A0A3Q0KM28_SCHMA Loading...

Serine/threonine-protein phosphatase PGAM5, mitochondrial

AlphaFold DB , UniProt , Accession A0A3Q0KM28, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 392 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	28.1	Very low	28.2	Very low	192 Å²	192	163.8 Å²	163.8	95%	0.946	74%	0.74	S	S	*	*				0	96.5	0	-154.8	170.2	-174.1	0	0	106.2	Y3	M1-Y3 HydrophobicContact CB-CD2 4.41Å; M1-Y3 HydrophobicContact CB-CE2 4.07Å; M1-Y3 HydrophobicContact CE-CE2 4.45Å; M1-Y3 WeakPolarHBondContact CE-OH 3.43Å; M1-Y3 HydrophobicContact CG-CD2 4.3Å; M1-Y3 HydrophobicContact CG-CE2 3.72Å; M1-Y3 PolarHBondContact O-N 3.32Å; M1-Y3 HydrophobicContact SD-CE2 3.72Å; M1-Y3 PolarHBondContact SD-OH 3.48Å
2	W	22.4	Very low	29.2	Very low	229 Å²	229	157 Å²	157	87%	0.867	71%	0.708	S	S	*	*			trans	-81.1	101.2	-177.1	-71.5	74.2	0	0	0	108.1	F4	W2-F4 HydrophobicContact CB-CD2 4.31Å; W2-F4 HydrophobicContact CB-CE2 4.14Å; W2-F4 HydrophobicContact CE3-CE2 4.2Å; W2-F4 HydrophobicContact CE3-CZ 4.29Å; W2-F4 PolarHBondContact O-N 2.87Å
3	Y	22.9	Very low	30.4	Very low	176 Å²	176	150 Å²	150	69%	0.69	69%	0.685	S	S	*	*			trans	-81.1	92.6	174.3	-79.1	-89.2	0	0	0	108.8	M1 R5	M1-Y3 HydrophobicContact CB-CD2 4.41Å; M1-Y3 HydrophobicContact CB-CE2 4.07Å; M1-Y3 HydrophobicContact CE-CE2 4.45Å; M1-Y3 WeakPolarHBondContact CE-OH 3.43Å; M1-Y3 HydrophobicContact CG-CD2 4.3Å; M1-Y3 HydrophobicContact CG-CE2 3.72Å; M1-Y3 PolarHBondContact O-N 3.32Å; M1-Y3 HydrophobicContact SD-CE2 3.72Å; M1-Y3 PolarHBondContact SD-OH 3.48Å; Y3-R5 VanDerWaalsContact C-N 3.34Å; Y3-R5 PolarHBondContact O-N 3.16Å; Y3-R5 VanDerWaalsContact O-N 3.1Å
4	F	24.9	Very low	31.6	Very low	164 Å²	164	141 Å²	141	72%	0.719	65%	0.65	S	S	*	*			trans	-78	89.3	165.2	-79	-83.3	0	0	0	108.6	W2 T6	W2-F4 HydrophobicContact CB-CD2 4.31Å; W2-F4 HydrophobicContact CB-CE2 4.14Å; W2-F4 HydrophobicContact CE3-CE2 4.2Å; W2-F4 HydrophobicContact CE3-CZ 4.29Å; W2-F4 PolarHBondContact O-N 2.87Å; F4-T6 PolarHBondContact O-N 2.93Å; F4-T6 VanDerWaalsContact O-N 3.14Å
5	R	23.6	Very low	32.3	Very low	222 Å²	222	136.8 Å²	136.8	84%	0.838	65%	0.65	S	S	*	*			trans	-73.6	92	164.1	-107.6	-176.9	168.6	-175.1	-2.4	107.6	Y3 F7	Y3-R5 VanDerWaalsContact C-N 3.34Å; Y3-R5 PolarHBondContact O-N 3.16Å; Y3-R5 VanDerWaalsContact O-N 3.1Å; R5-F7 PolarHBondContact O-N 2.96Å
6	T	30.5	Very low	32.6	Very low	100 Å²	100	131.9 Å²	131.9	61%	0.613	64%	0.635	S	S	*	*			trans	-83.9	91.9	172.8	50.1	0	0	0	0	109.4	F4	F4-T6 PolarHBondContact O-N 2.93Å; F4-T6 VanDerWaalsContact O-N 3.14Å
7	F	28.7	Very low	33.3	Very low	190 Å²	190	127.4 Å²	127.4	83%	0.833	62%	0.617	S	S	*	*			trans	-83.3	121.1	154.8	-88.6	-89.9	0	0	0	107.6	R5	R5-F7 PolarHBondContact O-N 2.96Å
8	G	28.2	Very low	33.7	Very low	54 Å²	54	124 Å²	124	56%	0.557	60%	0.597	S	S	*	*	S	Bend	trans	107.1	126.4	174.5	0	0	0	0	0	113.6	K10	G8-K10 PolarHBondContact O-N 2.95Å
9	F	32	Very low	33.8	Very low	177 Å²	177	122.7 Å²	122.7	78%	0.776	60%	0.601	S	S	*	*			trans	-50.4	94.4	174.5	-67.7	-90.5	0	0	0	111.3
10	K	33.4	Very low	33.9	Very low	159 Å²	159	121.9 Å²	121.9	69%	0.691	61%	0.608	S	S	*	*			trans	-100.8	110	165.4	-76.4	-170.5	176.6	-176.8	0	108	G8 F12	G8-K10 PolarHBondContact O-N 2.95Å; K10-F12 HydrophobicContact CB-CE2 4.4Å; K10-F12 VanDerWaalsContact O-CD2 3.29Å; K10-F12 WeakPolarHBondContact O-CD2 3.37Å; K10-F12 PolarHBondContact O-N 3.26Å; K10-F12 VanDerWaalsContact O-N 3.11Å
11	F	35.8	Very low	34.3	Very low	139 Å²	139	120.2 Å²	120.2	61%	0.61	61%	0.605	S	S	*	*			trans	-60.9	109.1	172.1	-64.5	-85.6	0	0	0	108.9	T13 T375	F11-T13 PolarHBondContact O-N 2.97Å; F11-T375 HydrophobicContact CD1-CG2 4.37Å
12	F	39.8	Very low	34.9	Very low	82 Å²	82	114 Å²	114	36%	0.36	57%	0.573	S	S	.	*	B	Isolated β-bridge	trans	-87.7	98.6	168.9	-69.8	-81.7	0	0	0	107.7	K10 V17	K10-F12 HydrophobicContact CB-CE2 4.4Å; K10-F12 VanDerWaalsContact O-CD2 3.29Å; K10-F12 WeakPolarHBondContact O-CD2 3.37Å; K10-F12 PolarHBondContact O-N 3.26Å; K10-F12 VanDerWaalsContact O-N 3.11Å; F12-V17 HydrophobicContact CB-CG2 4.23Å; F12-V17 HydrophobicContact CD1-CG2 4.11Å
13	T	44.5	Very low	35.9	Very low	66 Å²	66	108.6 Å²	108.6	41%	0.405	57%	0.57	S	S	.	*			trans	-74.5	151.1	156	58.3	0	0	0	0	108	F11 A15 S16	F11-T13 PolarHBondContact O-N 2.97Å; T13-A15 PolarHBondContact O-N 3.44Å; T13-S16 PolarHBondContact O-N 2.8Å
14	A	47.8	Very low	36.8	Very low	24 Å²	24	107.8 Å²	107.8	20%	0.198	57%	0.574	C	S	.	*	H	α-helix	trans	-50.4	-30.7	-179.9	0	0	0	0	0	112.9	S16 V17 W33 L323	A14-S16 VanDerWaalsContact C-N 3.33Å; A14-S16 PolarHBondContact O-N 3.34Å; A14-V17 PolarHBondContact O-N 3.2Å; A14-W33 HydrophobicContact CB-CE3 4.31Å; A14-W33 HydrophobicContact CB-CZ3 3.85Å; A14-L323 WeakPolarHBondContact CB-O 3.28Å
15	A	41.4	Very low	37.6	Very low	78 Å²	78	104.1 Å²	104.1	65%	0.645	58%	0.583	S	S	*	*	H	α-helix	trans	-59.1	-37.5	174.2	0	0	0	0	0	113.7	T13	T13-A15 PolarHBondContact O-N 3.44Å
16	S	38.1	Very low	38.8	Very low	59 Å²	59	96.4 Å²	96.4	41%	0.413	56%	0.563	S	S	.	*	H	α-helix	trans	-75.4	-32.6	-176.8	-167.3	0	0	0	0	112.7	T13 A14 Y18	T13-S16 PolarHBondContact O-N 2.8Å; A14-S16 VanDerWaalsContact C-N 3.33Å; A14-S16 PolarHBondContact O-N 3.34Å; S16-Y18 VanDerWaalsContact C-N 3.27Å; S16-Y18 PolarHBondContact O-N 3.09Å
17	V	43.9	Very low	39.8	Very low	54 Å²	54	99.9 Å²	99.9	33%	0.327	58%	0.578	S	S	.	*	H	α-helix	trans	-66.5	-31.6	177.4	-179.3	0	0	0	0	111.3	F12 A14 L325	F12-V17 HydrophobicContact CB-CG2 4.23Å; F12-V17 HydrophobicContact CD1-CG2 4.11Å; A14-V17 PolarHBondContact O-N 3.2Å; V17-L325 HydrophobicContact CB-CD2 4.07Å; V17-L325 HydrophobicContact CG1-CD1 4.39Å; V17-L325 HydrophobicContact CG1-CD2 3.83Å
18	Y	40.4	Very low	41.1	Very low	67 Å²	67	92.6 Å²	92.6	26%	0.263	55%	0.55	S	S	.	*	H	α-helix	trans	-79.9	-29	-176	-145.1	-114.5	0	0	0	113.4	S16 S20 V21 H22	S16-Y18 VanDerWaalsContact C-N 3.27Å; S16-Y18 PolarHBondContact O-N 3.09Å; Y18-S20 PolarHBondContact O-N 3.12Å; Y18-S20 VanDerWaalsContact O-N 3.15Å; Y18-V21 PolarHBondContact O-N 3.06Å; Y18-H22 AromaticContact CD1-CD2 3.34Å; Y18-H22 WeakPolarHBondContact CD1-CD2 3.43Å; Y18-H22 AromaticContact CD1-NE2 3.18Å; Y18-H22 WeakPolarHBondContact CD1-NE2 3.42Å; Y18-H22 AromaticContact CE1-CD2 3.54Å; Y18-H22 AromaticContact CE1-CE1 3.84Å; Y18-H22 AromaticContact CE1-NE2 2.92Å; Y18-H22 WeakPolarHBondContact CE1-NE2 3.49Å
19	C	35.2	Very low	42.4	Very low	99 Å²	99	99.2 Å²	99.2	67%	0.669	56%	0.564	S	S	*	*	H	α-helix	trans	-63.2	-25.8	-176.7	-150.3	0	0	0	0	113.2	V21	C19-V21 VanDerWaalsContact C-N 3.34Å
20	S	36.5	Very low	44	Very low	107 Å²	107	97.6 Å²	97.6	75%	0.748	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-18.6	174.6	-61.9	0	0	0	0	114.1	Y18	Y18-S20 PolarHBondContact O-N 3.12Å; Y18-S20 VanDerWaalsContact O-N 3.15Å
21	V	42.4	Very low	45.9	Very low	87 Å²	87	96 Å²	96	53%	0.527	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.3	-27.7	179.2	-173.3	0	0	0	0	111.3	Y18 C19 S23	Y18-V21 PolarHBondContact O-N 3.06Å; C19-V21 VanDerWaalsContact C-N 3.34Å; V21-S23 VanDerWaalsContact C-N 3.35Å; V21-S23 PolarHBondContact O-N 2.85Å
22	H	41.4	Very low	48.1	Very low	62 Å²	62	97.7 Å²	97.7	29%	0.287	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-3.2	-174.5	-86.4	-67.8	0	0	0	116.7	Y18 M24 S28	Y18-H22 AromaticContact CD1-CD2 3.34Å; Y18-H22 WeakPolarHBondContact CD1-CD2 3.43Å; Y18-H22 AromaticContact CD1-NE2 3.18Å; Y18-H22 WeakPolarHBondContact CD1-NE2 3.42Å; Y18-H22 AromaticContact CE1-CD2 3.54Å; Y18-H22 AromaticContact CE1-CE1 3.84Å; Y18-H22 AromaticContact CE1-NE2 2.92Å; Y18-H22 WeakPolarHBondContact CE1-NE2 3.49Å; H22-M24 PolarHBondContact O-N 2.73Å; H22-S28 PolarHBondContact CE1-O 3.05Å; H22-S28 PolarHBondContact CE1-OG 3.22Å
23	S	42.8	Very low	50.2	Low	114 Å²	114	96.3 Å²	96.3	80%	0.797	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-8	169.8	-173.2	0	0	0	0	112.8	V21	V21-S23 VanDerWaalsContact C-N 3.35Å; V21-S23 PolarHBondContact O-N 2.85Å
24	M	41.3	Very low	52.2	Low	159 Å²	159	97.1 Å²	97.1	78%	0.783	56%	0.561	S	S	*	*	S	Bend	trans	-111.8	78.6	174.7	-61.3	-179	74.8	0	0	109.8	H22 S26	H22-M24 PolarHBondContact O-N 2.73Å; M24-S26 PolarHBondContact O-N 2.76Å; M24-S26 PolarHBondContact O-OG 2.81Å
25	G	41.6	Very low	53.9	Low	87 Å²	87	100 Å²	100	90%	0.897	57%	0.567	S	S	*	*			trans	23	35.4	152.5	0	0	0	0	0	121
26	S	50	Low	55.9	Low	61 Å²	61	98.6 Å²	98.6	43%	0.427	55%	0.549	S	S	.	.			trans	-103.4	128.9	176.6	63	0	0	0	0	109.1	M24 S28	M24-S26 PolarHBondContact O-N 2.76Å; M24-S26 PolarHBondContact O-OG 2.81Å; S26-S28 PolarHBondContact O-N 3.47Å; S26-S28 PolarHBondContact O-OG 3.33Å; S26-S28 PolarHBondContact OG-OG 3.39Å
27	D	51.5	Low	58.3	Low	172 Å²	172	96.8 Å²	96.8	92%	0.92	53%	0.533	S	S	*	.			trans	-65.2	39.4	167.9	-71.8	-36	0	0	0	111.8	K29	D27-K29 PolarHBondContact O-N 3.29Å
28	S	54.3	Low	60.4	Low	37 Å²	37	95 Å²	95	26%	0.259	52%	0.522	S	S	.	.			trans	-71.6	104.5	175.9	34.1	0	0	0	0	107.9	H22 S26 I30	H22-S28 PolarHBondContact CE1-O 3.05Å; H22-S28 PolarHBondContact CE1-OG 3.22Å; S26-S28 PolarHBondContact O-N 3.47Å; S26-S28 PolarHBondContact O-OG 3.33Å; S26-S28 PolarHBondContact OG-OG 3.39Å; S28-I30 PolarHBondContact O-N 3.23Å
29	K	56.9	Low	62.4	Low	194 Å²	194	98.8 Å²	98.8	84%	0.843	54%	0.539	S	S	*	.			trans	-45.9	124.7	173.8	-72.7	180	177.4	178.6	0	109.2	D27 Q31	D27-K29 PolarHBondContact O-N 3.29Å; K29-Q31 PolarHBondContact O-N 3.37Å
30	I	64.8	Low	64.1	Low	142 Å²	142	95.8 Å²	95.8	73%	0.728	52%	0.52	S	S	*	.			trans	-54.2	115.7	172.8	-62.5	172.6	0	0	0	107.3	S28 Q32	S28-I30 PolarHBondContact O-N 3.23Å; I30-Q32 PolarHBondContact O-N 3.34Å
31	Q	74.1	Confident	65.2	Low	125 Å²	125	93.8 Å²	93.8	58%	0.584	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-65.8	120	176.7	-179.1	174.2	-8.9	0	0	108.6	K29	K29-Q31 PolarHBondContact O-N 3.37Å
32	Q	80.5	Confident	65.2	Low	175 Å²	175	92.3 Å²	92.3	82%	0.818	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-69.5	140.2	172.8	-68.7	-174.6	-7.6	0	0	109.8	I30 N34	I30-Q32 PolarHBondContact O-N 3.34Å; Q32-N34 PolarHBondContact O-N 3.39Å
33	W	84.8	Confident	64.9	Low	53 Å²	53	97.5 Å²	97.5	20%	0.201	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-64.4	125.1	177.7	-176.5	-96.6	0	0	0	110.9	A14 Y35 L322 Q324 S372 V374	A14-W33 HydrophobicContact CB-CE3 4.31Å; A14-W33 HydrophobicContact CB-CZ3 3.85Å; W33-Y35 AromaticContact CD1-CD1 3.49Å; W33-Y35 VanDerWaalsContact CD1-CD1 3.49Å; W33-Y35 AromaticContact CD1-CE1 3.58Å; W33-Y35 AromaticContact CD1-CG 3.82Å; W33-Y35 AromaticContact NE1-CD1 3.95Å; W33-Y35 PolarHBondContact O-N 3.26Å; W33-L322 VanDerWaalsContact CH2-O 3.32Å; W33-L322 WeakPolarHBondContact CH2-O 3.39Å; W33-Q324 VanDerWaalsContact CE2-NE2 3.32Å; W33-Q324 HydrophobicContact CE3-CB 4.34Å; W33-Q324 HydrophobicContact CE3-CG 4.09Å; W33-Q324 HydrophobicContact CH2-CG 4.1Å; W33-Q324 HydrophobicContact CZ3-CB 4.08Å; W33-Q324 HydrophobicContact CZ3-CG 3.8Å; W33-S372 PolarHBondContact NE1-O 3.03Å; W33-V374 HydrophobicContact CH2-CB 4.07Å; W33-V374 HydrophobicContact CH2-CG2 4.41Å; W33-V374 HydrophobicContact CZ2-CB 4.18Å; W33-V374 HydrophobicContact CZ2-CG2 4.14Å
34	N	86.2	Confident	64.6	Low	83 Å²	83	100.2 Å²	100.2	44%	0.444	53%	0.529	S	S	.	.			trans	-78.3	104.6	169	179.2	11.7	0	0	0	110.1	Q32 N36 W37 Q324	Q32-N34 PolarHBondContact O-N 3.39Å; N34-N36 PolarHBondContact O-N 3.09Å; N34-N36 WeakPolarHBondContact OD1-CA 3.31Å; N34-N36 PolarHBondContact OD1-N 3.32Å; N34-W37 PolarHBondContact O-N 3.45Å; N34-Q324 PolarHBondContact O-NE2 3.1Å
35	Y	83.7	Confident	64.1	Low	85 Å²	85	98.9 Å²	98.9	33%	0.333	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-19.3	176.9	-68.2	-76.4	0	0	0	114.1	W33 L350 I352 I373	W33-Y35 AromaticContact CD1-CD1 3.49Å; W33-Y35 VanDerWaalsContact CD1-CD1 3.49Å; W33-Y35 AromaticContact CD1-CE1 3.58Å; W33-Y35 AromaticContact CD1-CG 3.82Å; W33-Y35 AromaticContact NE1-CD1 3.95Å; W33-Y35 PolarHBondContact O-N 3.26Å; Y35-L350 HydrophobicContact CD1-CD1 3.67Å; Y35-L350 HydrophobicContact CE1-CD1 3.13Å; Y35-I352 HydrophobicContact CE2-CD1 4.39Å; Y35-I373 HydrophobicContact CE1-CD1 4.45Å; Y35-I373 HydrophobicContact CE1-CG1 4.08Å
36	N	84.2	Confident	63.5	Low	49 Å²	49	102.5 Å²	102.5	26%	0.262	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	43.1	176.6	-170.9	28.4	0	0	0	111.1	N34 D38 K39 S40 H41	N34-N36 PolarHBondContact O-N 3.09Å; N34-N36 WeakPolarHBondContact OD1-CA 3.31Å; N34-N36 PolarHBondContact OD1-N 3.32Å; N36-D38 PolarHBondContact O-N 3.26Å; N36-K39 PolarHBondContact O-N 2.84Å; N36-K39 VanDerWaalsContact O-N 3.12Å; N36-K39 WeakPolarHBondContact OD1-CA 3.49Å; N36-K39 PolarHBondContact OD1-N 3.41Å; N36-S40 PolarHBondContact OD1-N 3.01Å; N36-S40 VanDerWaalsContact OD1-N 3.09Å; N36-H41 HydrophobicContact CB-CB 4.22Å; N36-H41 PolarHBondContact ND2-O 3.37Å; N36-H41 WeakPolarHBondContact OD1-CA 3.27Å; N36-H41 WeakPolarHBondContact OD1-CB 3.42Å; N36-H41 PolarHBondContact OD1-N 3.28Å
37	W	87.5	Confident	62.4	Low	21 Å²	21	103.4 Å²	103.4	8%	0.08	53%	0.53	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-25.4	-175.3	61.4	-97.6	0	0	0	113.4	N34 Y243 L247 L322 I345 V374	N34-W37 PolarHBondContact O-N 3.45Å; W37-Y243 HydrophobicContact CE3-CE1 4.25Å; W37-Y243 HydrophobicContact CZ3-CE1 4.24Å; W37-Y243 AromaticContact CZ3-CZ 3.98Å; W37-Y243 WeakPolarHBondContact CZ3-OH 3.32Å; W37-L247 HydrophobicContact CZ3-CB 4.35Å; W37-L322 HydrophobicContact CE3-CD2 4.23Å; W37-L322 HydrophobicContact CH2-CD2 3.6Å; W37-L322 HydrophobicContact CZ2-CD2 4.25Å; W37-L322 HydrophobicContact CZ3-CD2 3.58Å; W37-I345 HydrophobicContact CH2-CD1 3.91Å; W37-I345 HydrophobicContact CZ2-CD1 3.97Å; W37-I345 HydrophobicContact CZ2-CG1 4.38Å; W37-I345 HydrophobicContact CZ2-CG2 4Å; W37-V374 HydrophobicContact CZ2-CG2 3.8Å
38	D	87.5	Confident	61.4	Low	17 Å²	17	105.7 Å²	105.7	9%	0.091	53%	0.532	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	3.6	177	68.8	-13.5	0	0	0	113.1	N36 S40 H41 C249	N36-D38 PolarHBondContact O-N 3.26Å; D38-S40 PolarHBondContact O-N 2.78Å; D38-S40 VanDerWaalsContact O-N 3.11Å; D38-S40 WeakPolarHBondContact OD1-CB 3.39Å; D38-S40 PolarHBondContact OD1-N 2.73Å; D38-S40 PolarHBondContact OD1-OG 2.93Å; D38-S40 WeakPolarHBondContact OD2-CB 3.4Å; D38-S40 PolarHBondContact OD2-OG 3.19Å; D38-H41 IonicContact OD1-ND1 2.87Å; D38-C249 VanDerWaalsContact OD2-CB 3.29Å; D38-C249 WeakPolarHBondContact OD2-CB 3.25Å; D38-C249 PolarHBondContact OD2-N 3.46Å; D38-C249 PolarHBondContact OD2-SG 3.35Å
39	K	82.1	Confident	60.1	Low	145 Å²	145	107.9 Å²	107.9	63%	0.63	55%	0.547	S	S	*	.	S	Bend	trans	59.1	17.1	-177.4	-52.3	171	-175.3	167.8	0	113.8	N36 E244	N36-K39 PolarHBondContact O-N 2.84Å; N36-K39 VanDerWaalsContact O-N 3.12Å; N36-K39 WeakPolarHBondContact OD1-CA 3.49Å; N36-K39 PolarHBondContact OD1-N 3.41Å; K39-E244 IonicContact NZ-OE1 2.65Å; K39-E244 PolarHBondContact NZ-OE1 2.9Å
40	S	72	Confident	58.7	Low	37 Å²	37	102.7 Å²	102.7	26%	0.259	55%	0.548	S	S	.	.			trans	-80.7	-21	-179.3	69	0	0	0	0	113.7	N36 D38 G42 C249	N36-S40 PolarHBondContact OD1-N 3.01Å; N36-S40 VanDerWaalsContact OD1-N 3.09Å; D38-S40 PolarHBondContact O-N 2.78Å; D38-S40 VanDerWaalsContact O-N 3.11Å; D38-S40 WeakPolarHBondContact OD1-CB 3.39Å; D38-S40 PolarHBondContact OD1-N 2.73Å; D38-S40 PolarHBondContact OD1-OG 2.93Å; D38-S40 WeakPolarHBondContact OD2-CB 3.4Å; D38-S40 PolarHBondContact OD2-OG 3.19Å; S40-G42 PolarHBondContact O-N 3.46Å; S40-C249 PolarHBondContact OG-SG 2.92Å
41	H	59.1	Low	56.8	Low	64 Å²	64	103.9 Å²	103.9	30%	0.296	56%	0.556	S	S	.	*	S	Bend	trans	-97.1	73.6	-179.7	-58.6	79.6	0	0	0	109.3	N36 D38 S372	N36-H41 HydrophobicContact CB-CB 4.22Å; N36-H41 PolarHBondContact ND2-O 3.37Å; N36-H41 WeakPolarHBondContact OD1-CA 3.27Å; N36-H41 WeakPolarHBondContact OD1-CB 3.42Å; N36-H41 PolarHBondContact OD1-N 3.28Å; D38-H41 IonicContact OD1-ND1 2.87Å; H41-S372 PolarHBondContact CE1-OG 3.01Å
42	G	42.7	Very low	54.5	Low	57 Å²	57	106.9 Å²	106.9	59%	0.588	57%	0.567	S	S	*	*			trans	-142.8	-10	-171.1	0	0	0	0	0	117.5	S40 H44	S40-G42 PolarHBondContact O-N 3.46Å; G42-H44 PolarHBondContact O-N 3.42Å
43	I	35.2	Very low	52.2	Low	171 Å²	171	103.9 Å²	103.9	88%	0.877	56%	0.563	S	S	*	*			trans	-92.1	64.3	169.6	-49.4	174.9	0	0	0	107.7	D45	I43-D45 VanDerWaalsContact C-N 3.29Å; I43-D45 PolarHBondContact O-N 3.31Å
44	H	36.6	Very low	49.5	Very low	170 Å²	170	109.1 Å²	109.1	79%	0.787	59%	0.594	S	S	*	*			trans	-77.4	94.6	159.5	-118	-81.1	0	0	0	106.1	G42 N46	G42-H44 PolarHBondContact O-N 3.42Å; H44-N46 PolarHBondContact O-N 3.22Å
45	D	29.9	Very low	46.9	Very low	131 Å²	131	110.9 Å²	110.9	70%	0.701	61%	0.608	S	S	*	*	S	Bend	trans	0.4	84.6	150	-112.2	-17.7	0	0	0	114.5	I43	I43-D45 VanDerWaalsContact C-N 3.29Å; I43-D45 PolarHBondContact O-N 3.31Å
46	N	29.8	Very low	44.3	Very low	164 Å²	164	113.8 Å²	113.8	88%	0.877	63%	0.629	S	S	*	*			trans	-135	3.5	161.2	-97	-13.5	0	0	0	112.9	H44	H44-N46 PolarHBondContact O-N 3.22Å
47	S	26.6	Very low	41.6	Very low	79 Å²	79	118.3 Å²	118.3	55%	0.552	65%	0.653	S	S	*	*			trans	-100.5	88.2	168.1	57.5	0	0	0	0	109.5	S49	S47-S49 PolarHBondContact O-N 3.4Å
48	K	30.2	Very low	39	Very low	221 Å²	221	121.7 Å²	121.7	96%	0.961	68%	0.676	S	S	*	*			trans	-59.4	80.4	143.9	-75.7	-175.5	178.6	179.1	0	107.3
49	S	28.2	Very low	36.6	Very low	82 Å²	82	125.5 Å²	125.5	57%	0.573	70%	0.699	S	S	*	*			trans	-153.1	113.9	165.5	53.5	0	0	0	0	108.5	S47 L51	S47-S49 PolarHBondContact O-N 3.4Å; S49-L51 PolarHBondContact O-N 3.31Å
50	G	26.2	Very low	34.8	Very low	85 Å²	85	126.3 Å²	126.3	88%	0.876	70%	0.703	S	S	*	*			trans	-53.5	119.1	-172.5	0	0	0	0	0	113
51	L	26.4	Very low	33.9	Very low	168 Å²	168	126.7 Å²	126.7	88%	0.88	70%	0.701	S	S	*	*			trans	-127.6	139	158.6	-76.1	168.3	0	0	0	108.3	S49	S49-L51 PolarHBondContact O-N 3.31Å
52	K	25.1	Very low	33.9	Very low	187 Å²	187	130.7 Å²	130.7	81%	0.813	72%	0.72	S	S	*	*			trans	-60.5	146.5	-163.6	-67.6	172.6	175.2	179	0	113	D54	K52-D54 VanDerWaalsContact C-N 3.3Å; K52-D54 PolarHBondContact O-N 2.99Å
53	P	32.1	Very low	35.4	Very low	113 Å²	113	133 Å²	133	73%	0.734	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	26.8	-163	35	-36.9	0	0	0	116.3
54	D	28.5	Very low	37.8	Very low	162 Å²	162	128.8 Å²	128.8	87%	0.866	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-3.4	175.8	-85.2	-9.6	0	0	0	113.9	K52 L56	K52-D54 VanDerWaalsContact C-N 3.3Å; K52-D54 PolarHBondContact O-N 2.99Å; D54-L56 VanDerWaalsContact C-N 3.3Å; D54-L56 PolarHBondContact O-N 3.06Å
55	T	30.7	Very low	40.4	Very low	120 Å²	120	121.8 Å²	121.8	74%	0.736	67%	0.665	S	S	*	*	S	Bend	trans	-81.9	84.7	163.9	21.7	0	0	0	0	109.4	N57	T55-N57 PolarHBondContact O-N 3.06Å
56	L	29.8	Very low	43.5	Very low	146 Å²	146	116.9 Å²	116.9	76%	0.764	64%	0.638	S	S	*	*			trans	17.3	92.6	147.4	-164.7	78	0	0	0	112.5	D54 V58	D54-L56 VanDerWaalsContact C-N 3.3Å; D54-L56 PolarHBondContact O-N 3.06Å; L56-V58 VanDerWaalsContact C-N 3.3Å; L56-V58 WeakPolarHBondContact O-CG2 3.23Å; L56-V58 PolarHBondContact O-N 3.45Å
57	N	27.5	Very low	46.7	Very low	144 Å²	144	109 Å²	109	77%	0.77	60%	0.596	S	S	*	*			trans	-47.4	97	170.3	-74.9	-35.2	0	0	0	108.6	T55 V59	T55-N57 PolarHBondContact O-N 3.06Å; N57-V59 PolarHBondContact O-N 3.16Å
58	V	33.8	Very low	50	Low	92 Å²	92	106.1 Å²	106.1	56%	0.558	57%	0.574	S	S	*	*			trans	-69.5	87.9	172.3	-178.9	0	0	0	0	104.8	L56 K60	L56-V58 VanDerWaalsContact C-N 3.3Å; L56-V58 WeakPolarHBondContact O-CG2 3.23Å; L56-V58 PolarHBondContact O-N 3.45Å; V58-K60 PolarHBondContact O-N 2.86Å
59	V	36.2	Very low	53.3	Low	97 Å²	97	95.6 Å²	95.6	59%	0.588	53%	0.528	S	S	*	.			trans	-47.8	114.4	167.2	178.5	0	0	0	0	105	N57 H61	N57-V59 PolarHBondContact O-N 3.16Å; V59-H61 VanDerWaalsContact C-N 3.33Å; V59-H61 PolarHBondContact O-N 3.37Å
60	K	45.2	Very low	56.6	Low	162 Å²	162	91.7 Å²	91.7	70%	0.704	50%	0.501	S	S	*	.			trans	-56.6	102.1	175.8	-75.4	179.7	179.2	175.1	0	106.3	V58 Q62	V58-K60 PolarHBondContact O-N 2.86Å; K60-Q62 PolarHBondContact O-N 3.44Å
61	H	51.3	Low	60.1	Low	46 Å²	46	87.7 Å²	87.7	21%	0.213	46%	0.46	C	S	.	.			trans	-67.9	120.6	-178.3	-116.3	-48.3	0	0	0	108.7	V59 Y260 N261	V59-H61 VanDerWaalsContact C-N 3.33Å; V59-H61 PolarHBondContact O-N 3.37Å; H61-Y260 HydrophobicContact CB-CE2 4.3Å; H61-Y260 PolarHBondContact CD2-O 3.35Å; H61-Y260 PolarHBondContact NE2-O 2.86Å; H61-N261 PolarHBondContact NE2-O 2.87Å
62	Q	60.1	Low	63.6	Low	148 Å²	148	79.7 Å²	79.7	69%	0.692	42%	0.418	S	S	*	.			trans	-87.2	-11.9	-173.1	-66.3	179.3	-45.2	0	0	112.8	K60 E349	K60-Q62 PolarHBondContact O-N 3.44Å; Q62-E349 WeakPolarHBondContact CA-OE1 3.29Å
63	Q	74.5	Confident	67.1	Low	106 Å²	106	72.5 Å²	72.5	50%	0.495	39%	0.385	S	S	.	.	S	Bend	trans	-91.9	134.9	-174.7	-65.7	-171.1	-9.6	0	0	111.6	Y65 I297	Q63-Y65 WeakPolarHBondContact O-CD1 3.41Å; Q63-I297 HydrophobicContact CB-CG2 4.18Å
64	P	86.1	Confident	70.2	Confident	81 Å²	81	67.2 Å²	67.2	53%	0.526	35%	0.351	S	S	.	.			trans	-57.1	140.2	169.7	-24.2	34	0	0	0	111.6	N347	P64-N347 VanDerWaalsContact CA-O 3.31Å; P64-N347 WeakPolarHBondContact CA-O 3.25Å
65	Y	90.9	Very high	73.5	Confident	23 Å²	23	59.5 Å²	59.5	9%	0.09	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	162.7	177.2	63.8	-89.3	0	0	0	110.6	Q63 Y260 I303 N347	Q63-Y65 WeakPolarHBondContact O-CD1 3.41Å; Y65-Y260 HydrophobicContact CD1-CD2 4.4Å; Y65-Y260 HydrophobicContact CD1-CE2 4.24Å; Y65-Y260 HydrophobicContact CE1-CD2 4.16Å; Y65-Y260 AromaticContact CE1-CE2 3.62Å; Y65-Y260 HydrophobicContact CE1-CE2 3.62Å; Y65-Y260 HydrophobicContact CE2-CD2 4.22Å; Y65-Y260 HydrophobicContact CE2-CE2 4.23Å; Y65-Y260 AromaticContact CZ-CE2 3.6Å; Y65-I303 HydrophobicContact CD2-CD1 3.33Å; Y65-I303 HydrophobicContact CD2-CG1 3.91Å; Y65-I303 HydrophobicContact CE2-CD1 3.7Å; Y65-I303 HydrophobicContact CG-CD1 4.17Å; Y65-N347 HydrophobicContact CD1-CB 4.03Å; Y65-N347 HydrophobicContact CD2-CB 4.07Å; Y65-N347 HydrophobicContact CE1-CB 3.58Å; Y65-N347 HydrophobicContact CE2-CB 3.68Å; Y65-N347 WeakPolarHBondContact CE2-ND2 3.17Å; Y65-N347 HydrophobicContact CG-CB 4.25Å; Y65-N347 VanDerWaalsContact CZ-CG 3.5Å; Y65-N347 PolarHBondContact N-O 3.43Å; Y65-N347 VanDerWaalsContact N-O 3.11Å; Y65-N347 PolarHBondContact O-N 3.4Å
66	H	94.6	Very high	76.7	Confident	28 Å²	28	56.4 Å²	56.4	13%	0.13	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	152.7	179.5	62	-90.1	0	0	0	112.9	N300 P302 I303 L344 I345 N346	H66-N300 PolarHBondContact CE1-O 2.88Å; H66-P302 VanDerWaalsContact CD2-CA 3.49Å; H66-P302 WeakPolarHBondContact CD2-CA 3.49Å; H66-P302 WeakPolarHBondContact NE2-CA 3.23Å; H66-P302 WeakPolarHBondContact NE2-CD 3.4Å; H66-P302 VanDerWaalsContact NE2-N 3.17Å; H66-P302 CarbonylContact O-C 3.58Å; H66-P302 VanDerWaalsContact O-CA 3.31Å; H66-P302 WeakPolarHBondContact O-CA 3.44Å; H66-I303 WeakPolarHBondContact O-CG1 3.39Å; H66-I303 PolarHBondContact O-N 3.49Å; H66-L344 HydrophobicContact CB-CD1 3.9Å; H66-L344 HydrophobicContact CB-CG 4.48Å; H66-I345 CarbonylContact C-O 3.53Å; H66-I345 WeakPolarHBondContact CA-O 3.17Å; H66-N346 WeakPolarHBondContact CB-OD1 3.47Å
67	K	95.9	Very high	79.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	147.6	175	-63.9	177.7	56.6	174.5	0	110.5	H248 C249 K250 I303 E304 I345	K67-H248 PolarHBondContact NZ-O 3.29Å; K67-C249 WeakPolarHBondContact CD-O 3.49Å; K67-K250 PolarHBondContact NZ-O 3.49Å; K67-I303 HydrophobicContact CG-CD1 4.06Å; K67-I303 HydrophobicContact CG-CG1 3.77Å; K67-E304 WeakPolarHBondContact CA-O 3.27Å; K67-E304 WeakPolarHBondContact CE-OE2 3.23Å; K67-E304 HydrophobicContact CG-CB 4.28Å; K67-E304 IonicContact NZ-OE2 3.22Å; K67-E304 PolarHBondContact NZ-OE2 3.21Å; K67-I345 HydrophobicContact CB-CB 4.33Å; K67-I345 PolarHBondContact N-O 2.97Å; K67-I345 PolarHBondContact O-N 3.44Å
68	L	97.7	Very high	83.1	Confident	17 Å²	17	47.7 Å²	47.7	9%	0.089	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124.1	175.8	-163	65.7	0	0	0	110	I70 I109 P302 E304 T305 I306 I342 L344	L68-I70 HydrophobicContact CD2-CD1 3.9Å; L68-I70 HydrophobicContact CD2-CG1 4.25Å; L68-I70 HydrophobicContact CG-CD1 4.27Å; L68-I70 HydrophobicContact CG-CG1 4.06Å; L68-I109 HydrophobicContact CD2-CD1 4.24Å; L68-I109 HydrophobicContact CD2-CG1 4.38Å; L68-I109 HydrophobicContact CD2-CG2 4.04Å; L68-P302 HydrophobicContact CB-CB 4.11Å; L68-P302 HydrophobicContact CB-CG 4.19Å; L68-E304 PolarHBondContact N-O 3.12Å; L68-T305 HydrophobicContact CB-CG2 4.04Å; L68-T305 HydrophobicContact CD2-CG2 4Å; L68-T305 HydrophobicContact CG-CG2 4.31Å; L68-T305 CarbonylContact O-C 3.6Å; L68-T305 VanDerWaalsContact O-CA 3.3Å; L68-T305 WeakPolarHBondContact O-CA 3.37Å; L68-I306 PolarHBondContact O-N 3.42Å; L68-I342 HydrophobicContact CD1-CG2 3.37Å; L68-I342 HydrophobicContact CG-CG2 4.11Å; L68-L344 HydrophobicContact CD1-CD1 4.36Å
69	I	98.3	Very high	85.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.1	173.8	-57.8	-59.9	0	0	0	107.8	F71 L247 I306 F308 L343 I345	I69-F71 HydrophobicContact CG2-CE1 4.1Å; I69-F71 HydrophobicContact CG2-CE2 4.15Å; I69-F71 HydrophobicContact CG2-CZ 3.76Å; I69-L247 HydrophobicContact CD1-CD2 4.25Å; I69-L247 HydrophobicContact CG1-CD2 4.27Å; I69-L247 HydrophobicContact CG2-CD2 3.86Å; I69-I306 HydrophobicContact CD1-CB 4.11Å; I69-I306 HydrophobicContact CD1-CD1 4.36Å; I69-I306 HydrophobicContact CD1-CG1 4.42Å; I69-F308 HydrophobicContact CD1-CE2 4.3Å; I69-F308 HydrophobicContact CG2-CD2 3.93Å; I69-F308 HydrophobicContact CG2-CE2 3.85Å; I69-L343 HydrophobicContact CB-CB 4.39Å; I69-L343 PolarHBondContact N-O 3.31Å; I69-L343 PolarHBondContact O-N 3.48Å; I69-I345 HydrophobicContact CD1-CD1 4.4Å; I69-I345 HydrophobicContact CG1-CD1 3.72Å; I69-I345 HydrophobicContact CG1-CG1 4.31Å
70	I	98.7	Very high	88	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.4	-178.5	-53.9	179.3	0	0	0	108.7	L68 I72 L104 I109 T305 I306 L307 F308 I340 S341 I342	L68-I70 HydrophobicContact CD2-CD1 3.9Å; L68-I70 HydrophobicContact CD2-CG1 4.25Å; L68-I70 HydrophobicContact CG-CD1 4.27Å; L68-I70 HydrophobicContact CG-CG1 4.06Å; I70-I72 HydrophobicContact CG2-CG1 4.44Å; I70-L104 HydrophobicContact CD1-CD2 3.91Å; I70-L104 HydrophobicContact CG2-CD2 4.31Å; I70-I109 HydrophobicContact CD1-CD1 3.93Å; I70-I109 HydrophobicContact CD1-CG2 3.96Å; I70-T305 HydrophobicContact CD1-CG2 4.02Å; I70-I306 PolarHBondContact N-O 3.13Å; I70-L307 HydrophobicContact CB-CD1 3.77Å; I70-L307 HydrophobicContact CG2-CD1 3.55Å; I70-L307 CarbonylContact O-C 3.57Å; I70-L307 WeakPolarHBondContact O-CA 3.4Å; I70-F308 PolarHBondContact O-N 2.88Å; I70-I340 HydrophobicContact CG2-CG2 3.82Å; I70-S341 CarbonylContact C-O 3.53Å; I70-S341 VanDerWaalsContact CA-O 3.32Å; I70-S341 WeakPolarHBondContact CA-O 3.24Å; I70-I342 HydrophobicContact CG1-CG1 4.41Å; I70-I342 HydrophobicContact CG1-CG2 4.47Å; I70-I342 HydrophobicContact CG2-CG1 4.39Å
71	F	98.8	Very high	89.8	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.8	171	-62	-59.2	0	0	0	109.8	I69 L247 F308 F315 W318 I319 L322 I340 S341 L343	I69-F71 HydrophobicContact CG2-CE1 4.1Å; I69-F71 HydrophobicContact CG2-CE2 4.15Å; I69-F71 HydrophobicContact CG2-CZ 3.76Å; F71-L247 HydrophobicContact CZ-CD2 4.4Å; F71-F308 HydrophobicContact CD1-CB 3.47Å; F71-F308 VanDerWaalsContact CD1-CB 3.47Å; F71-F308 HydrophobicContact CD1-CD2 4.1Å; F71-F308 AromaticContact CD1-CG 3.95Å; F71-F308 HydrophobicContact CD1-CG 3.95Å; F71-F308 HydrophobicContact CE1-CB 3.81Å; F71-F308 HydrophobicContact CE1-CD1 4.44Å; F71-F308 AromaticContact CE1-CD2 3.73Å; F71-F308 HydrophobicContact CE1-CD2 3.73Å; F71-F308 HydrophobicContact CE1-CE2 4.42Å; F71-F308 AromaticContact CE1-CG 3.74Å; F71-F308 HydrophobicContact CE1-CG 3.74Å; F71-F315 HydrophobicContact CB-CB 4.45Å; F71-F315 HydrophobicContact CB-CD1 4.29Å; F71-F315 HydrophobicContact CB-CD2 3.91Å; F71-F315 HydrophobicContact CB-CE2 4.15Å; F71-F315 HydrophobicContact CB-CG 3.98Å; F71-F315 HydrophobicContact CB-CZ 4.43Å; F71-F315 AromaticContact CD1-CD1 3.34Å; F71-F315 HydrophobicContact CD1-CD1 3.34Å; F71-F315 HydrophobicContact CD1-CD2 4.44Å; F71-F315 AromaticContact CD1-CE1 3.42Å; F71-F315 HydrophobicContact CD1-CE1 3.42Å; F71-F315 VanDerWaalsContact CD1-CE1 3.42Å; F71-F315 HydrophobicContact CD1-CE2 4.49Å; F71-F315 AromaticContact CD1-CG 3.89Å; F71-F315 HydrophobicContact CD1-CG 3.89Å; F71-F315 HydrophobicContact CD1-CZ 4.01Å; F71-F315 AromaticContact CE1-CD1 3.83Å; F71-F315 HydrophobicContact CE1-CD1 3.83Å; F71-F315 AromaticContact CE1-CE1 3.99Å; F71-F315 HydrophobicContact CE1-CE1 3.99Å; F71-F315 HydrophobicContact CG-CB 4.32Å; F71-F315 AromaticContact CG-CD1 3.9Å; F71-F315 HydrophobicContact CG-CD1 3.9Å; F71-F315 HydrophobicContact CG-CD2 4.39Å; F71-F315 HydrophobicContact CG-CE1 4.27Å; F71-F315 AromaticContact CG-CG 3.96Å; F71-F315 HydrophobicContact CG-CG 3.96Å; F71-W318 AromaticContact CE1-CE3 3.89Å; F71-W318 HydrophobicContact CE1-CE3 3.89Å; F71-W318 HydrophobicContact CE1-CZ3 4.37Å; F71-W318 HydrophobicContact CZ-CE3 4.08Å; F71-I319 HydrophobicContact CD2-CD1 4.04Å; F71-I319 HydrophobicContact CD2-CG1 3.92Å; F71-I319 HydrophobicContact CE2-CD1 4.47Å; F71-I319 HydrophobicContact CE2-CG1 3.85Å; F71-L322 HydrophobicContact CE2-CD1 4.14Å; F71-L322 HydrophobicContact CZ-CD1 4.19Å; F71-I340 CarbonylContact O-C 3.47Å; F71-I340 WeakPolarHBondContact O-CA 3.3Å; F71-S341 PolarHBondContact N-O 3.15Å; F71-S341 PolarHBondContact O-N 3.41Å; F71-L343 HydrophobicContact CD2-CD1 3.54Å; F71-L343 HydrophobicContact CE2-CD1 3.5Å; F71-L343 VanDerWaalsContact CE2-CD1 3.5Å
72	I	98.8	Very high	91.2	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.9	170.1	-69.2	-179.7	0	0	0	109.1	I70 A100 L104 T125 V129 L307 F308 I309 G310 F315 S339 I340	I70-I72 HydrophobicContact CG2-CG1 4.44Å; I72-A100 HydrophobicContact CD1-CB 4.17Å; I72-L104 HydrophobicContact CD1-CD1 3.84Å; I72-T125 HydrophobicContact CG2-CG2 4.18Å; I72-V129 HydrophobicContact CD1-CG1 4.44Å; I72-V129 HydrophobicContact CD1-CG2 4.23Å; I72-L307 HydrophobicContact CB-CD1 4.28Å; I72-L307 HydrophobicContact CD1-CD1 3.57Å; I72-L307 HydrophobicContact CD1-CD2 4.13Å; I72-L307 HydrophobicContact CD1-CG 4.45Å; I72-L307 HydrophobicContact CG1-CD1 3.64Å; I72-F308 PolarHBondContact N-O 2.85Å; I72-I309 HydrophobicContact CB-CG1 4.32Å; I72-I309 WeakPolarHBondContact O-CA 3.26Å; I72-G310 PolarHBondContact O-N 3.43Å; I72-G310 VanDerWaalsContact O-N 3.1Å; I72-F315 WeakPolarHBondContact O-CE2 3.48Å; I72-S339 WeakPolarHBondContact CA-O 3.37Å; I72-I340 HydrophobicContact CD1-CG1 4.37Å; I72-I340 HydrophobicContact CG1-CG1 4.1Å
73	R	98.5	Very high	92.4	Very high	36 Å²	36	56.5 Å²	56.5	14%	0.136	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	137	169.5	-174.8	-175.6	175.6	-165.5	-9.6	108.2	G310 A312 L335 G336 H337 G338 S339 Y392	R73-G310 WeakPolarHBondContact CA-O 3.18Å; R73-A312 HydrophobicContact CG-CB 4.44Å; R73-L335 WeakPolarHBondContact CD-O 3.39Å; R73-L335 PolarHBondContact NH1-O 2.96Å; R73-G336 WeakPolarHBondContact CB-O 3.44Å; R73-G336 VanDerWaalsContact CD-O 3.24Å; R73-G336 WeakPolarHBondContact CD-O 3.47Å; R73-H337 PolarHBondContact NH2-CE1 3.17Å; R73-H337 PolarHBondContact NH2-NE2 3.16Å; R73-G338 VanDerWaalsContact O-CA 3.29Å; R73-G338 WeakPolarHBondContact O-CA 2.98Å; R73-G338 PolarHBondContact O-N 2.95Å; R73-G338 VanDerWaalsContact O-N 3.13Å; R73-S339 PolarHBondContact N-O 3.32Å; R73-Y392 PolarHBondContact NH1-OXT 3.01Å; R73-Y392 PolarHBondContact NH2-OXT 3.37Å
74	H	98.4	Very high	92.7	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.009	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-49.2	153.4	172.9	67.1	69.3	0	0	0	112.3	Y77 R121 T125 G310 H311 H337 G338	H74-Y77 AromaticContact CE1-CD1 3.37Å; H74-Y77 WeakPolarHBondContact CE1-CD1 3.28Å; H74-Y77 AromaticContact CE1-CE1 3.28Å; H74-Y77 WeakPolarHBondContact CE1-CE1 3.42Å; H74-Y77 AromaticContact ND1-CD1 3.61Å; H74-Y77 AromaticContact ND1-CE1 3.99Å; H74-Y77 AromaticContact NE2-CE1 3.93Å; H74-R121 HydrophobicContact CB-CB 4.45Å; H74-R121 HydrophobicContact CB-CG 4.38Å; H74-T125 VanDerWaalsContact CA-OG1 3.25Å; H74-T125 WeakPolarHBondContact CA-OG1 3.38Å; H74-T125 WeakPolarHBondContact CB-OG1 3.42Å; H74-G310 PolarHBondContact CD2-O 3.19Å; H74-G310 VanDerWaalsContact CD2-O 3.27Å; H74-G310 PolarHBondContact N-O 3.33Å; H74-H311 AromaticContact CD2-ND1 3.22Å; H74-H311 PolarHBondContact CD2-ND1 3.29Å; H74-H311 AromaticContact NE2-ND1 3.78Å; H74-H337 AromaticContact CE1-CD2 3.82Å; H74-G338 PolarHBondContact O-N 3.01Å
75	G	98.2	Very high	92.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-64.3	168.7	172.6	0	0	0	0	0	112.7	L89 T125	G75-L89 VanDerWaalsContact O-CD2 3.29Å; G75-L89 WeakPolarHBondContact O-CD2 3.23Å; G75-T125 PolarHBondContact N-OG1 3.45Å
76	Q	97.9	Very high	92.5	Very high	55 Å²	55	52.5 Å²	52.5	26%	0.257	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-57.1	138.8	173.9	-169.6	-173.6	14.5	0	0	110.8	L89 T90 G93 H337	Q76-L89 WeakPolarHBondContact O-CA 3.44Å; Q76-L89 WeakPolarHBondContact O-CD2 3.24Å; Q76-T90 HydrophobicContact CG-CG2 4.4Å; Q76-T90 PolarHBondContact O-N 2.93Å; Q76-T90 PolarHBondContact O-OG1 2.93Å; Q76-G93 VanDerWaalsContact N-CA 3.35Å; Q76-G93 WeakPolarHBondContact O-CA 3.36Å; Q76-H337 HydrophobicContact CB-CB 4.4Å
77	Y	96.4	Very high	92.4	Very high	31 Å²	31	53.9 Å²	53.9	12%	0.122	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-137.2	165.2	-176.2	71.1	-87.2	0	0	0	111.8	H74 L79 K87 V88 R121	H74-Y77 AromaticContact CE1-CD1 3.37Å; H74-Y77 WeakPolarHBondContact CE1-CD1 3.28Å; H74-Y77 AromaticContact CE1-CE1 3.28Å; H74-Y77 WeakPolarHBondContact CE1-CE1 3.42Å; H74-Y77 AromaticContact ND1-CD1 3.61Å; H74-Y77 AromaticContact ND1-CE1 3.99Å; H74-Y77 AromaticContact NE2-CE1 3.93Å; Y77-L79 HydrophobicContact CE1-CD2 4.27Å; Y77-L79 HydrophobicContact CE2-CD2 3.61Å; Y77-L79 HydrophobicContact CE2-CG 4.23Å; Y77-L79 VanDerWaalsContact CZ-CD2 3.47Å; Y77-L79 PolarHBondContact O-N 2.84Å; Y77-L79 VanDerWaalsContact O-N 3.16Å; Y77-L79 VanDerWaalsContact OH-CD2 3.29Å; Y77-L79 WeakPolarHBondContact OH-CD2 3.49Å; Y77-K87 HydrophobicContact CD2-CB 3.77Å; Y77-K87 HydrophobicContact CD2-CG 4.41Å; Y77-K87 HydrophobicContact CE2-CB 4.01Å; Y77-K87 HydrophobicContact CE2-CD 4.08Å; Y77-K87 HydrophobicContact CE2-CG 4.31Å; Y77-V88 WeakPolarHBondContact CA-O 3.27Å; Y77-V88 VanDerWaalsContact CB-O 3.3Å; Y77-V88 WeakPolarHBondContact CB-O 3.31Å; Y77-R121 HydrophobicContact CD1-CB 4.44Å; Y77-R121 HydrophobicContact CG-CB 4.26Å
78	H	94.1	Very high	92.4	Very high	76 Å²	76	55.7 Å²	55.7	35%	0.352	26%	0.264	S	S	.	.			trans	-73	105.1	-179.9	-65	91.9	0	0	0	111.7	R81 V88	H78-R81 HydrophobicContact CB-CG 3.94Å; H78-V88 PolarHBondContact N-O 3.18Å; H78-V88 PolarHBondContact ND1-O 3.44Å; H78-V88 VanDerWaalsContact ND1-O 3.12Å
79	L	87.7	Confident	92.4	Very high	114 Å²	114	55.1 Å²	55.1	60%	0.597	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-32.8	-177.6	-72.3	163.6	0	0	0	114	Y77 R81	Y77-L79 HydrophobicContact CE1-CD2 4.27Å; Y77-L79 HydrophobicContact CE2-CD2 3.61Å; Y77-L79 HydrophobicContact CE2-CG 4.23Å; Y77-L79 VanDerWaalsContact CZ-CD2 3.47Å; Y77-L79 PolarHBondContact O-N 2.84Å; Y77-L79 VanDerWaalsContact O-N 3.16Å; Y77-L79 VanDerWaalsContact OH-CD2 3.29Å; Y77-L79 WeakPolarHBondContact OH-CD2 3.49Å; L79-R81 PolarHBondContact O-N 2.9Å; L79-R81 VanDerWaalsContact O-N 3.15Å
80	N	85.6	Confident	92.3	Very high	163 Å²	163	56.2 Å²	56.2	87%	0.872	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	1.7	-169.9	-63.4	-16.2	0	0	0	113.9
81	R	83.4	Confident	92.2	Very high	137 Å²	137	62.1 Å²	62.1	52%	0.517	30%	0.299	S	S	.	.			trans	-83	137.9	179.4	-60.6	-70.4	-172.4	-174.8	-0.6	110.3	H78 L79 E86 K87	H78-R81 HydrophobicContact CB-CG 3.94Å; L79-R81 PolarHBondContact O-N 2.9Å; L79-R81 VanDerWaalsContact O-N 3.15Å; R81-E86 HydrophobicContact CB-CB 3.65Å; R81-E86 HydrophobicContact CG-CB 4.04Å; R81-E86 WeakPolarHBondContact CG-O 3.41Å; R81-K87 HydrophobicContact CB-CG 4.07Å; R81-K87 WeakPolarHBondContact O-CE 3.29Å
82	K	80.1	Confident	92.2	Very high	202 Å²	202	65 Å²	65	88%	0.878	32%	0.315	S	S	*	.	S	Bend	trans	-75	-48.2	-173.7	-70.5	-175.2	180	178.9	0	111.5
83	K	84.6	Confident	92.2	Very high	114 Å²	114	65 Å²	65	50%	0.496	32%	0.315	S	S	.	.	S	Bend	trans	-84	142.3	-177.8	-62.1	-175.7	-178.8	179.2	0	110.7	A85 E86	K83-A85 PolarHBondContact O-N 3.02Å; K83-E86 HydrophobicContact CB-CG 4.12Å; K83-E86 PolarHBondContact O-N 3.26Å
84	S	82.5	Confident	92.1	Very high	16 Å²	16	66.2 Å²	66.2	11%	0.112	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-59.3	-37	177.2	-170.6	0	0	0	0	112.3	E86 K87 I120 D159	S84-E86 PolarHBondContact O-N 2.81Å; S84-K87 WeakPolarHBondContact O-CB 3.4Å; S84-K87 PolarHBondContact O-N 2.76Å; S84-K87 VanDerWaalsContact O-N 3.09Å; S84-I120 WeakPolarHBondContact O-CG2 3.5Å; S84-D159 VanDerWaalsContact CB-OD1 3.32Å; S84-D159 WeakPolarHBondContact CB-OD1 3.23Å; S84-D159 WeakPolarHBondContact CB-OD2 3.32Å
85	A	84.9	Confident	92.1	Very high	32 Å²	32	73.5 Å²	73.5	26%	0.264	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-61.9	-22.7	175.9	0	0	0	0	0	114.4	K83 P152	K83-A85 PolarHBondContact O-N 3.02Å; A85-P152 HydrophobicContact CB-CB 4.16Å
86	E	87.3	Confident	92.1	Very high	79 Å²	79	73.5 Å²	73.5	37%	0.369	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-91.6	-10	178.6	-67.2	168.7	-164.3	0	0	112.5	R81 K83 S84 V88	R81-E86 HydrophobicContact CB-CB 3.65Å; R81-E86 HydrophobicContact CG-CB 4.04Å; R81-E86 WeakPolarHBondContact CG-O 3.41Å; K83-E86 HydrophobicContact CB-CG 4.12Å; K83-E86 PolarHBondContact O-N 3.26Å; S84-E86 PolarHBondContact O-N 2.81Å; E86-V88 PolarHBondContact O-N 2.97Å
87	K	92.9	Very high	92.1	Very high	56 Å²	56	70.9 Å²	70.9	24%	0.243	33%	0.334	C	S	.	.			trans	-79.2	54.3	179.7	-67.8	-179.2	176.1	179.5	0	111.2	Y77 R81 S84	Y77-K87 HydrophobicContact CD2-CB 3.77Å; Y77-K87 HydrophobicContact CD2-CG 4.41Å; Y77-K87 HydrophobicContact CE2-CB 4.01Å; Y77-K87 HydrophobicContact CE2-CD 4.08Å; Y77-K87 HydrophobicContact CE2-CG 4.31Å; R81-K87 HydrophobicContact CB-CG 4.07Å; R81-K87 WeakPolarHBondContact O-CE 3.29Å; S84-K87 WeakPolarHBondContact O-CB 3.4Å; S84-K87 PolarHBondContact O-N 2.76Å; S84-K87 VanDerWaalsContact O-N 3.09Å
88	V	95.3	Very high	92.2	Very high	38 Å²	38	73.7 Å²	73.7	23%	0.23	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-73.5	157.3	178.3	-61.3	0	0	0	0	111.5	Y77 H78 E86 I120	Y77-V88 WeakPolarHBondContact CA-O 3.27Å; Y77-V88 VanDerWaalsContact CB-O 3.3Å; Y77-V88 WeakPolarHBondContact CB-O 3.31Å; H78-V88 PolarHBondContact N-O 3.18Å; H78-V88 PolarHBondContact ND1-O 3.44Å; H78-V88 VanDerWaalsContact ND1-O 3.12Å; E86-V88 PolarHBondContact O-N 2.97Å; V88-I120 HydrophobicContact CG1-CG1 3.92Å; V88-I120 HydrophobicContact CG1-CG2 4.28Å
89	L	97.2	Very high	92.4	Very high	6 Å²	6	70.9 Å²	70.9	3%	0.031	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-56.5	147.2	174.9	-64.7	-172.3	0	0	0	111.4	G75 Q76 W94 R121 Q124	G75-L89 VanDerWaalsContact O-CD2 3.29Å; G75-L89 WeakPolarHBondContact O-CD2 3.23Å; Q76-L89 WeakPolarHBondContact O-CA 3.44Å; Q76-L89 WeakPolarHBondContact O-CD2 3.24Å; L89-W94 HydrophobicContact CB-CG 4.3Å; L89-W94 HydrophobicContact CD1-CD2 4.29Å; L89-W94 HydrophobicContact CD1-CG 4.34Å; L89-R121 HydrophobicContact CD2-CB 4.05Å; L89-Q124 HydrophobicContact CD1-CB 3.7Å; L89-Q124 HydrophobicContact CG-CB 3.8Å
90	T	96.7	Very high	92.9	Very high	22 Å²	22	65.5 Å²	65.5	14%	0.135	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-80.1	170.2	164.7	64.9	0	0	0	0	109.5	Q76 I92 G93 W94	Q76-T90 HydrophobicContact CG-CG2 4.4Å; Q76-T90 PolarHBondContact O-N 2.93Å; Q76-T90 PolarHBondContact O-OG1 2.93Å; T90-I92 PolarHBondContact O-N 3.22Å; T90-I92 PolarHBondContact OG1-N 2.77Å; T90-G93 WeakPolarHBondContact O-CA 3.41Å; T90-G93 PolarHBondContact O-N 2.78Å; T90-G93 PolarHBondContact OG1-N 3.42Å; T90-W94 PolarHBondContact O-N 3.13Å
91	D	96.9	Very high	93.4	Very high	124 Å²	124	57.7 Å²	57.7	66%	0.663	27%	0.265	S	S	*	.	H	α-helix	trans	-57.7	-39.3	173.2	-60.7	-11.8	0	0	0	111.8	G93 W94 R95	D91-G93 VanDerWaalsContact C-N 3.34Å; D91-W94 PolarHBondContact O-N 3.33Å; D91-R95 WeakPolarHBondContact O-CG 3.27Å; D91-R95 PolarHBondContact O-N 2.87Å; D91-R95 VanDerWaalsContact O-N 3.13Å
92	I	98	Very high	94	Very high	63 Å²	63	51.9 Å²	51.9	32%	0.323	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-44.2	173	-64.7	172.5	0	0	0	110	T90 W94 R95 Q96 L389 T391	T90-I92 PolarHBondContact O-N 3.22Å; T90-I92 PolarHBondContact OG1-N 2.77Å; I92-W94 PolarHBondContact O-N 3.17Å; I92-R95 PolarHBondContact O-N 3.47Å; I92-Q96 HydrophobicContact CG2-CG 4.25Å; I92-Q96 VanDerWaalsContact O-CG 3.26Å; I92-Q96 WeakPolarHBondContact O-CG 3.31Å; I92-Q96 PolarHBondContact O-N 3.47Å; I92-L389 HydrophobicContact CG2-CD2 4.19Å; I92-T391 HydrophobicContact CG2-CG2 4.12Å
93	G	98.4	Very high	94.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-41	177.9	0	0	0	0	0	114.2	Q76 T90 D91 Q96 A97	Q76-G93 VanDerWaalsContact N-CA 3.35Å; Q76-G93 WeakPolarHBondContact O-CA 3.36Å; T90-G93 WeakPolarHBondContact O-CA 3.41Å; T90-G93 PolarHBondContact O-N 2.78Å; T90-G93 PolarHBondContact OG1-N 3.42Å; D91-G93 VanDerWaalsContact C-N 3.34Å; G93-Q96 PolarHBondContact O-N 2.73Å; G93-A97 WeakPolarHBondContact O-CB 3.24Å; G93-A97 PolarHBondContact O-N 3.4Å; G93-A97 VanDerWaalsContact O-N 3.08Å
94	W	97.8	Very high	95.5	Very high	60 Å²	60	40.7 Å²	40.7	23%	0.227	20%	0.195	C	C	.	.	H	α-helix	trans	-60.4	-48.1	173	-86	102.4	0	0	0	111.8	L89 T90 D91 I92 Q96 A97 Y98 Q124 A127 A128 V150	L89-W94 HydrophobicContact CB-CG 4.3Å; L89-W94 HydrophobicContact CD1-CD2 4.29Å; L89-W94 HydrophobicContact CD1-CG 4.34Å; T90-W94 PolarHBondContact O-N 3.13Å; D91-W94 PolarHBondContact O-N 3.33Å; I92-W94 PolarHBondContact O-N 3.17Å; W94-Q96 PolarHBondContact O-N 3Å; W94-A97 PolarHBondContact O-N 3.15Å; W94-Y98 WeakPolarHBondContact O-CB 3.28Å; W94-Y98 PolarHBondContact O-N 2.91Å; W94-Q124 HydrophobicContact CH2-CB 4.1Å; W94-Q124 HydrophobicContact CH2-CG 4.32Å; W94-Q124 HydrophobicContact CZ2-CB 3.72Å; W94-Q124 HydrophobicContact CZ2-CG 3.75Å; W94-A127 HydrophobicContact CH2-CB 4.09Å; W94-A127 HydrophobicContact CZ3-CB 4.23Å; W94-A128 HydrophobicContact CE3-CB 3.59Å; W94-A128 HydrophobicContact CZ3-CB 3.74Å; W94-V150 HydrophobicContact CH2-CG1 4.26Å; W94-V150 HydrophobicContact CH2-CG2 3.68Å; W94-V150 HydrophobicContact CZ2-CG1 3.98Å; W94-V150 HydrophobicContact CZ2-CG2 4.22Å
95	R	98	Very high	96.1	Very high	156 Å²	156	43.4 Å²	43.4	59%	0.589	20%	0.202	S	C	*	.	H	α-helix	trans	-65	-38.9	179.4	-66.8	177.3	-168.4	-176.4	4.2	112.3	D91 I92 Y98 A99 L389	D91-R95 WeakPolarHBondContact O-CG 3.27Å; D91-R95 PolarHBondContact O-N 2.87Å; D91-R95 VanDerWaalsContact O-N 3.13Å; I92-R95 PolarHBondContact O-N 3.47Å; R95-Y98 PolarHBondContact O-N 3.37Å; R95-A99 VanDerWaalsContact O-CB 3.28Å; R95-A99 WeakPolarHBondContact O-CB 3.46Å; R95-A99 PolarHBondContact O-N 3.22Å; R95-L389 HydrophobicContact CB-CD1 3.65Å; R95-L389 HydrophobicContact CB-CD2 3.84Å; R95-L389 HydrophobicContact CB-CG 4.45Å
96	Q	98.6	Very high	96.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59	-49.3	174.2	-73.5	164.9	-13.1	0	0	111.5	I92 G93 W94 A99 A100 H337 L385 L389 T391	I92-Q96 HydrophobicContact CG2-CG 4.25Å; I92-Q96 VanDerWaalsContact O-CG 3.26Å; I92-Q96 WeakPolarHBondContact O-CG 3.31Å; I92-Q96 PolarHBondContact O-N 3.47Å; G93-Q96 PolarHBondContact O-N 2.73Å; W94-Q96 PolarHBondContact O-N 3Å; Q96-A99 PolarHBondContact O-N 2.81Å; Q96-A100 PolarHBondContact O-N 3.48Å; Q96-H337 VanDerWaalsContact OE1-CB 3.24Å; Q96-L385 HydrophobicContact CB-CD2 4.29Å; Q96-L385 HydrophobicContact CG-CD1 4.15Å; Q96-L385 HydrophobicContact CG-CD2 4.41Å; Q96-L389 HydrophobicContact CG-CB 4.04Å; Q96-L389 PolarHBondContact NE2-O 3.24Å; Q96-T391 PolarHBondContact NE2-OG1 3.02Å
97	A	98.3	Very high	97	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.9	-40	-178.6	0	0	0	0	0	112.2	G93 W94 A100 G101 T125 A128 V129	G93-A97 WeakPolarHBondContact O-CB 3.24Å; G93-A97 PolarHBondContact O-N 3.4Å; G93-A97 VanDerWaalsContact O-N 3.08Å; W94-A97 PolarHBondContact O-N 3.15Å; A97-A100 WeakPolarHBondContact O-CB 3.2Å; A97-A100 PolarHBondContact O-N 3.01Å; A97-G101 PolarHBondContact O-N 3.24Å; A97-G101 VanDerWaalsContact O-N 3.1Å; A97-T125 HydrophobicContact CB-CG2 3.64Å; A97-A128 HydrophobicContact CB-CB 3.5Å; A97-A128 VanDerWaalsContact CB-CB 3.5Å; A97-V129 HydrophobicContact CB-CG2 4.47Å; A97-V129 VanDerWaalsContact O-CG2 3.26Å; A97-V129 WeakPolarHBondContact O-CG2 3.18Å
98	Y	97.3	Very high	97	Very high	90 Å²	90	48.1 Å²	48.1	35%	0.353	24%	0.236	S	C	.	.	H	α-helix	trans	-61.8	-44.6	173.2	176.1	-98.2	0	0	0	112.1	W94 R95 A100 G101 C102 I131 V137	W94-Y98 WeakPolarHBondContact O-CB 3.28Å; W94-Y98 PolarHBondContact O-N 2.91Å; R95-Y98 PolarHBondContact O-N 3.37Å; Y98-A100 VanDerWaalsContact C-N 3.3Å; Y98-A100 PolarHBondContact O-N 3.47Å; Y98-G101 PolarHBondContact O-N 3.04Å; Y98-G101 VanDerWaalsContact O-N 3.14Å; Y98-C102 WeakPolarHBondContact CE1-SG 3.49Å; Y98-C102 VanDerWaalsContact CZ-SG 3.6Å; Y98-C102 PolarHBondContact O-N 2.87Å; Y98-C102 PolarHBondContact O-SG 2.98Å; Y98-C102 VanDerWaalsContact O-SG 3.37Å; Y98-I131 HydrophobicContact CD2-CB 4.46Å; Y98-I131 HydrophobicContact CD2-CG2 4.17Å; Y98-I131 HydrophobicContact CE2-CG2 3.94Å; Y98-V137 HydrophobicContact CE2-CG2 4.43Å
99	A	97.8	Very high	96.9	Very high	17 Å²	17	47.7 Å²	47.7	14%	0.14	23%	0.232	C	C	.	.	H	α-helix	trans	-62.6	-36.6	176.2	0	0	0	0	0	112.1	R95 Q96 G101 C102 R103 L385	R95-A99 VanDerWaalsContact O-CB 3.28Å; R95-A99 WeakPolarHBondContact O-CB 3.46Å; R95-A99 PolarHBondContact O-N 3.22Å; Q96-A99 PolarHBondContact O-N 2.81Å; A99-G101 VanDerWaalsContact C-N 3.35Å; A99-C102 PolarHBondContact O-N 2.82Å; A99-R103 WeakPolarHBondContact O-CB 3.26Å; A99-R103 PolarHBondContact O-N 2.91Å; A99-L385 HydrophobicContact CB-CD2 3.72Å
100	A	98.2	Very high	96.6	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-40.5	173.3	0	0	0	0	0	112	I72 Q96 A97 Y98 R103 L104 I340	I72-A100 HydrophobicContact CD1-CB 4.17Å; Q96-A100 PolarHBondContact O-N 3.48Å; A97-A100 WeakPolarHBondContact O-CB 3.2Å; A97-A100 PolarHBondContact O-N 3.01Å; Y98-A100 VanDerWaalsContact C-N 3.3Å; Y98-A100 PolarHBondContact O-N 3.47Å; A100-R103 PolarHBondContact O-N 3.3Å; A100-L104 WeakPolarHBondContact O-CG 3.43Å; A100-L104 PolarHBondContact O-N 2.81Å; A100-L104 VanDerWaalsContact O-N 3.07Å; A100-I340 HydrophobicContact CB-CD1 4.25Å; A100-I340 HydrophobicContact CB-CG1 4.29Å
101	G	97.5	Very high	96.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-46.5	171.6	0	0	0	0	0	112.6	A97 Y98 A99 R103 L104 R105 G132	A97-G101 PolarHBondContact O-N 3.24Å; A97-G101 VanDerWaalsContact O-N 3.1Å; Y98-G101 PolarHBondContact O-N 3.04Å; Y98-G101 VanDerWaalsContact O-N 3.14Å; A99-G101 VanDerWaalsContact C-N 3.35Å; G101-R103 VanDerWaalsContact C-N 3.29Å; G101-R103 PolarHBondContact O-N 2.89Å; G101-L104 PolarHBondContact O-N 3.34Å; G101-R105 PolarHBondContact O-N 2.86Å; G101-R105 VanDerWaalsContact O-N 3.15Å; G101-G132 VanDerWaalsContact C-C 3.42Å; G101-G132 CarbonylContact C-O 3.4Å
102	C	96.6	Very high	96.7	Very high	15 Å²	15	45.8 Å²	45.8	10%	0.101	22%	0.217	C	C	.	.	H	α-helix	trans	-58.4	-43.3	175.8	-66.7	0	0	0	0	111.4	Y98 A99 L104 R105 E106 G132	Y98-C102 WeakPolarHBondContact CE1-SG 3.49Å; Y98-C102 VanDerWaalsContact CZ-SG 3.6Å; Y98-C102 PolarHBondContact O-N 2.87Å; Y98-C102 PolarHBondContact O-SG 2.98Å; Y98-C102 VanDerWaalsContact O-SG 3.37Å; A99-C102 PolarHBondContact O-N 2.82Å; C102-L104 PolarHBondContact O-N 3.23Å; C102-R105 WeakPolarHBondContact O-CB 3.35Å; C102-R105 PolarHBondContact O-N 2.77Å; C102-R105 PolarHBondContact SG-NH2 2.71Å; C102-E106 WeakPolarHBondContact O-CG 3.08Å; C102-E106 PolarHBondContact O-N 2.55Å; C102-G132 WeakPolarHBondContact CA-O 3.34Å; C102-G132 PolarHBondContact N-O 2.87Å
103	R	97.7	Very high	96.7	Very high	81 Å²	81	43.7 Å²	43.7	31%	0.306	21%	0.205	S	C	.	.	H	α-helix	trans	-60.6	-44.5	178.1	-179.6	55.3	175	176.2	1	112.4	A99 A100 G101 R105 E106 M107 I340 H384	A99-R103 WeakPolarHBondContact O-CB 3.26Å; A99-R103 PolarHBondContact O-N 2.91Å; A100-R103 PolarHBondContact O-N 3.3Å; G101-R103 VanDerWaalsContact C-N 3.29Å; G101-R103 PolarHBondContact O-N 2.89Å; R103-R105 VanDerWaalsContact C-N 3.3Å; R103-R105 PolarHBondContact O-N 3.32Å; R103-E106 IonicContact NH1-OE2 3.88Å; R103-E106 PolarHBondContact O-N 2.84Å; R103-M107 HydrophobicContact CG-SD 4.18Å; R103-M107 VanDerWaalsContact O-CG 3.25Å; R103-M107 WeakPolarHBondContact O-CG 3.25Å; R103-M107 PolarHBondContact O-N 2.94Å; R103-I340 HydrophobicContact CB-CD1 3.94Å; R103-I340 HydrophobicContact CG-CD1 3.7Å; R103-H384 HydrophobicContact CB-CB 3.77Å; R103-H384 HydrophobicContact CG-CB 3.6Å
104	L	97.4	Very high	96.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-41	177.5	-71.5	179.3	0	0	0	112	I70 I72 A100 G101 C102 M107 I109 V129 L133 L307	I70-L104 HydrophobicContact CD1-CD2 3.91Å; I70-L104 HydrophobicContact CG2-CD2 4.31Å; I72-L104 HydrophobicContact CD1-CD1 3.84Å; A100-L104 WeakPolarHBondContact O-CG 3.43Å; A100-L104 PolarHBondContact O-N 2.81Å; A100-L104 VanDerWaalsContact O-N 3.07Å; G101-L104 PolarHBondContact O-N 3.34Å; C102-L104 PolarHBondContact O-N 3.23Å; L104-M107 PolarHBondContact O-N 2.85Å; L104-I109 HydrophobicContact CD2-CD1 4.03Å; L104-I109 PolarHBondContact O-N 2.8Å; L104-V129 HydrophobicContact CD1-CG1 4.44Å; L104-L133 HydrophobicContact CB-CD2 3.67Å; L104-L133 HydrophobicContact CD1-CD2 4.23Å; L104-L307 HydrophobicContact CD1-CD1 4.39Å; L104-L307 HydrophobicContact CD1-CD2 3.75Å
105	R	95.3	Very high	96.8	Very high	72 Å²	72	40.9 Å²	40.9	27%	0.272	19%	0.194	S	C	.	.	H	α-helix	trans	-63.7	-47.4	175.2	172.9	-177.8	56.4	-174.9	-17.5	111.9	G101 C102 R103 M107 G108 G132 Q134 N135	G101-R105 PolarHBondContact O-N 2.86Å; G101-R105 VanDerWaalsContact O-N 3.15Å; C102-R105 WeakPolarHBondContact O-CB 3.35Å; C102-R105 PolarHBondContact O-N 2.77Å; C102-R105 PolarHBondContact SG-NH2 2.71Å; R103-R105 VanDerWaalsContact C-N 3.3Å; R103-R105 PolarHBondContact O-N 3.32Å; R105-M107 PolarHBondContact O-N 2.66Å; R105-G108 PolarHBondContact O-N 2.79Å; R105-G132 VanDerWaalsContact CZ-O 3.3Å; R105-G132 PolarHBondContact NE-O 2.64Å; R105-G132 PolarHBondContact NH2-O 2.8Å; R105-Q134 PolarHBondContact NH1-O 3.04Å; R105-N135 VanDerWaalsContact CD-OD1 3.27Å; R105-N135 WeakPolarHBondContact CD-OD1 3.44Å; R105-N135 PolarHBondContact NH1-OD1 3.32Å
106	E	96.2	Very high	96.8	Very high	131 Å²	131	33.6 Å²	33.6	61%	0.612	17%	0.167	S	C	*	.	H	α-helix	trans	-58.7	-35.2	177.5	-73.6	166.7	-169	0	0	112.6	C102 R103 G108	C102-E106 WeakPolarHBondContact O-CG 3.08Å; C102-E106 PolarHBondContact O-N 2.55Å; R103-E106 IonicContact NH1-OE2 3.88Å; R103-E106 PolarHBondContact O-N 2.84Å; E106-G108 PolarHBondContact O-N 2.78Å
107	M	95.3	Very high	96.8	Very high	78 Å²	78	33.6 Å²	33.6	38%	0.384	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-8.4	175.8	-69.1	176.7	72.7	0	0	113.4	R103 L104 R105 I109 I342	R103-M107 HydrophobicContact CG-SD 4.18Å; R103-M107 VanDerWaalsContact O-CG 3.25Å; R103-M107 WeakPolarHBondContact O-CG 3.25Å; R103-M107 PolarHBondContact O-N 2.94Å; L104-M107 PolarHBondContact O-N 2.85Å; R105-M107 PolarHBondContact O-N 2.66Å; M107-I109 HydrophobicContact CB-CD1 3.87Å; M107-I109 HydrophobicContact CB-CG1 3.87Å; M107-I109 HydrophobicContact CE-CD1 3.73Å; M107-I109 PolarHBondContact O-N 3.39Å; M107-I109 HydrophobicContact SD-CD1 3.97Å; M107-I342 HydrophobicContact CE-CD1 3.67Å; M107-I342 HydrophobicContact SD-CD1 4.38Å
108	G	93.5	Very high	96.6	Very high	57 Å²	57	35.1 Å²	35.1	59%	0.588	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.3	22.1	-177.4	0	0	0	0	0	113.7	R105 E106 K110	R105-G108 PolarHBondContact O-N 2.79Å; E106-G108 PolarHBondContact O-N 2.78Å; G108-K110 PolarHBondContact O-N 2.87Å
109	I	91.4	Very high	96.6	Very high	30 Å²	30	31.5 Å²	31.5	15%	0.154	16%	0.162	C	C	.	.			trans	-74.6	121.4	-177.4	-68	170.9	0	0	0	109.8	L68 I70 L104 M107 V111 T305	L68-I109 HydrophobicContact CD2-CD1 4.24Å; L68-I109 HydrophobicContact CD2-CG1 4.38Å; L68-I109 HydrophobicContact CD2-CG2 4.04Å; I70-I109 HydrophobicContact CD1-CD1 3.93Å; I70-I109 HydrophobicContact CD1-CG2 3.96Å; L104-I109 HydrophobicContact CD2-CD1 4.03Å; L104-I109 PolarHBondContact O-N 2.8Å; M107-I109 HydrophobicContact CB-CD1 3.87Å; M107-I109 HydrophobicContact CB-CG1 3.87Å; M107-I109 HydrophobicContact CE-CD1 3.73Å; M107-I109 PolarHBondContact O-N 3.39Å; M107-I109 HydrophobicContact SD-CD1 3.97Å; I109-V111 HydrophobicContact CG2-CG2 4.41Å; I109-V111 PolarHBondContact O-N 3.18Å; I109-T305 HydrophobicContact CG2-CG2 3.75Å
110	K	92.4	Very high	96.5	Very high	95 Å²	95	31 Å²	31	41%	0.413	16%	0.157	S	C	.	.			trans	-82.9	104.5	171.6	-61.5	176.4	-166.9	164.3	0	109.4	G108 E301 T305	G108-K110 PolarHBondContact O-N 2.87Å; K110-E301 IonicContact NZ-OE1 2.87Å; K110-E301 PolarHBondContact NZ-OE1 3.38Å; K110-E301 IonicContact NZ-OE2 2.77Å; K110-E301 PolarHBondContact NZ-OE2 3.35Å; K110-T305 WeakPolarHBondContact O-CB 3.45Å; K110-T305 PolarHBondContact O-OG1 2.81Å; K110-T305 VanDerWaalsContact O-OG1 3.07Å
111	V	97.4	Very high	96.4	Very high	14 Å²	14	31.5 Å²	31.5	9%	0.085	16%	0.159	C	C	.	.			trans	-77.1	136.5	174.7	-180	0	0	0	0	109.4	I109 I114 F201 L307	I109-V111 HydrophobicContact CG2-CG2 4.41Å; I109-V111 PolarHBondContact O-N 3.18Å; V111-I114 HydrophobicContact CG1-CG1 3.77Å; V111-F201 HydrophobicContact CG1-CD2 4.35Å; V111-F201 HydrophobicContact CG1-CG 4.36Å; V111-F201 VanDerWaalsContact O-CB 3.27Å; V111-F201 WeakPolarHBondContact O-CB 3.49Å; V111-L307 HydrophobicContact CG1-CB 4.32Å
112	D	97.9	Very high	96.4	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.011	16%	0.159	C	C	.	.	S	Bend	trans	-104.5	-32.5	173.4	-63.9	-66.9	0	0	0	112.5	F201 D202 T253 Q255 R296 E304 T305	D112-F201 WeakPolarHBondContact O-CB 3.45Å; D112-D202 PolarHBondContact O-N 3.33Å; D112-T253 HydrophobicContact CB-CG2 4.01Å; D112-Q255 VanDerWaalsContact OD1-CB 3.24Å; D112-Q255 WeakPolarHBondContact OD1-CB 3.45Å; D112-R296 IonicContact OD1-CZ 3.78Å; D112-R296 VanDerWaalsContact OD1-CZ 3.27Å; D112-R296 IonicContact OD1-NH1 2.86Å; D112-R296 PolarHBondContact OD1-NH1 3.48Å; D112-R296 IonicContact OD1-NH2 3.86Å; D112-R296 PolarHBondContact OD1-NH2 3.12Å; D112-R296 IonicContact OD2-CZ 2.78Å; D112-R296 IonicContact OD2-NH1 2.73Å; D112-R296 PolarHBondContact OD2-NH1 3.28Å; D112-R296 IonicContact OD2-NH2 3.27Å; D112-E304 VanDerWaalsContact OD2-CA 3.27Å; D112-E304 WeakPolarHBondContact OD2-CA 3.44Å; D112-T305 PolarHBondContact N-O 3.02Å; D112-T305 PolarHBondContact OD2-N 3.04Å
113	R	98.5	Very high	96.5	Very high	20 Å²	20	31 Å²	31	8%	0.075	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	140.2	176.3	176.9	167.6	-68.7	163.4	6.1	112.4	I115 D202 T253 T305 I306 L307	R113-I115 HydrophobicContact CG-CD1 4.39Å; R113-I115 HydrophobicContact CG-CG1 3.74Å; R113-D202 CarbonylContact C-O 3.47Å; R113-D202 VanDerWaalsContact CA-O 3.24Å; R113-D202 WeakPolarHBondContact CA-O 3.31Å; R113-D202 WeakPolarHBondContact CB-OD1 3.45Å; R113-D202 VanDerWaalsContact CG-OD1 3.28Å; R113-D202 WeakPolarHBondContact CG-OD1 3.44Å; R113-D202 IonicContact CZ-OD1 2.74Å; R113-D202 IonicContact CZ-OD2 2.83Å; R113-D202 IonicContact NE-OD1 2.89Å; R113-D202 PolarHBondContact NE-OD1 2.93Å; R113-D202 IonicContact NE-OD2 3.95Å; R113-D202 IonicContact NH2-OD1 3.9Å; R113-D202 PolarHBondContact NH2-OD1 3.3Å; R113-D202 IonicContact NH2-OD2 3.65Å; R113-D202 PolarHBondContact NH2-OD2 3.43Å; R113-T253 HydrophobicContact CB-CG2 3.59Å; R113-T305 PolarHBondContact N-O 2.9Å; R113-I306 WeakPolarHBondContact O-CA 3.32Å; R113-L307 PolarHBondContact O-N 3.09Å
114	I	98.7	Very high	96.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.1	166.8	-52.9	-176.3	0	0	0	109.9	V111 T126 L130 L133 F201 D202 C203 Q204 L307 I309	V111-I114 HydrophobicContact CG1-CG1 3.77Å; I114-T126 HydrophobicContact CG2-CG2 4.22Å; I114-L130 HydrophobicContact CD1-CD2 3.7Å; I114-L130 HydrophobicContact CD1-CG 4.41Å; I114-L133 HydrophobicContact CD1-CD1 4.13Å; I114-F201 HydrophobicContact CD1-CD2 4.22Å; I114-F201 HydrophobicContact CD1-CE2 3.51Å; I114-F201 HydrophobicContact CD1-CZ 4.15Å; I114-F201 HydrophobicContact CG1-CD2 4.09Å; I114-F201 HydrophobicContact CG1-CE2 3.88Å; I114-D202 PolarHBondContact N-O 2.91Å; I114-C203 CarbonylContact O-C 3.53Å; I114-C203 WeakPolarHBondContact O-CA 3.26Å; I114-Q204 PolarHBondContact O-N 3.35Å; I114-L307 CarbonylContact C-O 3.45Å; I114-L307 VanDerWaalsContact CA-O 3.3Å; I114-L307 WeakPolarHBondContact CA-O 3.3Å; I114-L307 HydrophobicContact CD1-CD2 4.02Å; I114-L307 HydrophobicContact CG1-CB 4.21Å; I114-L307 HydrophobicContact CG1-CD2 4.04Å; I114-L307 HydrophobicContact CG1-CG 4.49Å; I114-L307 HydrophobicContact CG2-CD2 4.23Å; I114-L307 HydrophobicContact CG2-CG 4.28Å; I114-I309 HydrophobicContact CG2-CD1 3.66Å; I114-I309 HydrophobicContact CG2-CG1 4.01Å
115	I	98.7	Very high	96.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.7	174.3	-48.6	-173	0	0	0	108.6	R113 Q204 L209 H246 I306 L307 F308 I309	R113-I115 HydrophobicContact CG-CD1 4.39Å; R113-I115 HydrophobicContact CG-CG1 3.74Å; I115-Q204 WeakPolarHBondContact CA-O 3.45Å; I115-Q204 HydrophobicContact CG1-CB 4.44Å; I115-L209 HydrophobicContact CB-CD1 4.28Å; I115-L209 HydrophobicContact CG2-CD1 3.65Å; I115-H246 WeakPolarHBondContact CD1-ND1 3.4Å; I115-I306 HydrophobicContact CD1-CG2 3.85Å; I115-I306 HydrophobicContact CG1-CG2 3.87Å; I115-L307 PolarHBondContact N-O 3.2Å; I115-F308 HydrophobicContact CB-CD1 3.91Å; I115-F308 HydrophobicContact CB-CE1 3.95Å; I115-F308 HydrophobicContact CD1-CE1 3.78Å; I115-F308 HydrophobicContact CD1-CZ 3.97Å; I115-F308 HydrophobicContact CG1-CE1 4.26Å; I115-F308 HydrophobicContact CG2-CD1 4.37Å; I115-F308 HydrophobicContact CG2-CE1 4.29Å; I115-F308 CarbonylContact O-C 3.54Å; I115-F308 VanDerWaalsContact O-CA 3.22Å; I115-F308 WeakPolarHBondContact O-CA 3.27Å; I115-I309 PolarHBondContact O-N 3.11Å
116	H	98.6	Very high	96.7	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.019	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	153.5	-176.2	67.1	86.3	0	0	0	113	T126 Y193 Q204 L205 S206 I309	H116-T126 HydrophobicContact CB-CG2 4.4Å; H116-T126 WeakPolarHBondContact CB-OG1 3.49Å; H116-Y193 AromaticContact NE2-CE1 3.69Å; H116-Y193 AromaticContact NE2-CZ 3.66Å; H116-Y193 PolarHBondContact NE2-OH 3.2Å; H116-Q204 PolarHBondContact N-O 3.32Å; H116-L205 VanDerWaalsContact CE1-CD1 3.41Å; H116-L205 WeakPolarHBondContact CE1-CD1 3.27Å; H116-S206 PolarHBondContact O-N 3.03Å; H116-I309 WeakPolarHBondContact CA-O 3.23Å; H116-I309 HydrophobicContact CB-CB 4.11Å
117	S	97.9	Very high	96.7	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.101	C	C	.	.			trans	-67.9	155.3	169.8	169.2	0	0	0	0	111.4	L119 R123 I309 H311	S117-L119 PolarHBondContact OG-N 2.68Å; S117-R123 WeakPolarHBondContact O-CG 3.42Å; S117-I309 PolarHBondContact N-O 3.32Å; S117-H311 WeakPolarHBondContact CB-NE2 3.22Å; S117-H311 PolarHBondContact OG-NE2 2.84Å
118	D	95.3	Very high	96.8	Very high	31 Å²	31	14.4 Å²	14.4	17%	0.166	8%	0.083	C	C	.	.	S	Bend	trans	-73.2	-19.2	173.3	63	-34.3	0	0	0	115	R123 L205 R207 T210	D118-R123 WeakPolarHBondContact O-CD 3.46Å; D118-L205 VanDerWaalsContact CA-CD1 3.43Å; D118-L205 HydrophobicContact CB-CD1 3.8Å; D118-L205 HydrophobicContact CB-CD2 4.41Å; D118-R207 HydrophobicContact CB-CG 4.23Å; D118-T210 VanDerWaalsContact CG-OG1 3.3Å; D118-T210 WeakPolarHBondContact OD1-CB 3.17Å; D118-T210 PolarHBondContact OD1-OG1 3.35Å; D118-T210 PolarHBondContact OD2-OG1 3.43Å
119	L	95.5	Very high	97	Very high	15 Å²	15	11.7 Å²	11.7	8%	0.079	6%	0.055	C	C	.	.	S	Bend	trans	-68.5	138.1	-178.9	-60.3	-173.2	0	0	0	110.8	S117 R121 A122 R123 T210 E211	S117-L119 PolarHBondContact OG-N 2.68Å; L119-R121 VanDerWaalsContact C-N 3.27Å; L119-R121 HydrophobicContact CB-CG 4.48Å; L119-R121 PolarHBondContact O-N 3.36Å; L119-R121 VanDerWaalsContact O-N 3.14Å; L119-A122 WeakPolarHBondContact O-CA 3.46Å; L119-A122 WeakPolarHBondContact O-CB 3.41Å; L119-A122 PolarHBondContact O-N 2.9Å; L119-R123 PolarHBondContact O-N 3.43Å; L119-T210 HydrophobicContact CD1-CG2 3.88Å; L119-T210 HydrophobicContact CD2-CG2 3.95Å; L119-T210 HydrophobicContact CG-CG2 3.9Å; L119-E211 HydrophobicContact CD1-CB 3.9Å
120	I	96	Very high	97.2	Very high	6 Å²	6	10.2 Å²	10.2	3%	0.031	5%	0.048	C	C	.	.	H	α-helix	trans	-55.1	-39.4	-170.4	-171	56.2	0	0	0	113.4	S84 V88 A122 R123 Q124 P152	S84-I120 WeakPolarHBondContact O-CG2 3.5Å; V88-I120 HydrophobicContact CG1-CG1 3.92Å; V88-I120 HydrophobicContact CG1-CG2 4.28Å; I120-A122 VanDerWaalsContact C-N 3.3Å; I120-A122 PolarHBondContact O-N 2.78Å; I120-R123 PolarHBondContact O-N 3.01Å; I120-Q124 HydrophobicContact CD1-CG 4.05Å; I120-Q124 HydrophobicContact CG1-CG 4.28Å; I120-Q124 WeakPolarHBondContact O-CB 3.38Å; I120-Q124 WeakPolarHBondContact O-CG 3.47Å; I120-Q124 PolarHBondContact O-N 3.07Å; I120-P152 HydrophobicContact CD1-CG 4.47Å; I120-P152 HydrophobicContact CG1-CG 4.38Å
121	R	96.8	Very high	97.3	Very high	10 Å²	10	5.8 Å²	5.8	4%	0.038	3%	0.028	C	C	.	.	H	α-helix	trans	-58.9	-37.9	174.4	60.5	-172.5	172.3	-77.9	5.4	113.4	H74 Y77 L89 L119 T125 E211 H311	H74-R121 HydrophobicContact CB-CB 4.45Å; H74-R121 HydrophobicContact CB-CG 4.38Å; Y77-R121 HydrophobicContact CD1-CB 4.44Å; Y77-R121 HydrophobicContact CG-CB 4.26Å; L89-R121 HydrophobicContact CD2-CB 4.05Å; L119-R121 VanDerWaalsContact C-N 3.27Å; L119-R121 HydrophobicContact CB-CG 4.48Å; L119-R121 PolarHBondContact O-N 3.36Å; L119-R121 VanDerWaalsContact O-N 3.14Å; R121-T125 WeakPolarHBondContact O-CB 3.21Å; R121-T125 PolarHBondContact O-N 3.33Å; R121-T125 VanDerWaalsContact O-N 3.11Å; R121-T125 PolarHBondContact O-OG1 2.99Å; R121-E211 IonicContact CZ-OE2 3.67Å; R121-E211 IonicContact NE-OE2 3.16Å; R121-E211 IonicContact NH2-OE2 2.99Å; R121-E211 PolarHBondContact NH2-OE2 2.93Å; R121-H311 PolarHBondContact NE-CE1 3.22Å; R121-H311 PolarHBondContact NE-ND1 2.86Å
122	A	98	Very high	97.2	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-75.4	-40.4	177.2	0	0	0	0	0	111	L119 I120 T125 T126	L119-A122 WeakPolarHBondContact O-CA 3.46Å; L119-A122 WeakPolarHBondContact O-CB 3.41Å; L119-A122 PolarHBondContact O-N 2.9Å; I120-A122 VanDerWaalsContact C-N 3.3Å; I120-A122 PolarHBondContact O-N 2.78Å; A122-T125 WeakPolarHBondContact O-CB 3.46Å; A122-T125 PolarHBondContact O-N 3.34Å; A122-T126 PolarHBondContact O-N 3.33Å; A122-T126 PolarHBondContact O-OG1 3.26Å
123	R	97.7	Very high	97.1	Very high	4 Å²	4	6 Å²	6	2%	0.015	3%	0.029	C	C	.	.	H	α-helix	trans	-62.8	-46.7	176.3	-67.3	168.2	57.3	-157.3	-0.8	112.5	S117 D118 L119 I120 T125 T126 A127 Q148 L149 I151 Y153	S117-R123 WeakPolarHBondContact O-CG 3.42Å; D118-R123 WeakPolarHBondContact O-CD 3.46Å; L119-R123 PolarHBondContact O-N 3.43Å; I120-R123 PolarHBondContact O-N 3.01Å; R123-T125 VanDerWaalsContact C-N 3.28Å; R123-T125 PolarHBondContact O-N 3.39Å; R123-T126 WeakPolarHBondContact O-CA 3.12Å; R123-T126 VanDerWaalsContact O-CB 3.26Å; R123-T126 WeakPolarHBondContact O-CB 3.5Å; R123-T126 PolarHBondContact O-N 3.19Å; R123-T126 VanDerWaalsContact O-N 3.08Å; R123-A127 PolarHBondContact O-N 3.26Å; R123-Q148 PolarHBondContact NH2-O 2.83Å; R123-L149 CarbonylContact C-O 3.59Å; R123-L149 HydrophobicContact CB-CB 4.36Å; R123-L149 HydrophobicContact CB-CD2 3.9Å; R123-L149 WeakPolarHBondContact CB-O 3.49Å; R123-L149 HydrophobicContact CG-CD2 4.09Å; R123-I151 PolarHBondContact NH1-O 3.27Å; R123-I151 PolarHBondContact NH2-O 3.38Å; R123-Y153 VanDerWaalsContact CZ-CZ 3.44Å; R123-Y153 VanDerWaalsContact NH1-CZ 3.3Å
124	Q	97.8	Very high	96.7	Very high	12 Å²	12	8 Å²	8	6%	0.056	4%	0.039	C	C	.	.	H	α-helix	trans	-63	-35.9	173.9	-73.9	178.2	-22.4	0	0	111.9	L89 W94 I120 T126 A127 A128 V150	L89-Q124 HydrophobicContact CD1-CB 3.7Å; L89-Q124 HydrophobicContact CG-CB 3.8Å; W94-Q124 HydrophobicContact CH2-CB 4.1Å; W94-Q124 HydrophobicContact CH2-CG 4.32Å; W94-Q124 HydrophobicContact CZ2-CB 3.72Å; W94-Q124 HydrophobicContact CZ2-CG 3.75Å; I120-Q124 HydrophobicContact CD1-CG 4.05Å; I120-Q124 HydrophobicContact CG1-CG 4.28Å; I120-Q124 WeakPolarHBondContact O-CB 3.38Å; I120-Q124 WeakPolarHBondContact O-CG 3.47Å; I120-Q124 PolarHBondContact O-N 3.07Å; Q124-T126 VanDerWaalsContact C-N 3.34Å; Q124-A127 PolarHBondContact O-N 3.28Å; Q124-A128 PolarHBondContact O-N 3.15Å; Q124-V150 HydrophobicContact CG-CG1 4.4Å; Q124-V150 PolarHBondContact NE2-O 3.26Å
125	T	98.5	Very high	96	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-62.2	-44.2	171.5	-59.7	0	0	0	0	110.3	I72 H74 G75 A97 R121 A122 R123 A127 A128 V129 I309	I72-T125 HydrophobicContact CG2-CG2 4.18Å; H74-T125 VanDerWaalsContact CA-OG1 3.25Å; H74-T125 WeakPolarHBondContact CA-OG1 3.38Å; H74-T125 WeakPolarHBondContact CB-OG1 3.42Å; G75-T125 PolarHBondContact N-OG1 3.45Å; A97-T125 HydrophobicContact CB-CG2 3.64Å; R121-T125 WeakPolarHBondContact O-CB 3.21Å; R121-T125 PolarHBondContact O-N 3.33Å; R121-T125 VanDerWaalsContact O-N 3.11Å; R121-T125 PolarHBondContact O-OG1 2.99Å; A122-T125 WeakPolarHBondContact O-CB 3.46Å; A122-T125 PolarHBondContact O-N 3.34Å; R123-T125 VanDerWaalsContact C-N 3.28Å; R123-T125 PolarHBondContact O-N 3.39Å; T125-A127 VanDerWaalsContact C-N 3.34Å; T125-A127 PolarHBondContact O-N 2.99Å; T125-A128 PolarHBondContact O-N 3.4Å; T125-V129 HydrophobicContact CG2-CG2 4.21Å; T125-V129 WeakPolarHBondContact O-CB 3.31Å; T125-V129 VanDerWaalsContact O-CG2 3.3Å; T125-V129 WeakPolarHBondContact O-CG2 3.3Å; T125-V129 PolarHBondContact O-N 3.37Å; T125-I309 HydrophobicContact CG2-CG2 3.52Å
126	T	98.4	Very high	94.9	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-57.1	-47	175.1	-54.8	0	0	0	0	111.3	I114 H116 A122 R123 Q124 A128 V129 L130 L149 I309	I114-T126 HydrophobicContact CG2-CG2 4.22Å; H116-T126 HydrophobicContact CB-CG2 4.4Å; H116-T126 WeakPolarHBondContact CB-OG1 3.49Å; A122-T126 PolarHBondContact O-N 3.33Å; A122-T126 PolarHBondContact O-OG1 3.26Å; R123-T126 WeakPolarHBondContact O-CA 3.12Å; R123-T126 VanDerWaalsContact O-CB 3.26Å; R123-T126 WeakPolarHBondContact O-CB 3.5Å; R123-T126 PolarHBondContact O-N 3.19Å; R123-T126 VanDerWaalsContact O-N 3.08Å; Q124-T126 VanDerWaalsContact C-N 3.34Å; T126-A128 PolarHBondContact O-N 2.87Å; T126-V129 PolarHBondContact O-N 2.93Å; T126-L130 HydrophobicContact CG2-CD1 3.97Å; T126-L130 HydrophobicContact CG2-CG 4.32Å; T126-L130 WeakPolarHBondContact O-CB 3.38Å; T126-L130 WeakPolarHBondContact O-CG 3.18Å; T126-L130 PolarHBondContact O-N 2.59Å; T126-L149 HydrophobicContact CG2-CD1 3.82Å; T126-I309 HydrophobicContact CG2-CD1 4.19Å
127	A	97	Very high	93.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-56.3	-51.1	176.3	0	0	0	0	0	111.6	W94 R123 Q124 T125 V129 L130 I131 I146 L149 V150	W94-A127 HydrophobicContact CH2-CB 4.09Å; W94-A127 HydrophobicContact CZ3-CB 4.23Å; R123-A127 PolarHBondContact O-N 3.26Å; Q124-A127 PolarHBondContact O-N 3.28Å; T125-A127 VanDerWaalsContact C-N 3.34Å; T125-A127 PolarHBondContact O-N 2.99Å; A127-V129 PolarHBondContact O-N 2.88Å; A127-L130 WeakPolarHBondContact O-CB 3.14Å; A127-L130 PolarHBondContact O-N 2.83Å; A127-I131 WeakPolarHBondContact O-CD1 3.41Å; A127-I131 VanDerWaalsContact O-CG1 3.28Å; A127-I131 WeakPolarHBondContact O-CG1 3.42Å; A127-I131 PolarHBondContact O-N 2.77Å; A127-I131 VanDerWaalsContact O-N 3.1Å; A127-I146 HydrophobicContact CB-CG2 4.15Å; A127-L149 HydrophobicContact CB-CB 4.04Å; A127-L149 HydrophobicContact CB-CD1 4.35Å; A127-V150 HydrophobicContact CB-CG2 3.9Å
128	A	96.8	Very high	92.4	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.017	14%	0.139	C	C	.	.	H	α-helix	trans	-61.6	-42	179.3	0	0	0	0	0	113.1	W94 A97 Q124 T125 T126 I131 G132	W94-A128 HydrophobicContact CE3-CB 3.59Å; W94-A128 HydrophobicContact CZ3-CB 3.74Å; A97-A128 HydrophobicContact CB-CB 3.5Å; A97-A128 VanDerWaalsContact CB-CB 3.5Å; Q124-A128 PolarHBondContact O-N 3.15Å; T125-A128 PolarHBondContact O-N 3.4Å; T126-A128 PolarHBondContact O-N 2.87Å; A128-I131 PolarHBondContact O-N 2.79Å; A128-G132 PolarHBondContact O-N 3.32Å
129	V	97.7	Very high	91.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.9	-44.1	176.7	168.4	0	0	0	0	110.7	I72 A97 L104 T125 T126 A127 I131 G132 L133 L307 I309	I72-V129 HydrophobicContact CD1-CG1 4.44Å; I72-V129 HydrophobicContact CD1-CG2 4.23Å; A97-V129 HydrophobicContact CB-CG2 4.47Å; A97-V129 VanDerWaalsContact O-CG2 3.26Å; A97-V129 WeakPolarHBondContact O-CG2 3.18Å; L104-V129 HydrophobicContact CD1-CG1 4.44Å; T125-V129 HydrophobicContact CG2-CG2 4.21Å; T125-V129 WeakPolarHBondContact O-CB 3.31Å; T125-V129 VanDerWaalsContact O-CG2 3.3Å; T125-V129 WeakPolarHBondContact O-CG2 3.3Å; T125-V129 PolarHBondContact O-N 3.37Å; T126-V129 PolarHBondContact O-N 2.93Å; A127-V129 PolarHBondContact O-N 2.88Å; V129-I131 VanDerWaalsContact C-N 3.27Å; V129-I131 PolarHBondContact O-N 2.75Å; V129-G132 PolarHBondContact O-N 2.74Å; V129-L133 HydrophobicContact CG1-CD1 4.17Å; V129-L133 HydrophobicContact CG1-CG 4.4Å; V129-L133 VanDerWaalsContact O-CG 3.31Å; V129-L133 WeakPolarHBondContact O-CG 3.3Å; V129-L133 PolarHBondContact O-N 2.84Å; V129-L307 HydrophobicContact CG1-CD2 3.98Å; V129-I309 HydrophobicContact CB-CD1 4.08Å; V129-I309 HydrophobicContact CG1-CD1 4.14Å; V129-I309 HydrophobicContact CG2-CD1 4.15Å
130	L	96.5	Very high	90.8	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57	-42.7	177.1	-75.8	168	0	0	0	111.7	I114 T126 A127 L133 I146 L149 P195 Y196 F201	I114-L130 HydrophobicContact CD1-CD2 3.7Å; I114-L130 HydrophobicContact CD1-CG 4.41Å; T126-L130 HydrophobicContact CG2-CD1 3.97Å; T126-L130 HydrophobicContact CG2-CG 4.32Å; T126-L130 WeakPolarHBondContact O-CB 3.38Å; T126-L130 WeakPolarHBondContact O-CG 3.18Å; T126-L130 PolarHBondContact O-N 2.59Å; A127-L130 WeakPolarHBondContact O-CB 3.14Å; A127-L130 PolarHBondContact O-N 2.83Å; L130-L133 PolarHBondContact O-N 3.47Å; L130-I146 HydrophobicContact CB-CD1 4.49Å; L130-I146 HydrophobicContact CD1-CG1 4.31Å; L130-L149 HydrophobicContact CD1-CD1 3.79Å; L130-P195 HydrophobicContact CD1-CB 3.76Å; L130-P195 HydrophobicContact CD2-CB 3.78Å; L130-P195 HydrophobicContact CD2-CG 3.87Å; L130-P195 HydrophobicContact CG-CB 4.43Å; L130-Y196 HydrophobicContact CB-CE1 4.38Å; L130-Y196 HydrophobicContact CD2-CE1 4.06Å; L130-F201 HydrophobicContact CD2-CE2 3.6Å; L130-F201 HydrophobicContact CD2-CZ 3.64Å
131	I	94.6	Very high	90.1	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-68.2	-45.2	177.6	-62.5	157.6	0	0	0	110.3	Y98 A127 A128 V129 L133 Q134 V137 L140 F141 I146	Y98-I131 HydrophobicContact CD2-CB 4.46Å; Y98-I131 HydrophobicContact CD2-CG2 4.17Å; Y98-I131 HydrophobicContact CE2-CG2 3.94Å; A127-I131 WeakPolarHBondContact O-CD1 3.41Å; A127-I131 VanDerWaalsContact O-CG1 3.28Å; A127-I131 WeakPolarHBondContact O-CG1 3.42Å; A127-I131 PolarHBondContact O-N 2.77Å; A127-I131 VanDerWaalsContact O-N 3.1Å; A128-I131 PolarHBondContact O-N 2.79Å; V129-I131 VanDerWaalsContact C-N 3.27Å; V129-I131 PolarHBondContact O-N 2.75Å; I131-L133 PolarHBondContact O-N 2.93Å; I131-Q134 PolarHBondContact O-N 3.11Å; I131-V137 HydrophobicContact CG2-CB 4.31Å; I131-V137 HydrophobicContact CG2-CG1 3.62Å; I131-V137 HydrophobicContact CG2-CG2 4.24Å; I131-L140 HydrophobicContact CG1-CB 4.16Å; I131-F141 HydrophobicContact CD1-CD1 3.71Å; I131-F141 HydrophobicContact CD1-CD2 4.3Å; I131-F141 HydrophobicContact CD1-CE1 3.32Å; I131-F141 HydrophobicContact CD1-CE2 3.96Å; I131-F141 HydrophobicContact CD1-CG 4.2Å; I131-F141 HydrophobicContact CD1-CZ 3.48Å; I131-F141 VanDerWaalsContact CD1-CZ 3.48Å; I131-F141 HydrophobicContact CG2-CE2 4.11Å; I131-F141 HydrophobicContact CG2-CZ 4.33Å; I131-I146 HydrophobicContact CD1-CG2 4.42Å; I131-I146 HydrophobicContact CG1-CD1 4.4Å
132	G	94.7	Very high	89.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64	-23.5	178.1	0	0	0	0	0	114.3	G101 C102 R105 A128 V129 Q134	G101-G132 VanDerWaalsContact C-C 3.42Å; G101-G132 CarbonylContact C-O 3.4Å; C102-G132 WeakPolarHBondContact CA-O 3.34Å; C102-G132 PolarHBondContact N-O 2.87Å; R105-G132 VanDerWaalsContact CZ-O 3.3Å; R105-G132 PolarHBondContact NE-O 2.64Å; R105-G132 PolarHBondContact NH2-O 2.8Å; A128-G132 PolarHBondContact O-N 3.32Å; V129-G132 PolarHBondContact O-N 2.74Å; G132-Q134 PolarHBondContact O-N 2.94Å
133	L	94.7	Very high	88.9	Confident	20 Å²	20	42 Å²	42	11%	0.105	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-15.8	173.4	-75	170.1	0	0	0	113.1	L104 I114 V129 L130 I131 F201	L104-L133 HydrophobicContact CB-CD2 3.67Å; L104-L133 HydrophobicContact CD1-CD2 4.23Å; I114-L133 HydrophobicContact CD1-CD1 4.13Å; V129-L133 HydrophobicContact CG1-CD1 4.17Å; V129-L133 HydrophobicContact CG1-CG 4.4Å; V129-L133 VanDerWaalsContact O-CG 3.31Å; V129-L133 WeakPolarHBondContact O-CG 3.3Å; V129-L133 PolarHBondContact O-N 2.84Å; L130-L133 PolarHBondContact O-N 3.47Å; I131-L133 PolarHBondContact O-N 2.93Å; L133-F201 HydrophobicContact CD1-CZ 4.16Å
134	Q	91.5	Very high	88.5	Confident	62 Å²	62	46 Å²	46	29%	0.29	25%	0.246	S	C	.	.			trans	-107.8	144.7	-174.1	-61.9	-55.3	-63.3	0	0	112.7	R105 I131 G132 L140 Y196	R105-Q134 PolarHBondContact NH1-O 3.04Å; I131-Q134 PolarHBondContact O-N 3.11Å; G132-Q134 PolarHBondContact O-N 2.94Å; Q134-L140 HydrophobicContact CB-CD1 3.44Å; Q134-L140 VanDerWaalsContact CB-CD1 3.44Å; Q134-L140 HydrophobicContact CG-CD1 3.48Å; Q134-L140 VanDerWaalsContact CG-CD1 3.48Å; Q134-Y196 HydrophobicContact CG-CE1 4.48Å; Q134-Y196 HydrophobicContact CG-CE2 4.44Å; Q134-Y196 PolarHBondContact NE2-OH 3.01Å
135	N	84.2	Confident	88.2	Confident	143 Å²	143	49 Å²	49	77%	0.765	26%	0.26	S	S	*	.	S	Bend	trans	-73.2	-32.9	176.7	-70.1	-20.2	0	0	0	113	R105	R105-N135 VanDerWaalsContact CD-OD1 3.27Å; R105-N135 WeakPolarHBondContact CD-OD1 3.44Å; R105-N135 PolarHBondContact NH1-OD1 3.32Å
136	N	74.7	Confident	87.9	Confident	87 Å²	87	49.1 Å²	49.1	47%	0.465	26%	0.261	S	S	.	.			trans	-104.2	120.2	176.4	-172.9	8	0	0	0	109	D138 D139 L140	N136-D138 PolarHBondContact OD1-N 2.78Å; N136-D139 PolarHBondContact ND2-OD2 2.56Å; N136-L140 VanDerWaalsContact O-CD1 3.27Å; N136-L140 WeakPolarHBondContact O-CD1 2.88Å
137	V	73.2	Confident	87.5	Confident	35 Å²	35	51.9 Å²	51.9	21%	0.212	28%	0.277	C	S	.	.			trans	-94.9	-30.6	-172.5	173.9	0	0	0	0	111.6	Y98 I131 D139 L140 F141	Y98-V137 HydrophobicContact CE2-CG2 4.43Å; I131-V137 HydrophobicContact CG2-CB 4.31Å; I131-V137 HydrophobicContact CG2-CG1 3.62Å; I131-V137 HydrophobicContact CG2-CG2 4.24Å; V137-D139 PolarHBondContact O-N 2.79Å; V137-L140 PolarHBondContact O-N 3.4Å; V137-F141 HydrophobicContact CG1-CD2 4.32Å; V137-F141 HydrophobicContact CG1-CE2 3.68Å
138	D	70.5	Confident	87.3	Confident	128 Å²	128	57.3 Å²	57.3	68%	0.684	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-34	-159.2	-64.1	-23.6	0	0	0	112.8	N136	N136-D138 PolarHBondContact OD1-N 2.78Å
139	D	74.1	Confident	87.2	Confident	121 Å²	121	57.5 Å²	57.5	65%	0.647	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-8.9	-174.9	-55.7	-44.1	0	0	0	114.2	N136 V137	N136-D139 PolarHBondContact ND2-OD2 2.56Å; V137-D139 PolarHBondContact O-N 2.79Å
140	L	83.9	Confident	86.9	Confident	17 Å²	17	59.8 Å²	59.8	9%	0.089	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-29.3	-170.6	-76.1	161.1	0	0	0	113.4	I131 Q134 N136 V137 D142 S143 I146 Y196	I131-L140 HydrophobicContact CG1-CB 4.16Å; Q134-L140 HydrophobicContact CB-CD1 3.44Å; Q134-L140 VanDerWaalsContact CB-CD1 3.44Å; Q134-L140 HydrophobicContact CG-CD1 3.48Å; Q134-L140 VanDerWaalsContact CG-CD1 3.48Å; N136-L140 VanDerWaalsContact O-CD1 3.27Å; N136-L140 WeakPolarHBondContact O-CD1 2.88Å; V137-L140 PolarHBondContact O-N 3.4Å; L140-D142 PolarHBondContact O-N 3.17Å; L140-S143 VanDerWaalsContact O-CB 3.29Å; L140-S143 WeakPolarHBondContact O-CB 3.04Å; L140-S143 PolarHBondContact O-N 3.3Å; L140-S143 VanDerWaalsContact O-N 3.13Å; L140-I146 HydrophobicContact CB-CD1 3.9Å; L140-I146 HydrophobicContact CD2-CD1 3.97Å; L140-I146 WeakPolarHBondContact O-CB 3.23Å; L140-I146 WeakPolarHBondContact O-CD1 3.39Å; L140-Y196 HydrophobicContact CD2-CD1 3.48Å; L140-Y196 VanDerWaalsContact CD2-CD1 3.48Å; L140-Y196 HydrophobicContact CD2-CD2 3.9Å; L140-Y196 HydrophobicContact CD2-CE1 3.92Å; L140-Y196 HydrophobicContact CD2-CE2 4.33Å; L140-Y196 HydrophobicContact CD2-CG 3.47Å; L140-Y196 VanDerWaalsContact CD2-CG 3.47Å
141	F	80.5	Confident	86.5	Confident	100 Å²	100	63.7 Å²	63.7	44%	0.439	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.7	-179.5	-77.9	-79.6	0	0	0	112.8	I131 V137 V147	I131-F141 HydrophobicContact CD1-CD1 3.71Å; I131-F141 HydrophobicContact CD1-CD2 4.3Å; I131-F141 HydrophobicContact CD1-CE1 3.32Å; I131-F141 HydrophobicContact CD1-CE2 3.96Å; I131-F141 HydrophobicContact CD1-CG 4.2Å; I131-F141 HydrophobicContact CD1-CZ 3.48Å; I131-F141 VanDerWaalsContact CD1-CZ 3.48Å; I131-F141 HydrophobicContact CG2-CE2 4.11Å; I131-F141 HydrophobicContact CG2-CZ 4.33Å; V137-F141 HydrophobicContact CG1-CD2 4.32Å; V137-F141 HydrophobicContact CG1-CE2 3.68Å; F141-V147 WeakPolarHBondContact O-CG2 3.32Å
142	D	83.1	Confident	85.9	Confident	136 Å²	136	66.3 Å²	66.3	73%	0.727	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-3.2	179	-64.2	-32.6	0	0	0	113.2	L140	L140-D142 PolarHBondContact O-N 3.17Å
143	S	87	Confident	85	Confident	14 Å²	14	71.8 Å²	71.8	10%	0.098	38%	0.376	C	S	.	.			trans	-60.1	126.7	174.3	173.4	0	0	0	0	109.9	L140 E145 I146 V147 P195	L140-S143 VanDerWaalsContact O-CB 3.29Å; L140-S143 WeakPolarHBondContact O-CB 3.04Å; L140-S143 PolarHBondContact O-N 3.3Å; L140-S143 VanDerWaalsContact O-N 3.13Å; S143-E145 PolarHBondContact O-N 3.43Å; S143-E145 VanDerWaalsContact O-N 3.15Å; S143-E145 PolarHBondContact OG-OE2 3.18Å; S143-I146 PolarHBondContact O-N 3.34Å; S143-V147 WeakPolarHBondContact O-CG2 3.31Å; S143-V147 PolarHBondContact O-N 3.11Å; S143-P195 PolarHBondContact OG-O 3.16Å
144	P	89.7	Confident	83.3	Confident	87 Å²	87	75.7 Å²	75.7	57%	0.565	41%	0.405	S	S	*	.	H	α-helix	trans	-52.5	-41.1	-177.9	-27.7	34.9	0	0	0	113.2	V147 Q148	P144-V147 PolarHBondContact O-N 2.81Å; P144-Q148 WeakPolarHBondContact O-CB 3.47Å; P144-Q148 VanDerWaalsContact O-CG 3.23Å; P144-Q148 WeakPolarHBondContact O-CG 3.43Å; P144-Q148 PolarHBondContact O-N 2.74Å
145	E	90.7	Very high	81.3	Confident	77 Å²	77	76.4 Å²	76.4	36%	0.36	42%	0.417	S	S	.	.	H	α-helix	trans	-70.6	-36.2	-180	-65.6	76.1	-164	0	0	112.3	S143 Q148 L149 Y193	S143-E145 PolarHBondContact O-N 3.43Å; S143-E145 VanDerWaalsContact O-N 3.15Å; S143-E145 PolarHBondContact OG-OE2 3.18Å; E145-Q148 PolarHBondContact O-N 2.9Å; E145-L149 WeakPolarHBondContact O-CG 3.42Å; E145-L149 PolarHBondContact O-N 3.34Å; E145-L149 VanDerWaalsContact O-N 3.15Å; E145-Y193 HydrophobicContact CB-CE2 4.41Å; E145-Y193 HydrophobicContact CG-CD2 4.31Å
146	I	91.5	Very high	79.5	Confident	1 Å²	1	78 Å²	78	1%	0.005	42%	0.419	C	S	.	.	H	α-helix	trans	-68.7	-45.5	174.5	-70.5	177.8	0	0	0	109.9	A127 L130 I131 L140 S143 Q148 L149 V150 Y196	A127-I146 HydrophobicContact CB-CG2 4.15Å; L130-I146 HydrophobicContact CB-CD1 4.49Å; L130-I146 HydrophobicContact CD1-CG1 4.31Å; I131-I146 HydrophobicContact CD1-CG2 4.42Å; I131-I146 HydrophobicContact CG1-CD1 4.4Å; L140-I146 HydrophobicContact CB-CD1 3.9Å; L140-I146 HydrophobicContact CD2-CD1 3.97Å; L140-I146 WeakPolarHBondContact O-CB 3.23Å; L140-I146 WeakPolarHBondContact O-CD1 3.39Å; S143-I146 PolarHBondContact O-N 3.34Å; I146-Q148 VanDerWaalsContact C-N 3.27Å; I146-Q148 PolarHBondContact O-N 2.93Å; I146-L149 WeakPolarHBondContact O-CB 3.45Å; I146-L149 PolarHBondContact O-N 3.36Å; I146-V150 WeakPolarHBondContact O-CG2 3.38Å; I146-V150 PolarHBondContact O-N 2.81Å; I146-Y196 HydrophobicContact CD1-CD1 4Å
147	V	91.5	Very high	78	Confident	58 Å²	58	79.9 Å²	79.9	35%	0.352	43%	0.429	S	S	.	.	H	α-helix	trans	-55.4	-46	174.3	171.9	0	0	0	0	110.3	F141 S143 P144 L149 V150 I151	F141-V147 WeakPolarHBondContact O-CG2 3.32Å; S143-V147 WeakPolarHBondContact O-CG2 3.31Å; S143-V147 PolarHBondContact O-N 3.11Å; P144-V147 PolarHBondContact O-N 2.81Å; V147-L149 PolarHBondContact O-N 3.42Å; V147-V150 PolarHBondContact O-N 2.9Å; V147-I151 HydrophobicContact CG1-CD1 3.74Å; V147-I151 HydrophobicContact CG1-CG1 4.4Å; V147-I151 WeakPolarHBondContact O-CG1 3.29Å; V147-I151 PolarHBondContact O-N 3.17Å
148	Q	92.5	Very high	76.4	Confident	114 Å²	114	84.2 Å²	84.2	53%	0.533	45%	0.451	S	S	.	.	H	α-helix	trans	-59.7	-33.2	176.9	-75.5	-66	-4.6	0	0	112.4	R123 P144 E145 I146 V150	R123-Q148 PolarHBondContact NH2-O 2.83Å; P144-Q148 WeakPolarHBondContact O-CB 3.47Å; P144-Q148 VanDerWaalsContact O-CG 3.23Å; P144-Q148 WeakPolarHBondContact O-CG 3.43Å; P144-Q148 PolarHBondContact O-N 2.74Å; E145-Q148 PolarHBondContact O-N 2.9Å; I146-Q148 VanDerWaalsContact C-N 3.27Å; I146-Q148 PolarHBondContact O-N 2.93Å; Q148-V150 VanDerWaalsContact C-N 3.25Å; Q148-V150 PolarHBondContact O-N 3.05Å
149	L	93.6	Very high	75	Confident	6 Å²	6	81.9 Å²	81.9	3%	0.031	44%	0.438	C	S	.	.	H	α-helix	trans	-67.4	-24.3	175.5	-72.3	170.4	0	0	0	113.6	R123 T126 A127 L130 E145 I146 V147	R123-L149 CarbonylContact C-O 3.59Å; R123-L149 HydrophobicContact CB-CB 4.36Å; R123-L149 HydrophobicContact CB-CD2 3.9Å; R123-L149 WeakPolarHBondContact CB-O 3.49Å; R123-L149 HydrophobicContact CG-CD2 4.09Å; T126-L149 HydrophobicContact CG2-CD1 3.82Å; A127-L149 HydrophobicContact CB-CB 4.04Å; A127-L149 HydrophobicContact CB-CD1 4.35Å; L130-L149 HydrophobicContact CD1-CD1 3.79Å; E145-L149 WeakPolarHBondContact O-CG 3.42Å; E145-L149 PolarHBondContact O-N 3.34Å; E145-L149 VanDerWaalsContact O-N 3.15Å; I146-L149 WeakPolarHBondContact O-CB 3.45Å; I146-L149 PolarHBondContact O-N 3.36Å; V147-L149 PolarHBondContact O-N 3.42Å
150	V	92	Very high	73.4	Confident	48 Å²	48	81.9 Å²	81.9	29%	0.291	45%	0.445	S	S	.	.	H	α-helix	trans	-90.6	-22	-174.5	-174.7	0	0	0	0	113.1	W94 Q124 A127 I146 V147 Q148	W94-V150 HydrophobicContact CH2-CG1 4.26Å; W94-V150 HydrophobicContact CH2-CG2 3.68Å; W94-V150 HydrophobicContact CZ2-CG1 3.98Å; W94-V150 HydrophobicContact CZ2-CG2 4.22Å; Q124-V150 HydrophobicContact CG-CG1 4.4Å; Q124-V150 PolarHBondContact NE2-O 3.26Å; A127-V150 HydrophobicContact CB-CG2 3.9Å; I146-V150 WeakPolarHBondContact O-CG2 3.38Å; I146-V150 PolarHBondContact O-N 2.81Å; V147-V150 PolarHBondContact O-N 2.9Å; Q148-V150 VanDerWaalsContact C-N 3.25Å; Q148-V150 PolarHBondContact O-N 3.05Å
151	I	87.9	Confident	71	Confident	83 Å²	83	88.5 Å²	88.5	43%	0.426	47%	0.473	S	S	.	.	S	Bend	trans	-83.5	124.7	-178	-58.7	168.9	0	0	0	110.3	R123 V147 Y153	R123-I151 PolarHBondContact NH1-O 3.27Å; R123-I151 PolarHBondContact NH2-O 3.38Å; V147-I151 HydrophobicContact CG1-CD1 3.74Å; V147-I151 HydrophobicContact CG1-CG1 4.4Å; V147-I151 WeakPolarHBondContact O-CG1 3.29Å; V147-I151 PolarHBondContact O-N 3.17Å; I151-Y153 PolarHBondContact O-N 2.98Å
152	P	82.6	Confident	68.9	Low	56 Å²	56	87.3 Å²	87.3	36%	0.364	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-57.1	138.2	169	-20.8	32	0	0	0	111	A85 I120 S154	A85-P152 HydrophobicContact CB-CB 4.16Å; I120-P152 HydrophobicContact CD1-CG 4.47Å; I120-P152 HydrophobicContact CG1-CG 4.38Å; P152-S154 PolarHBondContact O-N 2.84Å
153	Y	75.9	Confident	66.2	Low	115 Å²	115	86.4 Å²	86.4	45%	0.451	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-60.7	135.6	172.4	-68.8	-53.2	0	0	0	109.8	R123 I151 S155	R123-Y153 VanDerWaalsContact CZ-CZ 3.44Å; R123-Y153 VanDerWaalsContact NH1-CZ 3.3Å; I151-Y153 PolarHBondContact O-N 2.98Å; Y153-S155 PolarHBondContact O-N 2.91Å
154	S	59.4	Low	63.5	Low	101 Å²	101	90.9 Å²	90.9	71%	0.706	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-56.7	122.6	169.9	49.4	0	0	0	0	108.1	P152 E156	P152-S154 PolarHBondContact O-N 2.84Å; S154-E156 PolarHBondContact O-N 2.67Å
155	S	49.3	Very low	60.5	Low	78 Å²	78	92.9 Å²	92.9	55%	0.545	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	52.9	-168.1	60.4	0	0	0	0	114	Y153 L157	Y153-S155 PolarHBondContact O-N 2.91Å; S155-L157 VanDerWaalsContact C-N 3.31Å
156	E	46.8	Very low	57.5	Low	175 Å²	175	94.5 Å²	94.5	82%	0.818	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-15.7	164.7	-67.5	-168.5	168.1	0	0	111.8	S154	S154-E156 PolarHBondContact O-N 2.67Å
157	L	43.4	Very low	54.4	Low	127 Å²	127	103.1 Å²	103.1	67%	0.665	58%	0.575	S	S	*	*	S	Bend	trans	-107.9	84.6	177.8	-62	166.3	0	0	0	107.6	S155 D159 M186	S155-L157 VanDerWaalsContact C-N 3.31Å; L157-D159 PolarHBondContact O-N 3.07Å; L157-M186 HydrophobicContact CD1-CE 3.57Å; L157-M186 HydrophobicContact CD2-CE 3.85Å; L157-M186 HydrophobicContact CG-CE 4.33Å
158	D	38.3	Very low	51.3	Low	126 Å²	126	109.2 Å²	109.2	67%	0.674	60%	0.597	S	S	*	*			trans	-44.2	129.1	168.8	-83.4	-54.1	0	0	0	109.6
159	D	41	Very low	48.2	Very low	79 Å²	79	108.8 Å²	108.8	42%	0.422	61%	0.606	S	S	.	*			trans	-39.2	136.6	162.4	-82.8	-56.3	0	0	0	107.6	S84 L157 K161	S84-D159 VanDerWaalsContact CB-OD1 3.32Å; S84-D159 WeakPolarHBondContact CB-OD1 3.23Å; S84-D159 WeakPolarHBondContact CB-OD2 3.32Å; L157-D159 PolarHBondContact O-N 3.07Å; D159-K161 PolarHBondContact O-N 3.09Å
160	P	40.5	Very low	45.1	Very low	121 Å²	121	116 Å²	116	79%	0.786	65%	0.645	S	S	*	*			trans	-61.2	90.3	175.3	23.7	-30	0	0	0	108	S162	P160-S162 VanDerWaalsContact C-N 3.31Å; P160-S162 PolarHBondContact O-N 3.14Å
161	K	34.2	Very low	41.9	Very low	157 Å²	157	121.6 Å²	121.6	68%	0.683	67%	0.668	S	S	*	*			trans	-63.4	103.5	169.1	-74.5	-178.6	-175.1	163.7	0	103.6	D159 C163	D159-K161 PolarHBondContact O-N 3.09Å; K161-C163 PolarHBondContact O-N 2.8Å
162	S	36	Very low	39	Very low	74 Å²	74	126.6 Å²	126.6	52%	0.517	69%	0.686	S	S	.	*			trans	-16.2	97.1	156.3	55	0	0	0	0	110.4	P160 P164	P160-S162 VanDerWaalsContact C-N 3.31Å; P160-S162 PolarHBondContact O-N 3.14Å; S162-P164 WeakPolarHBondContact O-CD 3.32Å
163	C	26.2	Very low	36.4	Very low	118 Å²	118	129.6 Å²	129.6	80%	0.797	71%	0.709	S	S	*	*			trans	-61.9	113.3	-179.9	-69.2	0	0	0	0	107.5	K161 V165	K161-C163 PolarHBondContact O-N 2.8Å; C163-V165 PolarHBondContact O-N 2.88Å
164	P	30.8	Very low	34	Very low	107 Å²	107	130.6 Å²	130.6	70%	0.695	73%	0.727	S	S	*	*			trans	-77	110.1	166.3	3.8	16.2	0	0	0	105.4	S162 T166	S162-P164 WeakPolarHBondContact O-CD 3.32Å; P164-T166 VanDerWaalsContact C-N 3.29Å; P164-T166 PolarHBondContact O-N 2.67Å; P164-T166 PolarHBondContact O-OG1 3.49Å
165	V	26	Very low	32.5	Very low	130 Å²	130	133.4 Å²	133.4	79%	0.788	73%	0.732	S	S	*	*			trans	-58.8	97.8	168	177.3	0	0	0	0	106.8	C163 Q167	C163-V165 PolarHBondContact O-N 2.88Å; V165-Q167 HydrophobicContact CG1-CG 4.48Å
166	T	27.5	Very low	31.4	Very low	111 Å²	111	134.5 Å²	134.5	68%	0.681	74%	0.74	S	S	*	*			trans	-97.7	99.6	171	-31.3	0	0	0	0	106	P164 K168	P164-T166 VanDerWaalsContact C-N 3.29Å; P164-T166 PolarHBondContact O-N 2.67Å; P164-T166 PolarHBondContact O-OG1 3.49Å; T166-K168 PolarHBondContact O-N 2.89Å; T166-K168 VanDerWaalsContact O-N 3.11Å
167	Q	27	Very low	30.5	Very low	181 Å²	181	135.3 Å²	135.3	85%	0.846	74%	0.744	S	S	*	*			trans	-59.5	109.4	165.7	-67.7	176.6	-14	0	0	107.8	V165	V165-Q167 HydrophobicContact CG1-CG 4.48Å
168	K	26.1	Very low	30	Very low	186 Å²	186	135 Å²	135	81%	0.809	75%	0.75	S	S	*	*			trans	-137.8	98	158.9	-81.8	-168	175.9	179.6	0	109.1	T166 N170	T166-K168 PolarHBondContact O-N 2.89Å; T166-K168 VanDerWaalsContact O-N 3.11Å; K168-N170 PolarHBondContact O-N 3.11Å
169	S	26.7	Very low	29.7	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	76%	0.76	S	S	*	*			trans	-52.1	117.7	141.6	49.7	0	0	0	0	108.4
170	N	29.6	Very low	29.3	Very low	158 Å²	158	140.4 Å²	140.4	85%	0.845	78%	0.778	S	S	*	*				-173.9	137.3	124.6	-90.1	-10.4	0	0	0	110.8	K168	K168-N170 PolarHBondContact O-N 3.11Å
171	E	25.3	Very low	29.3	Very low	166 Å²	166	139.9 Å²	139.9	78%	0.776	78%	0.777	S	S	*	*			trans	-63	157.4	-171.2	-70.6	174.5	158.8	0	0	115.2
172	K	26.2	Very low	29.4	Very low	187 Å²	187	137.9 Å²	137.9	81%	0.813	78%	0.778	S	S	*	*			trans	71.8	100.8	154.2	-72	166.9	-172.4	175.4	0	117.6
173	S	27.9	Very low	29.9	Very low	119 Å²	119	140.3 Å²	140.3	83%	0.832	79%	0.792	S	S	*	*				-163.7	127.9	124.7	30.1	0	0	0	0	111.1
174	T	25.1	Very low	30.9	Very low	137 Å²	137	140.7 Å²	140.7	84%	0.84	79%	0.791	S	S	*	*			trans	-55.8	139.7	170.5	-10.7	0	0	0	0	110.8
175	I	27.9	Very low	32.1	Very low	159 Å²	159	145.2 Å²	145.2	82%	0.815	80%	0.799	S	S	*	*			trans	168.8	120.4	137	-84.3	152.7	0	0	0	111
176	S	27.6	Very low	34.3	Very low	102 Å²	102	142.7 Å²	142.7	71%	0.713	78%	0.78	S	S	*	*			trans	44.5	123.4	155.3	65.8	0	0	0	0	122
177	E	26.9	Very low	37.1	Very low	192 Å²	192	141.3 Å²	141.3	90%	0.897	77%	0.771	S	S	*	*			trans	-49.4	120.6	171.3	-65.2	173.4	156.9	0	0	114
178	P	32.7	Very low	40.3	Very low	121 Å²	121	135.5 Å²	135.5	79%	0.786	75%	0.745	S	S	*	*			trans	-80.5	129	161.2	15.2	-1.2	0	0	0	109.4	S180	P178-S180 PolarHBondContact O-N 3.36Å
179	K	31.7	Very low	43.5	Very low	205 Å²	205	128.6 Å²	128.6	89%	0.891	72%	0.716	S	S	*	*			trans	-43.8	120.8	175.7	-68.4	177.5	177.4	178.2	0	110.6	S181	K179-S181 PolarHBondContact O-N 3.09Å
180	S	33.8	Very low	46.7	Very low	112 Å²	112	125.9 Å²	125.9	78%	0.783	69%	0.693	S	S	*	*			trans	-64.5	92.2	-178.9	62	0	0	0	0	111.1	P178 T182	P178-S180 PolarHBondContact O-N 3.36Å; S180-T182 VanDerWaalsContact C-N 3.34Å; S180-T182 PolarHBondContact O-N 3.12Å; S180-T182 VanDerWaalsContact O-N 3.09Å
181	S	40.7	Very low	49.9	Very low	110 Å²	110	125.3 Å²	125.3	77%	0.769	69%	0.69	S	S	*	*			trans	-70.8	96.8	156.6	58	0	0	0	0	106.9	K179 P183	K179-S181 PolarHBondContact O-N 3.09Å; S181-P183 WeakPolarHBondContact O-CD 3.42Å; S181-P183 VanDerWaalsContact O-N 3.15Å
182	T	35.9	Very low	53.3	Low	116 Å²	116	120 Å²	120	71%	0.712	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-51.1	121.5	168.6	33.1	0	0	0	0	108.4	S180 V184	S180-T182 VanDerWaalsContact C-N 3.34Å; S180-T182 PolarHBondContact O-N 3.12Å; S180-T182 VanDerWaalsContact O-N 3.09Å; T182-V184 PolarHBondContact O-N 3.02Å
183	P	45.3	Very low	56.6	Low	124 Å²	124	113.9 Å²	113.9	81%	0.805	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-62	116.1	-177.8	18.7	-25.3	0	0	0	108.3	S181 K185	S181-P183 WeakPolarHBondContact O-CD 3.42Å; S181-P183 VanDerWaalsContact O-N 3.15Å; P183-K185 PolarHBondContact O-N 2.79Å
184	V	48.3	Very low	59.8	Low	127 Å²	127	112 Å²	112	77%	0.77	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-52.5	116.9	175.9	177.8	0	0	0	0	107	T182 M186	T182-V184 PolarHBondContact O-N 3.02Å; V184-M186 VanDerWaalsContact C-N 3.31Å; V184-M186 PolarHBondContact O-N 3.18Å
185	K	57	Low	63.1	Low	201 Å²	201	105.5 Å²	105.5	87%	0.874	59%	0.586	S	S	*	*			trans	-64.9	95.1	178.8	-172.4	177.8	-178.7	179.8	0	108	P183 T187	P183-K185 PolarHBondContact O-N 2.79Å; K185-T187 PolarHBondContact O-N 3.35Å
186	M	70.3	Confident	66.2	Low	78 Å²	78	98.7 Å²	98.7	38%	0.384	55%	0.55	S	S	.	*			trans	-63.9	125.8	-177.6	-168.1	64.4	65.9	0	0	109.9	L157 V184	L157-M186 HydrophobicContact CD1-CE 3.57Å; L157-M186 HydrophobicContact CD2-CE 3.85Å; L157-M186 HydrophobicContact CG-CE 4.33Å; V184-M186 VanDerWaalsContact C-N 3.31Å; V184-M186 PolarHBondContact O-N 3.18Å
187	T	87.7	Confident	69	Low	81 Å²	81	97.8 Å²	97.8	50%	0.497	55%	0.549	S	S	.	.			trans	-72.6	132.7	173.7	47.4	0	0	0	0	109.5	K185 I189 D190 R207	K185-T187 PolarHBondContact O-N 3.35Å; T187-I189 VanDerWaalsContact C-N 3.34Å; T187-D190 PolarHBondContact OG1-OD1 3.45Å; T187-R207 WeakPolarHBondContact O-CD 3.32Å; T187-R207 PolarHBondContact O-NH1 3.47Å
188	M	93.2	Very high	71.9	Confident	59 Å²	59	96.1 Å²	96.1	29%	0.291	55%	0.546	S	S	.	.	S	Bend	trans	-79.3	-22.5	178.9	-70.4	-60.7	-65.5	0	0	112.9	R207 Y208 R238	M188-R207 HydrophobicContact CE-CB 3.82Å; M188-R207 PolarHBondContact O-N 2.88Å; M188-R207 HydrophobicContact SD-CB 4.11Å; M188-Y208 HydrophobicContact CB-CD2 3.98Å; M188-Y208 HydrophobicContact CB-CE1 4.09Å; M188-Y208 HydrophobicContact CB-CE2 3.33Å; M188-Y208 VanDerWaalsContact CB-CZ 3.41Å; M188-Y208 HydrophobicContact CE-CD1 3.71Å; M188-Y208 HydrophobicContact CE-CE1 3.75Å; M188-Y208 HydrophobicContact CE-CG 4.19Å; M188-Y208 HydrophobicContact CG-CE1 4.18Å; M188-Y208 HydrophobicContact CG-CE2 4.27Å; M188-R238 HydrophobicContact CE-CG 3.8Å
189	I	94.2	Very high	74.7	Confident	42 Å²	42	91.3 Å²	91.3	22%	0.215	52%	0.516	C	S	.	.	B	Isolated β-bridge	trans	-136	130.8	177	-65.7	169.4	0	0	0	106.5	T187 Q204 Y208 I245	T187-I189 VanDerWaalsContact C-N 3.34Å; I189-Q204 HydrophobicContact CG2-CG 4.05Å; I189-Y208 HydrophobicContact CD1-CD2 3.63Å; I189-Y208 HydrophobicContact CD1-CE2 3.58Å; I189-Y208 HydrophobicContact CG1-CD2 3.55Å; I189-Y208 HydrophobicContact CG1-CE2 3.64Å; I189-I245 HydrophobicContact CD1-CB 4.22Å; I189-I245 HydrophobicContact CD1-CD1 4.03Å; I189-I245 HydrophobicContact CD1-CG2 3.32Å
190	D	94	Very high	77.5	Confident	47 Å²	47	89.5 Å²	89.5	25%	0.251	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-91.9	166.9	176.6	-63.6	-3.2	0	0	0	110	T187 Q204 L205 R207	T187-D190 PolarHBondContact OG1-OD1 3.45Å; D190-Q204 VanDerWaalsContact O-CG 3.3Å; D190-Q204 WeakPolarHBondContact O-CG 3.3Å; D190-Q204 PolarHBondContact O-NE2 3.42Å; D190-L205 HydrophobicContact CB-CB 4.18Å; D190-L205 PolarHBondContact N-O 3.38Å; D190-L205 WeakPolarHBondContact OD2-CD2 3.47Å; D190-R207 IonicContact OD1-NH1 2.66Å; D190-R207 PolarHBondContact OD1-NH1 3.29Å; D190-R207 IonicContact OD2-NH1 3.33Å
191	N	95.4	Very high	80.5	Confident	146 Å²	146	85.1 Å²	85.1	78%	0.781	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-65	146.4	174.2	-69.6	-32.1	0	0	0	110.5
192	P	96.8	Very high	83.2	Confident	54 Å²	54	81 Å²	81	35%	0.351	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-57.7	142.3	171.7	-22	32.7	0	0	0	111.6	D202 C203	P192-D202 HydrophobicContact CB-CB 4.09Å; P192-C203 CarbonylContact C-O 3.57Å; P192-C203 WeakPolarHBondContact CA-O 3.45Å
193	Y	96.3	Very high	86.1	Confident	59 Å²	59	75.5 Å²	75.5	23%	0.231	42%	0.416	C	S	.	.	B	Isolated β-bridge	trans	-130.3	156.3	180	68.2	-88.3	0	0	0	110.8	H116 E145 D202 C203	H116-Y193 AromaticContact NE2-CE1 3.69Å; H116-Y193 AromaticContact NE2-CZ 3.66Å; H116-Y193 PolarHBondContact NE2-OH 3.2Å; E145-Y193 HydrophobicContact CB-CE2 4.41Å; E145-Y193 HydrophobicContact CG-CD2 4.31Å; Y193-D202 CarbonylContact O-C 3.54Å; Y193-D202 WeakPolarHBondContact O-CA 3.33Å; Y193-D202 WeakPolarHBondContact O-CB 3.28Å; Y193-C203 HydrophobicContact CD1-CB 4.07Å; Y193-C203 VanDerWaalsContact CD1-O 3.24Å; Y193-C203 WeakPolarHBondContact CD1-O 3.24Å; Y193-C203 HydrophobicContact CD2-CB 4.08Å; Y193-C203 HydrophobicContact CE1-CB 3.52Å; Y193-C203 HydrophobicContact CE2-CB 3.53Å; Y193-C203 HydrophobicContact CG-CB 4.32Å; Y193-C203 PolarHBondContact N-O 2.94Å; Y193-C203 PolarHBondContact O-N 3.23Å; Y193-C203 WeakPolarHBondContact OH-CB 3.46Å
194	T	95.5	Very high	88.6	Confident	80 Å²	80	70.5 Å²	70.5	49%	0.491	38%	0.381	S	S	.	.			trans	-90	126.1	177.7	-52.3	0	0	0	0	108.5	Y196 A199	T194-Y196 VanDerWaalsContact CG2-O 3.27Å; T194-Y196 WeakPolarHBondContact CG2-O 3.14Å; T194-Y196 PolarHBondContact O-N 3.24Å; T194-A199 HydrophobicContact CG2-CB 3.83Å
195	P	94.1	Very high	91	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.346	C	S	.	.	S	Bend	trans	-75	-20.6	-172.4	27.2	-35.1	0	0	0	115.4	L130 S143 A199 F201	L130-P195 HydrophobicContact CD1-CB 3.76Å; L130-P195 HydrophobicContact CD2-CB 3.78Å; L130-P195 HydrophobicContact CD2-CG 3.87Å; L130-P195 HydrophobicContact CG-CB 4.43Å; S143-P195 PolarHBondContact OG-O 3.16Å; P195-A199 HydrophobicContact CG-CB 3.79Å; P195-F201 HydrophobicContact CG-CD2 4.44Å; P195-F201 HydrophobicContact CG-CE2 3.84Å; P195-F201 HydrophobicContact CG-CZ 4.26Å
196	Y	92.1	Very high	92.9	Very high	17 Å²	17	55.2 Å²	55.2	7%	0.067	31%	0.305	C	S	.	.	S	Bend	trans	-168.3	165.9	175.5	45.8	-98.5	0	0	0	109.2	L130 Q134 L140 I146 T194 N198 A199	L130-Y196 HydrophobicContact CB-CE1 4.38Å; L130-Y196 HydrophobicContact CD2-CE1 4.06Å; Q134-Y196 HydrophobicContact CG-CE1 4.48Å; Q134-Y196 HydrophobicContact CG-CE2 4.44Å; Q134-Y196 PolarHBondContact NE2-OH 3.01Å; L140-Y196 HydrophobicContact CD2-CD1 3.48Å; L140-Y196 VanDerWaalsContact CD2-CD1 3.48Å; L140-Y196 HydrophobicContact CD2-CD2 3.9Å; L140-Y196 HydrophobicContact CD2-CE1 3.92Å; L140-Y196 HydrophobicContact CD2-CE2 4.33Å; L140-Y196 HydrophobicContact CD2-CG 3.47Å; L140-Y196 VanDerWaalsContact CD2-CG 3.47Å; I146-Y196 HydrophobicContact CD1-CD1 4Å; T194-Y196 VanDerWaalsContact CG2-O 3.27Å; T194-Y196 WeakPolarHBondContact CG2-O 3.14Å; T194-Y196 PolarHBondContact O-N 3.24Å; Y196-N198 PolarHBondContact O-N 3.29Å; Y196-A199 HydrophobicContact CD2-CB 3.86Å; Y196-A199 HydrophobicContact CE2-CB 3.62Å; Y196-A199 HydrophobicContact CG-CB 4.42Å; Y196-A199 WeakPolarHBondContact O-CB 3.34Å; Y196-A199 PolarHBondContact O-N 2.95Å
197	A	87.9	Confident	94.1	Very high	82 Å²	82	53.4 Å²	53.4	68%	0.678	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	135.5	179.1	0	0	0	0	0	111.8	A199	A197-A199 PolarHBondContact O-N 3.46Å
198	N	87.2	Confident	94.6	Very high	158 Å²	158	51.3 Å²	51.3	85%	0.845	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	10.6	179.8	-46.6	-48.4	0	0	0	116.2	Y196 M200	Y196-N198 PolarHBondContact O-N 3.29Å; N198-M200 PolarHBondContact O-N 3.24Å
199	A	91.7	Very high	94.7	Very high	19 Å²	19	48.5 Å²	48.5	16%	0.157	26%	0.263	C	S	.	.			trans	-57.8	130.6	171.1	0	0	0	0	0	110.7	T194 P195 Y196 A197 F201	T194-A199 HydrophobicContact CG2-CB 3.83Å; P195-A199 HydrophobicContact CG-CB 3.79Å; Y196-A199 HydrophobicContact CD2-CB 3.86Å; Y196-A199 HydrophobicContact CE2-CB 3.62Å; Y196-A199 HydrophobicContact CG-CB 4.42Å; Y196-A199 WeakPolarHBondContact O-CB 3.34Å; Y196-A199 PolarHBondContact O-N 2.95Å; A197-A199 PolarHBondContact O-N 3.46Å; A199-F201 PolarHBondContact O-N 3.37Å
200	M	90.8	Very high	94.8	Very high	167 Å²	167	47.7 Å²	47.7	82%	0.823	26%	0.26	S	S	*	.	S	Bend	trans	-82.7	0.2	-180	-63	-170.9	73.4	0	0	113.6	N198 Q255	N198-M200 PolarHBondContact O-N 3.24Å; M200-Q255 PolarHBondContact O-NE2 3.15Å
201	F	95.8	Very high	94.8	Very high	20 Å²	20	48.1 Å²	48.1	9%	0.088	26%	0.261	C	S	.	.	S	Bend	trans	-138	164.9	-177.1	63	-91.9	0	0	0	109.8	V111 D112 I114 L130 L133 P195 A199	V111-F201 HydrophobicContact CG1-CD2 4.35Å; V111-F201 HydrophobicContact CG1-CG 4.36Å; V111-F201 VanDerWaalsContact O-CB 3.27Å; V111-F201 WeakPolarHBondContact O-CB 3.49Å; D112-F201 WeakPolarHBondContact O-CB 3.45Å; I114-F201 HydrophobicContact CD1-CD2 4.22Å; I114-F201 HydrophobicContact CD1-CE2 3.51Å; I114-F201 HydrophobicContact CD1-CZ 4.15Å; I114-F201 HydrophobicContact CG1-CD2 4.09Å; I114-F201 HydrophobicContact CG1-CE2 3.88Å; L130-F201 HydrophobicContact CD2-CE2 3.6Å; L130-F201 HydrophobicContact CD2-CZ 3.64Å; L133-F201 HydrophobicContact CD1-CZ 4.16Å; P195-F201 HydrophobicContact CG-CD2 4.44Å; P195-F201 HydrophobicContact CG-CE2 3.84Å; P195-F201 HydrophobicContact CG-CZ 4.26Å; A199-F201 PolarHBondContact O-N 3.37Å
202	D	97.3	Very high	94.6	Very high	24 Å²	24	41.6 Å²	41.6	13%	0.128	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	162.9	176.5	63.9	41.3	0	0	0	111.8	D112 R113 I114 P192 Y193	D112-D202 PolarHBondContact O-N 3.33Å; R113-D202 CarbonylContact C-O 3.47Å; R113-D202 VanDerWaalsContact CA-O 3.24Å; R113-D202 WeakPolarHBondContact CA-O 3.31Å; R113-D202 WeakPolarHBondContact CB-OD1 3.45Å; R113-D202 VanDerWaalsContact CG-OD1 3.28Å; R113-D202 WeakPolarHBondContact CG-OD1 3.44Å; R113-D202 IonicContact CZ-OD1 2.74Å; R113-D202 IonicContact CZ-OD2 2.83Å; R113-D202 IonicContact NE-OD1 2.89Å; R113-D202 PolarHBondContact NE-OD1 2.93Å; R113-D202 IonicContact NE-OD2 3.95Å; R113-D202 IonicContact NH2-OD1 3.9Å; R113-D202 PolarHBondContact NH2-OD1 3.3Å; R113-D202 IonicContact NH2-OD2 3.65Å; R113-D202 PolarHBondContact NH2-OD2 3.43Å; I114-D202 PolarHBondContact N-O 2.91Å; P192-D202 HydrophobicContact CB-CB 4.09Å; Y193-D202 CarbonylContact O-C 3.54Å; Y193-D202 WeakPolarHBondContact O-CA 3.33Å; Y193-D202 WeakPolarHBondContact O-CB 3.28Å
203	C	98.2	Very high	94.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	156.2	171.7	-71.7	0	0	0	0	109.5	I114 P192 Y193	I114-C203 CarbonylContact O-C 3.53Å; I114-C203 WeakPolarHBondContact O-CA 3.26Å; P192-C203 CarbonylContact C-O 3.57Å; P192-C203 WeakPolarHBondContact CA-O 3.45Å; Y193-C203 HydrophobicContact CD1-CB 4.07Å; Y193-C203 VanDerWaalsContact CD1-O 3.24Å; Y193-C203 WeakPolarHBondContact CD1-O 3.24Å; Y193-C203 HydrophobicContact CD2-CB 4.08Å; Y193-C203 HydrophobicContact CE1-CB 3.52Å; Y193-C203 HydrophobicContact CE2-CB 3.53Å; Y193-C203 HydrophobicContact CG-CB 4.32Å; Y193-C203 PolarHBondContact N-O 2.94Å; Y193-C203 PolarHBondContact O-N 3.23Å; Y193-C203 WeakPolarHBondContact OH-CB 3.46Å
204	Q	97.7	Very high	94.2	Very high	19 Å²	19	37 Å²	37	9%	0.089	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	129	177.1	-170.8	173.3	43.9	0	0	111.3	I114 I115 H116 I189 D190	I114-Q204 PolarHBondContact O-N 3.35Å; I115-Q204 WeakPolarHBondContact CA-O 3.45Å; I115-Q204 HydrophobicContact CG1-CB 4.44Å; H116-Q204 PolarHBondContact N-O 3.32Å; I189-Q204 HydrophobicContact CG2-CG 4.05Å; D190-Q204 VanDerWaalsContact O-CG 3.3Å; D190-Q204 WeakPolarHBondContact O-CG 3.3Å; D190-Q204 PolarHBondContact O-NE2 3.42Å
205	L	97.5	Very high	94	Very high	7 Å²	7	35.1 Å²	35.1	4%	0.037	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	131.4	171.9	-178.6	67.2	0	0	0	110.5	H116 D118 D190	H116-L205 VanDerWaalsContact CE1-CD1 3.41Å; H116-L205 WeakPolarHBondContact CE1-CD1 3.27Å; D118-L205 VanDerWaalsContact CA-CD1 3.43Å; D118-L205 HydrophobicContact CB-CD1 3.8Å; D118-L205 HydrophobicContact CB-CD2 4.41Å; D190-L205 HydrophobicContact CB-CB 4.18Å; D190-L205 PolarHBondContact N-O 3.38Å; D190-L205 WeakPolarHBondContact OD2-CD2 3.47Å
206	S	97.4	Very high	93.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-134.3	112.7	176.6	173.9	0	0	0	0	111.6	H116 Y208 L209 H246	H116-S206 PolarHBondContact O-N 3.03Å; S206-Y208 PolarHBondContact O-N 3.38Å; S206-Y208 PolarHBondContact OG-N 3.36Å; S206-L209 WeakPolarHBondContact O-CB 3.15Å; S206-L209 PolarHBondContact O-N 3.1Å; S206-L209 VanDerWaalsContact O-N 3.1Å; S206-H246 PolarHBondContact OG-NE2 3.27Å
207	R	96.3	Very high	93.7	Very high	40 Å²	40	38 Å²	38	15%	0.151	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-73.3	-8.3	172.5	-61.3	178	179.7	72.7	6.4	112.4	D118 T187 M188 D190 L209 T210 R238	D118-R207 HydrophobicContact CB-CG 4.23Å; T187-R207 WeakPolarHBondContact O-CD 3.32Å; T187-R207 PolarHBondContact O-NH1 3.47Å; M188-R207 HydrophobicContact CE-CB 3.82Å; M188-R207 PolarHBondContact O-N 2.88Å; M188-R207 HydrophobicContact SD-CB 4.11Å; D190-R207 IonicContact OD1-NH1 2.66Å; D190-R207 PolarHBondContact OD1-NH1 3.29Å; D190-R207 IonicContact OD2-NH1 3.33Å; R207-L209 PolarHBondContact O-N 3.43Å; R207-T210 WeakPolarHBondContact CA-OG1 3.18Å; R207-T210 WeakPolarHBondContact O-CB 3.49Å; R207-T210 PolarHBondContact O-N 3.33Å; R207-T210 PolarHBondContact O-OG1 3.33Å; R207-R238 PolarHBondContact O-NH1 2.89Å
208	Y	96.5	Very high	93.8	Very high	37 Å²	37	34.2 Å²	34.2	15%	0.145	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-70.9	-21.8	166.6	-65.4	-67.1	0	0	0	112.7	M188 I189 S206 T210 R238 K241 G242 I245	M188-Y208 HydrophobicContact CB-CD2 3.98Å; M188-Y208 HydrophobicContact CB-CE1 4.09Å; M188-Y208 HydrophobicContact CB-CE2 3.33Å; M188-Y208 VanDerWaalsContact CB-CZ 3.41Å; M188-Y208 HydrophobicContact CE-CD1 3.71Å; M188-Y208 HydrophobicContact CE-CE1 3.75Å; M188-Y208 HydrophobicContact CE-CG 4.19Å; M188-Y208 HydrophobicContact CG-CE1 4.18Å; M188-Y208 HydrophobicContact CG-CE2 4.27Å; I189-Y208 HydrophobicContact CD1-CD2 3.63Å; I189-Y208 HydrophobicContact CD1-CE2 3.58Å; I189-Y208 HydrophobicContact CG1-CD2 3.55Å; I189-Y208 HydrophobicContact CG1-CE2 3.64Å; S206-Y208 PolarHBondContact O-N 3.38Å; S206-Y208 PolarHBondContact OG-N 3.36Å; Y208-T210 VanDerWaalsContact C-N 3.34Å; Y208-R238 HydrophobicContact CD1-CG 3.86Å; Y208-R238 VanDerWaalsContact CD1-O 3.24Å; Y208-R238 WeakPolarHBondContact CD1-O 3.21Å; Y208-R238 HydrophobicContact CE1-CG 4.44Å; Y208-R238 PolarHBondContact O-NH1 3.29Å; Y208-K241 HydrophobicContact CD1-CB 4.3Å; Y208-K241 HydrophobicContact CE1-CB 3.83Å; Y208-K241 HydrophobicContact CE1-CG 3.92Å; Y208-G242 VanDerWaalsContact CB-CA 3.45Å; Y208-I245 HydrophobicContact CD2-CD1 3.98Å; Y208-I245 HydrophobicContact CE1-CD1 4.42Å; Y208-I245 HydrophobicContact CE2-CD1 3.27Å
209	L	97	Very high	93.9	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-84.9	-4.7	175.6	-66.5	174	0	0	0	113.2	I115 S206 R207 F308 H311 V314 F315 W318	I115-L209 HydrophobicContact CB-CD1 4.28Å; I115-L209 HydrophobicContact CG2-CD1 3.65Å; S206-L209 WeakPolarHBondContact O-CB 3.15Å; S206-L209 PolarHBondContact O-N 3.1Å; S206-L209 VanDerWaalsContact O-N 3.1Å; R207-L209 PolarHBondContact O-N 3.43Å; L209-F308 HydrophobicContact CD1-CD1 4.01Å; L209-F308 HydrophobicContact CD2-CD1 4.1Å; L209-H311 PolarHBondContact O-CD2 3.38Å; L209-V314 HydrophobicContact CD2-CG1 4.41Å; L209-F315 HydrophobicContact CD2-CE1 4.14Å; L209-W318 HydrophobicContact CD2-CE3 4.49Å; L209-W318 HydrophobicContact CD2-CH2 3.33Å; L209-W318 HydrophobicContact CD2-CZ2 4.15Å; L209-W318 HydrophobicContact CD2-CZ3 3.54Å; L209-W318 HydrophobicContact CG-CH2 4.38Å
210	T	95.3	Very high	93.6	Very high	24 Å²	24	33.8 Å²	33.8	15%	0.147	19%	0.189	C	C	.	.	S	Bend	trans	-53.9	139.6	176.2	-47.9	0	0	0	0	110.5	D118 L119 R207 Y208 G212 R238	D118-T210 VanDerWaalsContact CG-OG1 3.3Å; D118-T210 WeakPolarHBondContact OD1-CB 3.17Å; D118-T210 PolarHBondContact OD1-OG1 3.35Å; D118-T210 PolarHBondContact OD2-OG1 3.43Å; L119-T210 HydrophobicContact CD1-CG2 3.88Å; L119-T210 HydrophobicContact CD2-CG2 3.95Å; L119-T210 HydrophobicContact CG-CG2 3.9Å; R207-T210 WeakPolarHBondContact CA-OG1 3.18Å; R207-T210 WeakPolarHBondContact O-CB 3.49Å; R207-T210 PolarHBondContact O-N 3.33Å; R207-T210 PolarHBondContact O-OG1 3.33Å; Y208-T210 VanDerWaalsContact C-N 3.34Å; T210-G212 PolarHBondContact O-N 3.03Å; T210-R238 PolarHBondContact O-NH1 3.32Å; T210-R238 PolarHBondContact O-NH2 3.25Å
211	E	93.4	Very high	93.2	Very high	56 Å²	56	29.2 Å²	29.2	26%	0.262	17%	0.172	S	C	.	.			trans	-61	134.9	-179.4	-167	169.4	-168.8	0	0	111.2	L119 R121 H311 N313	L119-E211 HydrophobicContact CD1-CB 3.9Å; R121-E211 IonicContact CZ-OE2 3.67Å; R121-E211 IonicContact NE-OE2 3.16Å; R121-E211 IonicContact NH2-OE2 2.99Å; R121-E211 PolarHBondContact NH2-OE2 2.93Å; E211-H311 HydrophobicContact CB-CB 3.95Å; E211-H311 HydrophobicContact CG-CB 3.86Å; E211-H311 PolarHBondContact N-CD2 2.97Å; E211-H311 VanDerWaalsContact N-CD2 3.31Å; E211-H311 IonicContact OE2-ND1 3.41Å; E211-N313 PolarHBondContact OE1-ND2 3.41Å
212	G	91.9	Very high	92.5	Very high	9 Å²	9	31.1 Å²	31.1	9%	0.093	19%	0.185	C	C	.	.			trans	-168.6	166.6	176.5	0	0	0	0	0	111.6	T210	T210-G212 PolarHBondContact O-N 3.03Å
213	P	92.4	Very high	91.6	Very high	17 Å²	17	34.7 Å²	34.7	11%	0.11	21%	0.213	C	C	.	.			trans	-71.4	128.8	174.2	28.2	-32.1	0	0	0	111	I231 E235	P213-I231 HydrophobicContact CG-CD1 3.95Å; P213-I231 HydrophobicContact CG-CG1 3.92Å; P213-E235 HydrophobicContact CG-CB 4.04Å; P213-E235 HydrophobicContact CG-CG 4.45Å
214	P	93.1	Very high	90.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	24%	0.24	C	C	.	.			trans	-58.6	157.6	173.4	-26.6	36.7	0	0	0	113.3	V216 R232 Y317 W330	P214-V216 PolarHBondContact O-N 3.45Å; P214-R232 VanDerWaalsContact O-CD 3.22Å; P214-R232 WeakPolarHBondContact O-CD 3.47Å; P214-R232 WeakPolarHBondContact O-CG 3.09Å; P214-R232 PolarHBondContact O-NH1 3.08Å; P214-Y317 HydrophobicContact CB-CD1 4.18Å; P214-Y317 HydrophobicContact CB-CD2 3.63Å; P214-Y317 HydrophobicContact CB-CE2 4.28Å; P214-Y317 HydrophobicContact CB-CG 3.59Å; P214-Y317 HydrophobicContact CG-CD2 4.39Å; P214-Y317 HydrophobicContact CG-CG 4.04Å; P214-W330 HydrophobicContact CG-CD2 3.85Å; P214-W330 HydrophobicContact CG-CE3 4.1Å; P214-W330 HydrophobicContact CG-CG 4.36Å; P214-W330 HydrophobicContact CG-CH2 4.22Å; P214-W330 HydrophobicContact CG-CZ2 3.97Å; P214-W330 HydrophobicContact CG-CZ3 4.26Å
215	P	91.1	Very high	89.6	Confident	40 Å²	40	38.1 Å²	38.1	26%	0.26	24%	0.238	S	C	.	.	S	Bend	trans	-61.4	-20.2	-173.7	24.2	-33.4	0	0	0	114.5	R232 Y317	P215-R232 WeakPolarHBondContact O-CD 3.16Å; P215-Y317 HydrophobicContact CG-CE1 4Å; P215-Y317 HydrophobicContact CG-CE2 3.95Å; P215-Y317 VanDerWaalsContact CG-CZ 3.47Å; P215-Y317 VanDerWaalsContact CG-OH 3.27Å; P215-Y317 WeakPolarHBondContact CG-OH 3.45Å
216	V	90.6	Very high	88.3	Confident	36 Å²	36	44.1 Å²	44.1	22%	0.218	26%	0.264	C	S	.	.	S	Bend	trans	-107.5	132.6	-178.5	-177.3	0	0	0	0	110.5	P214 R232 L327 E328 W330	P214-V216 PolarHBondContact O-N 3.45Å; V216-R232 PolarHBondContact O-NH1 3.19Å; V216-L327 HydrophobicContact CB-CB 4.4Å; V216-L327 HydrophobicContact CG2-CB 4.15Å; V216-L327 HydrophobicContact CG2-CD1 4.42Å; V216-E328 HydrophobicContact CG1-CB 4.32Å; V216-E328 HydrophobicContact CG1-CG 3.57Å; V216-E328 WeakPolarHBondContact CG1-OE1 3.36Å; V216-W330 PolarHBondContact O-NE1 3.29Å; V216-W330 VanDerWaalsContact O-NE1 3.16Å
217	A	89.7	Confident	87.4	Confident	43 Å²	43	52.5 Å²	52.5	36%	0.355	30%	0.3	S	S	.	.			trans	-66.8	135.3	173.9	0	0	0	0	0	110.3
218	P	89.6	Confident	86.6	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.013	30%	0.3	C	S	.	.			trans	-72.8	151.1	-178.5	27.7	-31.1	0	0	0	112	P220 P221 T225 E328 W330 L331	P218-P220 CarbonylContact O-C 3.34Å; P218-P220 VanDerWaalsContact O-C 3.3Å; P218-P221 WeakPolarHBondContact O-CA 3.22Å; P218-T225 HydrophobicContact CG-CG2 3.39Å; P218-E328 CarbonylContact C-O 3.6Å; P218-E328 VanDerWaalsContact CA-O 3.25Å; P218-E328 WeakPolarHBondContact CA-O 3.48Å; P218-W330 HydrophobicContact CB-CZ2 4.16Å; P218-W330 HydrophobicContact CG-CZ2 3.86Å; P218-L331 HydrophobicContact CB-CB 3.98Å; P218-L331 HydrophobicContact CB-CD1 3.62Å; P218-L331 HydrophobicContact CB-CG 3.78Å; P218-L331 HydrophobicContact CG-CD1 3.43Å; P218-L331 VanDerWaalsContact CG-CD1 3.43Å; P218-L331 HydrophobicContact CG-CG 4.03Å
219	V	88.3	Confident	85.8	Confident	75 Å²	75	53.4 Å²	53.4	46%	0.455	31%	0.312	S	S	.	.	S	Bend	trans	-119.8	121.6	175.8	176.9	0	0	0	0	111.2	E328 R332	V219-E328 HydrophobicContact CB-CB 4.03Å; V219-E328 HydrophobicContact CG2-CB 3.83Å; V219-E328 HydrophobicContact CG2-CG 4.03Å; V219-E328 PolarHBondContact N-O 3.02Å; V219-R332 PolarHBondContact O-NE 3.24Å; V219-R332 PolarHBondContact O-NH2 2.72Å
220	P	85.5	Confident	85.2	Confident	92 Å²	92	58.1 Å²	58.1	60%	0.597	34%	0.343	S	S	*	.	S	Bend	cis	-73.2	151.9	-2	31.5	-35.2	0	0	0	112.3	P218	P218-P220 CarbonylContact O-C 3.34Å; P218-P220 VanDerWaalsContact O-C 3.3Å
221	P	81.8	Confident	84.9	Confident	72 Å²	72	60 Å²	60	47%	0.468	35%	0.352	S	S	.	.			trans	-69.6	146.5	175.6	29.3	-34.8	0	0	0	110.8	P218 K226	P218-P221 WeakPolarHBondContact O-CA 3.22Å; P221-K226 HydrophobicContact CB-CG 4.44Å
222	T	81.3	Confident	84.8	Confident	59 Å²	59	58 Å²	58	36%	0.362	34%	0.342	S	S	.	.			trans	-105.6	168.3	171.6	65.3	0	0	0	0	110.6	S224 T225 K226 L331	T222-S224 VanDerWaalsContact C-N 3.29Å; T222-S224 PolarHBondContact O-N 2.85Å; T222-S224 PolarHBondContact OG1-OG 3.29Å; T222-S224 VanDerWaalsContact OG1-OG 3.08Å; T222-T225 PolarHBondContact N-OG1 3.24Å; T222-T225 PolarHBondContact O-N 2.86Å; T222-T225 PolarHBondContact O-OG1 3.04Å; T222-T225 WeakPolarHBondContact OG1-CG2 3.41Å; T222-T225 PolarHBondContact OG1-N 2.99Å; T222-T225 PolarHBondContact OG1-OG1 3.03Å; T222-K226 WeakPolarHBondContact O-CG 3.26Å; T222-K226 PolarHBondContact O-N 2.9Å; T222-L331 HydrophobicContact CG2-CD1 4.45Å
223	S	78.1	Confident	84.4	Confident	100 Å²	100	61.2 Å²	61.2	70%	0.699	36%	0.363	S	S	*	.	H	α-helix	trans	-61.4	-37	177.1	58.6	0	0	0	0	112.7
224	S	77.9	Confident	84.1	Confident	81 Å²	81	66.1 Å²	66.1	57%	0.566	39%	0.387	S	S	*	.	H	α-helix	trans	-69.8	-37.9	176.5	57.1	0	0	0	0	111.8	T222 K227	T222-S224 VanDerWaalsContact C-N 3.29Å; T222-S224 PolarHBondContact O-N 2.85Å; T222-S224 PolarHBondContact OG1-OG 3.29Å; T222-S224 VanDerWaalsContact OG1-OG 3.08Å; S224-K227 PolarHBondContact O-N 3.49Å
225	T	76.5	Confident	84.1	Confident	9 Å²	9	67.8 Å²	67.8	6%	0.055	40%	0.395	C	S	.	.	H	α-helix	trans	-71.1	-34.6	-177.8	59.8	0	0	0	0	112.3	P218 T222 K227 S228 R232 L331	P218-T225 HydrophobicContact CG-CG2 3.39Å; T222-T225 PolarHBondContact N-OG1 3.24Å; T222-T225 PolarHBondContact O-N 2.86Å; T222-T225 PolarHBondContact O-OG1 3.04Å; T222-T225 WeakPolarHBondContact OG1-CG2 3.41Å; T222-T225 PolarHBondContact OG1-N 2.99Å; T222-T225 PolarHBondContact OG1-OG1 3.03Å; T225-K227 PolarHBondContact O-N 2.96Å; T225-S228 PolarHBondContact O-N 2.74Å; T225-S228 PolarHBondContact O-OG 2.81Å; T225-R232 PolarHBondContact O-NH2 3.21Å; T225-L331 HydrophobicContact CG2-CD1 3.63Å
226	K	71.1	Confident	84.1	Confident	134 Å²	134	65.9 Å²	65.9	58%	0.583	38%	0.382	S	S	*	.	H	α-helix	trans	-60	-34.5	174.2	-70.4	-178.4	-179	-174.3	0	112.7	P221 T222 S228	P221-K226 HydrophobicContact CB-CG 4.44Å; T222-K226 WeakPolarHBondContact O-CG 3.26Å; T222-K226 PolarHBondContact O-N 2.9Å; K226-S228 PolarHBondContact O-N 2.9Å
227	K	77.7	Confident	84.2	Confident	176 Å²	176	70 Å²	70	77%	0.765	40%	0.402	S	S	*	.	H	α-helix	trans	-70.5	-21.8	177.2	-65.3	-178.8	-179	-176.4	0	113.1	S224 T225	S224-K227 PolarHBondContact O-N 3.49Å; T225-K227 PolarHBondContact O-N 2.96Å
228	S	80	Confident	84.5	Confident	21 Å²	21	69.5 Å²	69.5	15%	0.147	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-6.8	-177.4	66.7	0	0	0	0	114.1	T225 K226 P230 I231 R232	T225-S228 PolarHBondContact O-N 2.74Å; T225-S228 PolarHBondContact O-OG 2.81Å; K226-S228 PolarHBondContact O-N 2.9Å; S228-P230 VanDerWaalsContact C-CD 3.47Å; S228-I231 WeakPolarHBondContact O-CG1 3.37Å; S228-I231 PolarHBondContact O-N 2.9Å; S228-R232 PolarHBondContact O-N 2.86Å; S228-R232 PolarHBondContact OG-NH2 3.1Å
229	D	79.7	Confident	84.8	Confident	74 Å²	74	69.4 Å²	69.4	40%	0.396	39%	0.39	S	S	.	.	H	α-helix	trans	-59.9	-36.9	-175.7	-65.1	-23.8	0	0	0	114.2	I231 R232	D229-I231 VanDerWaalsContact C-N 3.33Å; D229-I231 PolarHBondContact O-N 2.84Å; D229-R232 WeakPolarHBondContact O-CB 3.42Å; D229-R232 PolarHBondContact O-N 2.84Å; D229-R232 IonicContact OD1-CZ 2.79Å; D229-R232 IonicContact OD1-NE 3.61Å; D229-R232 PolarHBondContact OD1-NE 3.37Å; D229-R232 VanDerWaalsContact OD1-NE 3.16Å; D229-R232 IonicContact OD1-NH2 3.68Å; D229-R232 PolarHBondContact OD1-NH2 3.33Å
230	P	84.2	Confident	85.1	Confident	101 Å²	101	67.9 Å²	67.9	66%	0.656	38%	0.379	S	S	*	.	H	α-helix	trans	-64.1	-34.1	176.4	-23.9	34.9	0	0	0	114.3	S228 S233	S228-P230 VanDerWaalsContact C-CD 3.47Å; P230-S233 PolarHBondContact O-OG 2.84Å
231	I	88.6	Confident	85.5	Confident	63 Å²	63	68 Å²	68	32%	0.323	37%	0.37	S	S	.	.	H	α-helix	trans	-90.9	-13.4	-178.9	59.1	167.2	0	0	0	112.6	P213 S228 D229 S233 I234 E235	P213-I231 HydrophobicContact CG-CD1 3.95Å; P213-I231 HydrophobicContact CG-CG1 3.92Å; S228-I231 WeakPolarHBondContact O-CG1 3.37Å; S228-I231 PolarHBondContact O-N 2.9Å; D229-I231 VanDerWaalsContact C-N 3.33Å; D229-I231 PolarHBondContact O-N 2.84Å; I231-S233 VanDerWaalsContact C-N 3.27Å; I231-S233 PolarHBondContact O-N 2.95Å; I231-I234 PolarHBondContact O-N 3.39Å; I231-E235 WeakPolarHBondContact O-CB 3.45Å; I231-E235 PolarHBondContact O-N 3.29Å
232	R	90.7	Very high	86.2	Confident	14 Å²	14	64.5 Å²	64.5	5%	0.053	35%	0.348	C	S	.	.	H	α-helix	trans	-60.3	-34.8	-178.4	-165.7	-177.7	-60.3	-71.5	-5.3	112.9	P214 P215 V216 T225 S228 D229 I234 G236	P214-R232 VanDerWaalsContact O-CD 3.22Å; P214-R232 WeakPolarHBondContact O-CD 3.47Å; P214-R232 WeakPolarHBondContact O-CG 3.09Å; P214-R232 PolarHBondContact O-NH1 3.08Å; P215-R232 WeakPolarHBondContact O-CD 3.16Å; V216-R232 PolarHBondContact O-NH1 3.19Å; T225-R232 PolarHBondContact O-NH2 3.21Å; S228-R232 PolarHBondContact O-N 2.86Å; S228-R232 PolarHBondContact OG-NH2 3.1Å; D229-R232 WeakPolarHBondContact O-CB 3.42Å; D229-R232 PolarHBondContact O-N 2.84Å; D229-R232 IonicContact OD1-CZ 2.79Å; D229-R232 IonicContact OD1-NE 3.61Å; D229-R232 PolarHBondContact OD1-NE 3.37Å; D229-R232 VanDerWaalsContact OD1-NE 3.16Å; D229-R232 IonicContact OD1-NH2 3.68Å; D229-R232 PolarHBondContact OD1-NH2 3.33Å; R232-I234 VanDerWaalsContact C-N 3.35Å; R232-I234 PolarHBondContact O-N 3.4Å; R232-G236 VanDerWaalsContact O-CA 3.23Å; R232-G236 WeakPolarHBondContact O-CA 3.44Å; R232-G236 PolarHBondContact O-N 3.41Å
233	S	84.6	Confident	86.9	Confident	77 Å²	77	62.3 Å²	62.3	54%	0.538	33%	0.333	S	S	.	.	H	α-helix	trans	-61.4	-42.9	179.2	54.7	0	0	0	0	112	P230 I231 I237	P230-S233 PolarHBondContact O-OG 2.84Å; I231-S233 VanDerWaalsContact C-N 3.27Å; I231-S233 PolarHBondContact O-N 2.95Å; S233-I237 WeakPolarHBondContact O-CD1 3.44Å; S233-I237 VanDerWaalsContact O-CG1 3.23Å; S233-I237 WeakPolarHBondContact O-CG1 3.47Å
234	I	87	Confident	87.7	Confident	119 Å²	119	60.9 Å²	60.9	61%	0.61	32%	0.316	S	S	*	.	H	α-helix	trans	-79.8	-52.3	-179.2	-62.3	168.7	0	0	0	110.3	I231 R232 G236 I237 R238	I231-I234 PolarHBondContact O-N 3.39Å; R232-I234 VanDerWaalsContact C-N 3.35Å; R232-I234 PolarHBondContact O-N 3.4Å; I234-G236 VanDerWaalsContact C-N 3.31Å; I234-G236 PolarHBondContact O-N 2.97Å; I234-I237 PolarHBondContact O-N 2.76Å; I234-R238 PolarHBondContact O-N 3.06Å
235	E	91.9	Very high	88.4	Confident	36 Å²	36	59.6 Å²	59.6	17%	0.168	30%	0.302	C	S	.	.	H	α-helix	trans	-67.4	-33.6	-176.2	-70.9	-65.8	102.2	0	0	112.4	P213 I231 R238 I239	P213-E235 HydrophobicContact CG-CB 4.04Å; P213-E235 HydrophobicContact CG-CG 4.45Å; I231-E235 WeakPolarHBondContact O-CB 3.45Å; I231-E235 PolarHBondContact O-N 3.29Å; E235-R238 WeakPolarHBondContact O-CB 3.32Å; E235-R238 PolarHBondContact O-N 3.08Å; E235-R238 IonicContact OE1-NE 3.55Å; E235-R238 PolarHBondContact OE1-NE 3.45Å; E235-R238 IonicContact OE2-CZ 3.55Å; E235-R238 IonicContact OE2-NE 3.72Å; E235-R238 PolarHBondContact OE2-NE 2.85Å; E235-R238 IonicContact OE2-NH2 2.63Å; E235-R238 PolarHBondContact OE2-NH2 2.58Å; E235-I239 WeakPolarHBondContact O-CG1 3.34Å; E235-I239 PolarHBondContact O-N 3.04Å
236	G	92.3	Very high	89.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.5	-44.2	176.6	0	0	0	0	0	112.9	R232 I234 R238 I239 D240	R232-G236 VanDerWaalsContact O-CA 3.23Å; R232-G236 WeakPolarHBondContact O-CA 3.44Å; R232-G236 PolarHBondContact O-N 3.41Å; I234-G236 VanDerWaalsContact C-N 3.31Å; I234-G236 PolarHBondContact O-N 2.97Å; G236-R238 VanDerWaalsContact C-N 3.3Å; G236-R238 PolarHBondContact O-N 3.17Å; G236-I239 PolarHBondContact O-N 3.29Å; G236-D240 WeakPolarHBondContact O-CB 3.47Å; G236-D240 PolarHBondContact O-N 3.47Å
237	I	92.1	Very high	90.5	Very high	123 Å²	123	53 Å²	53	63%	0.631	27%	0.272	S	S	*	.	H	α-helix	trans	-61	-41.9	175.5	-68	167.8	0	0	0	110.4	S233 I234 D240 K241	S233-I237 WeakPolarHBondContact O-CD1 3.44Å; S233-I237 VanDerWaalsContact O-CG1 3.23Å; S233-I237 WeakPolarHBondContact O-CG1 3.47Å; I234-I237 PolarHBondContact O-N 2.76Å; I237-D240 PolarHBondContact O-N 3.48Å; I237-K241 WeakPolarHBondContact O-CB 3.43Å; I237-K241 PolarHBondContact O-N 2.85Å
238	R	95.1	Very high	91.1	Very high	31 Å²	31	46.7 Å²	46.7	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-49.5	176.6	-177.2	-178.3	63.8	70.2	6.8	111.1	M188 R207 Y208 T210 I234 E235 G236 D240 K241 G242	M188-R238 HydrophobicContact CE-CG 3.8Å; R207-R238 PolarHBondContact O-NH1 2.89Å; Y208-R238 HydrophobicContact CD1-CG 3.86Å; Y208-R238 VanDerWaalsContact CD1-O 3.24Å; Y208-R238 WeakPolarHBondContact CD1-O 3.21Å; Y208-R238 HydrophobicContact CE1-CG 4.44Å; Y208-R238 PolarHBondContact O-NH1 3.29Å; T210-R238 PolarHBondContact O-NH1 3.32Å; T210-R238 PolarHBondContact O-NH2 3.25Å; I234-R238 PolarHBondContact O-N 3.06Å; E235-R238 WeakPolarHBondContact O-CB 3.32Å; E235-R238 PolarHBondContact O-N 3.08Å; E235-R238 IonicContact OE1-NE 3.55Å; E235-R238 PolarHBondContact OE1-NE 3.45Å; E235-R238 IonicContact OE2-CZ 3.55Å; E235-R238 IonicContact OE2-NE 3.72Å; E235-R238 PolarHBondContact OE2-NE 2.85Å; E235-R238 IonicContact OE2-NH2 2.63Å; E235-R238 PolarHBondContact OE2-NH2 2.58Å; G236-R238 VanDerWaalsContact C-N 3.3Å; G236-R238 PolarHBondContact O-N 3.17Å; R238-D240 VanDerWaalsContact C-N 3.32Å; R238-D240 PolarHBondContact O-N 3.5Å; R238-K241 PolarHBondContact O-N 3.36Å; R238-G242 PolarHBondContact O-N 2.93Å
239	I	96.2	Very high	91.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.7	-39.7	179.9	-70.3	168.1	0	0	0	111.4	E235 G236 G242 Y243 V314 Y317 W318	E235-I239 WeakPolarHBondContact O-CG1 3.34Å; E235-I239 PolarHBondContact O-N 3.04Å; G236-I239 PolarHBondContact O-N 3.29Å; I239-G242 PolarHBondContact O-N 3.29Å; I239-Y243 PolarHBondContact O-N 3.41Å; I239-Y243 VanDerWaalsContact O-N 3.08Å; I239-V314 HydrophobicContact CD1-CG2 4.33Å; I239-V314 HydrophobicContact CG1-CG2 4.4Å; I239-V314 HydrophobicContact CG2-CG1 4.39Å; I239-Y317 HydrophobicContact CG2-CD1 3.49Å; I239-Y317 VanDerWaalsContact CG2-CD1 3.49Å; I239-Y317 HydrophobicContact CG2-CE1 3.88Å; I239-W318 PolarHBondContact O-NE1 3.38Å
240	D	94.9	Very high	92.1	Very high	43 Å²	43	46.4 Å²	46.4	23%	0.23	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-43	175.5	-92.2	-15	0	0	0	112.7	G236 I237 R238 G242 Y243 E244 Y317 K321	G236-D240 WeakPolarHBondContact O-CB 3.47Å; G236-D240 PolarHBondContact O-N 3.47Å; I237-D240 PolarHBondContact O-N 3.48Å; R238-D240 VanDerWaalsContact C-N 3.32Å; R238-D240 PolarHBondContact O-N 3.5Å; D240-G242 VanDerWaalsContact C-N 3.27Å; D240-G242 PolarHBondContact O-N 3.13Å; D240-Y243 WeakPolarHBondContact O-CB 3.24Å; D240-Y243 PolarHBondContact O-N 2.95Å; D240-E244 PolarHBondContact O-N 3.38Å; D240-Y317 VanDerWaalsContact OD1-CE1 3.29Å; D240-Y317 WeakPolarHBondContact OD1-CE1 3.19Å; D240-Y317 PolarHBondContact OD1-OH 3.22Å; D240-K321 IonicContact OD1-NZ 3.32Å; D240-K321 PolarHBondContact OD1-NZ 2.99Å; D240-K321 IonicContact OD2-NZ 2.66Å
241	K	94.2	Very high	92.5	Very high	94 Å²	94	42.3 Å²	42.3	41%	0.409	21%	0.212	S	C	.	.	H	α-helix	trans	-64.7	-36.4	176.6	-163.8	71.6	-158.8	160.6	0	111.6	Y208 I237 R238 Y243 E244 I245	Y208-K241 HydrophobicContact CD1-CB 4.3Å; Y208-K241 HydrophobicContact CE1-CB 3.83Å; Y208-K241 HydrophobicContact CE1-CG 3.92Å; I237-K241 WeakPolarHBondContact O-CB 3.43Å; I237-K241 PolarHBondContact O-N 2.85Å; R238-K241 PolarHBondContact O-N 3.36Å; K241-Y243 VanDerWaalsContact C-N 3.35Å; K241-E244 IonicContact NZ-OE2 3.28Å; K241-E244 PolarHBondContact NZ-OE2 3.44Å; K241-E244 PolarHBondContact O-N 3.28Å; K241-I245 HydrophobicContact CG-CD1 3.83Å; K241-I245 HydrophobicContact CG-CG1 4.46Å; K241-I245 WeakPolarHBondContact O-CD1 3.33Å; K241-I245 VanDerWaalsContact O-CG1 3.24Å; K241-I245 WeakPolarHBondContact O-CG1 3.42Å; K241-I245 PolarHBondContact O-N 3.4Å
242	G	95.7	Very high	92.7	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.8	-46	171.4	0	0	0	0	0	113.1	Y208 R238 I239 D240 E244 I245 H246	Y208-G242 VanDerWaalsContact CB-CA 3.45Å; R238-G242 PolarHBondContact O-N 2.93Å; I239-G242 PolarHBondContact O-N 3.29Å; D240-G242 VanDerWaalsContact C-N 3.27Å; D240-G242 PolarHBondContact O-N 3.13Å; G242-E244 PolarHBondContact O-N 3.02Å; G242-I245 PolarHBondContact O-N 2.83Å; G242-H246 WeakPolarHBondContact O-CB 3.45Å; G242-H246 PolarHBondContact O-CD2 3.35Å; G242-H246 PolarHBondContact O-N 2.89Å
243	Y	96.4	Very high	92.9	Very high	12 Å²	12	41.3 Å²	41.3	5%	0.047	21%	0.207	C	C	.	.	H	α-helix	trans	-56.4	-52.4	175.3	-179.9	-82.4	0	0	0	110.7	W37 I239 D240 K241 I245 H246 L247 W318 K321 L322	W37-Y243 HydrophobicContact CE3-CE1 4.25Å; W37-Y243 HydrophobicContact CZ3-CE1 4.24Å; W37-Y243 AromaticContact CZ3-CZ 3.98Å; W37-Y243 WeakPolarHBondContact CZ3-OH 3.32Å; I239-Y243 PolarHBondContact O-N 3.41Å; I239-Y243 VanDerWaalsContact O-N 3.08Å; D240-Y243 WeakPolarHBondContact O-CB 3.24Å; D240-Y243 PolarHBondContact O-N 2.95Å; K241-Y243 VanDerWaalsContact C-N 3.35Å; Y243-I245 PolarHBondContact O-N 2.85Å; Y243-H246 PolarHBondContact O-N 2.91Å; Y243-L247 HydrophobicContact CD2-CD1 3.43Å; Y243-L247 VanDerWaalsContact CD2-CD1 3.43Å; Y243-L247 HydrophobicContact CE2-CD1 3.6Å; Y243-L247 HydrophobicContact CG-CD1 4.13Å; Y243-L247 WeakPolarHBondContact O-CB 3.41Å; Y243-L247 PolarHBondContact O-N 3.37Å; Y243-W318 HydrophobicContact CD2-CB 4.16Å; Y243-W318 AromaticContact CD2-CD1 3.85Å; Y243-W318 HydrophobicContact CD2-CD2 4.36Å; Y243-W318 AromaticContact CD2-CG 3.9Å; Y243-W318 HydrophobicContact CD2-CG 3.9Å; Y243-W318 VanDerWaalsContact N-CZ2 3.29Å; Y243-K321 HydrophobicContact CD1-CD 4.37Å; Y243-K321 HydrophobicContact CD2-CB 3.99Å; Y243-K321 HydrophobicContact CD2-CD 3.86Å; Y243-K321 HydrophobicContact CE2-CB 3.38Å; Y243-K321 HydrophobicContact CE2-CD 4.03Å; Y243-K321 HydrophobicContact CE2-CG 4.32Å; Y243-K321 HydrophobicContact CG-CD 4.04Å; Y243-L322 HydrophobicContact CE2-CD2 4.23Å; Y243-L322 HydrophobicContact CE2-CG 3.91Å
244	E	94.1	Very high	93.2	Very high	71 Å²	71	45.3 Å²	45.3	33%	0.332	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-26.1	-178.8	-68.6	-172.1	157	0	0	113.7	K39 D240 K241 G242 H248	K39-E244 IonicContact NZ-OE1 2.65Å; K39-E244 PolarHBondContact NZ-OE1 2.9Å; D240-E244 PolarHBondContact O-N 3.38Å; K241-E244 IonicContact NZ-OE2 3.28Å; K241-E244 PolarHBondContact NZ-OE2 3.44Å; K241-E244 PolarHBondContact O-N 3.28Å; G242-E244 PolarHBondContact O-N 3.02Å; E244-H248 PolarHBondContact O-CE1 2.86Å; E244-H248 PolarHBondContact O-NE2 3.14Å
245	I	93.2	Very high	93.4	Very high	54 Å²	54	42 Å²	42	28%	0.277	20%	0.197	S	C	.	.	H	α-helix	trans	-85.1	-37.7	-179.7	-68.8	164.8	0	0	0	111.1	I189 Y208 K241 G242 Y243 H248	I189-I245 HydrophobicContact CD1-CB 4.22Å; I189-I245 HydrophobicContact CD1-CD1 4.03Å; I189-I245 HydrophobicContact CD1-CG2 3.32Å; Y208-I245 HydrophobicContact CD2-CD1 3.98Å; Y208-I245 HydrophobicContact CE1-CD1 4.42Å; Y208-I245 HydrophobicContact CE2-CD1 3.27Å; K241-I245 HydrophobicContact CG-CD1 3.83Å; K241-I245 HydrophobicContact CG-CG1 4.46Å; K241-I245 WeakPolarHBondContact O-CD1 3.33Å; K241-I245 VanDerWaalsContact O-CG1 3.24Å; K241-I245 WeakPolarHBondContact O-CG1 3.42Å; K241-I245 PolarHBondContact O-N 3.4Å; G242-I245 PolarHBondContact O-N 2.83Å; Y243-I245 PolarHBondContact O-N 2.85Å; I245-H248 VanDerWaalsContact C-NE2 3.34Å; I245-H248 PolarHBondContact O-CD2 2.93Å; I245-H248 PolarHBondContact O-NE2 3.42Å
246	H	95.5	Very high	93.5	Very high	3 Å²	3	40.3 Å²	40.3	1%	0.014	19%	0.189	C	C	.	.	H	α-helix	trans	-99.9	-27	-167.1	-68.7	-56.8	0	0	0	114.7	I115 S206 G242 Y243 F308 W318	I115-H246 WeakPolarHBondContact CD1-ND1 3.4Å; S206-H246 PolarHBondContact OG-NE2 3.27Å; G242-H246 WeakPolarHBondContact O-CB 3.45Å; G242-H246 PolarHBondContact O-CD2 3.35Å; G242-H246 PolarHBondContact O-N 2.89Å; Y243-H246 PolarHBondContact O-N 2.91Å; H246-F308 HydrophobicContact CB-CE1 3.68Å; H246-F308 HydrophobicContact CB-CZ 3.79Å; H246-W318 HydrophobicContact CB-CH2 4.48Å
247	L	95.8	Very high	93.4	Very high	1 Å²	1	44 Å²	44	1%	0.005	21%	0.208	C	C	.	.			trans	-110.5	102.3	-170.1	-65	170.3	0	0	0	111.4	W37 I69 F71 Y243 F308 W318 L322	W37-L247 HydrophobicContact CZ3-CB 4.35Å; I69-L247 HydrophobicContact CD1-CD2 4.25Å; I69-L247 HydrophobicContact CG1-CD2 4.27Å; I69-L247 HydrophobicContact CG2-CD2 3.86Å; F71-L247 HydrophobicContact CZ-CD2 4.4Å; Y243-L247 HydrophobicContact CD2-CD1 3.43Å; Y243-L247 VanDerWaalsContact CD2-CD1 3.43Å; Y243-L247 HydrophobicContact CE2-CD1 3.6Å; Y243-L247 HydrophobicContact CG-CD1 4.13Å; Y243-L247 WeakPolarHBondContact O-CB 3.41Å; Y243-L247 PolarHBondContact O-N 3.37Å; L247-F308 HydrophobicContact CD2-CE2 4.1Å; L247-F308 HydrophobicContact CD2-CZ 4.15Å; L247-W318 HydrophobicContact CD1-CB 4.3Å; L247-W318 HydrophobicContact CD1-CD2 3.99Å; L247-W318 HydrophobicContact CD1-CE3 3.64Å; L247-W318 HydrophobicContact CD1-CG 4.3Å; L247-W318 HydrophobicContact CD1-CZ3 4.21Å; L247-W318 HydrophobicContact CG-CE3 4.41Å; L247-L322 HydrophobicContact CB-CD2 4.48Å; L247-L322 HydrophobicContact CD1-CD1 3.92Å; L247-L322 HydrophobicContact CD1-CD2 4.33Å; L247-L322 HydrophobicContact CD1-CG 4.18Å; L247-L322 HydrophobicContact CD2-CD1 4.32Å
248	H	92	Very high	93.3	Very high	43 Å²	43	40.6 Å²	40.6	20%	0.199	19%	0.191	C	C	.	.			trans	-136.3	156.3	-177.6	-59.9	-75	0	0	0	111.8	K67 E244 I245	K67-H248 PolarHBondContact NZ-O 3.29Å; E244-H248 PolarHBondContact O-CE1 2.86Å; E244-H248 PolarHBondContact O-NE2 3.14Å; I245-H248 VanDerWaalsContact C-NE2 3.34Å; I245-H248 PolarHBondContact O-CD2 2.93Å; I245-H248 PolarHBondContact O-NE2 3.42Å
249	C	90.1	Very high	93.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-72.8	-31.7	171.4	81.2	0	0	0	0	112.5	D38 S40 K67 I345 N347 S372	D38-C249 VanDerWaalsContact OD2-CB 3.29Å; D38-C249 WeakPolarHBondContact OD2-CB 3.25Å; D38-C249 PolarHBondContact OD2-N 3.46Å; D38-C249 PolarHBondContact OD2-SG 3.35Å; S40-C249 PolarHBondContact OG-SG 2.92Å; K67-C249 WeakPolarHBondContact CD-O 3.49Å; C249-I345 HydrophobicContact CB-CG2 4.46Å; C249-N347 WeakPolarHBondContact CB-OD1 3.47Å; C249-N347 PolarHBondContact O-ND2 3.07Å; C249-S372 VanDerWaalsContact CB-OG 3.23Å; C249-S372 WeakPolarHBondContact CB-OG 3.45Å
250	K	89.5	Confident	92.8	Very high	89 Å²	89	40.5 Å²	40.5	39%	0.387	19%	0.19	S	C	.	.	S	Bend	trans	-82.2	150.1	176.9	-71.1	-179.6	180	176.7	0	111.1	K67	K67-K250 PolarHBondContact NZ-O 3.49Å
251	P	93.2	Very high	92.3	Very high	16 Å²	16	41.2 Å²	41.2	10%	0.104	19%	0.194	C	C	.	.			trans	-69.8	152.6	176.5	32.6	-39.1	0	0	0	112.2	G256 I257 Y260 I303 E304	P251-G256 WeakPolarHBondContact CB-O 3.44Å; P251-G256 WeakPolarHBondContact CG-O 3.42Å; P251-I257 HydrophobicContact CB-CG1 4.49Å; P251-I257 HydrophobicContact CG-CG1 4.16Å; P251-Y260 HydrophobicContact CG-CD1 4.49Å; P251-Y260 HydrophobicContact CG-CG 4.02Å; P251-I303 HydrophobicContact CB-CD1 4.28Å; P251-I303 HydrophobicContact CG-CD1 4.24Å; P251-E304 WeakPolarHBondContact CA-OE2 3.26Å; P251-E304 HydrophobicContact CB-CB 4.29Å
252	I	92.5	Very high	91.7	Very high	56 Å²	56	37.1 Å²	37.1	29%	0.287	18%	0.179	S	C	.	.			trans	-122.7	-13.1	176.5	64.8	171.6	0	0	0	113.4	E304 I306	I252-E304 PolarHBondContact N-OE1 2.9Å; I252-E304 PolarHBondContact N-OE2 3.04Å; I252-I306 HydrophobicContact CD1-CD1 3.69Å; I252-I306 HydrophobicContact CG1-CD1 3.79Å
253	T	94.4	Very high	90.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-88.3	156.5	176.6	62.3	0	0	0	0	110.6	D112 R113 Q255 G256 I257 E304	D112-T253 HydrophobicContact CB-CG2 4.01Å; R113-T253 HydrophobicContact CB-CG2 3.59Å; T253-Q255 VanDerWaalsContact C-N 3.33Å; T253-Q255 PolarHBondContact O-N 3.48Å; T253-G256 PolarHBondContact O-N 2.67Å; T253-G256 WeakPolarHBondContact OG1-CA 3.49Å; T253-G256 PolarHBondContact OG1-N 3.11Å; T253-I257 VanDerWaalsContact O-CG1 3.28Å; T253-I257 WeakPolarHBondContact O-CG1 3.38Å; T253-I257 PolarHBondContact O-N 3.1Å; T253-E304 VanDerWaalsContact CB-OE1 3.25Å; T253-E304 WeakPolarHBondContact CB-OE1 3.29Å; T253-E304 HydrophobicContact CG2-CG 4.27Å; T253-E304 VanDerWaalsContact CG2-OE1 3.26Å; T253-E304 WeakPolarHBondContact CG2-OE1 3.21Å; T253-E304 PolarHBondContact N-OE1 3.34Å; T253-E304 PolarHBondContact OG1-OE1 3.25Å
254	K	91.4	Very high	89.4	Confident	160 Å²	160	46.9 Å²	46.9	70%	0.696	22%	0.223	S	C	*	.	H	α-helix	trans	-61.2	-45.1	178.2	-66.1	178.6	-179.8	175.7	0	111	I257 I258	K254-I257 PolarHBondContact O-N 3.31Å; K254-I258 VanDerWaalsContact O-CG1 3.32Å; K254-I258 WeakPolarHBondContact O-CG1 3.38Å; K254-I258 PolarHBondContact O-N 3.32Å
255	Q	91.5	Very high	88.2	Confident	50 Å²	50	49 Å²	49	23%	0.234	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-43.3	178	-70.7	75.9	-5.6	0	0	110.6	D112 M200 T253 I257 I258 A259 P293	D112-Q255 VanDerWaalsContact OD1-CB 3.24Å; D112-Q255 WeakPolarHBondContact OD1-CB 3.45Å; M200-Q255 PolarHBondContact O-NE2 3.15Å; T253-Q255 VanDerWaalsContact C-N 3.33Å; T253-Q255 PolarHBondContact O-N 3.48Å; Q255-I257 PolarHBondContact O-N 2.97Å; Q255-I258 PolarHBondContact O-N 3.05Å; Q255-A259 VanDerWaalsContact O-CB 3.3Å; Q255-A259 WeakPolarHBondContact O-CB 3.36Å; Q255-A259 PolarHBondContact O-N 2.82Å; Q255-P293 HydrophobicContact CB-CB 4.3Å; Q255-P293 HydrophobicContact CB-CG 4.06Å; Q255-P293 HydrophobicContact CG-CG 4.01Å; Q255-P293 WeakPolarHBondContact O-CB 3.44Å
256	G	93.3	Very high	87.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.9	-42.5	174.1	0	0	0	0	0	113.5	P251 T253 A259 Y260 I303	P251-G256 WeakPolarHBondContact CB-O 3.44Å; P251-G256 WeakPolarHBondContact CG-O 3.42Å; T253-G256 PolarHBondContact O-N 2.67Å; T253-G256 WeakPolarHBondContact OG1-CA 3.49Å; T253-G256 PolarHBondContact OG1-N 3.11Å; G256-A259 PolarHBondContact O-N 3.28Å; G256-Y260 VanDerWaalsContact O-CB 3.23Å; G256-Y260 WeakPolarHBondContact O-CB 3.25Å; G256-Y260 PolarHBondContact O-N 2.89Å; G256-I303 VanDerWaalsContact CA-O 3.31Å; G256-I303 WeakPolarHBondContact CA-O 3.48Å
257	I	91.4	Very high	86	Confident	77 Å²	77	51.5 Å²	51.5	40%	0.395	26%	0.256	S	S	.	.	H	α-helix	trans	-65.9	-42.3	176.9	-67.9	163.9	0	0	0	111	P251 T253 K254 Q255 Y260 N261	P251-I257 HydrophobicContact CB-CG1 4.49Å; P251-I257 HydrophobicContact CG-CG1 4.16Å; T253-I257 VanDerWaalsContact O-CG1 3.28Å; T253-I257 WeakPolarHBondContact O-CG1 3.38Å; T253-I257 PolarHBondContact O-N 3.1Å; K254-I257 PolarHBondContact O-N 3.31Å; Q255-I257 PolarHBondContact O-N 2.97Å; I257-Y260 PolarHBondContact O-N 3.14Å; I257-N261 WeakPolarHBondContact O-CB 3.44Å; I257-N261 PolarHBondContact O-N 3.22Å; I257-N261 PolarHBondContact O-ND2 3.27Å
258	I	89.2	Confident	84.6	Confident	53 Å²	53	57.6 Å²	57.6	27%	0.272	29%	0.288	S	S	.	.	H	α-helix	trans	-62.3	-44.7	175.1	-66.4	164.2	0	0	0	110.5	K254 Q255 N261 G262 P293 C294	K254-I258 VanDerWaalsContact O-CG1 3.32Å; K254-I258 WeakPolarHBondContact O-CG1 3.38Å; K254-I258 PolarHBondContact O-N 3.32Å; Q255-I258 PolarHBondContact O-N 3.05Å; I258-N261 PolarHBondContact O-N 2.83Å; I258-G262 PolarHBondContact O-N 2.85Å; I258-P293 HydrophobicContact CB-CB 4.26Å; I258-P293 HydrophobicContact CG2-CB 4.06Å; I258-C294 HydrophobicContact CG2-CB 3.88Å
259	A	90.7	Very high	83.4	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.4	-42.8	178.5	0	0	0	0	0	112.6	Q255 G256 G262 P293 R296 I297 I303	Q255-A259 VanDerWaalsContact O-CB 3.3Å; Q255-A259 WeakPolarHBondContact O-CB 3.36Å; Q255-A259 PolarHBondContact O-N 2.82Å; G256-A259 PolarHBondContact O-N 3.28Å; A259-G262 PolarHBondContact O-N 3.1Å; A259-P293 WeakPolarHBondContact CA-O 3.26Å; A259-P293 HydrophobicContact CB-CB 4.27Å; A259-P293 WeakPolarHBondContact CB-O 3.41Å; A259-R296 HydrophobicContact CB-CB 4.12Å; A259-R296 HydrophobicContact CB-CG 4.37Å; A259-I297 WeakPolarHBondContact O-CD1 3.5Å; A259-I303 HydrophobicContact CB-CB 3.85Å; A259-I303 HydrophobicContact CB-CG2 4.16Å; A259-I303 WeakPolarHBondContact CB-O 3.4Å
260	Y	89.1	Confident	82.2	Confident	29 Å²	29	63 Å²	63	11%	0.114	32%	0.321	C	S	.	.	H	α-helix	trans	-64.6	-46.2	176.1	177.7	-103.8	0	0	0	111.8	H61 Y65 P251 G256 I257 G262 I303	H61-Y260 HydrophobicContact CB-CE2 4.3Å; H61-Y260 PolarHBondContact CD2-O 3.35Å; H61-Y260 PolarHBondContact NE2-O 2.86Å; Y65-Y260 HydrophobicContact CD1-CD2 4.4Å; Y65-Y260 HydrophobicContact CD1-CE2 4.24Å; Y65-Y260 HydrophobicContact CE1-CD2 4.16Å; Y65-Y260 AromaticContact CE1-CE2 3.62Å; Y65-Y260 HydrophobicContact CE1-CE2 3.62Å; Y65-Y260 HydrophobicContact CE2-CD2 4.22Å; Y65-Y260 HydrophobicContact CE2-CE2 4.23Å; Y65-Y260 AromaticContact CZ-CE2 3.6Å; P251-Y260 HydrophobicContact CG-CD1 4.49Å; P251-Y260 HydrophobicContact CG-CG 4.02Å; G256-Y260 VanDerWaalsContact O-CB 3.23Å; G256-Y260 WeakPolarHBondContact O-CB 3.25Å; G256-Y260 PolarHBondContact O-N 2.89Å; I257-Y260 PolarHBondContact O-N 3.14Å; Y260-G262 PolarHBondContact O-N 2.81Å; Y260-I303 HydrophobicContact CD2-CD1 4.08Å
261	N	85.6	Confident	80.9	Confident	57 Å²	57	59.5 Å²	59.5	31%	0.305	31%	0.307	S	S	.	.	H	α-helix	trans	-68.5	-26.9	179.3	-67.1	-20.1	0	0	0	112.3	H61 I257 I258 H265	H61-N261 PolarHBondContact NE2-O 2.87Å; I257-N261 WeakPolarHBondContact O-CB 3.44Å; I257-N261 PolarHBondContact O-N 3.22Å; I257-N261 PolarHBondContact O-ND2 3.27Å; I258-N261 PolarHBondContact O-N 2.83Å; N261-H265 HydrophobicContact CB-CB 3.68Å; N261-H265 PolarHBondContact O-CD2 3.32Å
262	G	81.3	Confident	79.1	Confident	9 Å²	9	61.9 Å²	61.9	9%	0.093	32%	0.324	C	S	.	.			trans	76.2	-167.6	175.3	0	0	0	0	0	113.7	I258 A259 Y260 F264 H265 C294	I258-G262 PolarHBondContact O-N 2.85Å; A259-G262 PolarHBondContact O-N 3.1Å; Y260-G262 PolarHBondContact O-N 2.81Å; G262-F264 VanDerWaalsContact C-N 3.34Å; G262-F264 PolarHBondContact O-N 2.83Å; G262-H265 PolarHBondContact O-N 3.21Å; G262-C294 WeakPolarHBondContact CA-O 3.38Å
263	L	74.3	Confident	77.2	Confident	33 Å²	33	63.2 Å²	63.2	17%	0.173	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-62.2	-37.6	-167.8	-72.4	77.4	0	0	0	113.4	H265 C266 C271 L274 C294 H295 I298	L263-H265 PolarHBondContact O-N 3.07Å; L263-H265 VanDerWaalsContact O-N 3.1Å; L263-C266 VanDerWaalsContact O-CB 3.31Å; L263-C266 WeakPolarHBondContact O-CB 3.42Å; L263-C266 PolarHBondContact O-N 3.09Å; L263-C266 VanDerWaalsContact O-N 3.09Å; L263-C271 HydrophobicContact CB-CB 4.03Å; L263-C271 HydrophobicContact CD2-CB 4.07Å; L263-C271 HydrophobicContact CG-CB 4.19Å; L263-L274 HydrophobicContact CD2-CD1 3.46Å; L263-L274 VanDerWaalsContact CD2-CD1 3.46Å; L263-C294 WeakPolarHBondContact CD1-O 3.49Å; L263-H295 WeakPolarHBondContact CD2-NE2 3.32Å; L263-I298 HydrophobicContact CD1-CD1 3.38Å; L263-I298 HydrophobicContact CD1-CG1 4.13Å; L263-I298 HydrophobicContact CD2-CD1 4.26Å; L263-I298 HydrophobicContact CG-CD1 4.49Å
264	F	69.1	Low	75.1	Confident	183 Å²	183	69 Å²	69	80%	0.803	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-65.7	-14.1	-176.4	-58.8	-70.1	0	0	0	113.8	G262	G262-F264 VanDerWaalsContact C-N 3.34Å; G262-F264 PolarHBondContact O-N 2.83Å
265	H	70.2	Confident	72.8	Confident	115 Å²	115	67.3 Å²	67.3	53%	0.532	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-118.3	16.7	178.3	-64.2	-69	0	0	0	112.4	N261 G262 L263 S267	N261-H265 HydrophobicContact CB-CB 3.68Å; N261-H265 PolarHBondContact O-CD2 3.32Å; G262-H265 PolarHBondContact O-N 3.21Å; L263-H265 PolarHBondContact O-N 3.07Å; L263-H265 VanDerWaalsContact O-N 3.1Å; H265-S267 PolarHBondContact O-N 2.91Å; H265-S267 VanDerWaalsContact O-N 3.12Å
266	C	72	Confident	70.5	Confident	7 Å²	7	70.8 Å²	70.8	5%	0.047	38%	0.38	C	S	.	.			trans	-72.7	104.1	178	-173.9	0	0	0	0	110.7	L263 L268 N269 C270 C292 C294	L263-C266 VanDerWaalsContact O-CB 3.31Å; L263-C266 WeakPolarHBondContact O-CB 3.42Å; L263-C266 PolarHBondContact O-N 3.09Å; L263-C266 VanDerWaalsContact O-N 3.09Å; C266-L268 PolarHBondContact O-N 3.43Å; C266-N269 PolarHBondContact O-N 3.3Å; C266-N269 VanDerWaalsContact O-N 3.09Å; C266-C270 PolarHBondContact SG-SG 2.97Å; C266-C292 VanDerWaalsContact SG-SG 3.62Å; C266-C294 HydrophobicContact CB-CB 4.09Å
267	S	68.7	Low	68	Low	104 Å²	104	76 Å²	76	73%	0.727	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.5	177.4	56.2	0	0	0	0	114.1	H265 N269	H265-S267 PolarHBondContact O-N 2.91Å; H265-S267 VanDerWaalsContact O-N 3.12Å; S267-N269 PolarHBondContact O-N 3.31Å
268	L	67.7	Low	65.7	Low	129 Å²	129	81.1 Å²	81.1	68%	0.675	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-6.8	177.4	-66.2	172.1	0	0	0	112.8	C266 C270	C266-L268 PolarHBondContact O-N 3.43Å; L268-C270 HydrophobicContact CB-CB 4.47Å; L268-C270 PolarHBondContact O-N 2.82Å
269	N	66.1	Low	63.3	Low	115 Å²	115	83.6 Å²	83.6	62%	0.615	45%	0.448	S	S	*	.			trans	48.6	14	-172.7	-78.6	-18.2	0	0	0	114.5	C266 S267 C271 S272	C266-N269 PolarHBondContact O-N 3.3Å; C266-N269 VanDerWaalsContact O-N 3.09Å; S267-N269 PolarHBondContact O-N 3.31Å; N269-C271 PolarHBondContact O-N 3.13Å; N269-S272 WeakPolarHBondContact O-CB 3.43Å; N269-S272 PolarHBondContact O-N 3.25Å; N269-S272 PolarHBondContact O-OG 2.99Å
270	C	65.9	Low	60.9	Low	42 Å²	42	90.8 Å²	90.8	28%	0.284	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-20.7	179	64.4	0	0	0	0	112.3	C266 L268 C290 C292	C266-C270 PolarHBondContact SG-SG 2.97Å; L268-C270 HydrophobicContact CB-CB 4.47Å; L268-C270 PolarHBondContact O-N 2.82Å; C270-C290 PolarHBondContact SG-SG 3.28Å; C270-C292 WeakPolarHBondContact SG-CB 3.48Å
271	C	61.2	Low	58.6	Low	15 Å²	15	97.9 Å²	97.9	10%	0.101	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-7	178.2	-54.9	0	0	0	0	114.6	L263 N269 I273 L274 C294 H295	L263-C271 HydrophobicContact CB-CB 4.03Å; L263-C271 HydrophobicContact CD2-CB 4.07Å; L263-C271 HydrophobicContact CG-CB 4.19Å; N269-C271 PolarHBondContact O-N 3.13Å; C271-I273 PolarHBondContact O-N 3.43Å; C271-L274 PolarHBondContact O-N 3.32Å; C271-C294 PolarHBondContact SG-SG 2.84Å; C271-H295 PolarHBondContact SG-CE1 2.8Å; C271-H295 PolarHBondContact SG-NE2 3.01Å
272	S	54.7	Low	56.5	Low	66 Å²	66	103.3 Å²	103.3	46%	0.462	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-58.6	-19.1	-177.5	56.1	0	0	0	0	112.6	N269 L274 N275	N269-S272 WeakPolarHBondContact O-CB 3.43Å; N269-S272 PolarHBondContact O-N 3.25Å; N269-S272 PolarHBondContact O-OG 2.99Å; S272-L274 VanDerWaalsContact C-N 3.3Å; S272-L274 PolarHBondContact O-N 2.81Å; S272-N275 PolarHBondContact O-N 3.04Å
273	I	52.5	Low	54.5	Low	83 Å²	83	110.1 Å²	110.1	43%	0.426	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-71.7	-21.3	178.4	-60.5	173.6	0	0	0	112.5	C271 N275 I288	C271-I273 PolarHBondContact O-N 3.43Å; I273-N275 VanDerWaalsContact C-N 3.35Å; I273-I288 HydrophobicContact CB-CD1 4.32Å; I273-I288 HydrophobicContact CD1-CD1 3.14Å; I273-I288 HydrophobicContact CG1-CD1 4.25Å; I273-I288 HydrophobicContact CG2-CD1 3.91Å
274	L	50.9	Low	53	Low	122 Å²	122	117 Å²	117	64%	0.639	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-77.8	-17.3	173.1	-79.6	164.2	0	0	0	113.4	L263 C271 S272	L263-L274 HydrophobicContact CD2-CD1 3.46Å; L263-L274 VanDerWaalsContact CD2-CD1 3.46Å; C271-L274 PolarHBondContact O-N 3.32Å; S272-L274 VanDerWaalsContact C-N 3.3Å; S272-L274 PolarHBondContact O-N 2.81Å
275	N	43.4	Very low	51.7	Low	125 Å²	125	116.1 Å²	116.1	67%	0.668	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-23.9	-178.3	-106.5	5.4	0	0	0	114.4	S272 I273	S272-N275 PolarHBondContact O-N 3.04Å; I273-N275 VanDerWaalsContact C-N 3.35Å
276	N	42.5	Very low	50.5	Low	123 Å²	123	118.4 Å²	118.4	66%	0.658	62%	0.617	S	S	*	*	S	Bend	trans	-99.6	-3.6	-169	-74.6	-10.5	0	0	0	115.6	H278	N276-H278 PolarHBondContact O-N 3.32Å
277	N	41.9	Very low	49.5	Very low	109 Å²	109	125.2 Å²	125.2	58%	0.583	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	13.8	-174.1	-73.2	-12.2	0	0	0	115.4	T279	N277-T279 PolarHBondContact O-N 2.94Å
278	H	43.4	Very low	48.7	Very low	185 Å²	185	124.8 Å²	124.8	86%	0.856	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-1.7	167.9	-94.1	-61.4	0	0	0	114.2	N276	N276-H278 PolarHBondContact O-N 3.32Å
279	T	38.6	Very low	48.4	Very low	105 Å²	105	125.8 Å²	125.8	64%	0.644	64%	0.641	S	S	*	*	S	Bend	trans	-135	89.3	172.4	57	0	0	0	0	110.1	N277	N277-T279 PolarHBondContact O-N 2.94Å
280	N	39.3	Very low	48.7	Very low	151 Å²	151	121.4 Å²	121.4	81%	0.807	62%	0.619	S	S	*	*			trans	167.9	107.9	132.7	-79.9	-20.7	0	0	0	108.9
281	H	42.4	Very low	49.3	Very low	178 Å²	178	126 Å²	126	82%	0.824	64%	0.636	S	S	*	*	S	Bend	trans	-54.9	138.6	170	-80.2	-88.2	0	0	0	109.9
282	H	40.7	Very low	50.4	Low	171 Å²	171	125.9 Å²	125.9	79%	0.792	64%	0.635	S	S	*	*			trans	74.1	72.8	176.8	-46.3	-73.5	0	0	0	115.4
283	N	39.2	Very low	52.1	Low	152 Å²	152	123.9 Å²	123.9	81%	0.813	62%	0.621	S	S	*	*	S	Bend	trans	-155.1	137.8	137.9	-90.2	-34.7	0	0	0	108.8	H285	N283-H285 PolarHBondContact O-N 3.06Å; N283-H285 VanDerWaalsContact O-N 3.16Å
284	H	42	Very low	53.8	Low	176 Å²	176	120 Å²	120	82%	0.815	60%	0.601	S	S	*	*			trans	-43.2	121.7	-178.1	-82.9	-95.5	0	0	0	110.8	H286	H284-H286 PolarHBondContact O-N 3.33Å
285	H	43.5	Very low	55.5	Low	165 Å²	165	114.7 Å²	114.7	76%	0.764	57%	0.573	S	S	*	*			trans	-58.4	88.6	169.8	-81.3	60.1	0	0	0	108	N283 I287	N283-H285 PolarHBondContact O-N 3.06Å; N283-H285 VanDerWaalsContact O-N 3.16Å; H285-I287 PolarHBondContact O-N 2.6Å
286	H	44.3	Very low	57.7	Low	163 Å²	163	109.7 Å²	109.7	76%	0.755	55%	0.545	S	S	*	.			trans	-65.6	91.5	158.6	-91.4	-92.9	0	0	0	105.2	H284 I288	H284-H286 PolarHBondContact O-N 3.33Å; H286-I288 PolarHBondContact O-N 2.91Å
287	I	50.1	Low	59.9	Low	151 Å²	151	105 Å²	105	77%	0.774	52%	0.52	S	S	*	.			trans	-57.7	96.1	158.8	-61.6	170.8	0	0	0	103.8	H285 Q289	H285-I287 PolarHBondContact O-N 2.6Å; I287-Q289 VanDerWaalsContact C-N 3.35Å; I287-Q289 PolarHBondContact O-N 3.22Å
288	I	53.3	Low	61.9	Low	94 Å²	94	104.8 Å²	104.8	48%	0.482	52%	0.517	S	S	.	.			trans	-63.5	108.1	171.1	-67.9	170.2	0	0	0	104.2	I273 H286 C290	I273-I288 HydrophobicContact CB-CD1 4.32Å; I273-I288 HydrophobicContact CD1-CD1 3.14Å; I273-I288 HydrophobicContact CG1-CD1 4.25Å; I273-I288 HydrophobicContact CG2-CD1 3.91Å; H286-I288 PolarHBondContact O-N 2.91Å; I288-C290 PolarHBondContact O-N 2.66Å
289	Q	61.4	Low	64	Low	151 Å²	151	100.8 Å²	100.8	71%	0.706	50%	0.499	S	S	*	.			trans	-64.7	89.6	174.9	-173.4	178.7	-17.7	0	0	107.5	I287 H291	I287-Q289 VanDerWaalsContact C-N 3.35Å; I287-Q289 PolarHBondContact O-N 3.22Å; Q289-H291 PolarHBondContact NE2-CE1 3.28Å; Q289-H291 PolarHBondContact NE2-NE2 3.44Å; Q289-H291 PolarHBondContact O-ND1 3.31Å
290	C	70.8	Confident	66.4	Low	23 Å²	23	101.7 Å²	101.7	16%	0.155	50%	0.5	C	S	.	.			trans	-89.2	116.2	-178.9	-175.6	0	0	0	0	109	C270 I288 C292 H295	C270-C290 PolarHBondContact SG-SG 3.28Å; I288-C290 PolarHBondContact O-N 2.66Å; C290-C292 PolarHBondContact O-N 2.94Å; C290-C292 WeakPolarHBondContact SG-CB 3.34Å; C290-C292 PolarHBondContact SG-N 2.98Å; C290-H295 VanDerWaalsContact CB-CE1 3.43Å; C290-H295 WeakPolarHBondContact CB-CE1 3.46Å; C290-H295 PolarHBondContact SG-CE1 3.29Å
291	H	78.3	Confident	69	Low	137 Å²	137	97.4 Å²	97.4	63%	0.634	48%	0.475	S	S	*	.			trans	-85	13	177.6	-60.6	93	0	0	0	112.8	Q289	Q289-H291 PolarHBondContact NE2-CE1 3.28Å; Q289-H291 PolarHBondContact NE2-NE2 3.44Å; Q289-H291 PolarHBondContact O-ND1 3.31Å
292	C	86.2	Confident	71.5	Confident	13 Å²	13	90.6 Å²	90.6	9%	0.088	45%	0.446	C	S	.	.			trans	-66	138.3	178.7	-172.8	0	0	0	0	110.4	C266 C270 C290 C294 H295	C266-C292 VanDerWaalsContact SG-SG 3.62Å; C270-C292 WeakPolarHBondContact SG-CB 3.48Å; C290-C292 PolarHBondContact O-N 2.94Å; C290-C292 WeakPolarHBondContact SG-CB 3.34Å; C290-C292 PolarHBondContact SG-N 2.98Å; C292-C294 PolarHBondContact O-N 2.82Å; C292-C294 PolarHBondContact SG-SG 3.4Å; C292-H295 PolarHBondContact O-N 2.65Å; C292-H295 VanDerWaalsContact O-N 3.16Å
293	P	89.6	Confident	74.1	Confident	24 Å²	24	82.4 Å²	82.4	16%	0.156	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-52	-27.6	177.3	-29	34.9	0	0	0	114.6	Q255 I258 A259 H295 R296	Q255-P293 HydrophobicContact CB-CB 4.3Å; Q255-P293 HydrophobicContact CB-CG 4.06Å; Q255-P293 HydrophobicContact CG-CG 4.01Å; Q255-P293 WeakPolarHBondContact O-CB 3.44Å; I258-P293 HydrophobicContact CB-CB 4.26Å; I258-P293 HydrophobicContact CG2-CB 4.06Å; A259-P293 WeakPolarHBondContact CA-O 3.26Å; A259-P293 HydrophobicContact CB-CB 4.27Å; A259-P293 WeakPolarHBondContact CB-O 3.41Å; P293-H295 PolarHBondContact O-N 2.79Å; P293-R296 WeakPolarHBondContact O-CB 3.49Å; P293-R296 VanDerWaalsContact O-CG 3.23Å; P293-R296 WeakPolarHBondContact O-CG 3.42Å; P293-R296 PolarHBondContact O-N 2.97Å
294	C	87.2	Confident	76.8	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.007	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-60	-19.3	-178.8	63.2	0	0	0	0	114.3	I258 G262 L263 C266 C271 C292	I258-C294 HydrophobicContact CG2-CB 3.88Å; G262-C294 WeakPolarHBondContact CA-O 3.38Å; L263-C294 WeakPolarHBondContact CD1-O 3.49Å; C266-C294 HydrophobicContact CB-CB 4.09Å; C271-C294 PolarHBondContact SG-SG 2.84Å; C292-C294 PolarHBondContact O-N 2.82Å; C292-C294 PolarHBondContact SG-SG 3.4Å
295	H	87.1	Confident	79.5	Confident	12 Å²	12	67 Å²	67	6%	0.056	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-91.7	-4.7	178.5	-60	98.6	0	0	0	114.1	L263 C271 C290 C292 P293 I297 I298 H299	L263-H295 WeakPolarHBondContact CD2-NE2 3.32Å; C271-H295 PolarHBondContact SG-CE1 2.8Å; C271-H295 PolarHBondContact SG-NE2 3.01Å; C290-H295 VanDerWaalsContact CB-CE1 3.43Å; C290-H295 WeakPolarHBondContact CB-CE1 3.46Å; C290-H295 PolarHBondContact SG-CE1 3.29Å; C292-H295 PolarHBondContact O-N 2.65Å; C292-H295 VanDerWaalsContact O-N 3.16Å; P293-H295 PolarHBondContact O-N 2.79Å; H295-I297 VanDerWaalsContact C-N 3.3Å; H295-I297 PolarHBondContact O-N 3.13Å; H295-I298 PolarHBondContact O-N 3.22Å; H295-H299 VanDerWaalsContact CB-CD2 3.4Å; H295-H299 WeakPolarHBondContact CB-CD2 3.32Å; H295-H299 WeakPolarHBondContact CB-NE2 3.34Å; H295-H299 PolarHBondContact O-CD2 3.31Å; H295-H299 PolarHBondContact O-N 2.93Å
296	R	89.9	Confident	82.1	Confident	20 Å²	20	59.1 Å²	59.1	8%	0.075	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-42.8	-172.1	-72.4	176.6	-176.8	-175.8	-5.1	112.7	D112 A259 P293 I298 H299 N300 E301 P302 I303	D112-R296 IonicContact OD1-CZ 3.78Å; D112-R296 VanDerWaalsContact OD1-CZ 3.27Å; D112-R296 IonicContact OD1-NH1 2.86Å; D112-R296 PolarHBondContact OD1-NH1 3.48Å; D112-R296 IonicContact OD1-NH2 3.86Å; D112-R296 PolarHBondContact OD1-NH2 3.12Å; D112-R296 IonicContact OD2-CZ 2.78Å; D112-R296 IonicContact OD2-NH1 2.73Å; D112-R296 PolarHBondContact OD2-NH1 3.28Å; D112-R296 IonicContact OD2-NH2 3.27Å; A259-R296 HydrophobicContact CB-CB 4.12Å; A259-R296 HydrophobicContact CB-CG 4.37Å; P293-R296 WeakPolarHBondContact O-CB 3.49Å; P293-R296 VanDerWaalsContact O-CG 3.23Å; P293-R296 WeakPolarHBondContact O-CG 3.42Å; P293-R296 PolarHBondContact O-N 2.97Å; R296-I298 PolarHBondContact O-N 3.43Å; R296-H299 CarbonylContact O-C 3.53Å; R296-H299 PolarHBondContact O-N 3.44Å; R296-N300 PolarHBondContact O-N 3.49Å; R296-E301 HydrophobicContact CB-CB 4Å; R296-E301 HydrophobicContact CG-CB 4.13Å; R296-E301 PolarHBondContact O-N 3.35Å; R296-P302 VanDerWaalsContact CD-O 3.31Å; R296-P302 WeakPolarHBondContact CD-O 2.99Å; R296-I303 PolarHBondContact NH1-O 2.92Å
297	I	87.9	Confident	84.7	Confident	25 Å²	25	51.4 Å²	51.4	13%	0.128	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-48.5	176.9	-62.1	179.2	0	0	0	111.2	Q63 A259 H295 H299 N300 I303	Q63-I297 HydrophobicContact CB-CG2 4.18Å; A259-I297 WeakPolarHBondContact O-CD1 3.5Å; H295-I297 VanDerWaalsContact C-N 3.3Å; H295-I297 PolarHBondContact O-N 3.13Å; I297-H299 VanDerWaalsContact C-N 3.27Å; I297-H299 PolarHBondContact O-N 2.97Å; I297-N300 PolarHBondContact O-N 3.08Å; I297-I303 HydrophobicContact CD1-CG2 3.91Å; I297-I303 HydrophobicContact CG1-CG2 3.36Å
298	I	85.2	Confident	87	Confident	103 Å²	103	44.2 Å²	44.2	53%	0.528	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-36.1	179.7	-62.5	-171.4	0	0	0	111.3	L263 H295 R296 N300	L263-I298 HydrophobicContact CD1-CD1 3.38Å; L263-I298 HydrophobicContact CD1-CG1 4.13Å; L263-I298 HydrophobicContact CD2-CD1 4.26Å; L263-I298 HydrophobicContact CG-CD1 4.49Å; H295-I298 PolarHBondContact O-N 3.22Å; R296-I298 PolarHBondContact O-N 3.43Å; I298-N300 PolarHBondContact O-N 3.48Å
299	H	87	Confident	89.2	Confident	101 Å²	101	39.7 Å²	39.7	47%	0.468	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	3	176.5	-63.5	-34.1	0	0	0	113.7	H295 R296 I297 E301	H295-H299 VanDerWaalsContact CB-CD2 3.4Å; H295-H299 WeakPolarHBondContact CB-CD2 3.32Å; H295-H299 WeakPolarHBondContact CB-NE2 3.34Å; H295-H299 PolarHBondContact O-CD2 3.31Å; H295-H299 PolarHBondContact O-N 2.93Å; R296-H299 CarbonylContact O-C 3.53Å; R296-H299 PolarHBondContact O-N 3.44Å; I297-H299 VanDerWaalsContact C-N 3.27Å; I297-H299 PolarHBondContact O-N 2.97Å; H299-E301 HydrophobicContact CB-CG 4.01Å; H299-E301 PolarHBondContact O-N 3.04Å
300	N	89.2	Confident	91	Very high	124 Å²	124	32.5 Å²	32.5	66%	0.663	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	35.1	-174.1	-168.9	48	0	0	0	112.6	H66 R296 I297 I298	H66-N300 PolarHBondContact CE1-O 2.88Å; R296-N300 PolarHBondContact O-N 3.49Å; I297-N300 PolarHBondContact O-N 3.08Å; I298-N300 PolarHBondContact O-N 3.48Å
301	E	93	Very high	92.2	Very high	61 Å²	61	31.4 Å²	31.4	29%	0.285	16%	0.159	S	C	.	.			trans	-91.5	152.5	170	-64.2	-172.2	165.8	0	0	109.8	K110 R296 H299 I303	K110-E301 IonicContact NZ-OE1 2.87Å; K110-E301 PolarHBondContact NZ-OE1 3.38Å; K110-E301 IonicContact NZ-OE2 2.77Å; K110-E301 PolarHBondContact NZ-OE2 3.35Å; R296-E301 HydrophobicContact CB-CB 4Å; R296-E301 HydrophobicContact CG-CB 4.13Å; R296-E301 PolarHBondContact O-N 3.35Å; H299-E301 HydrophobicContact CB-CG 4.01Å; H299-E301 PolarHBondContact O-N 3.04Å; E301-I303 PolarHBondContact O-N 3.42Å
302	P	95.7	Very high	93.1	Very high	35 Å²	35	25.3 Å²	25.3	23%	0.227	13%	0.132	C	C	.	.			trans	-58.3	130.1	174.8	-21	30.4	0	0	0	110.3	H66 L68 R296 E304	H66-P302 VanDerWaalsContact CD2-CA 3.49Å; H66-P302 WeakPolarHBondContact CD2-CA 3.49Å; H66-P302 WeakPolarHBondContact NE2-CA 3.23Å; H66-P302 WeakPolarHBondContact NE2-CD 3.4Å; H66-P302 VanDerWaalsContact NE2-N 3.17Å; H66-P302 CarbonylContact O-C 3.58Å; H66-P302 VanDerWaalsContact O-CA 3.31Å; H66-P302 WeakPolarHBondContact O-CA 3.44Å; L68-P302 HydrophobicContact CB-CB 4.11Å; L68-P302 HydrophobicContact CB-CG 4.19Å; R296-P302 VanDerWaalsContact CD-O 3.31Å; R296-P302 WeakPolarHBondContact CD-O 2.99Å; P302-E304 PolarHBondContact O-N 2.94Å
303	I	94.9	Very high	93.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-61.5	-32.4	177.6	58.5	158.7	0	0	0	111	Y65 H66 K67 P251 G256 A259 Y260 R296 I297 E301	Y65-I303 HydrophobicContact CD2-CD1 3.33Å; Y65-I303 HydrophobicContact CD2-CG1 3.91Å; Y65-I303 HydrophobicContact CE2-CD1 3.7Å; Y65-I303 HydrophobicContact CG-CD1 4.17Å; H66-I303 WeakPolarHBondContact O-CG1 3.39Å; H66-I303 PolarHBondContact O-N 3.49Å; K67-I303 HydrophobicContact CG-CD1 4.06Å; K67-I303 HydrophobicContact CG-CG1 3.77Å; P251-I303 HydrophobicContact CB-CD1 4.28Å; P251-I303 HydrophobicContact CG-CD1 4.24Å; G256-I303 VanDerWaalsContact CA-O 3.31Å; G256-I303 WeakPolarHBondContact CA-O 3.48Å; A259-I303 HydrophobicContact CB-CB 3.85Å; A259-I303 HydrophobicContact CB-CG2 4.16Å; A259-I303 WeakPolarHBondContact CB-O 3.4Å; Y260-I303 HydrophobicContact CD2-CD1 4.08Å; R296-I303 PolarHBondContact NH1-O 2.92Å; I297-I303 HydrophobicContact CD1-CG2 3.91Å; I297-I303 HydrophobicContact CG1-CG2 3.36Å; E301-I303 PolarHBondContact O-N 3.42Å
304	E	96.8	Very high	93.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	133.8	-179.2	175.5	173.4	-94.5	0	0	110.2	K67 L68 D112 P251 I252 T253 P302 I306	K67-E304 WeakPolarHBondContact CA-O 3.27Å; K67-E304 WeakPolarHBondContact CE-OE2 3.23Å; K67-E304 HydrophobicContact CG-CB 4.28Å; K67-E304 IonicContact NZ-OE2 3.22Å; K67-E304 PolarHBondContact NZ-OE2 3.21Å; L68-E304 PolarHBondContact N-O 3.12Å; D112-E304 VanDerWaalsContact OD2-CA 3.27Å; D112-E304 WeakPolarHBondContact OD2-CA 3.44Å; P251-E304 WeakPolarHBondContact CA-OE2 3.26Å; P251-E304 HydrophobicContact CB-CB 4.29Å; I252-E304 PolarHBondContact N-OE1 2.9Å; I252-E304 PolarHBondContact N-OE2 3.04Å; T253-E304 VanDerWaalsContact CB-OE1 3.25Å; T253-E304 WeakPolarHBondContact CB-OE1 3.29Å; T253-E304 HydrophobicContact CG2-CG 4.27Å; T253-E304 VanDerWaalsContact CG2-OE1 3.26Å; T253-E304 WeakPolarHBondContact CG2-OE1 3.21Å; T253-E304 PolarHBondContact N-OE1 3.34Å; T253-E304 PolarHBondContact OG1-OE1 3.25Å; P302-E304 PolarHBondContact O-N 2.94Å; E304-I306 HydrophobicContact CG-CD1 4.3Å; E304-I306 HydrophobicContact CG-CG1 3.83Å; E304-I306 WeakPolarHBondContact OE2-CD1 3.28Å
305	T	98.3	Very high	94.3	Very high	4 Å²	4	25.2 Å²	25.2	3%	0.025	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116.3	169.6	-57.7	0	0	0	0	110.5	L68 I70 I109 K110 D112 R113	L68-T305 HydrophobicContact CB-CG2 4.04Å; L68-T305 HydrophobicContact CD2-CG2 4Å; L68-T305 HydrophobicContact CG-CG2 4.31Å; L68-T305 CarbonylContact O-C 3.6Å; L68-T305 VanDerWaalsContact O-CA 3.3Å; L68-T305 WeakPolarHBondContact O-CA 3.37Å; I70-T305 HydrophobicContact CD1-CG2 4.02Å; I109-T305 HydrophobicContact CG2-CG2 3.75Å; K110-T305 WeakPolarHBondContact O-CB 3.45Å; K110-T305 PolarHBondContact O-OG1 2.81Å; K110-T305 VanDerWaalsContact O-OG1 3.07Å; D112-T305 PolarHBondContact N-O 3.02Å; D112-T305 PolarHBondContact OD2-N 3.04Å; R113-T305 PolarHBondContact N-O 2.9Å
306	I	98.7	Very high	94.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123.9	174.1	-51.8	177.5	0	0	0	109.5	L68 I69 I70 R113 I115 I252 E304 F308	L68-I306 PolarHBondContact O-N 3.42Å; I69-I306 HydrophobicContact CD1-CB 4.11Å; I69-I306 HydrophobicContact CD1-CD1 4.36Å; I69-I306 HydrophobicContact CD1-CG1 4.42Å; I70-I306 PolarHBondContact N-O 3.13Å; R113-I306 WeakPolarHBondContact O-CA 3.32Å; I115-I306 HydrophobicContact CD1-CG2 3.85Å; I115-I306 HydrophobicContact CG1-CG2 3.87Å; I252-I306 HydrophobicContact CD1-CD1 3.69Å; I252-I306 HydrophobicContact CG1-CD1 3.79Å; E304-I306 HydrophobicContact CG-CD1 4.3Å; E304-I306 HydrophobicContact CG-CG1 3.83Å; E304-I306 WeakPolarHBondContact OE2-CD1 3.28Å; I306-F308 HydrophobicContact CB-CD2 4.49Å; I306-F308 HydrophobicContact CB-CE2 3.85Å; I306-F308 HydrophobicContact CB-CZ 4.46Å; I306-F308 HydrophobicContact CG2-CD2 3.9Å; I306-F308 HydrophobicContact CG2-CE1 4.44Å; I306-F308 HydrophobicContact CG2-CE2 3.34Å; I306-F308 HydrophobicContact CG2-CZ 3.66Å
307	L	98.7	Very high	95.2	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	132.7	170.8	173.7	61.9	0	0	0	110	I70 I72 L104 V111 R113 I114 I115 V129 I309	I70-L307 HydrophobicContact CB-CD1 3.77Å; I70-L307 HydrophobicContact CG2-CD1 3.55Å; I70-L307 CarbonylContact O-C 3.57Å; I70-L307 WeakPolarHBondContact O-CA 3.4Å; I72-L307 HydrophobicContact CB-CD1 4.28Å; I72-L307 HydrophobicContact CD1-CD1 3.57Å; I72-L307 HydrophobicContact CD1-CD2 4.13Å; I72-L307 HydrophobicContact CD1-CG 4.45Å; I72-L307 HydrophobicContact CG1-CD1 3.64Å; L104-L307 HydrophobicContact CD1-CD1 4.39Å; L104-L307 HydrophobicContact CD1-CD2 3.75Å; V111-L307 HydrophobicContact CG1-CB 4.32Å; R113-L307 PolarHBondContact O-N 3.09Å; I114-L307 CarbonylContact C-O 3.45Å; I114-L307 VanDerWaalsContact CA-O 3.3Å; I114-L307 WeakPolarHBondContact CA-O 3.3Å; I114-L307 HydrophobicContact CD1-CD2 4.02Å; I114-L307 HydrophobicContact CG1-CB 4.21Å; I114-L307 HydrophobicContact CG1-CD2 4.04Å; I114-L307 HydrophobicContact CG1-CG 4.49Å; I114-L307 HydrophobicContact CG2-CD2 4.23Å; I114-L307 HydrophobicContact CG2-CG 4.28Å; I115-L307 PolarHBondContact N-O 3.2Å; V129-L307 HydrophobicContact CG1-CD2 3.98Å; L307-I309 HydrophobicContact CD1-CG1 4.48Å; L307-I309 HydrophobicContact CD2-CD1 4.11Å; L307-I309 HydrophobicContact CD2-CG1 4.28Å; L307-I309 HydrophobicContact CG-CD1 4.44Å; L307-I309 HydrophobicContact CG-CG1 4.08Å
308	F	98.8	Very high	95.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.1	176.6	-71.7	-91.8	0	0	0	109.8	I69 I70 F71 I72 I115 L209 H246 L247 I306 F315 W318	I69-F308 HydrophobicContact CD1-CE2 4.3Å; I69-F308 HydrophobicContact CG2-CD2 3.93Å; I69-F308 HydrophobicContact CG2-CE2 3.85Å; I70-F308 PolarHBondContact O-N 2.88Å; F71-F308 HydrophobicContact CD1-CB 3.47Å; F71-F308 VanDerWaalsContact CD1-CB 3.47Å; F71-F308 HydrophobicContact CD1-CD2 4.1Å; F71-F308 AromaticContact CD1-CG 3.95Å; F71-F308 HydrophobicContact CD1-CG 3.95Å; F71-F308 HydrophobicContact CE1-CB 3.81Å; F71-F308 HydrophobicContact CE1-CD1 4.44Å; F71-F308 AromaticContact CE1-CD2 3.73Å; F71-F308 HydrophobicContact CE1-CD2 3.73Å; F71-F308 HydrophobicContact CE1-CE2 4.42Å; F71-F308 AromaticContact CE1-CG 3.74Å; F71-F308 HydrophobicContact CE1-CG 3.74Å; I72-F308 PolarHBondContact N-O 2.85Å; I115-F308 HydrophobicContact CB-CD1 3.91Å; I115-F308 HydrophobicContact CB-CE1 3.95Å; I115-F308 HydrophobicContact CD1-CE1 3.78Å; I115-F308 HydrophobicContact CD1-CZ 3.97Å; I115-F308 HydrophobicContact CG1-CE1 4.26Å; I115-F308 HydrophobicContact CG2-CD1 4.37Å; I115-F308 HydrophobicContact CG2-CE1 4.29Å; I115-F308 CarbonylContact O-C 3.54Å; I115-F308 VanDerWaalsContact O-CA 3.22Å; I115-F308 WeakPolarHBondContact O-CA 3.27Å; L209-F308 HydrophobicContact CD1-CD1 4.01Å; L209-F308 HydrophobicContact CD2-CD1 4.1Å; H246-F308 HydrophobicContact CB-CE1 3.68Å; H246-F308 HydrophobicContact CB-CZ 3.79Å; L247-F308 HydrophobicContact CD2-CE2 4.1Å; L247-F308 HydrophobicContact CD2-CZ 4.15Å; I306-F308 HydrophobicContact CB-CD2 4.49Å; I306-F308 HydrophobicContact CB-CE2 3.85Å; I306-F308 HydrophobicContact CB-CZ 4.46Å; I306-F308 HydrophobicContact CG2-CD2 3.9Å; I306-F308 HydrophobicContact CG2-CE1 4.44Å; I306-F308 HydrophobicContact CG2-CE2 3.34Å; I306-F308 HydrophobicContact CG2-CZ 3.66Å; F308-F315 HydrophobicContact CB-CE1 3.95Å; F308-F315 HydrophobicContact CB-CZ 4.05Å; F308-W318 HydrophobicContact CD1-CZ3 4.09Å; F308-W318 HydrophobicContact CE1-CZ3 4.02Å
309	I	98.8	Very high	96.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	119.8	179.8	-55.4	-178.6	0	0	0	109.7	I72 I114 I115 H116 S117 T125 T126 V129 L307	I72-I309 HydrophobicContact CB-CG1 4.32Å; I72-I309 WeakPolarHBondContact O-CA 3.26Å; I114-I309 HydrophobicContact CG2-CD1 3.66Å; I114-I309 HydrophobicContact CG2-CG1 4.01Å; I115-I309 PolarHBondContact O-N 3.11Å; H116-I309 WeakPolarHBondContact CA-O 3.23Å; H116-I309 HydrophobicContact CB-CB 4.11Å; S117-I309 PolarHBondContact N-O 3.32Å; T125-I309 HydrophobicContact CG2-CG2 3.52Å; T126-I309 HydrophobicContact CG2-CD1 4.19Å; V129-I309 HydrophobicContact CB-CD1 4.08Å; V129-I309 HydrophobicContact CG1-CD1 4.14Å; V129-I309 HydrophobicContact CG2-CD1 4.15Å; L307-I309 HydrophobicContact CD1-CG1 4.48Å; L307-I309 HydrophobicContact CD2-CD1 4.11Å; L307-I309 HydrophobicContact CD2-CG1 4.28Å; L307-I309 HydrophobicContact CG-CD1 4.44Å; L307-I309 HydrophobicContact CG-CG1 4.08Å
310	G	98.2	Very high	96.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.4	-141.8	-168.5	0	0	0	0	0	114.4	I72 R73 H74 F315	I72-G310 PolarHBondContact O-N 3.43Å; I72-G310 VanDerWaalsContact O-N 3.1Å; R73-G310 WeakPolarHBondContact CA-O 3.18Å; H74-G310 PolarHBondContact CD2-O 3.19Å; H74-G310 VanDerWaalsContact CD2-O 3.27Å; H74-G310 PolarHBondContact N-O 3.33Å; G310-F315 VanDerWaalsContact C-CE2 3.47Å
311	H	97.5	Very high	97	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.055	C	C	.	.			trans	-120.2	148	-161.3	-42.5	-78.8	0	0	0	112.4	H74 S117 R121 L209 E211 N313 V314 F315	H74-H311 AromaticContact CD2-ND1 3.22Å; H74-H311 PolarHBondContact CD2-ND1 3.29Å; H74-H311 AromaticContact NE2-ND1 3.78Å; S117-H311 WeakPolarHBondContact CB-NE2 3.22Å; S117-H311 PolarHBondContact OG-NE2 2.84Å; R121-H311 PolarHBondContact NE-CE1 3.22Å; R121-H311 PolarHBondContact NE-ND1 2.86Å; L209-H311 PolarHBondContact O-CD2 3.38Å; E211-H311 HydrophobicContact CB-CB 3.95Å; E211-H311 HydrophobicContact CG-CB 3.86Å; E211-H311 PolarHBondContact N-CD2 2.97Å; E211-H311 VanDerWaalsContact N-CD2 3.31Å; E211-H311 IonicContact OE2-ND1 3.41Å; H311-N313 VanDerWaalsContact C-N 3.33Å; H311-N313 PolarHBondContact O-N 3.37Å; H311-V314 PolarHBondContact O-N 2.92Å; H311-F315 WeakPolarHBondContact O-CD2 3.24Å; H311-F315 WeakPolarHBondContact O-CG 3.29Å; H311-F315 PolarHBondContact O-N 3.11Å
312	A	96.2	Very high	97.2	Very high	8 Å²	8	8 Å²	8	7%	0.066	4%	0.041	C	C	.	.	H	α-helix	trans	-62.2	-35.4	-173.6	0	0	0	0	0	113.7	R73 V314 R316 L335	R73-A312 HydrophobicContact CG-CB 4.44Å; A312-V314 PolarHBondContact O-N 2.98Å; A312-R316 VanDerWaalsContact O-CB 3.28Å; A312-R316 WeakPolarHBondContact O-CB 3.08Å; A312-R316 WeakPolarHBondContact O-CG 3.33Å; A312-R316 PolarHBondContact O-N 3.37Å; A312-R316 PolarHBondContact O-NE 2.63Å; A312-L335 HydrophobicContact CB-CB 4.3Å; A312-L335 HydrophobicContact CB-CD1 4.36Å
313	N	93.9	Very high	97.2	Very high	35 Å²	35	6.6 Å²	6.6	19%	0.187	3%	0.032	C	C	.	.	H	α-helix	trans	-63.5	-44.1	-178.5	-67	-14.2	0	0	0	111.9	E211 H311 R316 Y317 W330	E211-N313 PolarHBondContact OE1-ND2 3.41Å; H311-N313 VanDerWaalsContact C-N 3.33Å; H311-N313 PolarHBondContact O-N 3.37Å; N313-R316 PolarHBondContact OD1-NH2 3.04Å; N313-Y317 PolarHBondContact O-N 3.5Å; N313-W330 HydrophobicContact CB-CZ3 3.98Å; N313-W330 WeakPolarHBondContact OD1-CZ3 3.46Å
314	V	97.3	Very high	97.1	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-66.4	-50.2	179	-178.1	0	0	0	0	110	L209 I239 H311 A312 R316 Y317 W318	L209-V314 HydrophobicContact CD2-CG1 4.41Å; I239-V314 HydrophobicContact CD1-CG2 4.33Å; I239-V314 HydrophobicContact CG1-CG2 4.4Å; I239-V314 HydrophobicContact CG2-CG1 4.39Å; H311-V314 PolarHBondContact O-N 2.92Å; A312-V314 PolarHBondContact O-N 2.98Å; V314-R316 PolarHBondContact O-N 3.25Å; V314-Y317 PolarHBondContact O-N 3.28Å; V314-W318 HydrophobicContact CG1-CD2 4.07Å; V314-W318 HydrophobicContact CG1-CG 4.47Å; V314-W318 HydrophobicContact CG1-CZ2 4.01Å; V314-W318 PolarHBondContact O-N 3.33Å
315	F	98.3	Very high	96.9	Very high	1 Å²	1	9.1 Å²	9.1	0%	0.004	4%	0.044	C	C	.	.	H	α-helix	trans	-66.4	-41.3	-176.5	-62.5	-28.1	0	0	0	113.4	F71 I72 L209 F308 G310 H311 Y317 W318 I319 L335	F71-F315 HydrophobicContact CB-CB 4.45Å; F71-F315 HydrophobicContact CB-CD1 4.29Å; F71-F315 HydrophobicContact CB-CD2 3.91Å; F71-F315 HydrophobicContact CB-CE2 4.15Å; F71-F315 HydrophobicContact CB-CG 3.98Å; F71-F315 HydrophobicContact CB-CZ 4.43Å; F71-F315 AromaticContact CD1-CD1 3.34Å; F71-F315 HydrophobicContact CD1-CD1 3.34Å; F71-F315 HydrophobicContact CD1-CD2 4.44Å; F71-F315 AromaticContact CD1-CE1 3.42Å; F71-F315 HydrophobicContact CD1-CE1 3.42Å; F71-F315 VanDerWaalsContact CD1-CE1 3.42Å; F71-F315 HydrophobicContact CD1-CE2 4.49Å; F71-F315 AromaticContact CD1-CG 3.89Å; F71-F315 HydrophobicContact CD1-CG 3.89Å; F71-F315 HydrophobicContact CD1-CZ 4.01Å; F71-F315 AromaticContact CE1-CD1 3.83Å; F71-F315 HydrophobicContact CE1-CD1 3.83Å; F71-F315 AromaticContact CE1-CE1 3.99Å; F71-F315 HydrophobicContact CE1-CE1 3.99Å; F71-F315 HydrophobicContact CG-CB 4.32Å; F71-F315 AromaticContact CG-CD1 3.9Å; F71-F315 HydrophobicContact CG-CD1 3.9Å; F71-F315 HydrophobicContact CG-CD2 4.39Å; F71-F315 HydrophobicContact CG-CE1 4.27Å; F71-F315 AromaticContact CG-CG 3.96Å; F71-F315 HydrophobicContact CG-CG 3.96Å; I72-F315 WeakPolarHBondContact O-CE2 3.48Å; L209-F315 HydrophobicContact CD2-CE1 4.14Å; F308-F315 HydrophobicContact CB-CE1 3.95Å; F308-F315 HydrophobicContact CB-CZ 4.05Å; G310-F315 VanDerWaalsContact C-CE2 3.47Å; H311-F315 WeakPolarHBondContact O-CD2 3.24Å; H311-F315 WeakPolarHBondContact O-CG 3.29Å; H311-F315 PolarHBondContact O-N 3.11Å; F315-Y317 VanDerWaalsContact C-N 3.28Å; F315-Y317 PolarHBondContact O-N 3.19Å; F315-W318 PolarHBondContact O-N 2.95Å; F315-I319 WeakPolarHBondContact O-CB 3.29Å; F315-I319 WeakPolarHBondContact O-CD1 3.33Å; F315-I319 WeakPolarHBondContact O-CG1 3.34Å; F315-I319 PolarHBondContact O-N 3.5Å; F315-L335 HydrophobicContact CB-CD1 3.81Å
316	R	97.4	Very high	96.7	Very high	33 Å²	33	12.2 Å²	12.2	13%	0.125	6%	0.064	C	C	.	.	H	α-helix	trans	-60.4	-42.1	177.3	-70.6	179.9	-70.1	172.6	-7.2	111.6	A312 N313 V314 I319 C320 W330 L333 L335	A312-R316 VanDerWaalsContact O-CB 3.28Å; A312-R316 WeakPolarHBondContact O-CB 3.08Å; A312-R316 WeakPolarHBondContact O-CG 3.33Å; A312-R316 PolarHBondContact O-N 3.37Å; A312-R316 PolarHBondContact O-NE 2.63Å; N313-R316 PolarHBondContact OD1-NH2 3.04Å; V314-R316 PolarHBondContact O-N 3.25Å; R316-I319 PolarHBondContact O-N 3.41Å; R316-C320 PolarHBondContact O-N 2.97Å; R316-C320 PolarHBondContact O-SG 2.78Å; R316-C320 VanDerWaalsContact O-SG 3.38Å; R316-W330 HydrophobicContact CB-CB 4.3Å; R316-W330 HydrophobicContact CB-CE3 4.46Å; R316-W330 WeakPolarHBondContact CB-O 3.48Å; R316-W330 WeakPolarHBondContact CD-O 3.32Å; R316-L333 HydrophobicContact CB-CB 4.26Å; R316-L333 HydrophobicContact CB-CD1 4.34Å; R316-L333 WeakPolarHBondContact CD-O 3.36Å; R316-L333 HydrophobicContact CG-CB 3.79Å; R316-L333 PolarHBondContact NH1-O 2.81Å; R316-L335 HydrophobicContact CG-CD1 3.73Å; R316-L335 HydrophobicContact CG-CG 3.99Å
317	Y	96.9	Very high	96.4	Very high	3 Å²	3	14.4 Å²	14.4	1%	0.012	8%	0.076	C	C	.	.	H	α-helix	trans	-65.1	-46.4	175.5	175.8	-108.1	0	0	0	112.4	P214 P215 I239 D240 N313 V314 F315 I319 C320 K321 L327	P214-Y317 HydrophobicContact CB-CD1 4.18Å; P214-Y317 HydrophobicContact CB-CD2 3.63Å; P214-Y317 HydrophobicContact CB-CE2 4.28Å; P214-Y317 HydrophobicContact CB-CG 3.59Å; P214-Y317 HydrophobicContact CG-CD2 4.39Å; P214-Y317 HydrophobicContact CG-CG 4.04Å; P215-Y317 HydrophobicContact CG-CE1 4Å; P215-Y317 HydrophobicContact CG-CE2 3.95Å; P215-Y317 VanDerWaalsContact CG-CZ 3.47Å; P215-Y317 VanDerWaalsContact CG-OH 3.27Å; P215-Y317 WeakPolarHBondContact CG-OH 3.45Å; I239-Y317 HydrophobicContact CG2-CD1 3.49Å; I239-Y317 VanDerWaalsContact CG2-CD1 3.49Å; I239-Y317 HydrophobicContact CG2-CE1 3.88Å; D240-Y317 VanDerWaalsContact OD1-CE1 3.29Å; D240-Y317 WeakPolarHBondContact OD1-CE1 3.19Å; D240-Y317 PolarHBondContact OD1-OH 3.22Å; N313-Y317 PolarHBondContact O-N 3.5Å; V314-Y317 PolarHBondContact O-N 3.28Å; F315-Y317 VanDerWaalsContact C-N 3.28Å; F315-Y317 PolarHBondContact O-N 3.19Å; Y317-I319 VanDerWaalsContact C-N 3.33Å; Y317-I319 PolarHBondContact O-N 3.36Å; Y317-C320 WeakPolarHBondContact O-CB 3.4Å; Y317-C320 PolarHBondContact O-N 3.13Å; Y317-K321 HydrophobicContact CE1-CD 3.68Å; Y317-K321 HydrophobicContact CE1-CG 4.19Å; Y317-K321 HydrophobicContact CE2-CG 4.38Å; Y317-K321 PolarHBondContact O-N 3Å; Y317-K321 WeakPolarHBondContact OH-CD 3.37Å; Y317-K321 WeakPolarHBondContact OH-CE 3.17Å; Y317-L327 HydrophobicContact CE2-CB 4.13Å; Y317-L327 HydrophobicContact CE2-CD1 4.13Å; Y317-L327 HydrophobicContact CE2-CD2 4.16Å; Y317-L327 HydrophobicContact CE2-CG 4.37Å
318	W	98.1	Very high	96.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63.6	-37.2	176.7	-73.5	4.9	0	0	0	112.8	F71 L209 I239 Y243 H246 L247 F308 V314 F315 K321 L322	F71-W318 AromaticContact CE1-CE3 3.89Å; F71-W318 HydrophobicContact CE1-CE3 3.89Å; F71-W318 HydrophobicContact CE1-CZ3 4.37Å; F71-W318 HydrophobicContact CZ-CE3 4.08Å; L209-W318 HydrophobicContact CD2-CE3 4.49Å; L209-W318 HydrophobicContact CD2-CH2 3.33Å; L209-W318 HydrophobicContact CD2-CZ2 4.15Å; L209-W318 HydrophobicContact CD2-CZ3 3.54Å; L209-W318 HydrophobicContact CG-CH2 4.38Å; I239-W318 PolarHBondContact O-NE1 3.38Å; Y243-W318 HydrophobicContact CD2-CB 4.16Å; Y243-W318 AromaticContact CD2-CD1 3.85Å; Y243-W318 HydrophobicContact CD2-CD2 4.36Å; Y243-W318 AromaticContact CD2-CG 3.9Å; Y243-W318 HydrophobicContact CD2-CG 3.9Å; Y243-W318 VanDerWaalsContact N-CZ2 3.29Å; H246-W318 HydrophobicContact CB-CH2 4.48Å; L247-W318 HydrophobicContact CD1-CB 4.3Å; L247-W318 HydrophobicContact CD1-CD2 3.99Å; L247-W318 HydrophobicContact CD1-CE3 3.64Å; L247-W318 HydrophobicContact CD1-CG 4.3Å; L247-W318 HydrophobicContact CD1-CZ3 4.21Å; L247-W318 HydrophobicContact CG-CE3 4.41Å; F308-W318 HydrophobicContact CD1-CZ3 4.09Å; F308-W318 HydrophobicContact CE1-CZ3 4.02Å; V314-W318 HydrophobicContact CG1-CD2 4.07Å; V314-W318 HydrophobicContact CG1-CG 4.47Å; V314-W318 HydrophobicContact CG1-CZ2 4.01Å; V314-W318 PolarHBondContact O-N 3.33Å; F315-W318 PolarHBondContact O-N 2.95Å; W318-K321 PolarHBondContact O-N 3.49Å; W318-L322 WeakPolarHBondContact O-CB 3.15Å; W318-L322 WeakPolarHBondContact O-CG 3.3Å; W318-L322 PolarHBondContact O-N 3.44Å
319	I	98	Very high	95.8	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-62.8	-45	173.7	-71.2	165	0	0	0	110	F71 F315 R316 Y317 K321 L322 L323 L333 L343 L376 L379	F71-I319 HydrophobicContact CD2-CD1 4.04Å; F71-I319 HydrophobicContact CD2-CG1 3.92Å; F71-I319 HydrophobicContact CE2-CD1 4.47Å; F71-I319 HydrophobicContact CE2-CG1 3.85Å; F315-I319 WeakPolarHBondContact O-CB 3.29Å; F315-I319 WeakPolarHBondContact O-CD1 3.33Å; F315-I319 WeakPolarHBondContact O-CG1 3.34Å; F315-I319 PolarHBondContact O-N 3.5Å; R316-I319 PolarHBondContact O-N 3.41Å; Y317-I319 VanDerWaalsContact C-N 3.33Å; Y317-I319 PolarHBondContact O-N 3.36Å; I319-K321 VanDerWaalsContact C-N 3.32Å; I319-K321 PolarHBondContact O-N 3.19Å; I319-L322 PolarHBondContact O-N 3.35Å; I319-L323 HydrophobicContact CG2-CD1 3.71Å; I319-L323 HydrophobicContact CG2-CG 4.39Å; I319-L323 WeakPolarHBondContact O-CB 3Å; I319-L323 WeakPolarHBondContact O-CG 3.33Å; I319-L323 PolarHBondContact O-N 3.01Å; I319-L333 HydrophobicContact CB-CD1 4.27Å; I319-L333 HydrophobicContact CG2-CD1 3.88Å; I319-L343 HydrophobicContact CG1-CD1 4.31Å; I319-L376 HydrophobicContact CG2-CD2 4.48Å; I319-L379 HydrophobicContact CD1-CD1 3.84Å; I319-L379 HydrophobicContact CG2-CD1 4.45Å
320	C	96.3	Very high	95.5	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.014	10%	0.103	C	C	.	.	H	α-helix	trans	-57.4	-44.5	173.4	-73.3	0	0	0	0	111.6	R316 Y317 Q324 L325 L327	R316-C320 PolarHBondContact O-N 2.97Å; R316-C320 PolarHBondContact O-SG 2.78Å; R316-C320 VanDerWaalsContact O-SG 3.38Å; Y317-C320 WeakPolarHBondContact O-CB 3.4Å; Y317-C320 PolarHBondContact O-N 3.13Å; C320-Q324 WeakPolarHBondContact O-CA 3.28Å; C320-Q324 PolarHBondContact O-N 3.38Å; C320-L325 HydrophobicContact CB-CB 4.33Å; C320-L325 PolarHBondContact O-N 3.19Å; C320-L327 HydrophobicContact CB-CD2 4.1Å
321	K	95.5	Very high	95.2	Very high	47 Å²	47	22 Å²	22	20%	0.204	12%	0.116	C	C	.	.	H	α-helix	trans	-62.6	-50.2	175.9	-75.7	-166	114.7	170	0	112.9	D240 Y243 Y317 W318 I319 L323 Q324 L327	D240-K321 IonicContact OD1-NZ 3.32Å; D240-K321 PolarHBondContact OD1-NZ 2.99Å; D240-K321 IonicContact OD2-NZ 2.66Å; Y243-K321 HydrophobicContact CD1-CD 4.37Å; Y243-K321 HydrophobicContact CD2-CB 3.99Å; Y243-K321 HydrophobicContact CD2-CD 3.86Å; Y243-K321 HydrophobicContact CE2-CB 3.38Å; Y243-K321 HydrophobicContact CE2-CD 4.03Å; Y243-K321 HydrophobicContact CE2-CG 4.32Å; Y243-K321 HydrophobicContact CG-CD 4.04Å; Y317-K321 HydrophobicContact CE1-CD 3.68Å; Y317-K321 HydrophobicContact CE1-CG 4.19Å; Y317-K321 HydrophobicContact CE2-CG 4.38Å; Y317-K321 PolarHBondContact O-N 3Å; Y317-K321 WeakPolarHBondContact OH-CD 3.37Å; Y317-K321 WeakPolarHBondContact OH-CE 3.17Å; W318-K321 PolarHBondContact O-N 3.49Å; I319-K321 VanDerWaalsContact C-N 3.32Å; I319-K321 PolarHBondContact O-N 3.19Å; K321-L323 PolarHBondContact O-N 2.77Å; K321-Q324 PolarHBondContact O-N 2.86Å; K321-L327 HydrophobicContact CB-CD2 4.37Å; K321-L327 HydrophobicContact CG-CD2 3.55Å
322	L	96	Very high	95	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.1	-37.8	-178.9	-82.5	171.2	0	0	0	111.9	W33 W37 F71 Y243 L247 W318 I319 L343 V374	W33-L322 VanDerWaalsContact CH2-O 3.32Å; W33-L322 WeakPolarHBondContact CH2-O 3.39Å; W37-L322 HydrophobicContact CE3-CD2 4.23Å; W37-L322 HydrophobicContact CH2-CD2 3.6Å; W37-L322 HydrophobicContact CZ2-CD2 4.25Å; W37-L322 HydrophobicContact CZ3-CD2 3.58Å; F71-L322 HydrophobicContact CE2-CD1 4.14Å; F71-L322 HydrophobicContact CZ-CD1 4.19Å; Y243-L322 HydrophobicContact CE2-CD2 4.23Å; Y243-L322 HydrophobicContact CE2-CG 3.91Å; L247-L322 HydrophobicContact CB-CD2 4.48Å; L247-L322 HydrophobicContact CD1-CD1 3.92Å; L247-L322 HydrophobicContact CD1-CD2 4.33Å; L247-L322 HydrophobicContact CD1-CG 4.18Å; L247-L322 HydrophobicContact CD2-CD1 4.32Å; W318-L322 WeakPolarHBondContact O-CB 3.15Å; W318-L322 WeakPolarHBondContact O-CG 3.3Å; W318-L322 PolarHBondContact O-N 3.44Å; I319-L322 PolarHBondContact O-N 3.35Å; L322-L343 HydrophobicContact CB-CD2 4.1Å; L322-L343 HydrophobicContact CD1-CD2 3.83Å; L322-V374 HydrophobicContact CB-CG1 4.2Å; L322-V374 HydrophobicContact CD2-CG2 4.35Å; L322-V374 WeakPolarHBondContact O-CB 3.45Å
323	L	95.6	Very high	94.9	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	1.8	179.3	-60.7	177.6	0	0	0	113.6	A14 I319 K321 L325 L343 V374 L376	A14-L323 WeakPolarHBondContact CB-O 3.28Å; I319-L323 HydrophobicContact CG2-CD1 3.71Å; I319-L323 HydrophobicContact CG2-CG 4.39Å; I319-L323 WeakPolarHBondContact O-CB 3Å; I319-L323 WeakPolarHBondContact O-CG 3.33Å; I319-L323 PolarHBondContact O-N 3.01Å; K321-L323 PolarHBondContact O-N 2.77Å; L323-L325 HydrophobicContact CB-CD1 4.03Å; L323-L325 HydrophobicContact CB-CG 3.82Å; L323-L325 HydrophobicContact CD1-CD1 4.08Å; L323-L325 PolarHBondContact O-N 3.23Å; L323-L343 HydrophobicContact CD2-CD2 4.39Å; L323-L343 HydrophobicContact CG-CD2 4.48Å; L323-V374 HydrophobicContact CD2-CG1 4.22Å; L323-L376 HydrophobicContact CD1-CB 3.9Å; L323-L376 HydrophobicContact CD1-CD2 3.64Å; L323-L376 HydrophobicContact CD1-CG 4.34Å; L323-L376 HydrophobicContact CD2-CB 4.02Å
324	Q	94	Very high	94.9	Very high	29 Å²	29	33.8 Å²	33.8	14%	0.136	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	35.6	-176.3	-52.3	-176.1	26.2	0	0	113.1	W33 N34 C320 K321	W33-Q324 VanDerWaalsContact CE2-NE2 3.32Å; W33-Q324 HydrophobicContact CE3-CB 4.34Å; W33-Q324 HydrophobicContact CE3-CG 4.09Å; W33-Q324 HydrophobicContact CH2-CG 4.1Å; W33-Q324 HydrophobicContact CZ3-CB 4.08Å; W33-Q324 HydrophobicContact CZ3-CG 3.8Å; N34-Q324 PolarHBondContact O-NE2 3.1Å; C320-Q324 WeakPolarHBondContact O-CA 3.28Å; C320-Q324 PolarHBondContact O-N 3.38Å; K321-Q324 PolarHBondContact O-N 2.86Å
325	L	92.7	Very high	94.9	Very high	25 Å²	25	33.9 Å²	33.9	13%	0.131	17%	0.172	C	C	.	.			trans	-81.2	157.7	173	-61.8	175.4	0	0	0	110.2	V17 C320 L323 L327	V17-L325 HydrophobicContact CB-CD2 4.07Å; V17-L325 HydrophobicContact CG1-CD1 4.39Å; V17-L325 HydrophobicContact CG1-CD2 3.83Å; C320-L325 HydrophobicContact CB-CB 4.33Å; C320-L325 PolarHBondContact O-N 3.19Å; L323-L325 HydrophobicContact CB-CD1 4.03Å; L323-L325 HydrophobicContact CB-CG 3.82Å; L323-L325 HydrophobicContact CD1-CD1 4.08Å; L323-L325 PolarHBondContact O-N 3.23Å; L325-L327 PolarHBondContact O-N 3.32Å; L325-L327 VanDerWaalsContact O-N 3.13Å
326	P	93.2	Very high	94.8	Very high	68 Å²	68	34 Å²	34	44%	0.442	17%	0.173	S	C	.	.			trans	-50.9	122	172.5	-27.5	35.3	0	0	0	111.2	E328 G329	P326-E328 PolarHBondContact O-N 3.34Å; P326-G329 PolarHBondContact O-N 3.22Å
327	L	93	Very high	94.8	Very high	47 Å²	47	33.1 Å²	33.1	25%	0.246	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-67.5	-28.8	-170.4	-62.8	-175.5	0	0	0	111.5	V216 Y317 C320 K321 L325 G329 W330	V216-L327 HydrophobicContact CB-CB 4.4Å; V216-L327 HydrophobicContact CG2-CB 4.15Å; V216-L327 HydrophobicContact CG2-CD1 4.42Å; Y317-L327 HydrophobicContact CE2-CB 4.13Å; Y317-L327 HydrophobicContact CE2-CD1 4.13Å; Y317-L327 HydrophobicContact CE2-CD2 4.16Å; Y317-L327 HydrophobicContact CE2-CG 4.37Å; C320-L327 HydrophobicContact CB-CD2 4.1Å; K321-L327 HydrophobicContact CB-CD2 4.37Å; K321-L327 HydrophobicContact CG-CD2 3.55Å; L325-L327 PolarHBondContact O-N 3.32Å; L325-L327 VanDerWaalsContact O-N 3.13Å; L327-G329 PolarHBondContact O-N 3.45Å; L327-W330 PolarHBondContact O-N 3.24Å
328	E	92.5	Very high	94.9	Very high	82 Å²	82	33 Å²	33	38%	0.383	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-63.1	-19	173.7	-58	69.7	-157.7	0	0	112.4	V216 P218 V219 P326 W330	V216-E328 HydrophobicContact CG1-CB 4.32Å; V216-E328 HydrophobicContact CG1-CG 3.57Å; V216-E328 WeakPolarHBondContact CG1-OE1 3.36Å; P218-E328 CarbonylContact C-O 3.6Å; P218-E328 VanDerWaalsContact CA-O 3.25Å; P218-E328 WeakPolarHBondContact CA-O 3.48Å; V219-E328 HydrophobicContact CB-CB 4.03Å; V219-E328 HydrophobicContact CG2-CB 3.83Å; V219-E328 HydrophobicContact CG2-CG 4.03Å; V219-E328 PolarHBondContact N-O 3.02Å; P326-E328 PolarHBondContact O-N 3.34Å; E328-W330 VanDerWaalsContact C-N 3.27Å; E328-W330 PolarHBondContact O-N 2.83Å
329	G	91.6	Very high	94.9	Very high	16 Å²	16	33 Å²	33	17%	0.165	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-79	-2.2	-178	0	0	0	0	0	114.5	P326 L327 L331 R332	P326-G329 PolarHBondContact O-N 3.22Å; L327-G329 PolarHBondContact O-N 3.45Å; G329-L331 VanDerWaalsContact C-N 3.27Å; G329-L331 PolarHBondContact O-N 2.89Å; G329-L331 VanDerWaalsContact O-N 3.14Å; G329-R332 WeakPolarHBondContact O-CA 3.1Å; G329-R332 WeakPolarHBondContact O-CB 3.35Å; G329-R332 WeakPolarHBondContact O-CG 3.16Å; G329-R332 PolarHBondContact O-N 3.12Å
330	W	93.5	Very high	94.9	Very high	7 Å²	7	33.1 Å²	33.1	3%	0.027	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-57	-34.6	-170.7	68.5	-93.3	0	0	0	113.9	P214 V216 P218 N313 R316 L327 E328 R332 L333	P214-W330 HydrophobicContact CG-CD2 3.85Å; P214-W330 HydrophobicContact CG-CE3 4.1Å; P214-W330 HydrophobicContact CG-CG 4.36Å; P214-W330 HydrophobicContact CG-CH2 4.22Å; P214-W330 HydrophobicContact CG-CZ2 3.97Å; P214-W330 HydrophobicContact CG-CZ3 4.26Å; V216-W330 PolarHBondContact O-NE1 3.29Å; V216-W330 VanDerWaalsContact O-NE1 3.16Å; P218-W330 HydrophobicContact CB-CZ2 4.16Å; P218-W330 HydrophobicContact CG-CZ2 3.86Å; N313-W330 HydrophobicContact CB-CZ3 3.98Å; N313-W330 WeakPolarHBondContact OD1-CZ3 3.46Å; R316-W330 HydrophobicContact CB-CB 4.3Å; R316-W330 HydrophobicContact CB-CE3 4.46Å; R316-W330 WeakPolarHBondContact CB-O 3.48Å; R316-W330 WeakPolarHBondContact CD-O 3.32Å; L327-W330 PolarHBondContact O-N 3.24Å; E328-W330 VanDerWaalsContact C-N 3.27Å; E328-W330 PolarHBondContact O-N 2.83Å; W330-R332 PolarHBondContact O-N 3.38Å; W330-L333 PolarHBondContact O-N 3.11Å
331	L	92.6	Very high	95	Very high	53 Å²	53	33.1 Å²	33.1	28%	0.277	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-72.2	-12.3	175.8	-83.4	-172	0	0	0	114.8	P218 T222 T225 G329 L333	P218-L331 HydrophobicContact CB-CB 3.98Å; P218-L331 HydrophobicContact CB-CD1 3.62Å; P218-L331 HydrophobicContact CB-CG 3.78Å; P218-L331 HydrophobicContact CG-CD1 3.43Å; P218-L331 VanDerWaalsContact CG-CD1 3.43Å; P218-L331 HydrophobicContact CG-CG 4.03Å; T222-L331 HydrophobicContact CG2-CD1 4.45Å; T225-L331 HydrophobicContact CG2-CD1 3.63Å; G329-L331 VanDerWaalsContact C-N 3.27Å; G329-L331 PolarHBondContact O-N 2.89Å; G329-L331 VanDerWaalsContact O-N 3.14Å; L331-L333 VanDerWaalsContact C-N 3.26Å
332	R	93.3	Very high	95.2	Very high	178 Å²	178	31.5 Å²	31.5	67%	0.672	16%	0.164	S	C	*	.	G	3₁₀ helix	trans	-79.4	-13	176.9	-54.5	-179.3	-177	-162.8	1.2	112.4	V219 G329 W330	V219-R332 PolarHBondContact O-NE 3.24Å; V219-R332 PolarHBondContact O-NH2 2.72Å; G329-R332 WeakPolarHBondContact O-CA 3.1Å; G329-R332 WeakPolarHBondContact O-CB 3.35Å; G329-R332 WeakPolarHBondContact O-CG 3.16Å; G329-R332 PolarHBondContact O-N 3.12Å; W330-R332 PolarHBondContact O-N 3.38Å
333	L	94.2	Very high	95.3	Very high	32 Å²	32	31.5 Å²	31.5	17%	0.168	16%	0.164	C	C	.	.			trans	-86	139.9	171.2	-55.8	179.5	0	0	0	109.4	R316 I319 W330 L331 L379	R316-L333 HydrophobicContact CB-CB 4.26Å; R316-L333 HydrophobicContact CB-CD1 4.34Å; R316-L333 WeakPolarHBondContact CD-O 3.36Å; R316-L333 HydrophobicContact CG-CB 3.79Å; R316-L333 PolarHBondContact NH1-O 2.81Å; I319-L333 HydrophobicContact CB-CD1 4.27Å; I319-L333 HydrophobicContact CG2-CD1 3.88Å; W330-L333 PolarHBondContact O-N 3.11Å; L331-L333 VanDerWaalsContact C-N 3.26Å; L333-L379 HydrophobicContact CD2-CD2 4.02Å
334	S	93.6	Very high	95.3	Very high	81 Å²	81	32.8 Å²	32.8	57%	0.566	17%	0.171	S	C	*	.			trans	-115.1	134.3	174.5	-171.2	0	0	0	0	109.5
335	L	96.4	Very high	95.4	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.016	16%	0.164	C	C	.	.			trans	-130.4	113.8	175.8	-60.7	179.4	0	0	0	106.2	R73 A312 F315 R316 S341 L379	R73-L335 WeakPolarHBondContact CD-O 3.39Å; R73-L335 PolarHBondContact NH1-O 2.96Å; A312-L335 HydrophobicContact CB-CB 4.3Å; A312-L335 HydrophobicContact CB-CD1 4.36Å; F315-L335 HydrophobicContact CB-CD1 3.81Å; R316-L335 HydrophobicContact CG-CD1 3.73Å; R316-L335 HydrophobicContact CG-CG 3.99Å; L335-S341 WeakPolarHBondContact CD2-OG 3.33Å; L335-L379 HydrophobicContact CD2-CD1 3.81Å; L335-L379 HydrophobicContact CD2-CG 4.36Å
336	G	96.5	Very high	95.3	Very high	3 Å²	3	32.2 Å²	32.2	3%	0.031	17%	0.169	C	C	.	.			trans	-72.7	164.2	179.5	0	0	0	0	0	113.1	R73 G338 S339	R73-G336 WeakPolarHBondContact CB-O 3.44Å; R73-G336 VanDerWaalsContact CD-O 3.24Å; R73-G336 WeakPolarHBondContact CD-O 3.47Å; G336-G338 PolarHBondContact O-N 3.39Å; G336-S339 PolarHBondContact N-OG 2.8Å; G336-S339 WeakPolarHBondContact O-CB 3.22Å; G336-S339 PolarHBondContact O-N 3.31Å; G336-S339 PolarHBondContact O-OG 3.47Å
337	H	98.3	Very high	95.1	Very high	15 Å²	15	29.5 Å²	29.5	7%	0.069	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	134.8	174.7	-65.1	106	0	0	0	110.9	R73 H74 Q76 Q96 S339 L385 T391 Y392	R73-H337 PolarHBondContact NH2-CE1 3.17Å; R73-H337 PolarHBondContact NH2-NE2 3.16Å; H74-H337 AromaticContact CE1-CD2 3.82Å; Q76-H337 HydrophobicContact CB-CB 4.4Å; Q96-H337 VanDerWaalsContact OE1-CB 3.24Å; H337-S339 PolarHBondContact O-N 3.28Å; H337-L385 WeakPolarHBondContact O-CD1 3.25Å; H337-T391 PolarHBondContact N-O 3.5Å; H337-T391 PolarHBondContact ND1-O 2.88Å; H337-T391 PolarHBondContact ND1-OG1 2.65Å; H337-T391 VanDerWaalsContact ND1-OG1 3.17Å; H337-Y392 PolarHBondContact CE1-O 3.42Å; H337-Y392 VanDerWaalsContact CE1-O 3.31Å; H337-Y392 PolarHBondContact CE1-OXT 3.36Å; H337-Y392 VanDerWaalsContact CE1-OXT 3.28Å
338	G	98.1	Very high	94.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	5.7	-173.6	0	0	0	0	0	114.9	R73 H74 G336 H384	R73-G338 VanDerWaalsContact O-CA 3.29Å; R73-G338 WeakPolarHBondContact O-CA 2.98Å; R73-G338 PolarHBondContact O-N 2.95Å; R73-G338 VanDerWaalsContact O-N 3.13Å; H74-G338 PolarHBondContact O-N 3.01Å; G336-G338 PolarHBondContact O-N 3.39Å; G338-H384 PolarHBondContact O-CE1 3.03Å; G338-H384 PolarHBondContact O-NE2 3.34Å
339	S	98.3	Very high	93	Very high	1 Å²	1	30 Å²	30	1%	0.007	15%	0.153	C	C	.	.			trans	-69.7	147.4	-176.4	73.9	0	0	0	0	112.7	I72 R73 G336 H337 G380 D381	I72-S339 WeakPolarHBondContact CA-O 3.37Å; R73-S339 PolarHBondContact N-O 3.32Å; G336-S339 PolarHBondContact N-OG 2.8Å; G336-S339 WeakPolarHBondContact O-CB 3.22Å; G336-S339 PolarHBondContact O-N 3.31Å; G336-S339 PolarHBondContact O-OG 3.47Å; H337-S339 PolarHBondContact O-N 3.28Å; S339-G380 VanDerWaalsContact CB-C 3.47Å; S339-G380 WeakPolarHBondContact CB-O 3.05Å; S339-D381 CarbonylContact C-O 3.5Å; S339-D381 VanDerWaalsContact CA-O 3.23Å; S339-D381 WeakPolarHBondContact CA-O 3.14Å
340	I	98.6	Very high	91.1	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.015	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.9	178.4	-58.6	169.6	0	0	0	109.4	I70 F71 I72 A100 R103 I342 C378 G380 D381	I70-I340 HydrophobicContact CG2-CG2 3.82Å; F71-I340 CarbonylContact O-C 3.47Å; F71-I340 WeakPolarHBondContact O-CA 3.3Å; I72-I340 HydrophobicContact CD1-CG1 4.37Å; I72-I340 HydrophobicContact CG1-CG1 4.1Å; A100-I340 HydrophobicContact CB-CD1 4.25Å; A100-I340 HydrophobicContact CB-CG1 4.29Å; R103-I340 HydrophobicContact CB-CD1 3.94Å; R103-I340 HydrophobicContact CG-CD1 3.7Å; I340-I342 HydrophobicContact CG2-CD1 4.11Å; I340-I342 HydrophobicContact CG2-CG1 3.78Å; I340-C378 PolarHBondContact O-SG 2.64Å; I340-G380 PolarHBondContact O-N 3.39Å; I340-D381 PolarHBondContact N-O 2.84Å; I340-D381 PolarHBondContact O-N 3.19Å
341	S	98.6	Very high	88.9	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.007	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.9	166.5	-48.1	0	0	0	0	109.6	I70 F71 L335 C378 G380	I70-S341 CarbonylContact C-O 3.53Å; I70-S341 VanDerWaalsContact CA-O 3.32Å; I70-S341 WeakPolarHBondContact CA-O 3.24Å; F71-S341 PolarHBondContact N-O 3.15Å; F71-S341 PolarHBondContact O-N 3.41Å; L335-S341 WeakPolarHBondContact CD2-OG 3.33Å; S341-C378 CarbonylContact C-O 3.3Å; S341-C378 WeakPolarHBondContact CA-O 3.41Å; S341-C378 WeakPolarHBondContact CB-O 3.22Å; S341-G380 PolarHBondContact OG-N 3.19Å
342	I	98.5	Very high	86.7	Confident	13 Å²	13	35.7 Å²	35.7	7%	0.067	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.8	-173.8	-54.7	179.7	0	0	0	108.9	L68 I70 M107 I340 N377 C378	L68-I342 HydrophobicContact CD1-CG2 3.37Å; L68-I342 HydrophobicContact CG-CG2 4.11Å; I70-I342 HydrophobicContact CG1-CG1 4.41Å; I70-I342 HydrophobicContact CG1-CG2 4.47Å; I70-I342 HydrophobicContact CG2-CG1 4.39Å; M107-I342 HydrophobicContact CE-CD1 3.67Å; M107-I342 HydrophobicContact SD-CD1 4.38Å; I340-I342 HydrophobicContact CG2-CD1 4.11Å; I340-I342 HydrophobicContact CG2-CG1 3.78Å; I342-N377 PolarHBondContact O-N 3.05Å; I342-C378 HydrophobicContact CB-CB 3.91Å; I342-C378 HydrophobicContact CD1-CB 4.33Å; I342-C378 HydrophobicContact CG1-CB 4.03Å; I342-C378 PolarHBondContact N-O 2.72Å; I342-C378 PolarHBondContact O-N 3.31Å
343	L	98.3	Very high	84.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.8	174.5	-60.6	94.1	0	0	0	110.1	I69 F71 I319 L322 L323 V374 T375 L376	I69-L343 HydrophobicContact CB-CB 4.39Å; I69-L343 PolarHBondContact N-O 3.31Å; I69-L343 PolarHBondContact O-N 3.48Å; F71-L343 HydrophobicContact CD2-CD1 3.54Å; F71-L343 HydrophobicContact CE2-CD1 3.5Å; F71-L343 VanDerWaalsContact CE2-CD1 3.5Å; I319-L343 HydrophobicContact CG1-CD1 4.31Å; L322-L343 HydrophobicContact CB-CD2 4.1Å; L322-L343 HydrophobicContact CD1-CD2 3.83Å; L323-L343 HydrophobicContact CD2-CD2 4.39Å; L323-L343 HydrophobicContact CG-CD2 4.48Å; L343-V374 HydrophobicContact CB-CG1 4.3Å; L343-V374 HydrophobicContact CD2-CG1 3.99Å; L343-T375 CarbonylContact C-O 3.56Å; L343-T375 VanDerWaalsContact CA-O 3.26Å; L343-T375 WeakPolarHBondContact CA-O 3.18Å; L343-L376 HydrophobicContact CD1-CD1 4.15Å; L343-L376 HydrophobicContact CD2-CD1 4.2Å; L343-L376 HydrophobicContact CG-CD1 3.78Å
344	L	96.9	Very high	81.7	Confident	31 Å²	31	34.7 Å²	34.7	16%	0.162	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.2	176.8	-176.5	72	0	0	0	108.5	H66 L68 N346 V374 T375	H66-L344 HydrophobicContact CB-CD1 3.9Å; H66-L344 HydrophobicContact CB-CG 4.48Å; L68-L344 HydrophobicContact CD1-CD1 4.36Å; L344-N346 WeakPolarHBondContact CD2-OD1 3.25Å; L344-N346 WeakPolarHBondContact CG-OD1 3.19Å; L344-V374 CarbonylContact O-C 3.51Å; L344-V374 WeakPolarHBondContact O-CA 3.14Å; L344-T375 PolarHBondContact N-O 3.4Å; L344-T375 PolarHBondContact O-N 3.36Å
345	I	95.1	Very high	79	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	109.7	173.2	-56.2	173.6	0	0	0	107.4	W37 H66 K67 I69 C249 V374	W37-I345 HydrophobicContact CH2-CD1 3.91Å; W37-I345 HydrophobicContact CZ2-CD1 3.97Å; W37-I345 HydrophobicContact CZ2-CG1 4.38Å; W37-I345 HydrophobicContact CZ2-CG2 4Å; H66-I345 CarbonylContact C-O 3.53Å; H66-I345 WeakPolarHBondContact CA-O 3.17Å; K67-I345 HydrophobicContact CB-CB 4.33Å; K67-I345 PolarHBondContact N-O 2.97Å; K67-I345 PolarHBondContact O-N 3.44Å; I69-I345 HydrophobicContact CD1-CD1 4.4Å; I69-I345 HydrophobicContact CG1-CD1 3.72Å; I69-I345 HydrophobicContact CG1-CG1 4.31Å; C249-I345 HydrophobicContact CB-CG2 4.46Å; I345-V374 HydrophobicContact CG1-CG1 4.41Å; I345-V374 HydrophobicContact CG1-CG2 4.2Å
346	N	91.6	Very high	76.3	Confident	43 Å²	43	42.9 Å²	42.9	23%	0.23	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	128.3	178.1	-71.5	-7.3	0	0	0	110	H66 L344 S372 I373	H66-N346 WeakPolarHBondContact CB-OD1 3.47Å; L344-N346 WeakPolarHBondContact CD2-OD1 3.25Å; L344-N346 WeakPolarHBondContact CG-OD1 3.19Å; N346-S372 CarbonylContact O-C 3.51Å; N346-S372 VanDerWaalsContact O-CA 3.26Å; N346-S372 WeakPolarHBondContact O-CA 3.39Å; N346-I373 PolarHBondContact N-O 3.29Å; N346-I373 PolarHBondContact O-N 3.14Å
347	N	87.5	Confident	73.4	Confident	10 Å²	10	49.7 Å²	49.7	5%	0.053	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	107.9	172	-73	-74.7	0	0	0	108.6	P64 Y65 C249 S372	P64-N347 VanDerWaalsContact CA-O 3.31Å; P64-N347 WeakPolarHBondContact CA-O 3.25Å; Y65-N347 HydrophobicContact CD1-CB 4.03Å; Y65-N347 HydrophobicContact CD2-CB 4.07Å; Y65-N347 HydrophobicContact CE1-CB 3.58Å; Y65-N347 HydrophobicContact CE2-CB 3.68Å; Y65-N347 WeakPolarHBondContact CE2-ND2 3.17Å; Y65-N347 HydrophobicContact CG-CB 4.25Å; Y65-N347 VanDerWaalsContact CZ-CG 3.5Å; Y65-N347 PolarHBondContact N-O 3.43Å; Y65-N347 VanDerWaalsContact N-O 3.11Å; Y65-N347 PolarHBondContact O-N 3.4Å; C249-N347 WeakPolarHBondContact CB-OD1 3.47Å; C249-N347 PolarHBondContact O-ND2 3.07Å; N347-S372 WeakPolarHBondContact OD1-CB 3.33Å; N347-S372 PolarHBondContact OD1-OG 3.34Å
348	N	76.7	Confident	70.6	Confident	61 Å²	61	55.9 Å²	55.9	33%	0.326	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	153.1	179.6	-65.9	1.2	0	0	0	110	L350 G371	N348-L350 PolarHBondContact O-N 3.29Å; N348-G371 PolarHBondContact N-O 3.22Å; N348-G371 PolarHBondContact O-N 3.08Å
349	E	64.2	Low	67.8	Low	78 Å²	78	59.5 Å²	59.5	36%	0.364	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	107.4	159	-77	-174.8	-174.3	0	0	108.5	Q62 Y370	Q62-E349 WeakPolarHBondContact CA-OE1 3.29Å; E349-Y370 HydrophobicContact CB-CE1 4.36Å; E349-Y370 VanDerWaalsContact CD-OH 3.32Å; E349-Y370 HydrophobicContact CG-CD1 3.73Å; E349-Y370 HydrophobicContact CG-CE1 3.09Å; E349-Y370 HydrophobicContact CG-CE2 4.41Å; E349-Y370 VanDerWaalsContact CG-CZ 3.49Å; E349-Y370 WeakPolarHBondContact OE1-CE1 3.29Å; E349-Y370 VanDerWaalsContact OE1-CZ 3.28Å; E349-Y370 PolarHBondContact OE1-OH 2.98Å
350	L	53	Low	65.1	Low	42 Å²	42	66.7 Å²	66.7	22%	0.22	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	111.7	170.1	-64.9	166.1	0	0	0	107.9	Y35 N348 I352 S368 K369 I373	Y35-L350 HydrophobicContact CD1-CD1 3.67Å; Y35-L350 HydrophobicContact CE1-CD1 3.13Å; N348-L350 PolarHBondContact O-N 3.29Å; L350-I352 HydrophobicContact CB-CG1 4.49Å; L350-I352 PolarHBondContact O-N 2.93Å; L350-I352 VanDerWaalsContact O-N 3.16Å; L350-S368 CarbonylContact O-C 3.53Å; L350-K369 CarbonylContact C-O 3.46Å; L350-K369 WeakPolarHBondContact CA-O 3.36Å; L350-K369 WeakPolarHBondContact CB-O 3.4Å; L350-K369 PolarHBondContact N-O 3.15Å; L350-K369 VanDerWaalsContact N-O 3.11Å; L350-K369 CarbonylContact O-C 3.56Å; L350-K369 PolarHBondContact O-N 3.33Å; L350-I373 HydrophobicContact CD1-CD1 4.28Å
351	I	47.2	Very low	62.3	Low	104 Å²	104	77 Å²	77	53%	0.533	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	103	167.1	-58.5	172.9	0	0	0	106.6	N353 K366	I351-N353 WeakPolarHBondContact CG2-OD1 2.9Å; I351-N353 PolarHBondContact O-N 2.99Å; I351-K366 HydrophobicContact CG2-CB 4.2Å; I351-K366 HydrophobicContact CG2-CD 4.4Å; I351-K366 HydrophobicContact CG2-CG 4.46Å
352	I	45.9	Very low	59.4	Low	51 Å²	51	85.3 Å²	85.3	26%	0.262	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	102.4	172.3	-56.2	-171.7	0	0	0	106.6	Y35 L350 N354 Q367 K369	Y35-I352 HydrophobicContact CE2-CD1 4.39Å; L350-I352 HydrophobicContact CB-CG1 4.49Å; L350-I352 PolarHBondContact O-N 2.93Å; L350-I352 VanDerWaalsContact O-N 3.16Å; I352-N354 PolarHBondContact O-N 2.65Å; I352-N354 VanDerWaalsContact O-N 3.13Å; I352-Q367 PolarHBondContact N-O 3.29Å; I352-K369 HydrophobicContact CD1-CB 3.97Å; I352-K369 HydrophobicContact CD1-CD 3.9Å; I352-K369 HydrophobicContact CG1-CB 4.22Å
353	N	41.7	Very low	56.7	Low	97 Å²	97	93.8 Å²	93.8	52%	0.519	49%	0.49	S	S	.	.			trans	-71.1	104.3	168.8	-70.5	-18.9	0	0	0	107.7	I351 N355	I351-N353 WeakPolarHBondContact CG2-OD1 2.9Å; I351-N353 PolarHBondContact O-N 2.99Å; N353-N355 VanDerWaalsContact C-N 3.31Å; N353-N355 PolarHBondContact O-N 3.16Å
354	N	41.5	Very low	53.8	Low	92 Å²	92	100.5 Å²	100.5	49%	0.492	53%	0.526	S	S	.	.			trans	-72.9	91.6	165.6	-82.7	-8.8	0	0	0	107.7	I352 N356	I352-N354 PolarHBondContact O-N 2.65Å; I352-N354 VanDerWaalsContact O-N 3.13Å; N354-N356 PolarHBondContact O-N 3.02Å
355	N	36.3	Very low	51.2	Low	124 Å²	124	105.3 Å²	105.3	66%	0.663	55%	0.55	S	S	*	*			trans	-72.3	73.7	163.3	-74.4	1.8	0	0	0	108.1	N353 N357	N353-N355 VanDerWaalsContact C-N 3.31Å; N353-N355 PolarHBondContact O-N 3.16Å; N355-N357 PolarHBondContact O-N 3.2Å
356	N	39.7	Very low	48.7	Very low	132 Å²	132	112.2 Å²	112.2	71%	0.706	58%	0.58	S	S	*	*			trans	-73	88.5	161.6	-80.1	-7.6	0	0	0	106.3	N354 N358	N354-N356 PolarHBondContact O-N 3.02Å; N356-N358 PolarHBondContact O-N 3.39Å
357	N	35.2	Very low	46.5	Very low	146 Å²	146	114.9 Å²	114.9	78%	0.781	59%	0.591	S	S	*	*			trans	-69.8	55.2	167.7	-79.4	-10.9	0	0	0	110.5	N355	N355-N357 PolarHBondContact O-N 3.2Å
358	N	40.2	Very low	44.6	Very low	145 Å²	145	117.2 Å²	117.2	78%	0.775	61%	0.608	S	S	*	*	S	Bend	trans	-114.8	107.4	159.4	-78.7	-11.1	0	0	0	105	N356 D360	N356-N358 PolarHBondContact O-N 3.39Å; N358-D360 PolarHBondContact O-N 3.05Å
359	G	39	Very low	43.5	Very low	76 Å²	76	119.6 Å²	119.6	78%	0.784	62%	0.616	S	S	*	*			trans	-58.7	102.8	-173.2	0	0	0	0	0	110.3
360	D	42.3	Very low	43.3	Very low	152 Å²	152	119.8 Å²	119.8	81%	0.813	61%	0.614	S	S	*	*			trans	-150.4	130	151.1	-84.8	-41.3	0	0	0	106.6	N358 E362	N358-D360 PolarHBondContact O-N 3.05Å; D360-E362 PolarHBondContact O-N 3.16Å
361	K	39.4	Very low	44.2	Very low	220 Å²	220	117.9 Å²	117.9	96%	0.957	60%	0.604	S	S	*	*			trans	-71.6	71.6	-175.1	-68.6	176.8	177.3	174.3	0	110.1
362	E	38.6	Very low	46	Very low	175 Å²	175	112.9 Å²	112.9	82%	0.818	58%	0.579	S	S	*	*			trans	-121.6	106.6	168.2	-109.7	-177.1	169.5	0	0	109.6	D360 D364	D360-E362 PolarHBondContact O-N 3.16Å; E362-D364 PolarHBondContact O-N 3.22Å
363	K	39.7	Very low	48.1	Very low	190 Å²	190	113.3 Å²	113.3	83%	0.826	58%	0.581	S	S	*	*			trans	8.9	109.2	166.5	-64.5	176.1	-179.5	175.2	0	113.7	I365	K363-I365 PolarHBondContact O-N 3.24Å
364	D	39	Very low	50.6	Low	141 Å²	141	108.8 Å²	108.8	75%	0.754	56%	0.557	S	S	*	*			trans	-52.1	87.3	163.9	-73.9	-35.9	0	0	0	109.9	E362 K366	E362-D364 PolarHBondContact O-N 3.22Å; D364-K366 PolarHBondContact O-N 3.14Å
365	I	41.6	Very low	53.1	Low	133 Å²	133	105.2 Å²	105.2	68%	0.682	54%	0.538	S	S	*	.			trans	-71.3	91.9	169.1	-61.6	174.4	0	0	0	104.4	K363 Q367	K363-I365 PolarHBondContact O-N 3.24Å; I365-Q367 HydrophobicContact CG2-CG 3.88Å; I365-Q367 PolarHBondContact O-N 3.4Å
366	K	41.7	Very low	56	Low	144 Å²	144	99.8 Å²	99.8	63%	0.626	51%	0.509	S	S	*	.			trans	-60	91.6	166.5	-71.3	-176.8	179.2	177.7	0	107.6	I351 D364 S368	I351-K366 HydrophobicContact CG2-CB 4.2Å; I351-K366 HydrophobicContact CG2-CD 4.4Å; I351-K366 HydrophobicContact CG2-CG 4.46Å; D364-K366 PolarHBondContact O-N 3.14Å; K366-S368 PolarHBondContact O-N 2.85Å; K366-S368 VanDerWaalsContact O-N 3.14Å
367	Q	45.9	Very low	58.6	Low	100 Å²	100	95.8 Å²	95.8	47%	0.467	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	100.9	171.3	-74.1	-174.5	-1.9	0	0	107.5	I352 I365 K369	I352-Q367 PolarHBondContact N-O 3.29Å; I365-Q367 HydrophobicContact CG2-CG 3.88Å; I365-Q367 PolarHBondContact O-N 3.4Å; Q367-K369 PolarHBondContact O-N 2.97Å; Q367-K369 VanDerWaalsContact O-N 3.09Å
368	S	47.9	Very low	61.5	Low	58 Å²	58	90.1 Å²	90.1	41%	0.406	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	106.8	161.8	54.8	0	0	0	0	107.9	L350 K366	L350-S368 CarbonylContact O-C 3.53Å; K366-S368 PolarHBondContact O-N 2.85Å; K366-S368 VanDerWaalsContact O-N 3.14Å
369	K	54.6	Low	64.2	Low	111 Å²	111	86.4 Å²	86.4	48%	0.483	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116.5	169.1	-87.5	178.2	172.2	177.8	0	107.5	L350 I352 Q367 G371	L350-K369 CarbonylContact C-O 3.46Å; L350-K369 WeakPolarHBondContact CA-O 3.36Å; L350-K369 WeakPolarHBondContact CB-O 3.4Å; L350-K369 PolarHBondContact N-O 3.15Å; L350-K369 VanDerWaalsContact N-O 3.11Å; L350-K369 CarbonylContact O-C 3.56Å; L350-K369 PolarHBondContact O-N 3.33Å; I352-K369 HydrophobicContact CD1-CB 3.97Å; I352-K369 HydrophobicContact CD1-CD 3.9Å; I352-K369 HydrophobicContact CG1-CB 4.22Å; Q367-K369 PolarHBondContact O-N 2.97Å; Q367-K369 VanDerWaalsContact O-N 3.09Å; K369-G371 PolarHBondContact O-N 2.87Å
370	Y	59.8	Low	66.9	Low	82 Å²	82	83.4 Å²	83.4	32%	0.322	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	131.8	167	-67.6	-96	0	0	0	108.1	E349	E349-Y370 HydrophobicContact CB-CE1 4.36Å; E349-Y370 VanDerWaalsContact CD-OH 3.32Å; E349-Y370 HydrophobicContact CG-CD1 3.73Å; E349-Y370 HydrophobicContact CG-CE1 3.09Å; E349-Y370 HydrophobicContact CG-CE2 4.41Å; E349-Y370 VanDerWaalsContact CG-CZ 3.49Å; E349-Y370 WeakPolarHBondContact OE1-CE1 3.29Å; E349-Y370 VanDerWaalsContact OE1-CZ 3.28Å; E349-Y370 PolarHBondContact OE1-OH 2.98Å
371	G	71.5	Confident	69.6	Low	2 Å²	2	78.9 Å²	78.9	2%	0.021	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	137.5	-178.4	0	0	0	0	0	111.3	N348 K369	N348-G371 PolarHBondContact N-O 3.22Å; N348-G371 PolarHBondContact O-N 3.08Å; K369-G371 PolarHBondContact O-N 2.87Å
372	S	83.8	Confident	72.3	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.9	175.6	-44.9	0	0	0	0	109.7	W33 H41 C249 N346 N347	W33-S372 PolarHBondContact NE1-O 3.03Å; H41-S372 PolarHBondContact CE1-OG 3.01Å; C249-S372 VanDerWaalsContact CB-OG 3.23Å; C249-S372 WeakPolarHBondContact CB-OG 3.45Å; N346-S372 CarbonylContact O-C 3.51Å; N346-S372 VanDerWaalsContact O-CA 3.26Å; N346-S372 WeakPolarHBondContact O-CA 3.39Å; N347-S372 WeakPolarHBondContact OD1-CB 3.33Å; N347-S372 PolarHBondContact OD1-OG 3.34Å
373	I	90.2	Very high	75	Confident	59 Å²	59	64.7 Å²	64.7	30%	0.303	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	135.3	172.2	-63.4	172.8	0	0	0	108.1	Y35 N346 L350	Y35-I373 HydrophobicContact CE1-CD1 4.45Å; Y35-I373 HydrophobicContact CE1-CG1 4.08Å; N346-I373 PolarHBondContact N-O 3.29Å; N346-I373 PolarHBondContact O-N 3.14Å; L350-I373 HydrophobicContact CD1-CD1 4.28Å
374	V	93.9	Very high	77.7	Confident	2 Å²	2	57 Å²	57	1%	0.012	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129	174.9	-171.5	0	0	0	0	109.7	W33 W37 L322 L323 L343 L344 I345	W33-V374 HydrophobicContact CH2-CB 4.07Å; W33-V374 HydrophobicContact CH2-CG2 4.41Å; W33-V374 HydrophobicContact CZ2-CB 4.18Å; W33-V374 HydrophobicContact CZ2-CG2 4.14Å; W37-V374 HydrophobicContact CZ2-CG2 3.8Å; L322-V374 HydrophobicContact CB-CG1 4.2Å; L322-V374 HydrophobicContact CD2-CG2 4.35Å; L322-V374 WeakPolarHBondContact O-CB 3.45Å; L323-V374 HydrophobicContact CD2-CG1 4.22Å; L343-V374 HydrophobicContact CB-CG1 4.3Å; L343-V374 HydrophobicContact CD2-CG1 3.99Å; L344-V374 CarbonylContact O-C 3.51Å; L344-V374 WeakPolarHBondContact O-CA 3.14Å; I345-V374 HydrophobicContact CG1-CG1 4.41Å; I345-V374 HydrophobicContact CG1-CG2 4.2Å
375	T	95.2	Very high	80.5	Confident	17 Å²	17	50.8 Å²	50.8	10%	0.104	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.7	176.2	-55.9	0	0	0	0	109.9	F11 L343 L344 N377	F11-T375 HydrophobicContact CD1-CG2 4.37Å; L343-T375 CarbonylContact C-O 3.56Å; L343-T375 VanDerWaalsContact CA-O 3.26Å; L343-T375 WeakPolarHBondContact CA-O 3.18Å; L344-T375 PolarHBondContact N-O 3.4Å; L344-T375 PolarHBondContact O-N 3.36Å; T375-N377 WeakPolarHBondContact CG2-OD1 3.34Å
376	L	96.6	Very high	83.1	Confident	10 Å²	10	46.9 Å²	46.9	5%	0.052	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	105.1	172.4	178.2	65.4	0	0	0	108.7	I319 L323 L343 C378 L379	I319-L376 HydrophobicContact CG2-CD2 4.48Å; L323-L376 HydrophobicContact CD1-CB 3.9Å; L323-L376 HydrophobicContact CD1-CD2 3.64Å; L323-L376 HydrophobicContact CD1-CG 4.34Å; L323-L376 HydrophobicContact CD2-CB 4.02Å; L343-L376 HydrophobicContact CD1-CD1 4.15Å; L343-L376 HydrophobicContact CD2-CD1 4.2Å; L343-L376 HydrophobicContact CG-CD1 3.78Å; L376-C378 WeakPolarHBondContact CD1-O 3.5Å; L376-L379 HydrophobicContact CD1-CB 4.3Å; L376-L379 HydrophobicContact CD1-CD1 4.36Å; L376-L379 HydrophobicContact CD2-CB 3.97Å; L376-L379 HydrophobicContact CD2-CD1 4.14Å; L376-L379 HydrophobicContact CD2-CD2 4.31Å; L376-L379 HydrophobicContact CD2-CG 4.36Å; L376-L379 HydrophobicContact CG-CB 4.33Å
377	N	95	Very high	85.7	Confident	48 Å²	48	45.2 Å²	45.2	26%	0.257	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-30.7	179.7	-73.4	-2.4	0	0	0	111.9	I342 T375	I342-N377 PolarHBondContact O-N 3.05Å; T375-N377 WeakPolarHBondContact CG2-OD1 3.34Å
378	C	95.1	Very high	88	Confident	27 Å²	27	46.7 Å²	46.7	18%	0.182	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	134.1	-173.1	-180	0	0	0	0	109.4	I340 S341 I342 L376 D381	I340-C378 PolarHBondContact O-SG 2.64Å; S341-C378 CarbonylContact C-O 3.3Å; S341-C378 WeakPolarHBondContact CA-O 3.41Å; S341-C378 WeakPolarHBondContact CB-O 3.22Å; I342-C378 HydrophobicContact CB-CB 3.91Å; I342-C378 HydrophobicContact CD1-CB 4.33Å; I342-C378 HydrophobicContact CG1-CB 4.03Å; I342-C378 PolarHBondContact N-O 2.72Å; I342-C378 PolarHBondContact O-N 3.31Å; L376-C378 WeakPolarHBondContact CD1-O 3.5Å; C378-D381 WeakPolarHBondContact SG-CB 2.92Å
379	L	97.3	Very high	90.4	Very high	67 Å²	67	44.5 Å²	44.5	35%	0.351	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	117.2	-179.8	-179.5	68.1	0	0	0	110.5	I319 L333 L335 L376 D381	I319-L379 HydrophobicContact CD1-CD1 3.84Å; I319-L379 HydrophobicContact CG2-CD1 4.45Å; L333-L379 HydrophobicContact CD2-CD2 4.02Å; L335-L379 HydrophobicContact CD2-CD1 3.81Å; L335-L379 HydrophobicContact CD2-CG 4.36Å; L376-L379 HydrophobicContact CD1-CB 4.3Å; L376-L379 HydrophobicContact CD1-CD1 4.36Å; L376-L379 HydrophobicContact CD2-CB 3.97Å; L376-L379 HydrophobicContact CD2-CD1 4.14Å; L376-L379 HydrophobicContact CD2-CD2 4.31Å; L376-L379 HydrophobicContact CD2-CG 4.36Å; L376-L379 HydrophobicContact CG-CB 4.33Å; L379-D381 PolarHBondContact O-N 2.95Å; L379-D381 VanDerWaalsContact O-N 3.11Å
380	G	96.6	Very high	92.3	Very high	13 Å²	13	42.8 Å²	42.8	13%	0.134	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.5	33.9	173.5	0	0	0	0	0	113.3	S339 I340 S341 V382	S339-G380 VanDerWaalsContact CB-C 3.47Å; S339-G380 WeakPolarHBondContact CB-O 3.05Å; I340-G380 PolarHBondContact O-N 3.39Å; S341-G380 PolarHBondContact OG-N 3.19Å; G380-V382 PolarHBondContact O-N 3.29Å
381	D	97.4	Very high	93.7	Very high	58 Å²	58	40.3 Å²	40.3	31%	0.31	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	131.8	-177.4	177.7	50	0	0	0	111.1	S339 I340 C378 L379 G383 H384	S339-D381 CarbonylContact C-O 3.5Å; S339-D381 VanDerWaalsContact CA-O 3.23Å; S339-D381 WeakPolarHBondContact CA-O 3.14Å; I340-D381 PolarHBondContact N-O 2.84Å; I340-D381 PolarHBondContact O-N 3.19Å; C378-D381 WeakPolarHBondContact SG-CB 2.92Å; L379-D381 PolarHBondContact O-N 2.95Å; L379-D381 VanDerWaalsContact O-N 3.11Å; D381-G383 PolarHBondContact OD1-N 3.27Å; D381-H384 PolarHBondContact O-CE1 2.83Å
382	V	97.1	Very high	93.8	Very high	31 Å²	31	49.3 Å²	49.3	19%	0.188	28%	0.276	C	S	.	.			trans	-122.9	9	178.3	-66.1	0	0	0	0	110.8	G380 H384 L385 L390	G380-V382 PolarHBondContact O-N 3.29Å; V382-H384 PolarHBondContact O-N 2.96Å; V382-H384 VanDerWaalsContact O-N 3.12Å; V382-L385 HydrophobicContact CB-CD1 4.03Å; V382-L385 HydrophobicContact CB-CG 4.43Å; V382-L385 HydrophobicContact CG1-CD1 4.08Å; V382-L385 WeakPolarHBondContact O-CB 3.4Å; V382-L385 PolarHBondContact O-N 2.76Å; V382-L390 HydrophobicContact CB-CD2 3.74Å; V382-L390 HydrophobicContact CG2-CD2 3.71Å
383	G	95.9	Very high	94.3	Very high	66 Å²	66	51.8 Å²	51.8	68%	0.68	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.5	-177.9	0	0	0	0	0	114.6	D381 L385	D381-G383 PolarHBondContact OD1-N 3.27Å; G383-L385 VanDerWaalsContact C-N 3.34Å
384	H	96.5	Very high	94.5	Very high	28 Å²	28	51.4 Å²	51.4	13%	0.13	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.5	172.7	66.5	-82.9	0	0	0	113.5	R103 G338 D381 V382	R103-H384 HydrophobicContact CB-CB 3.77Å; R103-H384 HydrophobicContact CG-CB 3.6Å; G338-H384 PolarHBondContact O-CE1 3.03Å; G338-H384 PolarHBondContact O-NE2 3.34Å; D381-H384 PolarHBondContact O-CE1 2.83Å; V382-H384 PolarHBondContact O-N 2.96Å; V382-H384 VanDerWaalsContact O-N 3.12Å
385	L	97.6	Very high	94.5	Very high	11 Å²	11	54.2 Å²	54.2	6%	0.058	31%	0.305	C	S	.	.	S	Bend	trans	-90.6	127.9	178.7	-59.8	-177.7	0	0	0	109.9	Q96 A99 H337 V382 G383 L389 L390	Q96-L385 HydrophobicContact CB-CD2 4.29Å; Q96-L385 HydrophobicContact CG-CD1 4.15Å; Q96-L385 HydrophobicContact CG-CD2 4.41Å; A99-L385 HydrophobicContact CB-CD2 3.72Å; H337-L385 WeakPolarHBondContact O-CD1 3.25Å; V382-L385 HydrophobicContact CB-CD1 4.03Å; V382-L385 HydrophobicContact CB-CG 4.43Å; V382-L385 HydrophobicContact CG1-CD1 4.08Å; V382-L385 WeakPolarHBondContact O-CB 3.4Å; V382-L385 PolarHBondContact O-N 2.76Å; G383-L385 VanDerWaalsContact C-N 3.34Å; L385-L389 HydrophobicContact CB-CB 4.33Å; L385-L390 HydrophobicContact CB-CD2 3.91Å; L385-L390 HydrophobicContact CD1-CD2 4.38Å
386	P	95.1	Very high	94.5	Very high	51 Å²	51	56.4 Å²	56.4	33%	0.331	32%	0.316	S	S	.	.			trans	-53	150.2	166.3	-26.9	35	0	0	0	112.1	E388 L389	P386-E388 HydrophobicContact CB-CG 4.45Å; P386-E388 VanDerWaalsContact CB-OE1 3.25Å; P386-E388 WeakPolarHBondContact CB-OE1 3.42Å; P386-E388 VanDerWaalsContact CB-OE2 3.25Å; P386-E388 WeakPolarHBondContact CB-OE2 3.5Å; P386-E388 PolarHBondContact O-N 3.32Å; P386-E388 VanDerWaalsContact O-N 3.12Å; P386-L389 HydrophobicContact CB-CG 4.5Å; P386-L389 HydrophobicContact CG-CD1 4.4Å; P386-L389 PolarHBondContact O-N 3.48Å
387	P	95.7	Very high	94.3	Very high	108 Å²	108	59.3 Å²	59.3	70%	0.701	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-52.5	-37.3	-175.7	-28.6	35.9	0	0	0	114.8	L389 L390	P387-L389 PolarHBondContact O-N 3.25Å; P387-L390 PolarHBondContact O-N 3.1Å
388	E	96	Very high	94.3	Very high	132 Å²	132	60 Å²	60	62%	0.617	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-68.2	-16.7	178.7	68	-84.4	-163.7	0	0	113.9	P386	P386-E388 HydrophobicContact CB-CG 4.45Å; P386-E388 VanDerWaalsContact CB-OE1 3.25Å; P386-E388 WeakPolarHBondContact CB-OE1 3.42Å; P386-E388 VanDerWaalsContact CB-OE2 3.25Å; P386-E388 WeakPolarHBondContact CB-OE2 3.5Å; P386-E388 PolarHBondContact O-N 3.32Å; P386-E388 VanDerWaalsContact O-N 3.12Å
389	L	96.7	Very high	94.2	Very high	11 Å²	11	62.4 Å²	62.4	6%	0.058	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-97	-2.8	176.6	-57.5	-168.5	0	0	0	112.9	I92 R95 Q96 L385 P386 P387 T391	I92-L389 HydrophobicContact CG2-CD2 4.19Å; R95-L389 HydrophobicContact CB-CD1 3.65Å; R95-L389 HydrophobicContact CB-CD2 3.84Å; R95-L389 HydrophobicContact CB-CG 4.45Å; Q96-L389 HydrophobicContact CG-CB 4.04Å; Q96-L389 PolarHBondContact NE2-O 3.24Å; L385-L389 HydrophobicContact CB-CB 4.33Å; P386-L389 HydrophobicContact CB-CG 4.5Å; P386-L389 HydrophobicContact CG-CD1 4.4Å; P386-L389 PolarHBondContact O-N 3.48Å; P387-L389 PolarHBondContact O-N 3.25Å; L389-T391 PolarHBondContact O-N 3.34Å
390	L	94.2	Very high	94	Very high	75 Å²	75	62 Å²	62	39%	0.393	35%	0.349	S	S	.	.			trans	-75.1	112.6	-179.1	-65.7	175.9	0	0	0	111.3	V382 L385 P387	V382-L390 HydrophobicContact CB-CD2 3.74Å; V382-L390 HydrophobicContact CG2-CD2 3.71Å; L385-L390 HydrophobicContact CB-CD2 3.91Å; L385-L390 HydrophobicContact CD1-CD2 4.38Å; P387-L390 PolarHBondContact O-N 3.1Å
391	T	89.3	Confident	93.8	Very high	30 Å²	30	66.1 Å²	66.1	18%	0.184	37%	0.367	C	S	.	.			trans	-140.6	149.1	176.4	69.8	0	0	0	0	110.9	I92 Q96 H337 L389	I92-T391 HydrophobicContact CG2-CG2 4.12Å; Q96-T391 PolarHBondContact NE2-OG1 3.02Å; H337-T391 PolarHBondContact N-O 3.5Å; H337-T391 PolarHBondContact ND1-O 2.88Å; H337-T391 PolarHBondContact ND1-OG1 2.65Å; H337-T391 VanDerWaalsContact ND1-OG1 3.17Å; L389-T391 PolarHBondContact O-N 3.34Å
392	Y	73.7	Confident	93.4	Very high	192 Å²	192	66.8 Å²	66.8	75%	0.753	37%	0.372	S	S	*	.			trans	-108.5	0	-174.9	-70.7	-76	0	0	0	113.7	R73 H337	R73-Y392 PolarHBondContact NH1-OXT 3.01Å; R73-Y392 PolarHBondContact NH2-OXT 3.37Å; H337-Y392 PolarHBondContact CE1-O 3.42Å; H337-Y392 VanDerWaalsContact CE1-O 3.31Å; H337-Y392 PolarHBondContact CE1-OXT 3.36Å; H337-Y392 VanDerWaalsContact CE1-OXT 3.28Å

Retrieved 392 of 392 residues in 203.1 ms (Link to these results)

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