3.33Å; A509-C511 VanDerWaalsContact C-N 3.33Å; A509-C511 PolarHBondContact O-N 3.15Å; A509-L512 PolarHBondContact O-N 3Å; A509-I513 WeakPolarHBondContact O-CD1 3.27Å; A509-I513 WeakPolarHBondContact O-CG1 3.26Å; A509-I513 PolarHBondContact O-N 2.93Å
510	A	95.1	Very high	92.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-41.9	-176.4	0	0	0	0	0	110.6	F104 L105 A506 S507 E508 I513 L514	F104-A510 HydrophobicContact CB-CB 3.99Å; L105-A510 HydrophobicContact CD2-CB 3.94Å; L105-A510 HydrophobicContact CG-CB 4.02Å; A506-A510 PolarHBondContact O-N 2.87Å; A506-A510 VanDerWaalsContact O-N 3.15Å; S507-A510 PolarHBondContact O-N 2.88Å; E508-A510 PolarHBondContact O-N 3.46Å; A510-I513 PolarHBondContact O-N 3.25Å; A510-L514 WeakPolarHBondContact O-CB 3.21Å; A510-L514 WeakPolarHBondContact O-CD1 3.3Å; A510-L514 VanDerWaalsContact O-CG 3.22Å; A510-L514 WeakPolarHBondContact O-CG 3.38Å; A510-L514 PolarHBondContact O-N 3.17Å
511	C	94.6	Very high	91.5	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.02	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-41.6	176.7	-66	0	0	0	0	112.4	I122 S507 E508 A509 L514 S515	I122-C511 HydrophobicContact CG1-CB 4.21Å; I122-C511 HydrophobicContact CG2-CB 4.03Å; S507-C511 WeakPolarHBondContact O-CB 3.36Å; S507-C511 PolarHBondContact O-N 3.18Å; S507-C511 PolarHBondContact O-SG 2.82Å; E508-C511 PolarHBondContact O-N 3.5Å; A509-C511 VanDerWaalsContact C-N 3.33Å; A509-C511 PolarHBondContact O-N 3.15Å; C511-L514 PolarHBondContact O-N 3.47Å; C511-S515 WeakPolarHBondContact O-CB 3.43Å; C511-S515 PolarHBondContact O-N 3.19Å
512	L	94.6	Very high	90.8	Very high	91 Å²	91	44.1 Å²	44.1	48%	0.476	24%	0.239	S	C	.	.	H	α-helix	trans	-61.6	-49.2	177.1	179.2	64.8	0	0	0	110.6	T78 E508 A509 L514 S515	T78-L512 HydrophobicContact CG2-CD2 4.16Å; E508-L512 VanDerWaalsContact O-CB 3.3Å; E508-L512 WeakPolarHBondContact O-CB 3.22Å; E508-L512 PolarHBondContact O-N 3.37Å; A509-L512 PolarHBondContact O-N 3Å; L512-L514 VanDerWaalsContact C-N 3.3Å; L512-L514 PolarHBondContact O-N 3.5Å; L512-S515 PolarHBondContact O-N 3.32Å; L512-S515 VanDerWaalsContact O-N 3.09Å; L512-S515 PolarHBondContact O-OG 3.3Å
513	I	93.7	Very high	89.8	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-39.2	-179.7	-68.3	160.9	0	0	0	111.5	N25 C29 A75 T78 L79 L105 A509 A510 S515 V516	N25-I513 HydrophobicContact CB-CG2 3.79Å; C29-I513 VanDerWaalsContact SG-CD1 3.52Å; A75-I513 HydrophobicContact CB-CG2 4.36Å; T78-I513 WeakPolarHBondContact OG1-CD1 3.49Å; L79-I513 HydrophobicContact CD2-CD1 4.41Å; L105-I513 HydrophobicContact CD1-CB 4.24Å; L105-I513 HydrophobicContact CD1-CD1 3.64Å; L105-I513 HydrophobicContact CD1-CG2 4.03Å; L105-I513 HydrophobicContact CD2-CB 4.32Å; L105-I513 HydrophobicContact CD2-CG2 4.22Å; A509-I513 WeakPolarHBondContact O-CD1 3.27Å; A509-I513 WeakPolarHBondContact O-CG1 3.26Å; A509-I513 PolarHBondContact O-N 2.93Å; A510-I513 PolarHBondContact O-N 3.25Å; I513-S515 VanDerWaalsContact C-N 3.29Å; I513-S515 PolarHBondContact O-N 3.02Å; I513-V516 PolarHBondContact O-N 3.38Å
514	L	92.8	Very high	88.2	Confident	3 Å²	3	58 Å²	58	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-72	-21.3	177.1	-71	167.5	0	0	0	113.9	L22 I26 L105 L108 V112 P118 I121 I122 A510 C511 L512 V516	L22-L514 WeakPolarHBondContact CD2-O 3.48Å; I26-L514 HydrophobicContact CD1-CD2 4.27Å; L105-L514 HydrophobicContact CD2-CD1 4.06Å; L105-L514 HydrophobicContact CD2-CD2 4.09Å; L105-L514 HydrophobicContact CD2-CG 3.72Å; L108-L514 HydrophobicContact CD1-CD1 3.54Å; V112-L514 HydrophobicContact CG2-CD2 4.26Å; P118-L514 WeakPolarHBondContact CB-O 3.26Å; I121-L514 HydrophobicContact CG2-CD1 4.08Å; I122-L514 HydrophobicContact CD1-CB 4.3Å; I122-L514 HydrophobicContact CG1-CB 4.31Å; A510-L514 WeakPolarHBondContact O-CB 3.21Å; A510-L514 WeakPolarHBondContact O-CD1 3.3Å; A510-L514 VanDerWaalsContact O-CG 3.22Å; A510-L514 WeakPolarHBondContact O-CG 3.38Å; A510-L514 PolarHBondContact O-N 3.17Å; C511-L514 PolarHBondContact O-N 3.47Å; L512-L514 VanDerWaalsContact C-N 3.3Å; L512-L514 PolarHBondContact O-N 3.5Å; L514-V516 VanDerWaalsContact C-N 3.3Å
515	S	92.4	Very high	86.4	Confident	64 Å²	64	58.8 Å²	58.8	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-80.4	-11.5	177.7	71.8	0	0	0	0	113.4	C511 L512 I513	C511-S515 WeakPolarHBondContact O-CB 3.43Å; C511-S515 PolarHBondContact O-N 3.19Å; L512-S515 PolarHBondContact O-N 3.32Å; L512-S515 VanDerWaalsContact O-N 3.09Å; L512-S515 PolarHBondContact O-OG 3.3Å; I513-S515 VanDerWaalsContact C-N 3.29Å; I513-S515 PolarHBondContact O-N 3.02Å
516	V	90.6	Very high	84.2	Confident	51 Å²	51	63.5 Å²	63.5	31%	0.309	34%	0.337	S	S	.	.			trans	-93.8	99.3	179.5	-179.2	0	0	0	0	109.7	L22 N25 I513 L514 E518	L22-V516 VanDerWaalsContact CD2-O 3.24Å; L22-V516 WeakPolarHBondContact CD2-O 3.47Å; N25-V516 PolarHBondContact ND2-O 3.42Å; I513-V516 PolarHBondContact O-N 3.38Å; L514-V516 VanDerWaalsContact C-N 3.3Å; V516-E518 WeakPolarHBondContact CG1-O 3.24Å
517	D	86.1	Confident	81.9	Confident	105 Å²	105	68.8 Å²	68.8	56%	0.561	37%	0.368	S	S	*	.			trans	-92	-19.6	178.6	64.9	-26	0	0	0	113.8	Q17 G18	Q17-D517 CarbonylContact C-O 3.53Å; Q17-D517 WeakPolarHBondContact CA-O 3.43Å; G18-D517 PolarHBondContact N-O 3.36Å
518	E	85.8	Confident	79.4	Confident	70 Å²	70	77.3 Å²	77.3	33%	0.327	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	138.7	175.5	-177.7	171.2	-164.1	0	0	111.3	S16 Q17 V516 I520	S16-E518 WeakPolarHBondContact O-CA 3.17Å; Q17-E518 HydrophobicContact CG-CB 4.19Å; Q17-E518 HydrophobicContact CG-CG 3.71Å; Q17-E518 VanDerWaalsContact NE2-CD 3.33Å; Q17-E518 PolarHBondContact NE2-OE1 3.39Å; V516-E518 WeakPolarHBondContact CG1-O 3.24Å; E518-I520 HydrophobicContact CG-CD1 4.42Å; E518-I520 HydrophobicContact CG-CG1 3.86Å
519	T	84	Confident	76.8	Confident	27 Å²	27	75.9 Å²	75.9	17%	0.166	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	116.6	169.9	-64.9	0	0	0	0	110	S16 Q21 P74	S16-T519 PolarHBondContact O-N 3.27Å; Q21-T519 PolarHBondContact NE2-OG1 3.13Å; P74-T519 HydrophobicContact CG-CG2 4.39Å
520	I	82.9	Confident	74.2	Confident	97 Å²	97	81.8 Å²	81.8	50%	0.497	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	114.1	179.8	-53.2	176.8	0	0	0	108.2	T13 E518	T13-I520 HydrophobicContact CG2-CG2 3.87Å; E518-I520 HydrophobicContact CG-CD1 4.42Å; E518-I520 HydrophobicContact CG-CG1 3.86Å
521	K	78.3	Confident	71.6	Confident	112 Å²	112	87.9 Å²	87.9	49%	0.487	50%	0.498	S	S	.	.			trans	-96.9	116.1	171	-71	-178.6	-176.2	173.2	0	109	T13 P523	T13-K521 WeakPolarHBondContact CG2-O 3.31Å; K521-P523 WeakPolarHBondContact O-CD 3.34Å
522	N	77.8	Confident	68.9	Low	121 Å²	121	91.3 Å²	91.3	65%	0.647	54%	0.535	S	S	*	.			trans	-94.2	98.3	174.8	-163.6	1.1	0	0	0	109
523	P	70.9	Confident	66.1	Low	60 Å²	60	91.1 Å²	91.1	39%	0.39	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-62	142	174.4	27	-34.2	0	0	0	109.4	K521 S525	K521-P523 WeakPolarHBondContact O-CD 3.34Å; P523-S525 PolarHBondContact O-N 3.27Å; P523-S525 VanDerWaalsContact O-N 3.13Å
524	R	62.6	Low	63.3	Low	245 Å²	245	95.7 Å²	95.7	93%	0.925	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-57.2	124.1	169.8	-79.8	-176	178.1	171.1	-0.2	107.6	S526	R524-S526 PolarHBondContact O-N 3.38Å; R524-S526 VanDerWaalsContact O-N 3.16Å
525	S	56.7	Low	60.6	Low	74 Å²	74	99.1 Å²	99.1	52%	0.517	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-57.9	120.4	174.5	48.1	0	0	0	0	108.8	P523 V527	P523-S525 PolarHBondContact O-N 3.27Å; P523-S525 VanDerWaalsContact O-N 3.13Å; S525-V527 PolarHBondContact O-N 3.22Å
526	S	49.1	Very low	57.9	Low	126 Å²	126	108.1 Å²	108.1	88%	0.881	65%	0.653	S	S	*	*			trans	-70.3	63.2	171.4	54.5	0	0	0	0	110.5	R524	R524-S526 PolarHBondContact O-N 3.38Å; R524-S526 VanDerWaalsContact O-N 3.16Å
527	V	46.7	Very low	55.2	Low	110 Å²	110	109.3 Å²	109.3	67%	0.667	68%	0.676	S	S	*	*			trans	-129.8	57.3	177.8	-160.7	0	0	0	0	108.6	S525 G529	S525-V527 PolarHBondContact O-N 3.22Å; V527-G529 VanDerWaalsContact C-N 3.29Å
528	D	43.3	Very low	52.8	Low	180 Å²	180	116.4 Å²	116.4	96%	0.963	70%	0.695	S	S	*	*			trans	-97.5	65.9	150.7	-85.8	-35.2	0	0	0	107.4
529	G	39.8	Very low	50.3	Low	49 Å²	49	116.8 Å²	116.8	51%	0.505	72%	0.718	S	S	.	*	P	Polyproline II helix	trans	-100.6	131.5	158.6	0	0	0	0	0	107.3	V527	V527-G529 VanDerWaalsContact C-N 3.29Å
530	P	39.9	Very low	48	Very low	125 Å²	125	127.5 Å²	127.5	81%	0.812	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-58	133	-178	-16.3	27	0	0	0	109.7	G532	P530-G532 PolarHBondContact O-N 3.45Å; P530-G532 VanDerWaalsContact O-N 3.1Å
531	P	41.9	Very low	45.7	Very low	128 Å²	128	126.3 Å²	126.3	83%	0.831	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-63	118.9	179.7	22	-29.2	0	0	0	109.7	G533	P531-G533 PolarHBondContact O-N 3.07Å
532	G	36.8	Very low	43.6	Very low	76 Å²	76	132.5 Å²	132.5	78%	0.784	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-53.9	118	171	0	0	0	0	0	110.4	P530 A534	P530-G532 PolarHBondContact O-N 3.45Å; P530-G532 VanDerWaalsContact O-N 3.1Å; G532-A534 PolarHBondContact O-N 3.15Å
533	G	35.7	Very low	42.2	Very low	86 Å²	86	130.8 Å²	130.8	89%	0.887	78%	0.783	S	S	*	*			trans	-66.6	96.3	171.3	0	0	0	0	0	110.3	P531	P531-G533 PolarHBondContact O-N 3.07Å
534	A	36	Very low	40.5	Very low	101 Å²	101	136.2 Å²	136.2	84%	0.835	80%	0.803	S	S	*	*			trans	-75.9	125.7	165.3	0	0	0	0	0	109.3	G532	G532-A534 PolarHBondContact O-N 3.15Å
535	G	34.5	Very low	39.4	Very low	75 Å²	75	128.2 Å²	128.2	77%	0.773	79%	0.789	S	S	*	*			trans	-54.2	151.6	-168.7	0	0	0	0	0	117.6
536	R	35.7	Very low	38.5	Very low	252 Å²	252	137.3 Å²	137.3	95%	0.951	82%	0.823	S	S	*	*			trans	-129.8	110.7	142.7	-91.7	-173.2	168.9	-178	-2.5	108.9
537	G	33.8	Very low	37.9	Very low	77 Å²	77	137.9 Å²	137.9	79%	0.794	82%	0.82	S	S	*	*			trans	-68.9	148.5	177.1	0	0	0	0	0	113.1
538	R	36	Very low	37.5	Very low	253 Å²	253	139.4 Å²	139.4	96%	0.955	83%	0.828	S	S	*	*			trans	-141.5	110.9	150.8	-107.1	-176.2	170.7	-178	-2.2	107.9
539	G	34.2	Very low	37.2	Very low	79 Å²	79	137.1 Å²	137.1	81%	0.814	82%	0.821	S	S	*	*			trans	-76	150.2	177.6	0	0	0	0	0	113.1
540	R	36.6	Very low	37	Very low	251 Å²	251	142.3 Å²	142.3	95%	0.947	84%	0.839	S	S	*	*			trans	-162.6	101.4	147.5	-98.1	179.4	171.7	-174.4	-4.3	103.4
541	G	32.7	Very low	36.8	Very low	73 Å²	73	143.4 Å²	143.4	75%	0.753	84%	0.841	S	S	*	*				82.9	82.8	77.7	0	0	0	0	0	109.5
542	R	35.8	Very low	36.5	Very low	241 Å²	241	144.4 Å²	144.4	91%	0.909	84%	0.842	S	S	*	*				94.8	161.2	107.6	-104.3	-165.4	169.7	-175.2	-0.4	112.6
543	P	48.1	Very low	36.5	Very low	85 Å²	85	149.3 Å²	149.3	55%	0.552	85%	0.846	S	S	*	*				-140	-175.6	-54.4	31.1	-8.8	0	0	0	114.1
544	H	34.1	Very low	36.5	Very low	174 Å²	174	154.2 Å²	154.2	81%	0.806	84%	0.843	S	S	*	*			trans	83.1	111.6	157.6	-67.8	-54.1	0	0	0	117.4
545	A	39.9	Very low	36.6	Very low	77 Å²	77	158.6 Å²	158.6	64%	0.636	84%	0.843	S	S	*	*				86.8	101.6	70.8	0	0	0	0	0	111.6
546	H	37.5	Very low	36.8	Very low	266 Å²	266	166.2 Å²	166.2	100%	1.231	85%	0.85	S	S	*	*				-165.1	0	116.5	-101.8	-64.4	0	0	0	109.8

Retrieved 546 of 546 residues in 103.7 ms (Link to these results)

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