G4V7D8_SCHMA Loading...

Aha1_N domain-containing protein

AlphaFold DB , UniProt , Accession G4V7D8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 343 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.1	Very low	50.4	Low	244 Å²	244	138.8 Å²	138.8	100%	1.202	70%	0.7	S	S	*	*				0	130	0	-72.3	177.5	178.1	0	0	107.3
2	A	48.6	Very low	50.2	Low	72 Å²	72	134.2 Å²	134.2	60%	0.595	68%	0.677	S	S	*	*			trans	-61.2	146.2	171.5	0	0	0	0	0	109.7	E6	A2-E6 WeakPolarHBondContact CB-O 3.23Å
3	K	49.4	Very low	50	Low	157 Å²	157	134.8 Å²	134.8	68%	0.683	69%	0.692	S	S	*	*			trans	-62.3	144.9	175.3	-78.7	-179.3	177.6	173.7	0	109.4	G5 E6	K3-G5 PolarHBondContact O-N 3.29Å; K3-G5 VanDerWaalsContact O-N 3.09Å; K3-E6 HydrophobicContact CB-CB 4.33Å; K3-E6 PolarHBondContact O-N 3.19Å
4	W	40.7	Very low	50.2	Low	269 Å²	269	130.4 Å²	130.4	100%	1.019	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	115.5	174.2	-171.2	-85.3	0	0	0	109.6
5	G	59	Low	49.8	Very low	79 Å²	79	135.7 Å²	135.7	81%	0.814	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.1	-11	-174.9	0	0	0	0	0	116	K3	K3-G5 PolarHBondContact O-N 3.29Å; K3-G5 VanDerWaalsContact O-N 3.09Å
6	E	57	Low	49.7	Very low	131 Å²	131	131.4 Å²	131.4	61%	0.612	66%	0.661	S	S	*	*			trans	-113.3	53	175.7	-69.5	-176.7	160.5	0	0	110.8	A2 K3 D8	A2-E6 WeakPolarHBondContact CB-O 3.23Å; K3-E6 HydrophobicContact CB-CB 4.33Å; K3-E6 PolarHBondContact O-N 3.19Å; E6-D8 PolarHBondContact O-N 2.78Å
7	G	52.4	Low	49.8	Very low	43 Å²	43	130.8 Å²	130.8	44%	0.443	68%	0.68	S	S	.	*			trans	-58.8	131.5	175.2	0	0	0	0	0	110.7	P9	G7-P9 WeakPolarHBondContact O-CD 3.48Å; G7-P9 VanDerWaalsContact O-N 3.17Å
8	D	51.5	Low	49.7	Very low	58 Å²	58	126.9 Å²	126.9	31%	0.31	66%	0.66	S	S	.	*			trans	-51.7	122.6	171.9	175.3	-14.5	0	0	0	108.2	E6 R10 W11	E6-D8 PolarHBondContact O-N 2.78Å; D8-R10 PolarHBondContact O-N 3.13Å; D8-R10 VanDerWaalsContact OD1-CB 3.26Å; D8-R10 WeakPolarHBondContact OD1-CB 3.48Å; D8-R10 WeakPolarHBondContact OD1-CD 3.38Å; D8-R10 WeakPolarHBondContact OD1-CG 3.44Å; D8-R10 PolarHBondContact OD1-N 3.33Å; D8-R10 IonicContact OD1-NE 2.76Å; D8-W11 PolarHBondContact O-N 3.27Å
9	P	54.9	Low	49.9	Very low	85 Å²	85	125.5 Å²	125.5	55%	0.552	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.9	-19	-177.7	-25.6	32.3	0	0	0	114.3	G7 W11 N23	G7-P9 WeakPolarHBondContact O-CD 3.48Å; G7-P9 VanDerWaalsContact O-N 3.17Å; P9-W11 PolarHBondContact O-N 3.02Å; P9-N23 PolarHBondContact O-ND2 3.07Å
10	R	48.4	Very low	50.2	Low	185 Å²	185	128.8 Å²	128.8	70%	0.698	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-17.5	173.8	-59.8	168.8	-168.2	168.4	3.9	113.7	D8	D8-R10 PolarHBondContact O-N 3.13Å; D8-R10 VanDerWaalsContact OD1-CB 3.26Å; D8-R10 WeakPolarHBondContact OD1-CB 3.48Å; D8-R10 WeakPolarHBondContact OD1-CD 3.38Å; D8-R10 WeakPolarHBondContact OD1-CG 3.44Å; D8-R10 PolarHBondContact OD1-N 3.33Å; D8-R10 IonicContact OD1-NE 2.76Å
11	W	46.3	Very low	50.6	Low	204 Å²	204	123.7 Å²	123.7	77%	0.773	65%	0.651	S	S	*	*	S	Bend	trans	-117.9	2.4	-171.5	-59.4	77.6	0	0	0	113.8	D8 P9 V13	D8-W11 PolarHBondContact O-N 3.27Å; P9-W11 PolarHBondContact O-N 3.02Å; W11-V13 PolarHBondContact O-N 3.43Å
12	I	47.8	Very low	50.9	Low	83 Å²	83	115.9 Å²	115.9	43%	0.426	62%	0.617	S	S	.	*			trans	-80.2	107.6	178.1	-56.1	176.5	0	0	0	108.3	E14	I12-E14 HydrophobicContact CG2-CG 3.99Å; I12-E14 PolarHBondContact O-N 3.12Å
13	V	47.6	Very low	51.1	Low	143 Å²	143	115 Å²	115	87%	0.867	60%	0.602	S	S	*	*			trans	-87.8	95.3	172.1	-177.6	0	0	0	0	107.9	W11	W11-V13 PolarHBondContact O-N 3.43Å
14	E	53.6	Low	51.5	Low	73 Å²	73	107.7 Å²	107.7	34%	0.341	57%	0.571	S	S	.	*			trans	-93.1	138.3	168.9	-82.4	177.6	163.6	0	0	109.9	I12 R16 K172	I12-E14 HydrophobicContact CG2-CG 3.99Å; I12-E14 PolarHBondContact O-N 3.12Å; E14-R16 PolarHBondContact O-N 3.21Å; E14-R16 IonicContact OE2-NE 3.48Å; E14-R16 IonicContact OE2-NH2 2.73Å; E14-R16 PolarHBondContact OE2-NH2 3.2Å; E14-K172 WeakPolarHBondContact OE1-CD 3.25Å; E14-K172 WeakPolarHBondContact OE1-CE 3.29Å; E14-K172 IonicContact OE1-NZ 2.73Å; E14-K172 PolarHBondContact OE1-NZ 3.35Å
15	E	43.6	Very low	52.2	Low	209 Å²	209	101.2 Å²	101.2	98%	0.977	55%	0.546	S	S	*	.			trans	-61.6	115.7	168.2	-80.3	-174.5	155.1	0	0	109.5
16	R	49.1	Very low	52.1	Low	68 Å²	68	103.1 Å²	103.1	26%	0.257	53%	0.533	S	S	.	.			trans	-127.9	154	176.5	-69.4	-171.4	-178.2	-168.4	-0.7	110.3	E14 D18 P170	E14-R16 PolarHBondContact O-N 3.21Å; E14-R16 IonicContact OE2-NE 3.48Å; E14-R16 IonicContact OE2-NH2 2.73Å; E14-R16 PolarHBondContact OE2-NH2 3.2Å; R16-D18 PolarHBondContact O-N 2.9Å; R16-D18 VanDerWaalsContact O-N 3.09Å; R16-P170 PolarHBondContact NH1-O 3.41Å; R16-P170 PolarHBondContact NH2-O 3.21Å
17	A	50.8	Low	52.3	Low	121 Å²	121	103.6 Å²	103.6	100%	1	53%	0.53	S	S	*	.	S	Bend	trans	-57.5	-24.1	180	0	0	0	0	0	113.1
18	D	48.8	Very low	53.1	Low	60 Å²	60	103.1 Å²	103.1	32%	0.321	52%	0.52	S	S	.	.			trans	-119.3	91	175.6	67.8	-38.8	0	0	0	111.7	R16 K20 L169	R16-D18 PolarHBondContact O-N 2.9Å; R16-D18 VanDerWaalsContact O-N 3.09Å; D18-K20 PolarHBondContact O-N 2.73Å; D18-L169 WeakPolarHBondContact OD2-CD1 3.18Å; D18-L169 WeakPolarHBondContact OD2-CD2 3.44Å
19	A	53.2	Low	54.5	Low	101 Å²	101	104.4 Å²	104.4	84%	0.835	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	17.7	-178.8	0	0	0	0	0	115.7
20	K	55.3	Low	55.9	Low	190 Å²	190	105.2 Å²	105.2	83%	0.826	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-27.8	-170	-79.8	-174.9	176.3	179.3	0	116.1	D18	D18-K20 PolarHBondContact O-N 2.73Å
21	N	58.3	Low	57.8	Low	23 Å²	23	101 Å²	101	12%	0.123	51%	0.513	C	S	.	.			trans	-130.5	64.2	-174.3	-162	8	0	0	0	114.4	N23 N24 W25 H26 L169	N21-N23 PolarHBondContact O-N 3.3Å; N21-N23 VanDerWaalsContact O-N 3.17Å; N21-N24 PolarHBondContact O-N 2.74Å; N21-N24 VanDerWaalsContact O-N 3.15Å; N21-W25 PolarHBondContact OD1-N 3.47Å; N21-H26 PolarHBondContact ND2-O 2.89Å; N21-H26 WeakPolarHBondContact OD1-CA 3.41Å; N21-H26 WeakPolarHBondContact OD1-CB 3.11Å; N21-H26 PolarHBondContact OD1-N 3.35Å; N21-H26 PolarHBondContact OD1-O 2.9Å; N21-L169 HydrophobicContact CB-CD1 4.42Å; N21-L169 WeakPolarHBondContact O-CD1 3.47Å
22	V	52.2	Low	60	Low	79 Å²	79	91.4 Å²	91.4	48%	0.479	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-51.1	121.9	178.4	-171.9	0	0	0	0	110.7	N24 W25	V22-N24 VanDerWaalsContact C-N 3.27Å; V22-N24 PolarHBondContact O-N 3.29Å; V22-W25 VanDerWaalsContact O-CB 3.26Å; V22-W25 WeakPolarHBondContact O-CB 3.5Å; V22-W25 PolarHBondContact O-N 3.49Å; V22-W25 VanDerWaalsContact O-N 3.13Å
23	N	53.4	Low	62.1	Low	55 Å²	55	88.7 Å²	88.7	29%	0.294	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	55.5	27.8	179	-65.4	-27.2	0	0	0	116	P9 N21 W25	P9-N23 PolarHBondContact O-ND2 3.07Å; N21-N23 PolarHBondContact O-N 3.3Å; N21-N23 VanDerWaalsContact O-N 3.17Å; N23-W25 PolarHBondContact O-N 3.3Å; N23-W25 VanDerWaalsContact O-N 3.14Å
24	N	57.2	Low	64.1	Low	3 Å²	3	83.9 Å²	83.9	2%	0.016	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	49.6	37.6	-172.5	-69.8	32.2	0	0	0	112.1	N21 V22 V72 K74 L167 L169	N21-N24 PolarHBondContact O-N 2.74Å; N21-N24 VanDerWaalsContact O-N 3.15Å; V22-N24 VanDerWaalsContact C-N 3.27Å; V22-N24 PolarHBondContact O-N 3.29Å; N24-V72 HydrophobicContact CB-CB 4.32Å; N24-V72 HydrophobicContact CB-CG1 3.69Å; N24-V72 WeakPolarHBondContact ND2-CB 3.41Å; N24-V72 WeakPolarHBondContact ND2-CG1 3.44Å; N24-K74 PolarHBondContact O-N 2.64Å; N24-L167 PolarHBondContact ND2-O 3Å; N24-L169 WeakPolarHBondContact OD1-CB 3.16Å; N24-L169 WeakPolarHBondContact OD1-CD1 3.48Å; N24-L169 VanDerWaalsContact OD1-CG 3.25Å; N24-L169 WeakPolarHBondContact OD1-CG 3.5Å; N24-L169 PolarHBondContact OD1-N 3.49Å
25	W	55.1	Low	66.1	Low	133 Å²	133	83.4 Å²	83.4	50%	0.504	44%	0.438	S	S	.	.			trans	-74.7	-33.8	-178.4	-167.8	-98.1	0	0	0	111.9	N21 V22 N23 K74	N21-W25 PolarHBondContact OD1-N 3.47Å; V22-W25 VanDerWaalsContact O-CB 3.26Å; V22-W25 WeakPolarHBondContact O-CB 3.5Å; V22-W25 PolarHBondContact O-N 3.49Å; V22-W25 VanDerWaalsContact O-N 3.13Å; N23-W25 PolarHBondContact O-N 3.3Å; N23-W25 VanDerWaalsContact O-N 3.14Å; W25-K74 HydrophobicContact CD2-CG 4.48Å; W25-K74 HydrophobicContact CE3-CG 4.06Å; W25-K74 HydrophobicContact CH2-CD 4.48Å; W25-K74 HydrophobicContact CH2-CG 4.44Å; W25-K74 HydrophobicContact CZ3-CB 4.49Å; W25-K74 HydrophobicContact CZ3-CD 4.46Å; W25-K74 HydrophobicContact CZ3-CG 4.03Å
26	H	57.8	Low	68.5	Low	118 Å²	118	73.4 Å²	73.4	55%	0.546	39%	0.392	S	S	.	.	S	Bend	trans	-87.2	144.6	171	-57.9	94.8	0	0	0	109.6	N21 S28	N21-H26 PolarHBondContact ND2-O 2.89Å; N21-H26 WeakPolarHBondContact OD1-CA 3.41Å; N21-H26 WeakPolarHBondContact OD1-CB 3.11Å; N21-H26 PolarHBondContact OD1-N 3.35Å; N21-H26 PolarHBondContact OD1-O 2.9Å; H26-S28 PolarHBondContact O-N 2.98Å
27	W	61.1	Low	70.7	Confident	141 Å²	141	72.3 Å²	72.3	53%	0.534	39%	0.391	S	S	.	.			trans	-53.7	124.5	176.7	-71.1	100.6	0	0	0	110.4	Y71 R73 M78	W27-Y71 AromaticContact CE3-CD1 3.99Å; W27-Y71 HydrophobicContact CE3-CD1 3.99Å; W27-Y71 HydrophobicContact CE3-CG 4.44Å; W27-Y71 HydrophobicContact CZ3-CD1 4.02Å; W27-Y71 HydrophobicContact CZ3-CG 4.16Å; W27-R73 HydrophobicContact CD2-CB 4.38Å; W27-R73 HydrophobicContact CD2-CG 4.25Å; W27-R73 HydrophobicContact CE3-CB 4.06Å; W27-R73 HydrophobicContact CE3-CG 4.4Å; W27-R73 VanDerWaalsContact CZ2-CD 3.41Å; W27-R73 HydrophobicContact CZ2-CG 4.48Å; W27-R73 HydrophobicContact CZ3-CB 4.17Å; W27-M78 HydrophobicContact CE3-CE 4.44Å; W27-M78 HydrophobicContact CH2-CE 4.02Å; W27-M78 HydrophobicContact CZ3-CE 3.55Å
28	S	68.9	Low	72.8	Confident	34 Å²	34	71.8 Å²	71.8	24%	0.238	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.1	158.6	59.7	0	0	0	0	108.3	H26 Y71 V72	H26-S28 PolarHBondContact O-N 2.98Å; S28-Y71 WeakPolarHBondContact O-CA 3.18Å; S28-V72 PolarHBondContact N-O 3Å; S28-V72 PolarHBondContact O-N 2.81Å
29	D	81	Confident	75.1	Confident	85 Å²	85	70.3 Å²	70.3	46%	0.455	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.6	172.5	-178	-19.1	0	0	0	107.3	Y71	D29-Y71 HydrophobicContact CB-CD1 3.89Å; D29-Y71 HydrophobicContact CB-CE1 3.65Å; D29-Y71 WeakPolarHBondContact OD2-CE1 3.43Å; D29-Y71 PolarHBondContact OD2-OH 3.01Å; D29-Y71 VanDerWaalsContact OD2-OH 3.05Å
30	K	84.5	Confident	77.1	Confident	101 Å²	101	65.6 Å²	65.6	44%	0.439	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	123.6	160.6	-63.1	-158.5	-169.4	168.3	0	109.7	A32 V70 Y163 L167	K30-A32 PolarHBondContact O-N 3.21Å; K30-V70 PolarHBondContact N-O 3.37Å; K30-V70 PolarHBondContact O-N 2.99Å; K30-Y163 HydrophobicContact CB-CE1 4.3Å; K30-L167 HydrophobicContact CB-CD1 4.47Å; K30-L167 HydrophobicContact CD-CD1 4.38Å; K30-L167 HydrophobicContact CD-CD2 3.34Å; K30-L167 HydrophobicContact CG-CD2 4.21Å
31	D	88.5	Confident	79	Confident	98 Å²	98	60.5 Å²	60.5	52%	0.524	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	121.3	166.3	176.8	13.9	0	0	0	109.6	T33 N69 Y163	D31-T33 WeakPolarHBondContact OD1-CB 3.4Å; D31-T33 PolarHBondContact OD1-N 2.87Å; D31-T33 PolarHBondContact OD1-OG1 2.76Å; D31-N69 WeakPolarHBondContact CA-OD1 3.39Å; D31-Y163 PolarHBondContact O-OH 3.43Å
32	A	92.3	Very high	80.8	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.008	32%	0.323	C	S	.	.			trans	-110.1	7.1	178.3	0	0	0	0	0	112.2	K30 W35 S36 A68 V70 L159 Y163	K30-A32 PolarHBondContact O-N 3.21Å; A32-W35 PolarHBondContact O-N 3.19Å; A32-S36 VanDerWaalsContact O-CB 3.24Å; A32-S36 WeakPolarHBondContact O-CB 3.22Å; A32-S36 PolarHBondContact O-N 2.95Å; A32-S36 PolarHBondContact O-OG 2.87Å; A32-A68 CarbonylContact C-O 3.35Å; A32-A68 WeakPolarHBondContact CA-O 3.33Å; A32-A68 HydrophobicContact CB-CB 4.13Å; A32-A68 WeakPolarHBondContact CB-O 3.47Å; A32-A68 PolarHBondContact N-O 3.1Å; A32-V70 HydrophobicContact CB-CG2 4.02Å; A32-L159 HydrophobicContact CB-CD1 3.83Å; A32-Y163 HydrophobicContact CB-CD1 3.69Å; A32-Y163 HydrophobicContact CB-CE1 3.37Å; A32-Y163 HydrophobicContact CB-CE2 4.48Å; A32-Y163 HydrophobicContact CB-CG 4.36Å
33	T	91.4	Very high	82.9	Confident	26 Å²	26	62.6 Å²	62.6	16%	0.16	30%	0.304	C	S	.	.	H	α-helix	trans	-59.2	-53.3	-174.1	-57.8	0	0	0	0	111.2	D31 W35 S36 I37 A68 W83	D31-T33 WeakPolarHBondContact OD1-CB 3.4Å; D31-T33 PolarHBondContact OD1-N 2.87Å; D31-T33 PolarHBondContact OD1-OG1 2.76Å; T33-W35 VanDerWaalsContact C-N 3.35Å; T33-W35 PolarHBondContact O-N 2.92Å; T33-S36 PolarHBondContact O-N 3.34Å; T33-I37 HydrophobicContact CG2-CD1 3.97Å; T33-I37 WeakPolarHBondContact O-CG1 3.45Å; T33-I37 PolarHBondContact O-N 3.42Å; T33-A68 PolarHBondContact N-O 3.19Å; T33-A68 PolarHBondContact OG1-N 2.79Å; T33-A68 VanDerWaalsContact OG1-N 3.09Å; T33-A68 PolarHBondContact OG1-O 2.9Å; T33-W83 HydrophobicContact CG2-CH2 3.89Å
34	G	91.1	Very high	84.9	Confident	42 Å²	42	60 Å²	60	43%	0.433	29%	0.291	S	S	.	.	H	α-helix	trans	-62.9	-38.7	-180	0	0	0	0	0	113.5	N38	G34-N38 PolarHBondContact O-N 2.79Å; G34-N38 PolarHBondContact O-ND2 3Å; G34-N38 VanDerWaalsContact O-ND2 3.17Å
35	W	94.4	Very high	86.6	Confident	63 Å²	63	64.4 Å²	64.4	24%	0.239	31%	0.311	C	S	.	.	H	α-helix	trans	-65	-44.1	174.7	179.5	93.3	0	0	0	111.2	A32 T33 N38 K39 Y155 L158 L159 D162 Y163	A32-W35 PolarHBondContact O-N 3.19Å; T33-W35 VanDerWaalsContact C-N 3.35Å; T33-W35 PolarHBondContact O-N 2.92Å; W35-N38 PolarHBondContact O-N 3.28Å; W35-K39 HydrophobicContact CE3-CB 4.35Å; W35-K39 HydrophobicContact CH2-CB 4.17Å; W35-K39 HydrophobicContact CH2-CG 3.84Å; W35-K39 HydrophobicContact CZ2-CB 4.39Å; W35-K39 HydrophobicContact CZ2-CD 4.45Å; W35-K39 HydrophobicContact CZ2-CG 4.16Å; W35-K39 HydrophobicContact CZ3-CB 4.16Å; W35-K39 HydrophobicContact CZ3-CG 4.23Å; W35-K39 WeakPolarHBondContact O-CB 3.46Å; W35-K39 PolarHBondContact O-N 3.21Å; W35-Y155 HydrophobicContact CE3-CE2 4.48Å; W35-Y155 HydrophobicContact CZ3-CD2 4.17Å; W35-Y155 AromaticContact CZ3-CE2 3.9Å; W35-Y155 HydrophobicContact CZ3-CE2 3.9Å; W35-L158 VanDerWaalsContact CH2-C 3.5Å; W35-L158 HydrophobicContact CH2-CB 3.89Å; W35-L158 WeakPolarHBondContact CH2-O 3.45Å; W35-L158 HydrophobicContact CZ2-CB 4.46Å; W35-L159 HydrophobicContact CE3-CD1 3.91Å; W35-L159 HydrophobicContact CH2-CB 4.42Å; W35-L159 HydrophobicContact CZ3-CB 3.93Å; W35-L159 HydrophobicContact CZ3-CD1 3.72Å; W35-L159 HydrophobicContact CZ3-CG 4.46Å; W35-D162 HydrophobicContact CZ2-CB 4.06Å; W35-Y163 HydrophobicContact CB-CD2 3.76Å; W35-Y163 HydrophobicContact CB-CE2 3.69Å; W35-Y163 AromaticContact CD1-CD2 3.61Å; W35-Y163 AromaticContact CD2-CD2 3.68Å; W35-Y163 HydrophobicContact CD2-CD2 3.68Å; W35-Y163 HydrophobicContact CD2-CG 4.14Å; W35-Y163 HydrophobicContact CE3-CD2 4.29Å; W35-Y163 HydrophobicContact CE3-CG 4.36Å; W35-Y163 AromaticContact CG-CD2 3.39Å; W35-Y163 HydrophobicContact CG-CD2 3.39Å; W35-Y163 AromaticContact CG-CE2 3.85Å; W35-Y163 HydrophobicContact CG-CE2 3.85Å; W35-Y163 HydrophobicContact CG-CG 4.29Å; W35-Y163 AromaticContact NE1-CD2 3.98Å
36	S	95.1	Very high	88.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-45.1	-179.2	-64.2	0	0	0	0	112	A32 T33 N38 K39 I40 A68 Y155	A32-S36 VanDerWaalsContact O-CB 3.24Å; A32-S36 WeakPolarHBondContact O-CB 3.22Å; A32-S36 PolarHBondContact O-N 2.95Å; A32-S36 PolarHBondContact O-OG 2.87Å; T33-S36 PolarHBondContact O-N 3.34Å; S36-N38 VanDerWaalsContact C-N 3.3Å; S36-N38 PolarHBondContact O-N 3.39Å; S36-K39 PolarHBondContact O-N 2.82Å; S36-I40 WeakPolarHBondContact O-CB 3.47Å; S36-I40 VanDerWaalsContact O-CG1 3.27Å; S36-I40 WeakPolarHBondContact O-CG1 3.3Å; S36-I40 PolarHBondContact O-N 2.78Å; S36-A68 WeakPolarHBondContact OG-CB 3.38Å; S36-Y155 VanDerWaalsContact CB-OH 3.25Å; S36-Y155 WeakPolarHBondContact CB-OH 3.28Å; S36-Y155 WeakPolarHBondContact OG-CE2 3.46Å; S36-Y155 PolarHBondContact OG-OH 2.93Å
37	I	94.4	Very high	90.3	Very high	45 Å²	45	55.1 Å²	55.1	23%	0.231	29%	0.286	C	S	.	.	H	α-helix	trans	-55.1	-48.2	175.7	-72.1	168.8	0	0	0	110.8	T33 K41 L64 W83	T33-I37 HydrophobicContact CG2-CD1 3.97Å; T33-I37 WeakPolarHBondContact O-CG1 3.45Å; T33-I37 PolarHBondContact O-N 3.42Å; I37-K41 HydrophobicContact CG2-CD 4.33Å; I37-K41 WeakPolarHBondContact O-CB 3.34Å; I37-K41 WeakPolarHBondContact O-CG 3.32Å; I37-K41 PolarHBondContact O-N 3.27Å; I37-K41 VanDerWaalsContact O-N 3.14Å; I37-L64 HydrophobicContact CB-CD2 4.24Å; I37-L64 HydrophobicContact CG1-CD2 4.22Å; I37-L64 HydrophobicContact CG1-CG 4.31Å; I37-L64 HydrophobicContact CG2-CD2 4.11Å; I37-W83 HydrophobicContact CD1-CH2 4.36Å; I37-W83 HydrophobicContact CD1-CZ3 4.36Å; I37-W83 HydrophobicContact CG1-CH2 3.74Å; I37-W83 HydrophobicContact CG1-CZ3 3.81Å
38	N	95.2	Very high	91.9	Very high	109 Å²	109	55.4 Å²	55.4	58%	0.583	29%	0.291	S	S	*	.	H	α-helix	trans	-65.4	-42.2	179.5	-71.1	-29.6	0	0	0	111.7	G34 W35 S36 K41 E42	G34-N38 PolarHBondContact O-N 2.79Å; G34-N38 PolarHBondContact O-ND2 3Å; G34-N38 VanDerWaalsContact O-ND2 3.17Å; W35-N38 PolarHBondContact O-N 3.28Å; S36-N38 VanDerWaalsContact C-N 3.3Å; S36-N38 PolarHBondContact O-N 3.39Å; N38-K41 PolarHBondContact O-N 3.05Å; N38-E42 WeakPolarHBondContact O-CB 3.4Å; N38-E42 PolarHBondContact O-N 2.87Å
39	K	95.9	Very high	93.1	Very high	30 Å²	30	54.1 Å²	54.1	13%	0.13	28%	0.281	C	S	.	.	H	α-helix	trans	-68.6	-41.6	-178	-172.2	59.9	66.5	-172.5	0	112.4	W35 S36 E42 L43 Y155 L158	W35-K39 HydrophobicContact CE3-CB 4.35Å; W35-K39 HydrophobicContact CH2-CB 4.17Å; W35-K39 HydrophobicContact CH2-CG 3.84Å; W35-K39 HydrophobicContact CZ2-CB 4.39Å; W35-K39 HydrophobicContact CZ2-CD 4.45Å; W35-K39 HydrophobicContact CZ2-CG 4.16Å; W35-K39 HydrophobicContact CZ3-CB 4.16Å; W35-K39 HydrophobicContact CZ3-CG 4.23Å; W35-K39 WeakPolarHBondContact O-CB 3.46Å; W35-K39 PolarHBondContact O-N 3.21Å; S36-K39 PolarHBondContact O-N 2.82Å; K39-E42 IonicContact NZ-OE1 2.69Å; K39-E42 IonicContact NZ-OE2 2.95Å; K39-E42 PolarHBondContact NZ-OE2 2.78Å; K39-E42 WeakPolarHBondContact O-CB 3.27Å; K39-E42 PolarHBondContact O-N 2.82Å; K39-L43 HydrophobicContact CD-CD1 4.34Å; K39-L43 HydrophobicContact CD-CG 4.42Å; K39-L43 HydrophobicContact CG-CD1 4.09Å; K39-L43 WeakPolarHBondContact O-CB 3.47Å; K39-L43 VanDerWaalsContact O-CG 3.28Å; K39-L43 WeakPolarHBondContact O-CG 3.39Å; K39-L43 PolarHBondContact O-N 2.99Å; K39-Y155 HydrophobicContact CB-CD2 4.37Å; K39-Y155 HydrophobicContact CG-CD2 4.24Å; K39-L158 HydrophobicContact CD-CD1 3.83Å; K39-L158 HydrophobicContact CG-CD1 4.31Å
40	I	96	Very high	93.7	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-45	175.7	-68.7	168.6	0	0	0	109.9	S36 L43 L44 I61 L64 W83 I85 L152 Y155	S36-I40 WeakPolarHBondContact O-CB 3.47Å; S36-I40 VanDerWaalsContact O-CG1 3.27Å; S36-I40 WeakPolarHBondContact O-CG1 3.3Å; S36-I40 PolarHBondContact O-N 2.78Å; I40-L43 PolarHBondContact O-N 2.94Å; I40-L44 HydrophobicContact CG2-CD1 3.82Å; I40-L44 WeakPolarHBondContact O-CB 3.42Å; I40-L44 PolarHBondContact O-N 2.75Å; I40-L44 VanDerWaalsContact O-N 3.08Å; I40-I61 HydrophobicContact CG2-CD1 4.14Å; I40-L64 HydrophobicContact CB-CD2 3.98Å; I40-L64 HydrophobicContact CD1-CD1 4Å; I40-L64 HydrophobicContact CD1-CD2 4.42Å; I40-L64 HydrophobicContact CG2-CD1 4.18Å; I40-L64 HydrophobicContact CG2-CD2 3.86Å; I40-W83 HydrophobicContact CD1-CD2 4.19Å; I40-W83 HydrophobicContact CD1-CG 4.33Å; I40-I85 HydrophobicContact CG2-CD1 4.38Å; I40-L152 HydrophobicContact CG2-CD2 4.31Å; I40-Y155 HydrophobicContact CD1-CD1 4.15Å; I40-Y155 HydrophobicContact CD1-CD2 4.34Å; I40-Y155 HydrophobicContact CD1-CE1 4.02Å; I40-Y155 HydrophobicContact CD1-CE2 4.21Å; I40-Y155 HydrophobicContact CD1-CG 4.31Å; I40-Y155 HydrophobicContact CG1-CD1 4.05Å; I40-Y155 HydrophobicContact CG1-CD2 3.79Å; I40-Y155 HydrophobicContact CG1-CE1 4.36Å; I40-Y155 HydrophobicContact CG1-CE2 4.12Å; I40-Y155 HydrophobicContact CG1-CG 3.75Å
41	K	96.2	Very high	94	Very high	83 Å²	83	52.6 Å²	52.6	36%	0.361	28%	0.275	S	S	.	.	H	α-helix	trans	-59.5	-47	174.4	-75.4	178	178.8	-177.4	0	112.3	I37 N38 L43 L44 Q45 I61 L64	I37-K41 HydrophobicContact CG2-CD 4.33Å; I37-K41 WeakPolarHBondContact O-CB 3.34Å; I37-K41 WeakPolarHBondContact O-CG 3.32Å; I37-K41 PolarHBondContact O-N 3.27Å; I37-K41 VanDerWaalsContact O-N 3.14Å; N38-K41 PolarHBondContact O-N 3.05Å; K41-L43 VanDerWaalsContact C-N 3.29Å; K41-L43 PolarHBondContact O-N 3.18Å; K41-L44 PolarHBondContact O-N 3.2Å; K41-Q45 WeakPolarHBondContact O-CB 3.38Å; K41-Q45 PolarHBondContact O-N 2.76Å; K41-I61 HydrophobicContact CB-CD1 4.45Å; K41-I61 HydrophobicContact CG-CD1 3.95Å; K41-L64 HydrophobicContact CG-CD2 4.4Å
42	E	95.8	Very high	94	Very high	131 Å²	131	55.3 Å²	55.3	61%	0.612	29%	0.289	S	S	*	.	H	α-helix	trans	-57.2	-41	177	-174.7	-165.3	151.8	0	0	112.3	N38 K39	N38-E42 WeakPolarHBondContact O-CB 3.4Å; N38-E42 PolarHBondContact O-N 2.87Å; K39-E42 IonicContact NZ-OE1 2.69Å; K39-E42 IonicContact NZ-OE2 2.95Å; K39-E42 PolarHBondContact NZ-OE2 2.78Å; K39-E42 WeakPolarHBondContact O-CB 3.27Å; K39-E42 PolarHBondContact O-N 2.82Å
43	L	95.8	Very high	93.9	Very high	15 Å²	15	59.6 Å²	59.6	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-77.3	-32.6	-175.7	-73.2	170.6	0	0	0	113.9	K39 I40 K41 S47 K151 K154 L158	K39-L43 HydrophobicContact CD-CD1 4.34Å; K39-L43 HydrophobicContact CD-CG 4.42Å; K39-L43 HydrophobicContact CG-CD1 4.09Å; K39-L43 WeakPolarHBondContact O-CB 3.47Å; K39-L43 VanDerWaalsContact O-CG 3.28Å; K39-L43 WeakPolarHBondContact O-CG 3.39Å; K39-L43 PolarHBondContact O-N 2.99Å; I40-L43 PolarHBondContact O-N 2.94Å; K41-L43 VanDerWaalsContact C-N 3.29Å; K41-L43 PolarHBondContact O-N 3.18Å; L43-S47 PolarHBondContact O-OG 2.84Å; L43-S47 VanDerWaalsContact O-OG 3.13Å; L43-K151 HydrophobicContact CB-CB 4.47Å; L43-K154 HydrophobicContact CD2-CD 3.93Å; L43-K154 HydrophobicContact CD2-CG 4.35Å; L43-L158 HydrophobicContact CD1-CD1 4.37Å
44	L	95.7	Very high	94	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-102.8	-46.4	-172.5	-73.4	170	0	0	0	112.8	I40 K41 G46 S47 V58 I61 I87 I148 K151 L152	I40-L44 HydrophobicContact CG2-CD1 3.82Å; I40-L44 WeakPolarHBondContact O-CB 3.42Å; I40-L44 PolarHBondContact O-N 2.75Å; I40-L44 VanDerWaalsContact O-N 3.08Å; K41-L44 PolarHBondContact O-N 3.2Å; L44-G46 PolarHBondContact O-N 2.85Å; L44-S47 WeakPolarHBondContact O-CB 3.26Å; L44-S47 PolarHBondContact O-N 2.87Å; L44-S47 PolarHBondContact O-OG 2.69Å; L44-S47 VanDerWaalsContact O-OG 3.07Å; L44-V58 WeakPolarHBondContact O-CB 3.29Å; L44-V58 WeakPolarHBondContact O-CG1 3.35Å; L44-I61 HydrophobicContact CB-CD1 3.94Å; L44-I61 HydrophobicContact CD1-CD1 4.07Å; L44-I87 HydrophobicContact CD1-CD1 3.92Å; L44-I148 HydrophobicContact CD2-CB 4.35Å; L44-I148 HydrophobicContact CD2-CG1 4.15Å; L44-I148 HydrophobicContact CD2-CG2 4.14Å; L44-K151 HydrophobicContact CD2-CB 3.64Å; L44-K151 HydrophobicContact CD2-CG 3.99Å; L44-K151 HydrophobicContact CG-CB 4.21Å; L44-L152 HydrophobicContact CD1-CD2 4.17Å
45	Q	93.4	Very high	94.1	Very high	96 Å²	96	58.9 Å²	58.9	45%	0.449	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	128	-169.4	-167	168.4	7.7	0	0	111.5	K41 S47 T59	K41-Q45 WeakPolarHBondContact O-CB 3.38Å; K41-Q45 PolarHBondContact O-N 2.76Å; Q45-S47 VanDerWaalsContact C-N 3.25Å; Q45-S47 PolarHBondContact O-N 3.48Å; Q45-T59 PolarHBondContact NE2-O 3.23Å
46	G	93.8	Very high	94.1	Very high	37 Å²	37	56 Å²	56	38%	0.381	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-0.4	-177.1	0	0	0	0	0	115	L44 V58	L44-G46 PolarHBondContact O-N 2.85Å; G46-V58 WeakPolarHBondContact CA-O 3.45Å; G46-V58 PolarHBondContact N-O 3.41Å
47	S	95	Very high	94.1	Very high	19 Å²	19	60.1 Å²	60.1	13%	0.133	30%	0.304	C	S	.	.			trans	-60.1	137.4	174.3	-72.9	0	0	0	0	111.4	L43 L44 Q45 K57 V58	L43-S47 PolarHBondContact O-OG 2.84Å; L43-S47 VanDerWaalsContact O-OG 3.13Å; L44-S47 WeakPolarHBondContact O-CB 3.26Å; L44-S47 PolarHBondContact O-N 2.87Å; L44-S47 PolarHBondContact O-OG 2.69Å; L44-S47 VanDerWaalsContact O-OG 3.07Å; Q45-S47 VanDerWaalsContact C-N 3.25Å; Q45-S47 PolarHBondContact O-N 3.48Å; S47-K57 WeakPolarHBondContact O-CA 3.4Å; S47-V58 PolarHBondContact O-N 3.5Å
48	K	94.9	Very high	94.2	Very high	147 Å²	147	58 Å²	58	64%	0.639	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	133.5	174.4	-62.9	-176.3	178.6	-174.1	0	109.9	E50	K48-E50 HydrophobicContact CB-CG 4.37Å
49	I	94.2	Very high	94.3	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	102.5	-179.5	-52.4	173.1	0	0	0	106.2	C56 V58 F139 M140 F147	I49-C56 HydrophobicContact CB-CB 4.3Å; I49-C56 PolarHBondContact N-O 2.89Å; I49-C56 WeakPolarHBondContact O-CA 3.15Å; I49-C56 PolarHBondContact O-N 3.03Å; I49-V58 HydrophobicContact CD1-CG2 4.34Å; I49-F139 HydrophobicContact CG2-CE1 3.94Å; I49-F139 HydrophobicContact CG2-CZ 3.95Å; I49-M140 HydrophobicContact CD1-CE 4.1Å; I49-M140 HydrophobicContact CD1-SD 4.13Å; I49-F147 HydrophobicContact CD1-CB 4.37Å; I49-F147 HydrophobicContact CD1-CD1 3.7Å; I49-F147 HydrophobicContact CD1-CE1 4.28Å; I49-F147 HydrophobicContact CD1-CG 4.2Å; I49-F147 HydrophobicContact CG1-CB 4.49Å; I49-F147 HydrophobicContact CG1-CD1 3.7Å; I49-F147 HydrophobicContact CG1-CE1 3.98Å; I49-F147 HydrophobicContact CG1-CG 4Å; I49-F147 HydrophobicContact CG1-CZ 4.5Å
50	E	93.1	Very high	94.2	Very high	97 Å²	97	58.9 Å²	58.9	45%	0.453	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	151.7	-171.7	-48.9	-170.2	-173.8	0	0	111.7	K48 Y54 A55 K94	K48-E50 HydrophobicContact CB-CG 4.37Å; E50-Y54 VanDerWaalsContact CA-O 3.32Å; E50-Y54 WeakPolarHBondContact CA-O 3.48Å; E50-A55 HydrophobicContact CG-CB 3.88Å; E50-K94 WeakPolarHBondContact OE2-CE 3.35Å; E50-K94 IonicContact OE2-NZ 2.7Å; E50-K94 PolarHBondContact OE2-NZ 2.8Å
51	N	90.8	Very high	94.3	Very high	58 Å²	58	59.4 Å²	59.4	31%	0.31	30%	0.3	S	S	.	.			trans	-131.9	-162.5	163.4	69.8	6.2	0	0	0	109	L53 Y54 K94 F139	N51-L53 PolarHBondContact O-N 3.16Å; N51-L53 PolarHBondContact OD1-N 3.22Å; N51-Y54 PolarHBondContact N-O 2.8Å; N51-Y54 WeakPolarHBondContact OD1-CD2 3.36Å; N51-Y54 PolarHBondContact OD1-N 2.93Å; N51-K94 VanDerWaalsContact O-CE 3.3Å; N51-K94 WeakPolarHBondContact O-CE 3.15Å; N51-K94 PolarHBondContact O-NZ 2.99Å; N51-F139 HydrophobicContact CB-CE2 4.11Å; N51-F139 HydrophobicContact CB-CZ 4.44Å; N51-F139 WeakPolarHBondContact ND2-CE2 3.16Å
52	D	89.8	Confident	94.2	Very high	155 Å²	155	58.1 Å²	58.1	83%	0.829	30%	0.302	S	S	*	.	S	Bend	trans	-66.1	-25.5	-179.5	-63.9	-22.8	0	0	0	113.5
53	L	90.7	Very high	94.1	Very high	91 Å²	91	55.4 Å²	55.4	48%	0.476	29%	0.288	S	S	.	.	S	Bend	trans	-108.2	-33.3	-172.2	-62.3	177.2	0	0	0	113.7	N51 I93 K94	N51-L53 PolarHBondContact O-N 3.16Å; N51-L53 PolarHBondContact OD1-N 3.22Å; L53-I93 CarbonylContact O-C 3.53Å; L53-K94 WeakPolarHBondContact O-CB 3.31Å; L53-K94 PolarHBondContact O-N 3.32Å
54	Y	92.2	Very high	94.1	Very high	36 Å²	36	56 Å²	56	14%	0.141	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	144.1	-169.1	-47.8	-60.2	0	0	0	110.6	E50 N51 I92 I93 K94 L135 V136 F139	E50-Y54 VanDerWaalsContact CA-O 3.32Å; E50-Y54 WeakPolarHBondContact CA-O 3.48Å; N51-Y54 PolarHBondContact N-O 2.8Å; N51-Y54 WeakPolarHBondContact OD1-CD2 3.36Å; N51-Y54 PolarHBondContact OD1-N 2.93Å; Y54-I92 WeakPolarHBondContact CA-O 3.16Å; Y54-I93 HydrophobicContact CD1-CG1 4.02Å; Y54-I93 HydrophobicContact CE1-CD1 4.35Å; Y54-I93 HydrophobicContact CE1-CG1 4.08Å; Y54-K94 WeakPolarHBondContact O-CE 3.42Å; Y54-L135 HydrophobicContact CE1-CB 4.18Å; Y54-V136 HydrophobicContact CD1-CG2 4.03Å; Y54-F139 HydrophobicContact CD2-CB 3.75Å; Y54-F139 HydrophobicContact CD2-CD1 4.31Å; Y54-F139 AromaticContact CD2-CD2 3.81Å; Y54-F139 HydrophobicContact CD2-CD2 3.81Å; Y54-F139 AromaticContact CD2-CG 3.68Å; Y54-F139 HydrophobicContact CD2-CG 3.68Å; Y54-F139 HydrophobicContact CE2-CB 4.21Å; Y54-F139 HydrophobicContact CG-CB 4.3Å; Y54-F139 HydrophobicContact CG-CD1 4.4Å; Y54-F139 HydrophobicContact CG-CG 4.2Å
55	A	93.6	Very high	93.8	Very high	16 Å²	16	60.5 Å²	60.5	13%	0.132	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	117.2	169.3	0	0	0	0	0	109.5	E50 G91 I92 K94	E50-A55 HydrophobicContact CG-CB 3.88Å; A55-G91 CarbonylContact O-C 3.45Å; A55-G91 VanDerWaalsContact O-CA 3.27Å; A55-G91 WeakPolarHBondContact O-CA 3.47Å; A55-I92 HydrophobicContact CB-CG1 4.02Å; A55-I92 PolarHBondContact N-O 2.69Å; A55-I92 PolarHBondContact O-N 2.79Å; A55-K94 HydrophobicContact CB-CG 4.19Å
56	C	94.5	Very high	93.7	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.02	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	155	176.4	-59.6	0	0	0	0	110.6	I49 E90 F139 M140	I49-C56 HydrophobicContact CB-CB 4.3Å; I49-C56 PolarHBondContact N-O 2.89Å; I49-C56 WeakPolarHBondContact O-CA 3.15Å; I49-C56 PolarHBondContact O-N 3.03Å; C56-E90 CarbonylContact C-O 3.45Å; C56-E90 VanDerWaalsContact CA-O 3.28Å; C56-E90 WeakPolarHBondContact CA-O 3.48Å; C56-F139 HydrophobicContact CB-CE1 4.38Å; C56-M140 HydrophobicContact CB-CG 4.08Å; C56-M140 HydrophobicContact CB-SD 3.4Å; C56-M140 WeakPolarHBondContact CB-SD 3.3Å
57	K	95.7	Very high	93.6	Very high	86 Å²	86	60.8 Å²	60.8	37%	0.374	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136.3	179.6	-177.3	-173.2	172.1	-167.8	0	109.8	S47 T59 W89 E90	S47-K57 WeakPolarHBondContact O-CA 3.4Å; K57-T59 PolarHBondContact O-N 3.11Å; K57-W89 VanDerWaalsContact O-CA 3.29Å; K57-W89 WeakPolarHBondContact O-CA 3.43Å; K57-E90 HydrophobicContact CB-CG 4.37Å; K57-E90 PolarHBondContact N-O 2.87Å; K57-E90 PolarHBondContact O-N 2.81Å
58	V	96.5	Very high	93.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	117.6	167	176.9	0	0	0	0	108.9	L44 G46 S47 I49 I87	L44-V58 WeakPolarHBondContact O-CB 3.29Å; L44-V58 WeakPolarHBondContact O-CG1 3.35Å; G46-V58 WeakPolarHBondContact CA-O 3.45Å; G46-V58 PolarHBondContact N-O 3.41Å; S47-V58 PolarHBondContact O-N 3.5Å; I49-V58 HydrophobicContact CD1-CG2 4.34Å; V58-I87 HydrophobicContact CB-CG2 4.42Å; V58-I87 HydrophobicContact CG1-CG2 3.52Å; V58-I87 HydrophobicContact CG2-CG2 4.14Å
59	T	95.5	Very high	93.2	Very high	50 Å²	50	54 Å²	54	31%	0.307	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-49.2	-177.5	51.1	0	0	0	0	111.3	Q45 K57 D88 E90	Q45-T59 PolarHBondContact NE2-O 3.23Å; K57-T59 PolarHBondContact O-N 3.11Å; T59-D88 PolarHBondContact N-O 3.36Å; T59-D88 VanDerWaalsContact OG1-C 3.28Å; T59-D88 WeakPolarHBondContact OG1-CB 3.48Å; T59-D88 PolarHBondContact OG1-O 2.89Å; T59-E90 HydrophobicContact CG2-CB 4Å; T59-E90 HydrophobicContact CG2-CG 3.59Å
60	E	95.8	Very high	92.9	Very high	109 Å²	109	53.7 Å²	53.7	51%	0.509	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	155.2	-171.9	-177	167.3	-160.7	0	0	110.8	D88	E60-D88 HydrophobicContact CB-CB 4.36Å; E60-D88 PolarHBondContact N-O 2.76Å; E60-D88 PolarHBondContact O-N 2.7Å
61	I	96.1	Very high	92.5	Very high	12 Å²	12	51.4 Å²	51.4	6%	0.062	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	97.5	165.9	-54.1	-177.4	0	0	0	106.3	I40 K41 L44 K63 L64 I85 V86	I40-I61 HydrophobicContact CG2-CD1 4.14Å; K41-I61 HydrophobicContact CB-CD1 4.45Å; K41-I61 HydrophobicContact CG-CD1 3.95Å; L44-I61 HydrophobicContact CB-CD1 3.94Å; L44-I61 HydrophobicContact CD1-CD1 4.07Å; I61-K63 WeakPolarHBondContact CG2-O 3.37Å; I61-L64 HydrophobicContact CG2-CB 3.95Å; I61-I85 HydrophobicContact CG2-CG2 3.76Å; I61-V86 CarbonylContact C-O 3.5Å; I61-V86 WeakPolarHBondContact CA-O 3.43Å
62	S	94.1	Very high	92	Very high	56 Å²	56	48.7 Å²	48.7	39%	0.392	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-23.7	-171.5	54.2	0	0	0	0	113	V86 D88 K105	S62-V86 PolarHBondContact N-O 3.5Å; S62-V86 WeakPolarHBondContact OG-CG1 3.28Å; S62-V86 PolarHBondContact OG-O 3.47Å; S62-D88 WeakPolarHBondContact CB-OD1 3.41Å; S62-D88 PolarHBondContact OG-OD1 3.1Å; S62-K105 PolarHBondContact OG-NZ 3.23Å
63	K	94.9	Very high	91.1	Very high	74 Å²	74	46.5 Å²	46.5	32%	0.322	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	133.7	169.2	-173.3	178.2	174.5	-175.7	0	109.5	I61 D65 E84 I85 V86	I61-K63 WeakPolarHBondContact CG2-O 3.37Å; K63-D65 HydrophobicContact CG-CB 4.22Å; K63-E84 WeakPolarHBondContact CE-OE2 3.39Å; K63-E84 IonicContact NZ-OE1 3.74Å; K63-E84 PolarHBondContact NZ-OE1 2.86Å; K63-E84 IonicContact NZ-OE2 3.65Å; K63-E84 PolarHBondContact NZ-OE2 3.44Å; K63-I85 CarbonylContact O-C 3.51Å; K63-I85 WeakPolarHBondContact O-CA 3.38Å; K63-V86 HydrophobicContact CB-CB 3.77Å; K63-V86 HydrophobicContact CB-CG2 3.73Å; K63-V86 HydrophobicContact CD-CG2 4.21Å; K63-V86 HydrophobicContact CG-CG2 4.49Å; K63-V86 PolarHBondContact N-O 3.03Å; K63-V86 PolarHBondContact O-N 2.88Å
64	L	94.6	Very high	90.2	Very high	26 Å²	26	48.1 Å²	48.1	14%	0.136	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	88.2	170.4	178.7	55.3	0	0	0	106.4	I37 I40 K41 I61 W83 E84 I85	I37-L64 HydrophobicContact CB-CD2 4.24Å; I37-L64 HydrophobicContact CG1-CD2 4.22Å; I37-L64 HydrophobicContact CG1-CG 4.31Å; I37-L64 HydrophobicContact CG2-CD2 4.11Å; I40-L64 HydrophobicContact CB-CD2 3.98Å; I40-L64 HydrophobicContact CD1-CD1 4Å; I40-L64 HydrophobicContact CD1-CD2 4.42Å; I40-L64 HydrophobicContact CG2-CD1 4.18Å; I40-L64 HydrophobicContact CG2-CD2 3.86Å; K41-L64 HydrophobicContact CG-CD2 4.4Å; I61-L64 HydrophobicContact CG2-CB 3.95Å; L64-W83 HydrophobicContact CD1-CD2 4.21Å; L64-W83 HydrophobicContact CD1-CE3 3.7Å; L64-W83 HydrophobicContact CD1-CZ3 4.29Å; L64-W83 HydrophobicContact CG-CE3 4.22Å; L64-W83 HydrophobicContact CG-CZ3 4.34Å; L64-E84 WeakPolarHBondContact CA-O 3.35Å; L64-I85 HydrophobicContact CD1-CB 4.38Å; L64-I85 HydrophobicContact CD1-CD1 3.94Å; L64-I85 HydrophobicContact CD1-CG1 3.68Å; L64-I85 HydrophobicContact CD1-CG2 4.13Å
65	D	90.6	Very high	88.9	Confident	97 Å²	97	48.3 Å²	48.3	52%	0.519	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.4	-172.2	-165.1	14.5	0	0	0	109.9	K63 W83 E84	K63-D65 HydrophobicContact CG-CB 4.22Å; D65-W83 WeakPolarHBondContact O-CA 3.5Å; D65-E84 PolarHBondContact N-O 3.18Å; D65-E84 PolarHBondContact O-N 2.75Å
66	G	90.8	Very high	87.9	Confident	28 Å²	28	54.4 Å²	54.4	29%	0.289	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	126.4	-167.2	-173.6	0	0	0	0	0	113.8	E82 W83	G66-E82 CarbonylContact C-O 3.53Å; G66-E82 WeakPolarHBondContact CA-O 3.32Å; G66-W83 WeakPolarHBondContact O-CZ3 3.47Å
67	E	91.9	Very high	87.3	Confident	111 Å²	111	56.9 Å²	56.9	52%	0.519	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	157	-169.8	60.4	178.7	-155.2	0	0	112.3	Y81 E82	E67-Y81 CarbonylContact O-C 3.43Å; E67-Y81 VanDerWaalsContact O-CA 3.27Å; E67-Y81 WeakPolarHBondContact O-CA 3.35Å; E67-E82 PolarHBondContact N-O 2.71Å; E67-E82 PolarHBondContact O-N 2.83Å
68	A	92.8	Very high	86.7	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	133.1	169.5	0	0	0	0	0	110	A32 T33 S36 F80 W83	A32-A68 CarbonylContact C-O 3.35Å; A32-A68 WeakPolarHBondContact CA-O 3.33Å; A32-A68 HydrophobicContact CB-CB 4.13Å; A32-A68 WeakPolarHBondContact CB-O 3.47Å; A32-A68 PolarHBondContact N-O 3.1Å; T33-A68 PolarHBondContact N-O 3.19Å; T33-A68 PolarHBondContact OG1-N 2.79Å; T33-A68 VanDerWaalsContact OG1-N 3.09Å; T33-A68 PolarHBondContact OG1-O 2.9Å; S36-A68 WeakPolarHBondContact OG-CB 3.38Å; A68-F80 CarbonylContact C-O 3.46Å; A68-F80 VanDerWaalsContact CA-O 3.27Å; A68-F80 WeakPolarHBondContact CA-O 3.24Å; A68-W83 HydrophobicContact CB-CZ2 3.79Å
69	N	88.1	Confident	86.3	Confident	22 Å²	22	56.5 Å²	56.5	12%	0.118	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.6	179.9	-67.7	-64.8	0	0	0	110.2	D31 Y71 C79 F80	D31-N69 WeakPolarHBondContact CA-OD1 3.39Å; N69-Y71 HydrophobicContact CB-CD2 4.45Å; N69-Y71 HydrophobicContact CB-CE2 3.54Å; N69-Y71 WeakPolarHBondContact CB-OH 3.19Å; N69-C79 WeakPolarHBondContact O-CA 3.47Å; N69-F80 PolarHBondContact N-O 2.96Å; N69-F80 PolarHBondContact O-N 3.11Å
70	V	89.2	Confident	86	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.4	177.8	-178	0	0	0	0	110	K30 A32 L77 C79 L159 Y163 A164 L167	K30-V70 PolarHBondContact N-O 3.37Å; K30-V70 PolarHBondContact O-N 2.99Å; A32-V70 HydrophobicContact CB-CG2 4.02Å; V70-L77 HydrophobicContact CG1-CD1 3.37Å; V70-L77 HydrophobicContact CG1-CG 4.19Å; V70-C79 HydrophobicContact CG2-CB 4.33Å; V70-L159 HydrophobicContact CG2-CD1 4.09Å; V70-L159 HydrophobicContact CG2-CG 4.46Å; V70-Y163 HydrophobicContact CB-CD1 4.39Å; V70-Y163 HydrophobicContact CB-CE1 4.45Å; V70-Y163 HydrophobicContact CG2-CD1 3.85Å; V70-Y163 HydrophobicContact CG2-CE1 4.21Å; V70-A164 HydrophobicContact CG1-CB 4.08Å; V70-L167 HydrophobicContact CB-CD1 3.95Å; V70-L167 HydrophobicContact CG1-CD1 3.47Å; V70-L167 VanDerWaalsContact CG1-CD1 3.47Å
71	Y	84.5	Confident	85.8	Confident	49 Å²	49	53.9 Å²	53.9	19%	0.192	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	142.7	179.9	-59	-87.4	0	0	0	110.7	W27 S28 D29 N69 L77 M78 F80	W27-Y71 AromaticContact CE3-CD1 3.99Å; W27-Y71 HydrophobicContact CE3-CD1 3.99Å; W27-Y71 HydrophobicContact CE3-CG 4.44Å; W27-Y71 HydrophobicContact CZ3-CD1 4.02Å; W27-Y71 HydrophobicContact CZ3-CG 4.16Å; S28-Y71 WeakPolarHBondContact O-CA 3.18Å; D29-Y71 HydrophobicContact CB-CD1 3.89Å; D29-Y71 HydrophobicContact CB-CE1 3.65Å; D29-Y71 WeakPolarHBondContact OD2-CE1 3.43Å; D29-Y71 PolarHBondContact OD2-OH 3.01Å; D29-Y71 VanDerWaalsContact OD2-OH 3.05Å; N69-Y71 HydrophobicContact CB-CD2 4.45Å; N69-Y71 HydrophobicContact CB-CE2 3.54Å; N69-Y71 WeakPolarHBondContact CB-OH 3.19Å; Y71-L77 CarbonylContact O-C 3.57Å; Y71-L77 WeakPolarHBondContact O-CA 3.33Å; Y71-M78 PolarHBondContact N-O 3.02Å; Y71-M78 PolarHBondContact O-N 3.38Å; Y71-F80 AromaticContact CD2-CD2 3.38Å; Y71-F80 HydrophobicContact CD2-CD2 3.38Å; Y71-F80 AromaticContact CD2-CE2 3.63Å; Y71-F80 HydrophobicContact CD2-CE2 3.63Å; Y71-F80 AromaticContact CE2-CD2 3.39Å; Y71-F80 HydrophobicContact CE2-CD2 3.39Å; Y71-F80 AromaticContact CE2-CE2 3.93Å; Y71-F80 HydrophobicContact CE2-CE2 3.93Å; Y71-F80 HydrophobicContact CE2-CG 4.33Å
72	V	79.3	Confident	85.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.8	161.6	-163.5	0	0	0	0	109.6	N24 S28 K76 L77 L167	N24-V72 HydrophobicContact CB-CB 4.32Å; N24-V72 HydrophobicContact CB-CG1 3.69Å; N24-V72 WeakPolarHBondContact ND2-CB 3.41Å; N24-V72 WeakPolarHBondContact ND2-CG1 3.44Å; S28-V72 PolarHBondContact N-O 3Å; S28-V72 PolarHBondContact O-N 2.81Å; V72-K76 WeakPolarHBondContact CA-O 3.05Å; V72-L77 HydrophobicContact CG2-CD1 4.05Å; V72-L167 HydrophobicContact CG2-CB 3.9Å
73	R	72.4	Confident	85.5	Confident	109 Å²	109	56 Å²	56	41%	0.411	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	124.2	176.5	-172	-177.6	-169	-179.1	0.9	110.2	W27 G75 K76 M78	W27-R73 HydrophobicContact CD2-CB 4.38Å; W27-R73 HydrophobicContact CD2-CG 4.25Å; W27-R73 HydrophobicContact CE3-CB 4.06Å; W27-R73 HydrophobicContact CE3-CG 4.4Å; W27-R73 VanDerWaalsContact CZ2-CD 3.41Å; W27-R73 HydrophobicContact CZ2-CG 4.48Å; W27-R73 HydrophobicContact CZ3-CB 4.17Å; R73-G75 PolarHBondContact O-N 3.33Å; R73-K76 PolarHBondContact N-O 2.84Å; R73-K76 WeakPolarHBondContact O-CB 3.23Å; R73-K76 PolarHBondContact O-N 2.96Å; R73-M78 HydrophobicContact CB-CE 3.6Å
74	K	70.5	Confident	85.4	Confident	126 Å²	126	56.3 Å²	56.3	55%	0.548	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	40	179.5	-61.3	176.2	175.6	-178	0	111.8	N24 W25 K76	N24-K74 PolarHBondContact O-N 2.64Å; W25-K74 HydrophobicContact CD2-CG 4.48Å; W25-K74 HydrophobicContact CE3-CG 4.06Å; W25-K74 HydrophobicContact CH2-CD 4.48Å; W25-K74 HydrophobicContact CH2-CG 4.44Å; W25-K74 HydrophobicContact CZ3-CB 4.49Å; W25-K74 HydrophobicContact CZ3-CD 4.46Å; W25-K74 HydrophobicContact CZ3-CG 4.03Å; K74-K76 PolarHBondContact O-N 3.03Å
75	G	65.4	Low	85.4	Confident	39 Å²	39	55 Å²	55	40%	0.402	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	4.3	-177	0	0	0	0	0	115.7	R73	R73-G75 PolarHBondContact O-N 3.33Å
76	K	73.7	Confident	85.7	Confident	145 Å²	145	51.1 Å²	51.1	63%	0.63	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	129.9	172.7	-65.2	-168.8	175.5	-166.6	0	110.6	V72 R73 K74	V72-K76 WeakPolarHBondContact CA-O 3.05Å; R73-K76 PolarHBondContact N-O 2.84Å; R73-K76 WeakPolarHBondContact O-CB 3.23Å; R73-K76 PolarHBondContact O-N 2.96Å; K74-K76 PolarHBondContact O-N 3.03Å
77	L	80.3	Confident	86	Confident	54 Å²	54	49.9 Å²	49.9	28%	0.283	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	134.4	169.8	-172.1	77.8	0	0	0	109.9	V70 Y71 V72 A164	V70-L77 HydrophobicContact CG1-CD1 3.37Å; V70-L77 HydrophobicContact CG1-CG 4.19Å; Y71-L77 CarbonylContact O-C 3.57Å; Y71-L77 WeakPolarHBondContact O-CA 3.33Å; V72-L77 HydrophobicContact CG2-CD1 4.05Å; L77-A164 HydrophobicContact CD1-CB 3.52Å; L77-A164 HydrophobicContact CD2-CB 3.31Å; L77-A164 HydrophobicContact CG-CB 3.97Å
78	M	83	Confident	86.2	Confident	61 Å²	61	45.9 Å²	45.9	30%	0.3	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	128.5	171.2	-61	169.8	-64.7	0	0	107.4	W27 Y71 R73 F80	W27-M78 HydrophobicContact CE3-CE 4.44Å; W27-M78 HydrophobicContact CH2-CE 4.02Å; W27-M78 HydrophobicContact CZ3-CE 3.55Å; Y71-M78 PolarHBondContact N-O 3.02Å; Y71-M78 PolarHBondContact O-N 3.38Å; R73-M78 HydrophobicContact CB-CE 3.6Å; M78-F80 HydrophobicContact CB-CE2 4.01Å
79	C	88.3	Confident	86.4	Confident	17 Å²	17	45.9 Å²	45.9	12%	0.115	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126	175.8	-54.2	0	0	0	0	107.6	N69 V70 L159	N69-C79 WeakPolarHBondContact O-CA 3.47Å; V70-C79 HydrophobicContact CG2-CB 4.33Å; C79-L159 HydrophobicContact CB-CD2 3.98Å; C79-L159 HydrophobicContact CB-CG 4.42Å
80	F	89.1	Confident	86.7	Confident	90 Å²	90	47.2 Å²	47.2	40%	0.395	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.9	169.5	-64.5	-89.8	0	0	0	107.6	A68 N69 Y71 M78 D113	A68-F80 CarbonylContact C-O 3.46Å; A68-F80 VanDerWaalsContact CA-O 3.27Å; A68-F80 WeakPolarHBondContact CA-O 3.24Å; N69-F80 PolarHBondContact N-O 2.96Å; N69-F80 PolarHBondContact O-N 3.11Å; Y71-F80 AromaticContact CD2-CD2 3.38Å; Y71-F80 HydrophobicContact CD2-CD2 3.38Å; Y71-F80 AromaticContact CD2-CE2 3.63Å; Y71-F80 HydrophobicContact CD2-CE2 3.63Å; Y71-F80 AromaticContact CE2-CD2 3.39Å; Y71-F80 HydrophobicContact CE2-CD2 3.39Å; Y71-F80 AromaticContact CE2-CE2 3.93Å; Y71-F80 HydrophobicContact CE2-CE2 3.93Å; Y71-F80 HydrophobicContact CE2-CG 4.33Å; M78-F80 HydrophobicContact CB-CE2 4.01Å; F80-D113 WeakPolarHBondContact CD1-OD2 3.43Å
81	Y	91.7	Very high	87	Confident	15 Å²	15	47.3 Å²	47.3	6%	0.059	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	145.1	175.3	55.7	-92.1	0	0	0	108.8	E67 L111 I112 D113 I156 L159	E67-Y81 CarbonylContact O-C 3.43Å; E67-Y81 VanDerWaalsContact O-CA 3.27Å; E67-Y81 WeakPolarHBondContact O-CA 3.35Å; Y81-L111 HydrophobicContact CD2-CG 4.22Å; Y81-L111 HydrophobicContact CE2-CD1 4.1Å; Y81-L111 HydrophobicContact CE2-CG 3.92Å; Y81-I112 VanDerWaalsContact CE2-C 3.49Å; Y81-I112 CarbonylContact O-C 3.58Å; Y81-I112 VanDerWaalsContact O-CA 3.25Å; Y81-I112 WeakPolarHBondContact O-CA 3.39Å; Y81-D113 HydrophobicContact CD1-CB 3.9Å; Y81-D113 HydrophobicContact CE1-CB 3.67Å; Y81-D113 HydrophobicContact CE2-CB 4.48Å; Y81-D113 HydrophobicContact CG-CB 4.39Å; Y81-D113 VanDerWaalsContact CZ-CA 3.49Å; Y81-D113 PolarHBondContact O-N 3.26Å; Y81-D113 VanDerWaalsContact O-N 3.12Å; Y81-I156 HydrophobicContact CE1-CG1 4.17Å; Y81-I156 HydrophobicContact CE1-CG2 4.22Å; Y81-I156 HydrophobicContact CE2-CD1 4.09Å; Y81-I156 HydrophobicContact CE2-CG1 4.19Å; Y81-I156 VanDerWaalsContact OH-CD1 3.31Å; Y81-I156 WeakPolarHBondContact OH-CD1 3.41Å; Y81-L159 HydrophobicContact CD1-CD2 4.07Å
82	E	90.7	Very high	87.3	Confident	110 Å²	110	47.1 Å²	47.1	51%	0.514	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	124.9	170.8	173.6	165.6	-160.1	0	0	107.2	G66 E67 L111 I112	G66-E82 CarbonylContact C-O 3.53Å; G66-E82 WeakPolarHBondContact CA-O 3.32Å; E67-E82 PolarHBondContact N-O 2.71Å; E67-E82 PolarHBondContact O-N 2.83Å; E82-L111 CarbonylContact C-O 3.56Å; E82-L111 VanDerWaalsContact CA-O 3.3Å; E82-L111 WeakPolarHBondContact CA-O 3.4Å; E82-I112 HydrophobicContact CB-CG2 3.97Å; E82-I112 HydrophobicContact CG-CG2 3.76Å
83	W	93.7	Very high	87.9	Confident	2 Å²	2	48 Å²	48	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.7	179.7	-61.4	105.5	0	0	0	112	T33 I37 I40 L64 D65 G66 A68 I85 L111 Y155	T33-W83 HydrophobicContact CG2-CH2 3.89Å; I37-W83 HydrophobicContact CD1-CH2 4.36Å; I37-W83 HydrophobicContact CD1-CZ3 4.36Å; I37-W83 HydrophobicContact CG1-CH2 3.74Å; I37-W83 HydrophobicContact CG1-CZ3 3.81Å; I40-W83 HydrophobicContact CD1-CD2 4.19Å; I40-W83 HydrophobicContact CD1-CG 4.33Å; L64-W83 HydrophobicContact CD1-CD2 4.21Å; L64-W83 HydrophobicContact CD1-CE3 3.7Å; L64-W83 HydrophobicContact CD1-CZ3 4.29Å; L64-W83 HydrophobicContact CG-CE3 4.22Å; L64-W83 HydrophobicContact CG-CZ3 4.34Å; D65-W83 WeakPolarHBondContact O-CA 3.5Å; G66-W83 WeakPolarHBondContact O-CZ3 3.47Å; A68-W83 HydrophobicContact CB-CZ2 3.79Å; W83-I85 HydrophobicContact CB-CD1 4.08Å; W83-I85 HydrophobicContact CB-CG1 3.92Å; W83-L111 HydrophobicContact CB-CB 4.28Å; W83-L111 PolarHBondContact N-O 3.4Å; W83-L111 PolarHBondContact O-N 2.95Å; W83-Y155 AromaticContact NE1-CE1 3.78Å; W83-Y155 AromaticContact NE1-CZ 3.67Å; W83-Y155 PolarHBondContact NE1-OH 2.99Å
84	E	92	Very high	88.6	Confident	80 Å²	80	47.1 Å²	47.1	37%	0.374	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.5	160.6	-170.3	-170.8	154.5	0	0	108.5	K63 L64 D65	K63-E84 WeakPolarHBondContact CE-OE2 3.39Å; K63-E84 IonicContact NZ-OE1 3.74Å; K63-E84 PolarHBondContact NZ-OE1 2.86Å; K63-E84 IonicContact NZ-OE2 3.65Å; K63-E84 PolarHBondContact NZ-OE2 3.44Å; L64-E84 WeakPolarHBondContact CA-O 3.35Å; D65-E84 PolarHBondContact N-O 3.18Å; D65-E84 PolarHBondContact O-N 2.75Å
85	I	95.5	Very high	89.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.7	-170.2	-40.5	-178.1	0	0	0	110.1	I40 I61 K63 L64 W83 I87 E107 V108 L111 L152	I40-I85 HydrophobicContact CG2-CD1 4.38Å; I61-I85 HydrophobicContact CG2-CG2 3.76Å; K63-I85 CarbonylContact O-C 3.51Å; K63-I85 WeakPolarHBondContact O-CA 3.38Å; L64-I85 HydrophobicContact CD1-CB 4.38Å; L64-I85 HydrophobicContact CD1-CD1 3.94Å; L64-I85 HydrophobicContact CD1-CG1 3.68Å; L64-I85 HydrophobicContact CD1-CG2 4.13Å; W83-I85 HydrophobicContact CB-CD1 4.08Å; W83-I85 HydrophobicContact CB-CG1 3.92Å; I85-I87 HydrophobicContact CG2-CD1 4.18Å; I85-I87 HydrophobicContact CG2-CG1 3.78Å; I85-E107 CarbonylContact O-C 3.58Å; I85-E107 WeakPolarHBondContact O-CA 3.49Å; I85-V108 HydrophobicContact CB-CB 4.04Å; I85-V108 HydrophobicContact CB-CG2 4.33Å; I85-V108 HydrophobicContact CG1-CB 4.36Å; I85-V108 PolarHBondContact N-O 2.95Å; I85-V108 PolarHBondContact O-N 2.98Å; I85-L111 HydrophobicContact CD1-CD2 4.49Å; I85-L152 HydrophobicContact CD1-CD1 4.32Å; I85-L152 HydrophobicContact CD1-CD2 3.66Å
86	V	96.2	Very high	89.8	Confident	15 Å²	15	45.3 Å²	45.3	9%	0.091	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	120.1	171.3	-175.3	0	0	0	0	108.9	I61 S62 K63 K105 E107	I61-V86 CarbonylContact C-O 3.5Å; I61-V86 WeakPolarHBondContact CA-O 3.43Å; S62-V86 PolarHBondContact N-O 3.5Å; S62-V86 WeakPolarHBondContact OG-CG1 3.28Å; S62-V86 PolarHBondContact OG-O 3.47Å; K63-V86 HydrophobicContact CB-CB 3.77Å; K63-V86 HydrophobicContact CB-CG2 3.73Å; K63-V86 HydrophobicContact CD-CG2 4.21Å; K63-V86 HydrophobicContact CG-CG2 4.49Å; K63-V86 PolarHBondContact N-O 3.03Å; K63-V86 PolarHBondContact O-N 2.88Å; V86-K105 HydrophobicContact CG1-CB 4.4Å; V86-K105 HydrophobicContact CG1-CD 4.09Å; V86-K105 HydrophobicContact CG1-CG 4.49Å; V86-E107 HydrophobicContact CG1-CG 4.16Å; V86-E107 HydrophobicContact CG2-CG 4.11Å
87	I	97.4	Very high	89.5	Confident	1 Å²	1	48 Å²	48	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	121.1	-172	-56	167.9	0	0	0	108.6	L44 V58 I85 K105 V106 I148	L44-I87 HydrophobicContact CD1-CD1 3.92Å; V58-I87 HydrophobicContact CB-CG2 4.42Å; V58-I87 HydrophobicContact CG1-CG2 3.52Å; V58-I87 HydrophobicContact CG2-CG2 4.14Å; I85-I87 HydrophobicContact CG2-CD1 4.18Å; I85-I87 HydrophobicContact CG2-CG1 3.78Å; I87-K105 CarbonylContact O-C 3.55Å; I87-K105 VanDerWaalsContact O-CA 3.26Å; I87-K105 WeakPolarHBondContact O-CA 3.32Å; I87-V106 HydrophobicContact CB-CB 4.38Å; I87-V106 PolarHBondContact N-O 3.29Å; I87-V106 PolarHBondContact O-N 3.4Å; I87-I148 HydrophobicContact CD1-CD1 3.98Å; I87-I148 HydrophobicContact CD1-CG1 4.24Å; I87-I148 HydrophobicContact CD1-CG2 3.55Å
88	D	97	Very high	89	Confident	28 Å²	28	51.3 Å²	51.3	15%	0.15	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	136.5	177.8	-66.2	15.1	0	0	0	109	T59 E60 S62 K105	T59-D88 PolarHBondContact N-O 3.36Å; T59-D88 VanDerWaalsContact OG1-C 3.28Å; T59-D88 WeakPolarHBondContact OG1-CB 3.48Å; T59-D88 PolarHBondContact OG1-O 2.89Å; E60-D88 HydrophobicContact CB-CB 4.36Å; E60-D88 PolarHBondContact N-O 2.76Å; E60-D88 PolarHBondContact O-N 2.7Å; S62-D88 WeakPolarHBondContact CB-OD1 3.41Å; S62-D88 PolarHBondContact OG-OD1 3.1Å; D88-K105 IonicContact OD1-NZ 2.84Å; D88-K105 PolarHBondContact OD1-NZ 2.91Å; D88-K105 IonicContact OD2-NZ 2.85Å; D88-K105 PolarHBondContact OD2-NZ 3Å
89	W	96.6	Very high	88.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	151	-178.4	63.8	-94.6	0	0	0	112	K57 I102 V103 G104 W126 V136 M140	K57-W89 VanDerWaalsContact O-CA 3.29Å; K57-W89 WeakPolarHBondContact O-CA 3.43Å; W89-I102 HydrophobicContact CH2-CG2 3.85Å; W89-I102 HydrophobicContact CZ3-CB 4.35Å; W89-I102 HydrophobicContact CZ3-CG2 3.96Å; W89-V103 WeakPolarHBondContact O-CA 3.38Å; W89-G104 PolarHBondContact N-O 3.07Å; W89-G104 PolarHBondContact O-N 3.45Å; W89-W126 HydrophobicContact CH2-CB 3.89Å; W89-W126 HydrophobicContact CH2-CG 4.48Å; W89-W126 HydrophobicContact CZ2-CB 3.7Å; W89-W126 HydrophobicContact CZ2-CE3 4.34Å; W89-W126 HydrophobicContact CZ2-CG 4.4Å; W89-V136 HydrophobicContact CH2-CG1 4.31Å; W89-V136 HydrophobicContact CZ3-CG1 3.91Å; W89-M140 HydrophobicContact CB-CE 3.88Å; W89-M140 HydrophobicContact CD2-CB 4.36Å; W89-M140 HydrophobicContact CD2-CE 3.89Å; W89-M140 HydrophobicContact CD2-CG 3.77Å; W89-M140 HydrophobicContact CD2-SD 4.41Å; W89-M140 HydrophobicContact CE3-CG 3.7Å; W89-M140 HydrophobicContact CE3-SD 4.49Å; W89-M140 HydrophobicContact CG-CE 3.6Å; W89-M140 HydrophobicContact CG-CG 4.49Å; W89-M140 HydrophobicContact CH2-CB 4.08Å; W89-M140 HydrophobicContact CH2-CG 3.84Å; W89-M140 HydrophobicContact CZ2-CB 3.75Å; W89-M140 HydrophobicContact CZ2-CG 3.87Å; W89-M140 HydrophobicContact CZ3-CB 4.5Å; W89-M140 HydrophobicContact CZ3-CG 3.76Å
90	E	94.9	Very high	88	Confident	50 Å²	50	57.1 Å²	57.1	23%	0.234	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	145.4	169.2	70.8	179.4	-174.5	0	0	110.4	C56 K57 T59 K101 I102 V103	C56-E90 CarbonylContact C-O 3.45Å; C56-E90 VanDerWaalsContact CA-O 3.28Å; C56-E90 WeakPolarHBondContact CA-O 3.48Å; K57-E90 HydrophobicContact CB-CG 4.37Å; K57-E90 PolarHBondContact N-O 2.87Å; K57-E90 PolarHBondContact O-N 2.81Å; T59-E90 HydrophobicContact CG2-CB 4Å; T59-E90 HydrophobicContact CG2-CG 3.59Å; E90-K101 IonicContact OE1-NZ 3.27Å; E90-K101 PolarHBondContact OE1-NZ 2.98Å; E90-K101 WeakPolarHBondContact OE2-CD 3.49Å; E90-K101 IonicContact OE2-NZ 2.75Å; E90-K101 PolarHBondContact OE2-NZ 3.43Å; E90-I102 CarbonylContact C-O 3.44Å; E90-I102 WeakPolarHBondContact CA-O 3.41Å; E90-V103 HydrophobicContact CB-CG2 4.49Å
91	G	94.2	Very high	88	Confident	2 Å²	2	59 Å²	59	2%	0.021	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	157.1	-179	0	0	0	0	0	113.8	A55 I102	A55-G91 CarbonylContact O-C 3.45Å; A55-G91 VanDerWaalsContact O-CA 3.27Å; A55-G91 WeakPolarHBondContact O-CA 3.47Å; G91-I102 PolarHBondContact N-O 2.9Å; G91-I102 PolarHBondContact O-N 3.36Å
92	I	92.1	Very high	88	Confident	45 Å²	45	59 Å²	59	23%	0.231	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	156.1	177.1	62.3	170.9	0	0	0	110.9	Y54 A55 K101	Y54-I92 WeakPolarHBondContact CA-O 3.16Å; A55-I92 HydrophobicContact CB-CG1 4.02Å; A55-I92 PolarHBondContact N-O 2.69Å; A55-I92 PolarHBondContact O-N 2.79Å; I92-K101 HydrophobicContact CG2-CG 4.19Å
93	I	90.6	Very high	88.1	Confident	19 Å²	19	57.6 Å²	57.6	10%	0.097	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	124.2	164.2	-55.2	-174.4	0	0	0	108.3	L53 Y54 S95 S96 D132 V136	L53-I93 CarbonylContact O-C 3.53Å; Y54-I93 HydrophobicContact CD1-CG1 4.02Å; Y54-I93 HydrophobicContact CE1-CD1 4.35Å; Y54-I93 HydrophobicContact CE1-CG1 4.08Å; I93-S95 VanDerWaalsContact C-N 3.26Å; I93-S95 WeakPolarHBondContact CG2-OG 3.2Å; I93-S95 PolarHBondContact O-N 3.28Å; I93-S96 PolarHBondContact O-N 3.31Å; I93-D132 HydrophobicContact CD1-CB 3.5Å; I93-V136 HydrophobicContact CD1-CG2 4.34Å; I93-V136 HydrophobicContact CG1-CG2 3.57Å
94	K	88.8	Confident	88.2	Confident	91 Å²	91	57.8 Å²	57.8	40%	0.396	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-32.2	-175.4	-70.7	-176.9	172.1	-177.1	0	113.1	E50 N51 L53 Y54 A55	E50-K94 WeakPolarHBondContact OE2-CE 3.35Å; E50-K94 IonicContact OE2-NZ 2.7Å; E50-K94 PolarHBondContact OE2-NZ 2.8Å; N51-K94 VanDerWaalsContact O-CE 3.3Å; N51-K94 WeakPolarHBondContact O-CE 3.15Å; N51-K94 PolarHBondContact O-NZ 2.99Å; L53-K94 WeakPolarHBondContact O-CB 3.31Å; L53-K94 PolarHBondContact O-N 3.32Å; Y54-K94 WeakPolarHBondContact O-CE 3.42Å; A55-K94 HydrophobicContact CB-CG 4.19Å
95	S	80.9	Confident	88.4	Confident	98 Å²	98	57.5 Å²	57.5	69%	0.685	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.6	-177.5	59.2	0	0	0	0	114.7	I93	I93-S95 VanDerWaalsContact C-N 3.26Å; I93-S95 WeakPolarHBondContact CG2-OG 3.2Å; I93-S95 PolarHBondContact O-N 3.28Å
96	S	78.4	Confident	88.4	Confident	29 Å²	29	57.5 Å²	57.5	20%	0.203	30%	0.3	C	S	.	.			trans	-77.2	130.7	-179	-174.6	0	0	0	0	110.7	I93 D98	I93-S96 PolarHBondContact O-N 3.31Å; S96-D98 WeakPolarHBondContact CB-O 3.49Å; S96-D98 PolarHBondContact OG-N 3.46Å; S96-D98 PolarHBondContact OG-O 3.15Å
97	E	68.4	Low	88.4	Confident	202 Å²	202	60 Å²	60	94%	0.944	31%	0.311	S	S	*	.	S	Bend	trans	-64.3	-35.3	170.3	-69.9	-173.8	169.2	0	0	110.9	K99	E97-K99 PolarHBondContact O-N 3.37Å
98	D	69	Low	88.2	Confident	123 Å²	123	60 Å²	60	66%	0.658	31%	0.311	S	S	*	.	S	Bend	trans	-90.4	100.7	172.3	-162.1	-6.4	0	0	0	109.3	S96 A100	S96-D98 WeakPolarHBondContact CB-O 3.49Å; S96-D98 PolarHBondContact OG-N 3.46Å; S96-D98 PolarHBondContact OG-O 3.15Å; D98-A100 PolarHBondContact O-N 2.87Å
99	K	73	Confident	87.8	Confident	144 Å²	144	63 Å²	63	63%	0.626	33%	0.326	S	S	*	.			trans	-78.1	44.9	178.8	-63.9	-178.8	-178.3	176	0	111.3	E97 K101	E97-K99 PolarHBondContact O-N 3.37Å; K99-K101 PolarHBondContact O-N 3.42Å
100	A	78.7	Confident	87.3	Confident	55 Å²	55	65.3 Å²	65.3	46%	0.455	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-54.3	125.7	173.5	0	0	0	0	0	108.6	D98 I102	D98-A100 PolarHBondContact O-N 2.87Å; A100-I102 WeakPolarHBondContact O-CD1 3.48Å
101	K	88.3	Confident	87	Confident	131 Å²	131	63 Å²	63	57%	0.57	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-84.3	122.3	-179.9	-71	-177.8	166.4	-156.9	0	109.3	E90 I92 K99	E90-K101 IonicContact OE1-NZ 3.27Å; E90-K101 PolarHBondContact OE1-NZ 2.98Å; E90-K101 WeakPolarHBondContact OE2-CD 3.49Å; E90-K101 IonicContact OE2-NZ 2.75Å; E90-K101 PolarHBondContact OE2-NZ 3.43Å; I92-K101 HydrophobicContact CG2-CG 4.19Å; K99-K101 PolarHBondContact O-N 3.42Å
102	I	91	Very high	86.7	Confident	15 Å²	15	64.2 Å²	64.2	8%	0.077	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129.9	170.7	-60.5	57.1	0	0	0	106.3	W89 E90 G91 A100 W126 V136	W89-I102 HydrophobicContact CH2-CG2 3.85Å; W89-I102 HydrophobicContact CZ3-CB 4.35Å; W89-I102 HydrophobicContact CZ3-CG2 3.96Å; E90-I102 CarbonylContact C-O 3.44Å; E90-I102 WeakPolarHBondContact CA-O 3.41Å; G91-I102 PolarHBondContact N-O 2.9Å; G91-I102 PolarHBondContact O-N 3.36Å; A100-I102 WeakPolarHBondContact O-CD1 3.48Å; I102-W126 HydrophobicContact CG2-CB 4.31Å; I102-V136 HydrophobicContact CB-CB 4.47Å; I102-V136 HydrophobicContact CB-CG1 4.2Å; I102-V136 HydrophobicContact CD1-CG2 4.32Å; I102-V136 HydrophobicContact CG1-CB 4.16Å; I102-V136 HydrophobicContact CG1-CG1 4.36Å; I102-V136 HydrophobicContact CG1-CG2 4.33Å; I102-V136 HydrophobicContact CG2-CG1 4.5Å
103	V	94	Very high	86.2	Confident	80 Å²	80	64.8 Å²	64.8	49%	0.485	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	139	178.1	-177.1	0	0	0	0	109.1	W89 E90 N127	W89-V103 WeakPolarHBondContact O-CA 3.38Å; E90-V103 HydrophobicContact CB-CG2 4.49Å; V103-N127 PolarHBondContact O-N 2.69Å
104	G	95	Very high	85.5	Confident	6 Å²	6	70.5 Å²	70.5	6%	0.062	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	-176.8	178.3	0	0	0	0	0	113.4	W89 S125	W89-G104 PolarHBondContact N-O 3.07Å; W89-G104 PolarHBondContact O-N 3.45Å; G104-S125 CarbonylContact C-O 3.59Å; G104-S125 WeakPolarHBondContact CA-O 3.39Å
105	K	96.8	Very high	84.7	Confident	73 Å²	73	71.8 Å²	71.8	32%	0.317	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	145.1	178.5	-64.9	-178.4	178.3	-77.4	0	110.7	S62 V86 I87 D88 T124 S125	S62-K105 PolarHBondContact OG-NZ 3.23Å; V86-K105 HydrophobicContact CG1-CB 4.4Å; V86-K105 HydrophobicContact CG1-CD 4.09Å; V86-K105 HydrophobicContact CG1-CG 4.49Å; I87-K105 CarbonylContact O-C 3.55Å; I87-K105 VanDerWaalsContact O-CA 3.26Å; I87-K105 WeakPolarHBondContact O-CA 3.32Å; D88-K105 IonicContact OD1-NZ 2.84Å; D88-K105 PolarHBondContact OD1-NZ 2.91Å; D88-K105 IonicContact OD2-NZ 2.85Å; D88-K105 PolarHBondContact OD2-NZ 3Å; K105-T124 WeakPolarHBondContact O-CA 3.35Å; K105-S125 PolarHBondContact N-O 2.68Å; K105-S125 PolarHBondContact O-N 2.89Å
106	V	96.1	Very high	84.2	Confident	0 Å²	0	69 Å²	69	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.2	165	177.3	0	0	0	0	107.3	I87 N123 T124 M140 V145 I148	I87-V106 HydrophobicContact CB-CB 4.38Å; I87-V106 PolarHBondContact N-O 3.29Å; I87-V106 PolarHBondContact O-N 3.4Å; V106-N123 CarbonylContact C-O 3.48Å; V106-N123 WeakPolarHBondContact CA-O 3.45Å; V106-T124 HydrophobicContact CG2-CG2 3.86Å; V106-M140 HydrophobicContact CG2-CE 4.33Å; V106-V145 HydrophobicContact CG1-CG2 4.26Å; V106-I148 HydrophobicContact CB-CD1 3.95Å; V106-I148 HydrophobicContact CG1-CD1 3.83Å; V106-I148 HydrophobicContact CG2-CD1 3.93Å
107	E	95.5	Very high	84.2	Confident	67 Å²	67	67.9 Å²	67.9	31%	0.313	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	119.4	178.3	-57.4	174.7	-174.8	0	0	108.3	I85 V86 T122 N123	I85-E107 CarbonylContact O-C 3.58Å; I85-E107 WeakPolarHBondContact O-CA 3.49Å; V86-E107 HydrophobicContact CG1-CG 4.16Å; V86-E107 HydrophobicContact CG2-CG 4.11Å; E107-T122 CarbonylContact O-C 3.59Å; E107-T122 WeakPolarHBondContact O-CA 3.19Å; E107-N123 HydrophobicContact CB-CB 4.29Å; E107-N123 PolarHBondContact N-O 2.8Å; E107-N123 PolarHBondContact O-N 3.31Å
108	V	93	Very high	84.6	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.006	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	103.8	166.9	-175.9	0	0	0	0	106.1	I85 L111 C120 T122 I148 L152	I85-V108 HydrophobicContact CB-CB 4.04Å; I85-V108 HydrophobicContact CB-CG2 4.33Å; I85-V108 HydrophobicContact CG1-CB 4.36Å; I85-V108 PolarHBondContact N-O 2.95Å; I85-V108 PolarHBondContact O-N 2.98Å; V108-L111 HydrophobicContact CG1-CB 4.12Å; V108-C120 HydrophobicContact CG1-CB 4.16Å; V108-T122 HydrophobicContact CG2-CG2 4.24Å; V108-I148 HydrophobicContact CG2-CG2 4.46Å; V108-L152 HydrophobicContact CG1-CD1 4.45Å; V108-L152 HydrophobicContact CG2-CD1 4.11Å
109	I	89.2	Confident	84.9	Confident	92 Å²	92	64.3 Å²	64.3	47%	0.472	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-44.9	-167.1	-62.9	171.2	0	0	0	110.8	D121	I109-D121 HydrophobicContact CB-CB 4.36Å; I109-D121 HydrophobicContact CD1-CB 4.05Å; I109-D121 PolarHBondContact N-O 3.48Å
110	S	84.9	Confident	85.2	Confident	48 Å²	48	57.7 Å²	57.7	34%	0.336	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	112.7	180	-175.6	0	0	0	0	109.8	I112 C120	S110-I112 WeakPolarHBondContact OG-CG2 3.4Å; S110-C120 WeakPolarHBondContact O-CB 3.39Å
111	L	89.2	Confident	85.5	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	103.1	168.1	173.7	65.7	0	0	0	108	Y81 E82 W83 I85 V108 V117 L152 I156	Y81-L111 HydrophobicContact CD2-CG 4.22Å; Y81-L111 HydrophobicContact CE2-CD1 4.1Å; Y81-L111 HydrophobicContact CE2-CG 3.92Å; E82-L111 CarbonylContact C-O 3.56Å; E82-L111 VanDerWaalsContact CA-O 3.3Å; E82-L111 WeakPolarHBondContact CA-O 3.4Å; W83-L111 HydrophobicContact CB-CB 4.28Å; W83-L111 PolarHBondContact N-O 3.4Å; W83-L111 PolarHBondContact O-N 2.95Å; I85-L111 HydrophobicContact CD1-CD2 4.49Å; V108-L111 HydrophobicContact CG1-CB 4.12Å; L111-V117 HydrophobicContact CD1-CB 4.5Å; L111-V117 HydrophobicContact CD1-CG2 4.04Å; L111-L152 HydrophobicContact CD2-CB 4.34Å; L111-L152 HydrophobicContact CD2-CD1 4.29Å; L111-L152 HydrophobicContact CD2-CD2 4.19Å; L111-I156 HydrophobicContact CD1-CD1 4.38Å
112	I	88	Confident	85.6	Confident	29 Å²	29	56.6 Å²	56.6	15%	0.149	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	157.4	-179.1	66.1	173.5	0	0	0	112.1	Y81 E82 S110 E114 Y115	Y81-I112 VanDerWaalsContact CE2-C 3.49Å; Y81-I112 CarbonylContact O-C 3.58Å; Y81-I112 VanDerWaalsContact O-CA 3.25Å; Y81-I112 WeakPolarHBondContact O-CA 3.39Å; E82-I112 HydrophobicContact CB-CG2 3.97Å; E82-I112 HydrophobicContact CG-CG2 3.76Å; S110-I112 WeakPolarHBondContact OG-CG2 3.4Å; I112-E114 VanDerWaalsContact C-N 3.29Å; I112-E114 HydrophobicContact CD1-CB 4.16Å; I112-E114 HydrophobicContact CG1-CB 4.37Å; I112-E114 PolarHBondContact O-N 3.07Å; I112-Y115 HydrophobicContact CD1-CD2 3.42Å; I112-Y115 VanDerWaalsContact CD1-CD2 3.42Å; I112-Y115 HydrophobicContact CD1-CE2 3.61Å; I112-Y115 HydrophobicContact CG1-CD2 3.54Å; I112-Y115 HydrophobicContact CG1-CE2 4.26Å; I112-Y115 HydrophobicContact CG1-CG 4.33Å; I112-Y115 CarbonylContact O-C 3.48Å; I112-Y115 PolarHBondContact O-N 3.13Å
113	D	82.5	Confident	85.6	Confident	56 Å²	56	59.6 Å²	59.6	30%	0.299	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.3	-177.1	68.7	-63.2	0	0	0	114.4	F80 Y81 Y115	F80-D113 WeakPolarHBondContact CD1-OD2 3.43Å; Y81-D113 HydrophobicContact CD1-CB 3.9Å; Y81-D113 HydrophobicContact CE1-CB 3.67Å; Y81-D113 HydrophobicContact CE2-CB 4.48Å; Y81-D113 HydrophobicContact CG-CB 4.39Å; Y81-D113 VanDerWaalsContact CZ-CA 3.49Å; Y81-D113 PolarHBondContact O-N 3.26Å; Y81-D113 VanDerWaalsContact O-N 3.12Å; D113-Y115 PolarHBondContact O-N 3.07Å
114	E	74	Confident	85.6	Confident	140 Å²	140	56.3 Å²	56.3	65%	0.654	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-24.9	176.9	-62.3	-165.7	163.7	0	0	113.1	I112	I112-E114 VanDerWaalsContact C-N 3.29Å; I112-E114 HydrophobicContact CD1-CB 4.16Å; I112-E114 HydrophobicContact CG1-CB 4.37Å; I112-E114 PolarHBondContact O-N 3.07Å
115	Y	72.1	Confident	85.5	Confident	117 Å²	117	58.3 Å²	58.3	46%	0.459	31%	0.307	S	S	.	.	S	Bend	trans	-126.2	108.4	-176.9	-56.9	-57.3	0	0	0	110	I112 D113 K119	I112-Y115 HydrophobicContact CD1-CD2 3.42Å; I112-Y115 VanDerWaalsContact CD1-CD2 3.42Å; I112-Y115 HydrophobicContact CD1-CE2 3.61Å; I112-Y115 HydrophobicContact CG1-CD2 3.54Å; I112-Y115 HydrophobicContact CG1-CE2 4.26Å; I112-Y115 HydrophobicContact CG1-CG 4.33Å; I112-Y115 CarbonylContact O-C 3.48Å; I112-Y115 PolarHBondContact O-N 3.13Å; D113-Y115 PolarHBondContact O-N 3.07Å; Y115-K119 HydrophobicContact CD1-CD 3.91Å; Y115-K119 HydrophobicContact CG-CD 4.44Å
116	G	71.2	Confident	85.3	Confident	41 Å²	41	58 Å²	58	42%	0.423	31%	0.305	S	S	.	.			trans	-53.3	157.3	173.6	0	0	0	0	0	112.5	N118 K119	G116-N118 PolarHBondContact O-N 3.04Å; G116-K119 PolarHBondContact O-N 3.41Å
117	V	78.9	Confident	84.9	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.024	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-50.4	-28.9	-171.6	-167.9	0	0	0	0	114	L111 K119 C120 K149 L152 D153 I156	L111-V117 HydrophobicContact CD1-CB 4.5Å; L111-V117 HydrophobicContact CD1-CG2 4.04Å; V117-K119 PolarHBondContact O-N 3.33Å; V117-C120 PolarHBondContact O-N 2.89Å; V117-C120 VanDerWaalsContact O-N 3.1Å; V117-C120 PolarHBondContact O-SG 3.02Å; V117-K149 HydrophobicContact CG1-CB 3.69Å; V117-K149 HydrophobicContact CG1-CD 4.43Å; V117-K149 HydrophobicContact CG1-CG 3.85Å; V117-L152 HydrophobicContact CG1-CB 4.04Å; V117-L152 HydrophobicContact CG2-CB 4.35Å; V117-D153 HydrophobicContact CG2-CB 4.1Å; V117-I156 HydrophobicContact CG2-CD1 3.27Å
118	N	76	Confident	84.1	Confident	147 Å²	147	63.3 Å²	63.3	79%	0.786	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-61	-25.8	178	-64.5	-29.7	0	0	0	113.5	G116	G116-N118 PolarHBondContact O-N 3.04Å
119	K	76.3	Confident	83.3	Confident	103 Å²	103	69.7 Å²	69.7	45%	0.448	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-95.8	-1.6	178.4	-70.6	-175.9	177.6	-179.8	0	113.9	Y115 G116 V117 D121	Y115-K119 HydrophobicContact CD1-CD 3.91Å; Y115-K119 HydrophobicContact CG-CD 4.44Å; G116-K119 PolarHBondContact O-N 3.41Å; V117-K119 PolarHBondContact O-N 3.33Å; K119-D121 PolarHBondContact O-N 3.17Å
120	C	79.3	Confident	83	Confident	6 Å²	6	68 Å²	68	4%	0.041	38%	0.379	C	S	.	.			trans	-68.6	130.2	177.6	74.8	0	0	0	0	110.1	V108 S110 V117 K149	V108-C120 HydrophobicContact CG1-CB 4.16Å; S110-C120 WeakPolarHBondContact O-CB 3.39Å; V117-C120 PolarHBondContact O-N 2.89Å; V117-C120 VanDerWaalsContact O-N 3.1Å; V117-C120 PolarHBondContact O-SG 3.02Å; C120-K149 PolarHBondContact O-NZ 3.46Å; C120-K149 VanDerWaalsContact SG-CE 3.51Å
121	D	84.8	Confident	83	Confident	115 Å²	115	71 Å²	71	62%	0.615	40%	0.395	S	S	*	.			trans	-75.1	127.2	173.8	-72.3	-31.3	0	0	0	108.9	I109 K119	I109-D121 HydrophobicContact CB-CB 4.36Å; I109-D121 HydrophobicContact CD1-CB 4.05Å; I109-D121 PolarHBondContact N-O 3.48Å; K119-D121 PolarHBondContact O-N 3.17Å
122	T	89.8	Confident	82.8	Confident	47 Å²	47	74.6 Å²	74.6	29%	0.288	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	132.3	-179.1	57.8	0	0	0	0	110.9	E107 V108 V145	E107-T122 CarbonylContact O-C 3.59Å; E107-T122 WeakPolarHBondContact O-CA 3.19Å; V108-T122 HydrophobicContact CG2-CG2 4.24Å; T122-V145 HydrophobicContact CG2-CG1 4.12Å; T122-V145 WeakPolarHBondContact OG1-CG1 3.33Å
123	N	91.4	Very high	82.7	Confident	78 Å²	78	73.2 Å²	73.2	42%	0.417	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.2	171	-173.1	18.1	0	0	0	109.5	V106 E107	V106-N123 CarbonylContact C-O 3.48Å; V106-N123 WeakPolarHBondContact CA-O 3.45Å; E107-N123 HydrophobicContact CB-CB 4.29Å; E107-N123 PolarHBondContact N-O 2.8Å; E107-N123 PolarHBondContact O-N 3.31Å
124	T	93.2	Very high	83	Confident	11 Å²	11	74.3 Å²	74.3	7%	0.067	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.9	177.1	-51.5	0	0	0	0	108.6	K105 V106 W126 M140 K141 V145	K105-T124 WeakPolarHBondContact O-CA 3.35Å; V106-T124 HydrophobicContact CG2-CG2 3.86Å; T124-W126 HydrophobicContact CG2-CE3 3.96Å; T124-W126 HydrophobicContact CG2-CZ3 3.87Å; T124-M140 HydrophobicContact CG2-CB 4.5Å; T124-K141 HydrophobicContact CG2-CB 4.15Å; T124-V145 WeakPolarHBondContact OG1-CG2 3.37Å
125	S	93.3	Very high	83.9	Confident	48 Å²	48	71.2 Å²	71.2	34%	0.336	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151	179	63.8	0	0	0	0	110.2	G104 K105	G104-S125 CarbonylContact C-O 3.59Å; G104-S125 WeakPolarHBondContact CA-O 3.39Å; K105-S125 PolarHBondContact N-O 2.68Å; K105-S125 PolarHBondContact O-N 2.89Å
126	W	93.1	Very high	84.8	Confident	68 Å²	68	65.7 Å²	65.7	26%	0.258	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	156.4	175.5	54.3	93	0	0	0	109.8	W89 I102 T124 D134 G137 K141	W89-W126 HydrophobicContact CH2-CB 3.89Å; W89-W126 HydrophobicContact CH2-CG 4.48Å; W89-W126 HydrophobicContact CZ2-CB 3.7Å; W89-W126 HydrophobicContact CZ2-CE3 4.34Å; W89-W126 HydrophobicContact CZ2-CG 4.4Å; I102-W126 HydrophobicContact CG2-CB 4.31Å; T124-W126 HydrophobicContact CG2-CE3 3.96Å; T124-W126 HydrophobicContact CG2-CZ3 3.87Å; W126-D134 PolarHBondContact NE1-OD1 3.14Å; W126-G137 VanDerWaalsContact CD2-CA 3.47Å; W126-G137 WeakPolarHBondContact CZ3-O 3.02Å; W126-K141 HydrophobicContact CH2-CB 4.42Å; W126-K141 HydrophobicContact CH2-CD 4.23Å; W126-K141 HydrophobicContact CZ3-CB 4.16Å; W126-K141 HydrophobicContact CZ3-CD 4.35Å
127	N	86.7	Confident	85.8	Confident	144 Å²	144	63.7 Å²	63.7	77%	0.77	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	111.9	172.5	-168	5.3	0	0	0	109	V103	V103-N127 PolarHBondContact O-N 2.69Å
128	S	79.6	Confident	86.4	Confident	34 Å²	34	66.6 Å²	66.6	24%	0.238	38%	0.379	C	S	.	.			trans	-141.7	143.5	171.4	-174	0	0	0	0	110.6	S130 G133	S128-S130 PolarHBondContact OG-N 3.23Å; S128-S130 PolarHBondContact OG-O 2.95Å; S128-S130 PolarHBondContact OG-OG 2.93Å; S128-G133 VanDerWaalsContact OG-CA 3.23Å; S128-G133 WeakPolarHBondContact OG-CA 3.24Å
129	S	76.4	Confident	87.3	Confident	135 Å²	135	60.1 Å²	60.1	94%	0.944	34%	0.344	S	S	*	.	S	Bend	trans	-114.1	4.1	164.8	52.8	0	0	0	0	112
130	S	82.5	Confident	88.2	Confident	57 Å²	57	55.2 Å²	55.2	40%	0.399	32%	0.322	S	S	.	.	S	Bend	trans	-118.9	150.4	-178	69	0	0	0	0	111.8	S128 D132 G133 D134	S128-S130 PolarHBondContact OG-N 3.23Å; S128-S130 PolarHBondContact OG-O 2.95Å; S128-S130 PolarHBondContact OG-OG 2.93Å; S130-D132 PolarHBondContact O-N 2.96Å; S130-G133 PolarHBondContact O-N 3.02Å; S130-G133 VanDerWaalsContact O-N 3.13Å; S130-G133 PolarHBondContact OG-N 3.06Å; S130-D134 PolarHBondContact O-N 2.84Å
131	T	84.6	Confident	88.9	Confident	109 Å²	109	61.1 Å²	61.1	67%	0.669	35%	0.348	S	S	*	.	H	α-helix	trans	-57.6	-37.4	172.8	-51.4	0	0	0	0	111.5	G133 D134 L135	T131-G133 VanDerWaalsContact C-N 3.32Å; T131-G133 PolarHBondContact O-N 2.98Å; T131-D134 PolarHBondContact O-N 2.69Å; T131-L135 WeakPolarHBondContact O-CG 3.44Å; T131-L135 PolarHBondContact O-N 3.12Å; T131-L135 VanDerWaalsContact O-N 3.12Å
132	D	84.7	Confident	89.3	Confident	78 Å²	78	58.5 Å²	58.5	42%	0.417	34%	0.338	S	S	.	.	H	α-helix	trans	-59.9	-41.6	176.8	-74.9	1.8	0	0	0	112	I93 S130 L135 V136	I93-D132 HydrophobicContact CD1-CB 3.5Å; S130-D132 PolarHBondContact O-N 2.96Å; D132-L135 PolarHBondContact O-N 3.29Å; D132-V136 WeakPolarHBondContact O-CG2 3.46Å; D132-V136 PolarHBondContact O-N 3.34Å
133	G	86.9	Confident	89.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-71.2	-30.1	178.1	0	0	0	0	0	113.7	S128 S130 T131 L135 V136 G137	S128-G133 VanDerWaalsContact OG-CA 3.23Å; S128-G133 WeakPolarHBondContact OG-CA 3.24Å; S130-G133 PolarHBondContact O-N 3.02Å; S130-G133 VanDerWaalsContact O-N 3.13Å; S130-G133 PolarHBondContact OG-N 3.06Å; T131-G133 VanDerWaalsContact C-N 3.32Å; T131-G133 PolarHBondContact O-N 2.98Å; G133-L135 VanDerWaalsContact C-N 3.34Å; G133-V136 PolarHBondContact O-N 3.03Å; G133-G137 PolarHBondContact O-N 3.47Å
134	D	89.3	Confident	89.6	Confident	78 Å²	78	55.9 Å²	55.9	42%	0.417	33%	0.325	S	S	.	.	H	α-helix	trans	-69	-33	173.9	-70.3	-26.5	0	0	0	112.6	W126 S130 T131 S138	W126-D134 PolarHBondContact NE1-OD1 3.14Å; S130-D134 PolarHBondContact O-N 2.84Å; T131-D134 PolarHBondContact O-N 2.69Å; D134-S138 VanDerWaalsContact O-CB 3.29Å; D134-S138 WeakPolarHBondContact O-CB 3.47Å; D134-S138 PolarHBondContact O-N 3.49Å; D134-S138 PolarHBondContact O-OG 2.89Å
135	L	91.1	Very high	89.6	Confident	76 Å²	76	55.7 Å²	55.7	40%	0.398	32%	0.324	S	S	.	.	H	α-helix	trans	-65.8	-46.4	173.3	-69.1	173.8	0	0	0	111.5	Y54 T131 D132 G133 S138 F139	Y54-L135 HydrophobicContact CE1-CB 4.18Å; T131-L135 WeakPolarHBondContact O-CG 3.44Å; T131-L135 PolarHBondContact O-N 3.12Å; T131-L135 VanDerWaalsContact O-N 3.12Å; D132-L135 PolarHBondContact O-N 3.29Å; G133-L135 VanDerWaalsContact C-N 3.34Å; L135-S138 PolarHBondContact O-N 3.15Å; L135-F139 PolarHBondContact O-N 3.46Å
136	V	91.9	Very high	89.6	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.7	-43	176.5	177.7	0	0	0	0	110.9	Y54 W89 I93 I102 D132 G133 S138 F139 M140	Y54-V136 HydrophobicContact CD1-CG2 4.03Å; W89-V136 HydrophobicContact CH2-CG1 4.31Å; W89-V136 HydrophobicContact CZ3-CG1 3.91Å; I93-V136 HydrophobicContact CD1-CG2 4.34Å; I93-V136 HydrophobicContact CG1-CG2 3.57Å; I102-V136 HydrophobicContact CB-CB 4.47Å; I102-V136 HydrophobicContact CB-CG1 4.2Å; I102-V136 HydrophobicContact CD1-CG2 4.32Å; I102-V136 HydrophobicContact CG1-CB 4.16Å; I102-V136 HydrophobicContact CG1-CG1 4.36Å; I102-V136 HydrophobicContact CG1-CG2 4.33Å; I102-V136 HydrophobicContact CG2-CG1 4.5Å; D132-V136 WeakPolarHBondContact O-CG2 3.46Å; D132-V136 PolarHBondContact O-N 3.34Å; G133-V136 PolarHBondContact O-N 3.03Å; V136-S138 PolarHBondContact O-N 3.42Å; V136-F139 WeakPolarHBondContact O-CB 3.49Å; V136-F139 PolarHBondContact O-N 2.77Å; V136-M140 PolarHBondContact O-N 3.27Å
137	G	92.4	Very high	89.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-42	175.7	0	0	0	0	0	113.1	W126 G133 F139 M140 K141	W126-G137 VanDerWaalsContact CD2-CA 3.47Å; W126-G137 WeakPolarHBondContact CZ3-O 3.02Å; G133-G137 PolarHBondContact O-N 3.47Å; G137-F139 PolarHBondContact O-N 3.29Å; G137-M140 PolarHBondContact O-N 3.32Å; G137-K141 WeakPolarHBondContact O-CB 3.24Å; G137-K141 PolarHBondContact O-N 3.46Å
138	S	92.2	Very high	90.1	Very high	64 Å²	64	51.4 Å²	51.4	45%	0.448	30%	0.299	S	S	.	.	H	α-helix	trans	-64.6	-38.6	175.6	-61.6	0	0	0	0	112.5	D134 L135 V136 K141 S142	D134-S138 VanDerWaalsContact O-CB 3.29Å; D134-S138 WeakPolarHBondContact O-CB 3.47Å; D134-S138 PolarHBondContact O-N 3.49Å; D134-S138 PolarHBondContact O-OG 2.89Å; L135-S138 PolarHBondContact O-N 3.15Å; V136-S138 PolarHBondContact O-N 3.42Å; S138-K141 PolarHBondContact O-N 3.1Å; S138-S142 PolarHBondContact O-N 2.73Å; S138-S142 PolarHBondContact O-OG 3.04Å
139	F	94.1	Very high	90.8	Very high	11 Å²	11	51.2 Å²	51.2	5%	0.048	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-43.9	171.8	170	-103.4	0	0	0	111.9	I49 N51 Y54 C56 L135 V136 G137 S142 T143 G144	I49-F139 HydrophobicContact CG2-CE1 3.94Å; I49-F139 HydrophobicContact CG2-CZ 3.95Å; N51-F139 HydrophobicContact CB-CE2 4.11Å; N51-F139 HydrophobicContact CB-CZ 4.44Å; N51-F139 WeakPolarHBondContact ND2-CE2 3.16Å; Y54-F139 HydrophobicContact CD2-CB 3.75Å; Y54-F139 HydrophobicContact CD2-CD1 4.31Å; Y54-F139 AromaticContact CD2-CD2 3.81Å; Y54-F139 HydrophobicContact CD2-CD2 3.81Å; Y54-F139 AromaticContact CD2-CG 3.68Å; Y54-F139 HydrophobicContact CD2-CG 3.68Å; Y54-F139 HydrophobicContact CE2-CB 4.21Å; Y54-F139 HydrophobicContact CG-CB 4.3Å; Y54-F139 HydrophobicContact CG-CD1 4.4Å; Y54-F139 HydrophobicContact CG-CG 4.2Å; C56-F139 HydrophobicContact CB-CE1 4.38Å; L135-F139 PolarHBondContact O-N 3.46Å; V136-F139 WeakPolarHBondContact O-CB 3.49Å; V136-F139 PolarHBondContact O-N 2.77Å; G137-F139 PolarHBondContact O-N 3.29Å; F139-S142 PolarHBondContact O-N 3.14Å; F139-S142 PolarHBondContact O-OG 3Å; F139-T143 HydrophobicContact CE2-CG2 3.79Å; F139-T143 HydrophobicContact CZ-CG2 4.09Å; F139-T143 PolarHBondContact O-N 3.47Å; F139-G144 PolarHBondContact O-N 3.38Å
140	M	95.1	Very high	91.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.275	C	S	.	.	I	π-helix	trans	-65.6	-40.4	175.8	-81.6	-60.7	-62.3	0	0	112.9	I49 C56 W89 V106 T124 V136 G137 S142 G144 V145	I49-M140 HydrophobicContact CD1-CE 4.1Å; I49-M140 HydrophobicContact CD1-SD 4.13Å; C56-M140 HydrophobicContact CB-CG 4.08Å; C56-M140 HydrophobicContact CB-SD 3.4Å; C56-M140 WeakPolarHBondContact CB-SD 3.3Å; W89-M140 HydrophobicContact CB-CE 3.88Å; W89-M140 HydrophobicContact CD2-CB 4.36Å; W89-M140 HydrophobicContact CD2-CE 3.89Å; W89-M140 HydrophobicContact CD2-CG 3.77Å; W89-M140 HydrophobicContact CD2-SD 4.41Å; W89-M140 HydrophobicContact CE3-CG 3.7Å; W89-M140 HydrophobicContact CE3-SD 4.49Å; W89-M140 HydrophobicContact CG-CE 3.6Å; W89-M140 HydrophobicContact CG-CG 4.49Å; W89-M140 HydrophobicContact CH2-CB 4.08Å; W89-M140 HydrophobicContact CH2-CG 3.84Å; W89-M140 HydrophobicContact CZ2-CB 3.75Å; W89-M140 HydrophobicContact CZ2-CG 3.87Å; W89-M140 HydrophobicContact CZ3-CB 4.5Å; W89-M140 HydrophobicContact CZ3-CG 3.76Å; V106-M140 HydrophobicContact CG2-CE 4.33Å; T124-M140 HydrophobicContact CG2-CB 4.5Å; V136-M140 PolarHBondContact O-N 3.27Å; G137-M140 PolarHBondContact O-N 3.32Å; M140-S142 PolarHBondContact O-N 3.23Å; M140-G144 CarbonylContact O-C 3.57Å; M140-G144 WeakPolarHBondContact O-CA 3.37Å; M140-G144 PolarHBondContact O-N 2.89Å; M140-V145 PolarHBondContact O-N 3.4Å
141	K	93.9	Very high	92.3	Very high	131 Å²	131	48.2 Å²	48.2	57%	0.57	27%	0.267	S	S	*	.	I	π-helix	trans	-63.6	-26.4	178.1	-175.1	172.5	179.6	175.5	0	113.5	T124 W126 G137 S138 V145	T124-K141 HydrophobicContact CG2-CB 4.15Å; W126-K141 HydrophobicContact CH2-CB 4.42Å; W126-K141 HydrophobicContact CH2-CD 4.23Å; W126-K141 HydrophobicContact CZ3-CB 4.16Å; W126-K141 HydrophobicContact CZ3-CD 4.35Å; G137-K141 WeakPolarHBondContact O-CB 3.24Å; G137-K141 PolarHBondContact O-N 3.46Å; S138-K141 PolarHBondContact O-N 3.1Å; K141-V145 WeakPolarHBondContact O-CG2 3.44Å
142	S	92.9	Very high	92.8	Very high	60 Å²	60	43.1 Å²	43.1	42%	0.42	24%	0.235	S	C	.	.	I	π-helix	trans	-98.2	-91.4	178.2	50.5	0	0	0	0	110.3	S138 F139 M140 G144 V145 D146	S138-S142 PolarHBondContact O-N 2.73Å; S138-S142 PolarHBondContact O-OG 3.04Å; F139-S142 PolarHBondContact O-N 3.14Å; F139-S142 PolarHBondContact O-OG 3Å; M140-S142 PolarHBondContact O-N 3.23Å; S142-G144 PolarHBondContact O-N 3.44Å; S142-V145 PolarHBondContact O-N 3.15Å; S142-V145 VanDerWaalsContact O-N 3.16Å; S142-D146 PolarHBondContact O-N 2.87Å; S142-D146 VanDerWaalsContact O-N 3.1Å
143	T	93.4	Very high	93.2	Very high	69 Å²	69	43.5 Å²	43.5	42%	0.423	24%	0.237	S	C	.	.	I	π-helix	trans	-56.3	-37	-177.2	-50	0	0	0	0	112.9	F139 F147	F139-T143 HydrophobicContact CE2-CG2 3.79Å; F139-T143 HydrophobicContact CZ-CG2 4.09Å; F139-T143 PolarHBondContact O-N 3.47Å; T143-F147 WeakPolarHBondContact O-CB 3.47Å; T143-F147 PolarHBondContact O-N 3.15Å
144	G	93.7	Very high	93.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-66.2	-44.4	179.4	0	0	0	0	0	112.9	F139 M140 S142 F147 I148	F139-G144 PolarHBondContact O-N 3.38Å; M140-G144 CarbonylContact O-C 3.57Å; M140-G144 WeakPolarHBondContact O-CA 3.37Å; M140-G144 PolarHBondContact O-N 2.89Å; S142-G144 PolarHBondContact O-N 3.44Å; G144-F147 PolarHBondContact O-N 3.31Å; G144-I148 VanDerWaalsContact O-CG1 3.32Å; G144-I148 WeakPolarHBondContact O-CG1 3.34Å; G144-I148 PolarHBondContact O-N 2.96Å
145	V	94.2	Very high	93.8	Very high	8 Å²	8	45 Å²	45	5%	0.048	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-45.1	175.5	171.6	0	0	0	0	110.8	V106 T122 T124 M140 K141 S142 F147 I148 K149	V106-V145 HydrophobicContact CG1-CG2 4.26Å; T122-V145 HydrophobicContact CG2-CG1 4.12Å; T122-V145 WeakPolarHBondContact OG1-CG1 3.33Å; T124-V145 WeakPolarHBondContact OG1-CG2 3.37Å; M140-V145 PolarHBondContact O-N 3.4Å; K141-V145 WeakPolarHBondContact O-CG2 3.44Å; S142-V145 PolarHBondContact O-N 3.15Å; S142-V145 VanDerWaalsContact O-N 3.16Å; V145-F147 VanDerWaalsContact C-N 3.29Å; V145-F147 PolarHBondContact O-N 3.06Å; V145-I148 PolarHBondContact O-N 3.17Å; V145-I148 VanDerWaalsContact O-N 3.15Å; V145-K149 HydrophobicContact CG1-CD 4.27Å; V145-K149 HydrophobicContact CG1-CG 4.35Å; V145-K149 WeakPolarHBondContact O-CG 3.48Å; V145-K149 PolarHBondContact O-N 2.86Å
146	D	93.7	Very high	93.8	Very high	110 Å²	110	41.9 Å²	41.9	59%	0.588	22%	0.224	S	C	*	.	H	α-helix	trans	-60.2	-40.7	177.8	-71.6	-21.8	0	0	0	111.9	S142 K149 S150	S142-D146 PolarHBondContact O-N 2.87Å; S142-D146 VanDerWaalsContact O-N 3.1Å; D146-K149 PolarHBondContact O-N 3.44Å; D146-S150 PolarHBondContact O-N 2.99Å
147	F	95.2	Very high	93.8	Very high	57 Å²	57	44.5 Å²	44.5	25%	0.25	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-45.6	174.2	178.8	-87	0	0	0	112.1	I49 T143 G144 V145 S150 K151	I49-F147 HydrophobicContact CD1-CB 4.37Å; I49-F147 HydrophobicContact CD1-CD1 3.7Å; I49-F147 HydrophobicContact CD1-CE1 4.28Å; I49-F147 HydrophobicContact CD1-CG 4.2Å; I49-F147 HydrophobicContact CG1-CB 4.49Å; I49-F147 HydrophobicContact CG1-CD1 3.7Å; I49-F147 HydrophobicContact CG1-CE1 3.98Å; I49-F147 HydrophobicContact CG1-CG 4Å; I49-F147 HydrophobicContact CG1-CZ 4.5Å; T143-F147 WeakPolarHBondContact O-CB 3.47Å; T143-F147 PolarHBondContact O-N 3.15Å; G144-F147 PolarHBondContact O-N 3.31Å; V145-F147 VanDerWaalsContact C-N 3.29Å; V145-F147 PolarHBondContact O-N 3.06Å; F147-S150 WeakPolarHBondContact O-CB 3.47Å; F147-S150 PolarHBondContact O-N 3.1Å; F147-K151 HydrophobicContact CD1-CG 4.25Å; F147-K151 HydrophobicContact CE1-CD 4.43Å; F147-K151 HydrophobicContact CE1-CG 3.85Å; F147-K151 HydrophobicContact CZ-CD 4.38Å; F147-K151 HydrophobicContact CZ-CG 4.26Å; F147-K151 WeakPolarHBondContact O-CG 3.44Å; F147-K151 PolarHBondContact O-N 3.4Å; F147-K151 VanDerWaalsContact O-N 3.07Å
148	I	95	Very high	93.8	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-46.1	177.2	-70.8	164.4	0	0	0	110.2	L44 I87 V106 V108 G144 V145 S150 K151 L152	L44-I148 HydrophobicContact CD2-CB 4.35Å; L44-I148 HydrophobicContact CD2-CG1 4.15Å; L44-I148 HydrophobicContact CD2-CG2 4.14Å; I87-I148 HydrophobicContact CD1-CD1 3.98Å; I87-I148 HydrophobicContact CD1-CG1 4.24Å; I87-I148 HydrophobicContact CD1-CG2 3.55Å; V106-I148 HydrophobicContact CB-CD1 3.95Å; V106-I148 HydrophobicContact CG1-CD1 3.83Å; V106-I148 HydrophobicContact CG2-CD1 3.93Å; V108-I148 HydrophobicContact CG2-CG2 4.46Å; G144-I148 VanDerWaalsContact O-CG1 3.32Å; G144-I148 WeakPolarHBondContact O-CG1 3.34Å; G144-I148 PolarHBondContact O-N 2.96Å; V145-I148 PolarHBondContact O-N 3.17Å; V145-I148 VanDerWaalsContact O-N 3.15Å; I148-S150 VanDerWaalsContact C-N 3.32Å; I148-S150 PolarHBondContact O-N 3.08Å; I148-K151 WeakPolarHBondContact O-CB 3.15Å; I148-K151 PolarHBondContact O-N 3.3Å; I148-K151 VanDerWaalsContact O-N 3.1Å; I148-L152 HydrophobicContact CG2-CD1 4.01Å; I148-L152 HydrophobicContact CG2-CG 4.48Å; I148-L152 WeakPolarHBondContact O-CG 3.23Å; I148-L152 PolarHBondContact O-N 2.88Å
149	K	94	Very high	93.7	Very high	31 Å²	31	42.7 Å²	42.7	14%	0.135	23%	0.225	C	C	.	.	H	α-helix	trans	-58.6	-43.1	176.3	-71.6	-170.1	178.7	-151.8	0	111.6	V117 C120 V145 D146 K151 L152 D153	V117-K149 HydrophobicContact CG1-CB 3.69Å; V117-K149 HydrophobicContact CG1-CD 4.43Å; V117-K149 HydrophobicContact CG1-CG 3.85Å; C120-K149 PolarHBondContact O-NZ 3.46Å; C120-K149 VanDerWaalsContact SG-CE 3.51Å; V145-K149 HydrophobicContact CG1-CD 4.27Å; V145-K149 HydrophobicContact CG1-CG 4.35Å; V145-K149 WeakPolarHBondContact O-CG 3.48Å; V145-K149 PolarHBondContact O-N 2.86Å; D146-K149 PolarHBondContact O-N 3.44Å; K149-K151 VanDerWaalsContact C-N 3.32Å; K149-K151 PolarHBondContact O-N 3.36Å; K149-L152 PolarHBondContact O-N 2.9Å; K149-D153 WeakPolarHBondContact O-CB 3.43Å; K149-D153 PolarHBondContact O-N 2.85Å
150	S	94.3	Very high	93.3	Very high	77 Å²	77	47.6 Å²	47.6	54%	0.538	25%	0.246	S	C	.	.	H	α-helix	trans	-60.2	-38	174.8	174.8	0	0	0	0	113.2	D146 F147 I148 K154	D146-S150 PolarHBondContact O-N 2.99Å; F147-S150 WeakPolarHBondContact O-CB 3.47Å; F147-S150 PolarHBondContact O-N 3.1Å; I148-S150 VanDerWaalsContact C-N 3.32Å; I148-S150 PolarHBondContact O-N 3.08Å; S150-K154 PolarHBondContact O-N 3.21Å; S150-K154 VanDerWaalsContact O-N 3.09Å
151	K	95.4	Very high	92.9	Very high	52 Å²	52	52.1 Å²	52.1	23%	0.226	27%	0.268	C	S	.	.	H	α-helix	trans	-69	-39	175.5	-66.5	-62.8	-174.2	174.3	0	112.5	L43 L44 F147 I148 K149 K154 Y155	L43-K151 HydrophobicContact CB-CB 4.47Å; L44-K151 HydrophobicContact CD2-CB 3.64Å; L44-K151 HydrophobicContact CD2-CG 3.99Å; L44-K151 HydrophobicContact CG-CB 4.21Å; F147-K151 HydrophobicContact CD1-CG 4.25Å; F147-K151 HydrophobicContact CE1-CD 4.43Å; F147-K151 HydrophobicContact CE1-CG 3.85Å; F147-K151 HydrophobicContact CZ-CD 4.38Å; F147-K151 HydrophobicContact CZ-CG 4.26Å; F147-K151 WeakPolarHBondContact O-CG 3.44Å; F147-K151 PolarHBondContact O-N 3.4Å; F147-K151 VanDerWaalsContact O-N 3.07Å; I148-K151 WeakPolarHBondContact O-CB 3.15Å; I148-K151 PolarHBondContact O-N 3.3Å; I148-K151 VanDerWaalsContact O-N 3.1Å; K149-K151 VanDerWaalsContact C-N 3.32Å; K149-K151 PolarHBondContact O-N 3.36Å; K151-K154 WeakPolarHBondContact O-CB 3.41Å; K151-K154 PolarHBondContact O-N 3.36Å; K151-Y155 PolarHBondContact O-N 2.97Å
152	L	95	Very high	92.5	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-67.6	-36.7	176.1	-66.9	172	0	0	0	111.8	I40 L44 I85 V108 L111 V117 I148 K149 K154 Y155 I156	I40-L152 HydrophobicContact CG2-CD2 4.31Å; L44-L152 HydrophobicContact CD1-CD2 4.17Å; I85-L152 HydrophobicContact CD1-CD1 4.32Å; I85-L152 HydrophobicContact CD1-CD2 3.66Å; V108-L152 HydrophobicContact CG1-CD1 4.45Å; V108-L152 HydrophobicContact CG2-CD1 4.11Å; L111-L152 HydrophobicContact CD2-CB 4.34Å; L111-L152 HydrophobicContact CD2-CD1 4.29Å; L111-L152 HydrophobicContact CD2-CD2 4.19Å; V117-L152 HydrophobicContact CG1-CB 4.04Å; V117-L152 HydrophobicContact CG2-CB 4.35Å; I148-L152 HydrophobicContact CG2-CD1 4.01Å; I148-L152 HydrophobicContact CG2-CG 4.48Å; I148-L152 WeakPolarHBondContact O-CG 3.23Å; I148-L152 PolarHBondContact O-N 2.88Å; K149-L152 PolarHBondContact O-N 2.9Å; L152-K154 VanDerWaalsContact C-N 3.33Å; L152-K154 PolarHBondContact O-N 3.33Å; L152-Y155 VanDerWaalsContact O-CB 3.32Å; L152-Y155 WeakPolarHBondContact O-CB 3.13Å; L152-Y155 PolarHBondContact O-N 3.09Å; L152-Y155 VanDerWaalsContact O-N 3.13Å; L152-I156 WeakPolarHBondContact O-CG1 3.42Å; L152-I156 PolarHBondContact O-N 3Å
153	D	93.2	Very high	92	Very high	86 Å²	86	50.1 Å²	50.1	46%	0.46	26%	0.255	S	S	.	.	H	α-helix	trans	-63.2	-40.9	173.2	-169.5	62.4	0	0	0	111.6	V117 K149 Y155 I156 T157	V117-D153 HydrophobicContact CG2-CB 4.1Å; K149-D153 WeakPolarHBondContact O-CB 3.43Å; K149-D153 PolarHBondContact O-N 2.85Å; D153-Y155 VanDerWaalsContact C-N 3.35Å; D153-Y155 PolarHBondContact O-N 2.83Å; D153-I156 PolarHBondContact O-N 2.92Å; D153-T157 PolarHBondContact O-N 3.24Å; D153-T157 PolarHBondContact O-OG1 3.05Å; D153-T157 VanDerWaalsContact O-OG1 3.04Å
154	K	94.1	Very high	91.3	Very high	110 Å²	110	46.9 Å²	46.9	48%	0.478	24%	0.235	S	C	.	.	H	α-helix	trans	-61.1	-41.2	170.7	-174	172.5	-179.5	-179.4	0	112.2	L43 S150 K151 L152 I156 T157 L158	L43-K154 HydrophobicContact CD2-CD 3.93Å; L43-K154 HydrophobicContact CD2-CG 4.35Å; S150-K154 PolarHBondContact O-N 3.21Å; S150-K154 VanDerWaalsContact O-N 3.09Å; K151-K154 WeakPolarHBondContact O-CB 3.41Å; K151-K154 PolarHBondContact O-N 3.36Å; L152-K154 VanDerWaalsContact C-N 3.33Å; L152-K154 PolarHBondContact O-N 3.33Å; K154-I156 PolarHBondContact O-N 3.16Å; K154-T157 WeakPolarHBondContact O-CB 3.39Å; K154-T157 PolarHBondContact O-N 3.4Å; K154-L158 HydrophobicContact CG-CD1 4.18Å; K154-L158 HydrophobicContact CG-CG 4.42Å; K154-L158 VanDerWaalsContact O-CG 3.3Å; K154-L158 WeakPolarHBondContact O-CG 3.28Å; K154-L158 PolarHBondContact O-N 3.2Å
155	Y	94.9	Very high	90.1	Very high	1 Å²	1	53.2 Å²	53.2	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-57.4	-47.6	173.7	151.5	-106	0	0	0	111.7	W35 S36 K39 I40 W83 K151 L152 D153 T157 L158 L159	W35-Y155 HydrophobicContact CE3-CE2 4.48Å; W35-Y155 HydrophobicContact CZ3-CD2 4.17Å; W35-Y155 AromaticContact CZ3-CE2 3.9Å; W35-Y155 HydrophobicContact CZ3-CE2 3.9Å; S36-Y155 VanDerWaalsContact CB-OH 3.25Å; S36-Y155 WeakPolarHBondContact CB-OH 3.28Å; S36-Y155 WeakPolarHBondContact OG-CE2 3.46Å; S36-Y155 PolarHBondContact OG-OH 2.93Å; K39-Y155 HydrophobicContact CB-CD2 4.37Å; K39-Y155 HydrophobicContact CG-CD2 4.24Å; I40-Y155 HydrophobicContact CD1-CD1 4.15Å; I40-Y155 HydrophobicContact CD1-CD2 4.34Å; I40-Y155 HydrophobicContact CD1-CE1 4.02Å; I40-Y155 HydrophobicContact CD1-CE2 4.21Å; I40-Y155 HydrophobicContact CD1-CG 4.31Å; I40-Y155 HydrophobicContact CG1-CD1 4.05Å; I40-Y155 HydrophobicContact CG1-CD2 3.79Å; I40-Y155 HydrophobicContact CG1-CE1 4.36Å; I40-Y155 HydrophobicContact CG1-CE2 4.12Å; I40-Y155 HydrophobicContact CG1-CG 3.75Å; W83-Y155 AromaticContact NE1-CE1 3.78Å; W83-Y155 AromaticContact NE1-CZ 3.67Å; W83-Y155 PolarHBondContact NE1-OH 2.99Å; K151-Y155 PolarHBondContact O-N 2.97Å; L152-Y155 VanDerWaalsContact O-CB 3.32Å; L152-Y155 WeakPolarHBondContact O-CB 3.13Å; L152-Y155 PolarHBondContact O-N 3.09Å; L152-Y155 VanDerWaalsContact O-N 3.13Å; D153-Y155 VanDerWaalsContact C-N 3.35Å; D153-Y155 PolarHBondContact O-N 2.83Å; Y155-T157 VanDerWaalsContact C-N 3.26Å; Y155-T157 PolarHBondContact O-N 2.82Å; Y155-L158 CarbonylContact O-C 3.57Å; Y155-L158 PolarHBondContact O-N 2.7Å; Y155-L158 VanDerWaalsContact O-N 3.16Å; Y155-L159 HydrophobicContact CE2-CB 4.36Å; Y155-L159 PolarHBondContact O-N 3.18Å
156	I	91.9	Very high	88.6	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-38.7	-179.9	-67.1	159.6	0	0	0	111	Y81 L111 V117 L152 D153 K154 L159 K160	Y81-I156 HydrophobicContact CE1-CG1 4.17Å; Y81-I156 HydrophobicContact CE1-CG2 4.22Å; Y81-I156 HydrophobicContact CE2-CD1 4.09Å; Y81-I156 HydrophobicContact CE2-CG1 4.19Å; Y81-I156 VanDerWaalsContact OH-CD1 3.31Å; Y81-I156 WeakPolarHBondContact OH-CD1 3.41Å; L111-I156 HydrophobicContact CD1-CD1 4.38Å; V117-I156 HydrophobicContact CG2-CD1 3.27Å; L152-I156 WeakPolarHBondContact O-CG1 3.42Å; L152-I156 PolarHBondContact O-N 3Å; D153-I156 PolarHBondContact O-N 2.92Å; K154-I156 PolarHBondContact O-N 3.16Å; I156-L159 PolarHBondContact O-N 3.01Å; I156-K160 WeakPolarHBondContact O-CG 3.17Å; I156-K160 PolarHBondContact O-N 3.14Å
157	T	91.1	Very high	87.1	Confident	54 Å²	54	51.8 Å²	51.8	33%	0.331	27%	0.273	S	S	.	.	H	α-helix	trans	-62	-50.3	174.8	-57.3	0	0	0	0	110.6	D153 K154 Y155 L159 K160 E161	D153-T157 PolarHBondContact O-N 3.24Å; D153-T157 PolarHBondContact O-OG1 3.05Å; D153-T157 VanDerWaalsContact O-OG1 3.04Å; K154-T157 WeakPolarHBondContact O-CB 3.39Å; K154-T157 PolarHBondContact O-N 3.4Å; Y155-T157 VanDerWaalsContact C-N 3.26Å; Y155-T157 PolarHBondContact O-N 2.82Å; T157-L159 VanDerWaalsContact C-N 3.3Å; T157-L159 PolarHBondContact O-N 2.81Å; T157-K160 PolarHBondContact O-N 3.12Å; T157-K160 VanDerWaalsContact O-N 3.11Å; T157-E161 HydrophobicContact CG2-CG 4.42Å; T157-E161 WeakPolarHBondContact O-CG 3.49Å; T157-E161 PolarHBondContact O-N 3.29Å
158	L	92.1	Very high	85.4	Confident	26 Å²	26	53.2 Å²	53.2	14%	0.136	28%	0.282	C	S	.	.	H	α-helix	trans	-65.3	-30	178.5	-64.4	174.1	0	0	0	113	W35 K39 L43 K154 Y155 K160 E161 D162 Y163	W35-L158 VanDerWaalsContact CH2-C 3.5Å; W35-L158 HydrophobicContact CH2-CB 3.89Å; W35-L158 WeakPolarHBondContact CH2-O 3.45Å; W35-L158 HydrophobicContact CZ2-CB 4.46Å; K39-L158 HydrophobicContact CD-CD1 3.83Å; K39-L158 HydrophobicContact CG-CD1 4.31Å; L43-L158 HydrophobicContact CD1-CD1 4.37Å; K154-L158 HydrophobicContact CG-CD1 4.18Å; K154-L158 HydrophobicContact CG-CG 4.42Å; K154-L158 VanDerWaalsContact O-CG 3.3Å; K154-L158 WeakPolarHBondContact O-CG 3.28Å; K154-L158 PolarHBondContact O-N 3.2Å; Y155-L158 CarbonylContact O-C 3.57Å; Y155-L158 PolarHBondContact O-N 2.7Å; Y155-L158 VanDerWaalsContact O-N 3.16Å; L158-K160 VanDerWaalsContact C-N 3.27Å; L158-K160 PolarHBondContact O-N 3.49Å; L158-E161 PolarHBondContact O-N 2.63Å; L158-D162 WeakPolarHBondContact CD2-OD2 3.46Å; L158-D162 WeakPolarHBondContact O-CA 3.3Å; L158-D162 WeakPolarHBondContact O-CB 3.38Å; L158-D162 PolarHBondContact O-N 3.24Å; L158-Y163 PolarHBondContact O-N 2.89Å
159	L	90.7	Very high	83.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.293	C	S	.	.	I	π-helix	trans	-62.7	-38.9	174.2	-179.5	65.5	0	0	0	111	A32 W35 V70 C79 Y81 Y155 I156 T157 Y163 A164	A32-L159 HydrophobicContact CB-CD1 3.83Å; W35-L159 HydrophobicContact CE3-CD1 3.91Å; W35-L159 HydrophobicContact CH2-CB 4.42Å; W35-L159 HydrophobicContact CZ3-CB 3.93Å; W35-L159 HydrophobicContact CZ3-CD1 3.72Å; W35-L159 HydrophobicContact CZ3-CG 4.46Å; V70-L159 HydrophobicContact CG2-CD1 4.09Å; V70-L159 HydrophobicContact CG2-CG 4.46Å; C79-L159 HydrophobicContact CB-CD2 3.98Å; C79-L159 HydrophobicContact CB-CG 4.42Å; Y81-L159 HydrophobicContact CD1-CD2 4.07Å; Y155-L159 HydrophobicContact CE2-CB 4.36Å; Y155-L159 PolarHBondContact O-N 3.18Å; I156-L159 PolarHBondContact O-N 3.01Å; T157-L159 VanDerWaalsContact C-N 3.3Å; T157-L159 PolarHBondContact O-N 2.81Å; L159-Y163 HydrophobicContact CD1-CD1 4.4Å; L159-Y163 HydrophobicContact CD1-CG 4.47Å; L159-A164 WeakPolarHBondContact O-CB 3.09Å; L159-A164 PolarHBondContact O-N 2.86Å
160	K	86.4	Confident	81.1	Confident	115 Å²	115	58.6 Å²	58.6	50%	0.5	32%	0.317	S	S	.	.	I	π-helix	trans	-79.9	-32.2	179	-66.6	173.9	-178.1	177.4	0	112.9	I156 T157 L158 A164	I156-K160 WeakPolarHBondContact O-CG 3.17Å; I156-K160 PolarHBondContact O-N 3.14Å; T157-K160 PolarHBondContact O-N 3.12Å; T157-K160 VanDerWaalsContact O-N 3.11Å; L158-K160 VanDerWaalsContact C-N 3.27Å; L158-K160 PolarHBondContact O-N 3.49Å; K160-A164 WeakPolarHBondContact O-CB 3.36Å
161	E	85.5	Confident	78.7	Confident	95 Å²	95	58.3 Å²	58.3	44%	0.444	32%	0.315	S	S	.	.	I	π-helix	trans	-91.5	-62.9	-177.6	-67.2	176.7	176.6	0	0	111.2	T157 L158 Q165	T157-E161 HydrophobicContact CG2-CG 4.42Å; T157-E161 WeakPolarHBondContact O-CG 3.49Å; T157-E161 PolarHBondContact O-N 3.29Å; L158-E161 PolarHBondContact O-N 2.63Å; E161-Q165 WeakPolarHBondContact O-CB 3.4Å; E161-Q165 WeakPolarHBondContact O-CG 3.2Å; E161-Q165 PolarHBondContact O-N 2.76Å; E161-Q165 PolarHBondContact O-NE2 2.88Å; E161-Q165 PolarHBondContact O-OE1 2.95Å
162	D	84.9	Confident	76.1	Confident	92 Å²	92	63.7 Å²	63.7	49%	0.492	34%	0.339	S	S	.	.	I	π-helix	trans	-75.2	-49.5	-171.7	-68.8	-3.2	0	0	0	113.1	W35 L158	W35-D162 HydrophobicContact CZ2-CB 4.06Å; L158-D162 WeakPolarHBondContact CD2-OD2 3.46Å; L158-D162 WeakPolarHBondContact O-CA 3.3Å; L158-D162 WeakPolarHBondContact O-CB 3.38Å; L158-D162 PolarHBondContact O-N 3.24Å
163	Y	83.3	Confident	73.7	Confident	57 Å²	57	71.4 Å²	71.4	22%	0.224	38%	0.38	C	S	.	.	I	π-helix	trans	-74.6	-37.4	-174	-168.9	-99.3	0	0	0	111.8	K30 D31 A32 W35 V70 L158 L159 L167	K30-Y163 HydrophobicContact CB-CE1 4.3Å; D31-Y163 PolarHBondContact O-OH 3.43Å; A32-Y163 HydrophobicContact CB-CD1 3.69Å; A32-Y163 HydrophobicContact CB-CE1 3.37Å; A32-Y163 HydrophobicContact CB-CE2 4.48Å; A32-Y163 HydrophobicContact CB-CG 4.36Å; W35-Y163 HydrophobicContact CB-CD2 3.76Å; W35-Y163 HydrophobicContact CB-CE2 3.69Å; W35-Y163 AromaticContact CD1-CD2 3.61Å; W35-Y163 AromaticContact CD2-CD2 3.68Å; W35-Y163 HydrophobicContact CD2-CD2 3.68Å; W35-Y163 HydrophobicContact CD2-CG 4.14Å; W35-Y163 HydrophobicContact CE3-CD2 4.29Å; W35-Y163 HydrophobicContact CE3-CG 4.36Å; W35-Y163 AromaticContact CG-CD2 3.39Å; W35-Y163 HydrophobicContact CG-CD2 3.39Å; W35-Y163 AromaticContact CG-CE2 3.85Å; W35-Y163 HydrophobicContact CG-CE2 3.85Å; W35-Y163 HydrophobicContact CG-CG 4.29Å; W35-Y163 AromaticContact NE1-CD2 3.98Å; V70-Y163 HydrophobicContact CB-CD1 4.39Å; V70-Y163 HydrophobicContact CB-CE1 4.45Å; V70-Y163 HydrophobicContact CG2-CD1 3.85Å; V70-Y163 HydrophobicContact CG2-CE1 4.21Å; L158-Y163 PolarHBondContact O-N 2.89Å; L159-Y163 HydrophobicContact CD1-CD1 4.4Å; L159-Y163 HydrophobicContact CD1-CG 4.47Å; Y163-L167 HydrophobicContact CD1-CD1 4.5Å
164	A	77.9	Confident	71	Confident	1 Å²	1	70 Å²	70	1%	0.008	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-23.6	-169.6	0	0	0	0	0	115.3	V70 L77 L159 K160 G166 L167	V70-A164 HydrophobicContact CG1-CB 4.08Å; L77-A164 HydrophobicContact CD1-CB 3.52Å; L77-A164 HydrophobicContact CD2-CB 3.31Å; L77-A164 HydrophobicContact CG-CB 3.97Å; L159-A164 WeakPolarHBondContact O-CB 3.09Å; L159-A164 PolarHBondContact O-N 2.86Å; K160-A164 WeakPolarHBondContact O-CB 3.36Å; A164-G166 PolarHBondContact O-N 3.33Å; A164-L167 HydrophobicContact CB-CD1 4.48Å; A164-L167 VanDerWaalsContact O-CB 3.29Å; A164-L167 WeakPolarHBondContact O-CB 3.3Å; A164-L167 WeakPolarHBondContact O-CG 3.24Å; A164-L167 PolarHBondContact O-N 3.19Å
165	Q	68.6	Low	68	Low	133 Å²	133	69.6 Å²	69.6	62%	0.621	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-59.4	-31.6	-177.5	-85.4	169.7	15.5	0	0	113.1	E161 L167	E161-Q165 WeakPolarHBondContact O-CB 3.4Å; E161-Q165 WeakPolarHBondContact O-CG 3.2Å; E161-Q165 PolarHBondContact O-N 2.76Å; E161-Q165 PolarHBondContact O-NE2 2.88Å; E161-Q165 PolarHBondContact O-OE1 2.95Å; Q165-L167 PolarHBondContact O-N 3.32Å
166	G	62.7	Low	65	Low	70 Å²	70	76.5 Å²	76.5	72%	0.722	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-78.6	1.3	176.3	0	0	0	0	0	115.3	A164	A164-G166 PolarHBondContact O-N 3.33Å
167	L	63.9	Low	62.2	Low	18 Å²	18	82.5 Å²	82.5	9%	0.094	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-97.4	-13.5	-174.4	-52	-172.3	0	0	0	113.6	N24 K30 V70 V72 Y163 A164 Q165	N24-L167 PolarHBondContact ND2-O 3Å; K30-L167 HydrophobicContact CB-CD1 4.47Å; K30-L167 HydrophobicContact CD-CD1 4.38Å; K30-L167 HydrophobicContact CD-CD2 3.34Å; K30-L167 HydrophobicContact CG-CD2 4.21Å; V70-L167 HydrophobicContact CB-CD1 3.95Å; V70-L167 HydrophobicContact CG1-CD1 3.47Å; V70-L167 VanDerWaalsContact CG1-CD1 3.47Å; V72-L167 HydrophobicContact CG2-CB 3.9Å; Y163-L167 HydrophobicContact CD1-CD1 4.5Å; A164-L167 HydrophobicContact CB-CD1 4.48Å; A164-L167 VanDerWaalsContact O-CB 3.29Å; A164-L167 WeakPolarHBondContact O-CB 3.3Å; A164-L167 WeakPolarHBondContact O-CG 3.24Å; A164-L167 PolarHBondContact O-N 3.19Å; Q165-L167 PolarHBondContact O-N 3.32Å
168	I	58.5	Low	59.5	Low	87 Å²	87	86.8 Å²	86.8	45%	0.446	50%	0.498	S	S	.	.	S	Bend	trans	-90	110.6	177.5	-56	175	0	0	0	107.3
169	L	54	Low	56.8	Low	45 Å²	45	91.6 Å²	91.6	24%	0.236	53%	0.531	C	S	.	.			trans	-61	142.6	174.2	-68.8	167.9	0	0	0	109.5	D18 N21 N24 S171	D18-L169 WeakPolarHBondContact OD2-CD1 3.18Å; D18-L169 WeakPolarHBondContact OD2-CD2 3.44Å; N21-L169 HydrophobicContact CB-CD1 4.42Å; N21-L169 WeakPolarHBondContact O-CD1 3.47Å; N24-L169 WeakPolarHBondContact OD1-CB 3.16Å; N24-L169 WeakPolarHBondContact OD1-CD1 3.48Å; N24-L169 VanDerWaalsContact OD1-CG 3.25Å; N24-L169 WeakPolarHBondContact OD1-CG 3.5Å; N24-L169 PolarHBondContact OD1-N 3.49Å; L169-S171 PolarHBondContact O-N 3Å
170	P	45.5	Very low	54.2	Low	100 Å²	100	96.3 Å²	96.3	65%	0.649	57%	0.57	S	S	*	*			trans	-51.9	128.1	-179.3	-23.7	30.8	0	0	0	111.3	R16	R16-P170 PolarHBondContact NH1-O 3.41Å; R16-P170 PolarHBondContact NH2-O 3.21Å
171	S	43.9	Very low	51.5	Low	71 Å²	71	94.1 Å²	94.1	50%	0.497	58%	0.58	S	S	.	*			trans	-115	141.8	170.2	172.5	0	0	0	0	107.8	L169 N173 G174	L169-S171 PolarHBondContact O-N 3Å; S171-N173 PolarHBondContact O-N 2.88Å; S171-G174 PolarHBondContact O-N 3.34Å
172	K	41.1	Very low	49	Very low	165 Å²	165	96 Å²	96	72%	0.717	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	6.2	-166.1	-143.8	176.1	-171.3	161.6	0	115.9	E14	E14-K172 WeakPolarHBondContact OE1-CD 3.25Å; E14-K172 WeakPolarHBondContact OE1-CE 3.29Å; E14-K172 IonicContact OE1-NZ 2.73Å; E14-K172 PolarHBondContact OE1-NZ 3.35Å
173	N	43.1	Very low	46.3	Very low	163 Å²	163	97.1 Å²	97.1	87%	0.872	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	7.1	179.8	-76.3	-2.5	0	0	0	115.1	S171	S171-N173 PolarHBondContact O-N 2.88Å
174	G	36.2	Very low	43.8	Very low	58 Å²	58	106.1 Å²	106.1	60%	0.598	64%	0.642	S	S	*	*	S	Bend	trans	-119.4	122.1	173.8	0	0	0	0	0	111	S171 N176	S171-G174 PolarHBondContact O-N 3.34Å; G174-N176 PolarHBondContact O-N 2.89Å
175	A	32.3	Very low	41.8	Very low	101 Å²	101	112.2 Å²	112.2	84%	0.835	69%	0.685	S	S	*	*			trans	-56.1	127.7	179.7	0	0	0	0	0	111.7	V177	A175-V177 PolarHBondContact O-N 3.11Å
176	N	31.8	Very low	40	Very low	145 Å²	145	109.3 Å²	109.3	78%	0.775	69%	0.691	S	S	*	*			trans	-47.5	123.8	168.3	-95.2	-23.2	0	0	0	111.8	G174	G174-N176 PolarHBondContact O-N 2.89Å
177	V	33.7	Very low	38.7	Very low	136 Å²	136	111 Å²	111	82%	0.824	70%	0.698	S	S	*	*			trans	-139.1	84.9	149.1	-143.5	0	0	0	0	109.3	A175	A175-V177 PolarHBondContact O-N 3.11Å
178	N	34.1	Very low	37.3	Very low	145 Å²	145	114.4 Å²	114.4	78%	0.775	73%	0.729	S	S	*	*			trans	-92.9	125.8	158.4	-84.3	-20.5	0	0	0	107.7	A180	N178-A180 PolarHBondContact O-N 2.79Å
179	P	34.8	Very low	36.5	Very low	126 Å²	126	117.5 Å²	117.5	82%	0.818	75%	0.745	S	S	*	*			trans	-92	94.2	161.7	30.1	-20.8	0	0	0	108.8
180	A	36.4	Very low	35.6	Very low	99 Å²	99	120.9 Å²	120.9	82%	0.818	76%	0.763	S	S	*	*			trans	-74.6	123.5	160.8	0	0	0	0	0	108.4	N178	N178-A180 PolarHBondContact O-N 2.79Å
181	G	29.1	Very low	35.2	Very low	70 Å²	70	124.7 Å²	124.7	72%	0.722	77%	0.77	S	S	*	*			trans	-68	159.6	-179.7	0	0	0	0	0	113.7
182	T	32.7	Very low	34.8	Very low	134 Å²	134	127.7 Å²	127.7	82%	0.822	79%	0.786	S	S	*	*			trans	-168.9	109.4	148	-73.7	0	0	0	0	110
183	T	29.7	Very low	34.4	Very low	116 Å²	116	125.2 Å²	125.2	71%	0.712	78%	0.784	S	S	*	*			trans	26.8	123.8	145.2	57.7	0	0	0	0	123.9
184	R	30.3	Very low	34	Very low	245 Å²	245	125.2 Å²	125.2	93%	0.925	78%	0.784	S	S	*	*				44.7	116.5	126.3	-62	-178.5	179.3	177.9	-0.1	120
185	S	35.1	Very low	33.9	Very low	129 Å²	129	131.8 Å²	131.8	90%	0.902	80%	0.796	S	S	*	*				-174.5	140.8	107.9	-162	0	0	0	0	110.1
186	G	30.8	Very low	33.9	Very low	73 Å²	73	131.1 Å²	131.1	75%	0.753	79%	0.791	S	S	*	*			trans	-98.4	175	-169.7	0	0	0	0	0	115.7
187	A	35.8	Very low	33.7	Very low	106 Å²	106	133.9 Å²	133.9	88%	0.876	80%	0.796	S	S	*	*			trans	-175.8	144.3	135.9	0	0	0	0	0	109.4
188	A	35.2	Very low	33.8	Very low	88 Å²	88	135.5 Å²	135.5	73%	0.727	79%	0.794	S	S	*	*			trans	-68.7	161.1	-172	0	0	0	0	0	114.8
189	L	39.9	Very low	33.5	Very low	152 Å²	152	135.8 Å²	135.8	80%	0.796	80%	0.801	S	S	*	*				-178.6	132.9	94.8	-132.6	82.3	0	0	0	113.3
190	D	35.4	Very low	33.3	Very low	116 Å²	116	134 Å²	134	62%	0.62	80%	0.797	S	S	*	*			trans	58.5	111.9	142.2	-77.9	-35.4	0	0	0	125.1
191	K	37.2	Very low	33	Very low	181 Å²	181	136.9 Å²	136.9	79%	0.787	80%	0.799	S	S	*	*				36.9	126.4	119.1	-66.2	175.7	-177.6	167.9	0	118
192	T	36.4	Very low	32.9	Very low	134 Å²	134	136.6 Å²	136.6	82%	0.822	80%	0.796	S	S	*	*				-176.1	137.6	90.4	-63.1	0	0	0	0	111.2
193	T	32	Very low	32.8	Very low	112 Å²	112	138.2 Å²	138.2	69%	0.687	80%	0.798	S	S	*	*			trans	-52.9	141.8	175.9	-31.1	0	0	0	0	114.2
194	N	35.9	Very low	33.4	Very low	164 Å²	164	140.6 Å²	140.6	88%	0.877	80%	0.798	S	S	*	*				-162.3	134.7	128.6	-97	-19.5	0	0	0	113.1
195	K	32.4	Very low	34.1	Very low	196 Å²	196	136.7 Å²	136.7	85%	0.852	79%	0.791	S	S	*	*			trans	-66.8	133.2	178.4	-70.3	172.5	172.9	177.3	0	111
196	A	32.6	Very low	34.5	Very low	86 Å²	86	136.8 Å²	136.8	71%	0.711	79%	0.788	S	S	*	*			trans	-151.1	119.8	147.9	0	0	0	0	0	109	H198	A196-H198 PolarHBondContact O-N 3Å
197	F	28.4	Very low	35.8	Very low	204 Å²	204	137.1 Å²	137.1	90%	0.895	77%	0.769	S	S	*	*			trans	-65.1	112.4	171.3	-89.5	-108.2	0	0	0	109
198	H	35.2	Very low	37	Very low	169 Å²	169	136 Å²	136	78%	0.782	75%	0.749	S	S	*	*			trans	-135.9	118.6	156.7	-80	-67	0	0	0	108.6	A196 A200	A196-H198 PolarHBondContact O-N 3Å; H198-A200 PolarHBondContact O-N 3.2Å; H198-A200 VanDerWaalsContact O-N 3.12Å
199	T	29.1	Very low	38.6	Very low	151 Å²	151	136.4 Å²	136.4	93%	0.926	74%	0.738	S	S	*	*			trans	-52.4	106.2	165	41.4	0	0	0	0	109
200	A	29.9	Very low	40.3	Very low	89 Å²	89	130.9 Å²	130.9	74%	0.736	71%	0.712	S	S	*	*			trans	-124.1	128.6	175.8	0	0	0	0	0	108.8	H198 G202	H198-A200 PolarHBondContact O-N 3.2Å; H198-A200 VanDerWaalsContact O-N 3.12Å; A200-G202 PolarHBondContact O-N 3.18Å
201	D	29	Very low	42.4	Very low	159 Å²	159	128.8 Å²	128.8	85%	0.85	70%	0.701	S	S	*	*			trans	-29.5	115.5	172.4	-82.9	-52.3	0	0	0	113.2	I203	D201-I203 PolarHBondContact O-N 3.3Å
202	G	28.5	Very low	44.6	Very low	64 Å²	64	125.4 Å²	125.4	66%	0.66	68%	0.683	S	S	*	*			trans	-62.1	108.8	161.4	0	0	0	0	0	107.5	A200 K204	A200-G202 PolarHBondContact O-N 3.18Å; G202-K204 VanDerWaalsContact C-N 3.27Å; G202-K204 PolarHBondContact O-N 3.02Å
203	I	30.8	Very low	47	Very low	168 Å²	168	124 Å²	124	86%	0.862	67%	0.67	S	S	*	*			trans	-52.1	94.1	171.2	-62.4	166.1	0	0	0	107	D201 E205	D201-I203 PolarHBondContact O-N 3.3Å; I203-E205 PolarHBondContact O-N 3.02Å
204	K	40.6	Very low	49.7	Very low	166 Å²	166	119 Å²	119	72%	0.722	64%	0.64	S	S	*	*			trans	-68.6	123.8	168.5	-75.5	176.5	178.9	170.2	0	105.4	G202	G202-K204 VanDerWaalsContact C-N 3.27Å; G202-K204 PolarHBondContact O-N 3.02Å
205	E	45.4	Very low	52.3	Low	164 Å²	164	114.8 Å²	114.8	77%	0.766	62%	0.623	S	S	*	*			trans	-43.5	150.3	170	-70.2	-156.3	159.2	0	0	111.2	I203 K207	I203-E205 PolarHBondContact O-N 3.02Å; E205-K207 PolarHBondContact O-N 3.13Å
206	P	43.8	Very low	55	Low	130 Å²	130	106 Å²	106	84%	0.844	59%	0.585	S	S	*	*			trans	-61.3	100.1	-176.7	25.8	-32.8	0	0	0	109.1	D208	P206-D208 PolarHBondContact O-N 3.49Å
207	K	58.1	Low	57.8	Low	80 Å²	80	105.8 Å²	105.8	35%	0.348	58%	0.575	S	S	.	*			trans	-58.5	132.1	173.1	-68	-176.5	174.4	-171.4	0	107.5	E205 L209 Y315	E205-K207 PolarHBondContact O-N 3.13Å; K207-L209 PolarHBondContact O-N 2.85Å; K207-Y315 HydrophobicContact CB-CD1 3.72Å; K207-Y315 HydrophobicContact CB-CE1 3.94Å; K207-Y315 HydrophobicContact CB-CG 4.2Å; K207-Y315 HydrophobicContact CD-CD1 4.19Å; K207-Y315 HydrophobicContact CD-CD2 4.21Å; K207-Y315 HydrophobicContact CD-CE1 3.82Å; K207-Y315 HydrophobicContact CD-CE2 3.89Å; K207-Y315 HydrophobicContact CD-CG 4.38Å; K207-Y315 HydrophobicContact CG-CD1 4.4Å; K207-Y315 HydrophobicContact CG-CE1 4.46Å
208	D	62.1	Low	60.8	Low	84 Å²	84	97.6 Å²	97.6	45%	0.449	54%	0.54	S	S	.	.			trans	-62.3	99.6	173.8	-179.8	7.7	0	0	0	109.2	P206 S210 A314 Y315	P206-D208 PolarHBondContact O-N 3.49Å; D208-S210 PolarHBondContact O-N 3.36Å; D208-S210 WeakPolarHBondContact OD1-CA 3.29Å; D208-S210 WeakPolarHBondContact OD1-CB 3.43Å; D208-S210 PolarHBondContact OD1-N 3.17Å; D208-S210 PolarHBondContact OD1-OG 3.43Å; D208-S210 PolarHBondContact OD2-OG 3.14Å; D208-A314 HydrophobicContact CB-CB 4.48Å; D208-Y315 WeakPolarHBondContact O-CD1 3.44Å
209	L	68.2	Low	63.5	Low	96 Å²	96	93 Å²	93	50%	0.503	52%	0.519	S	S	.	.			trans	-79.8	9	177.2	-68.9	168.9	0	0	0	112.1	K207 N211 P285	K207-L209 PolarHBondContact O-N 2.85Å; L209-N211 PolarHBondContact O-N 2.92Å; L209-N211 PolarHBondContact O-OD1 2.91Å; L209-P285 HydrophobicContact CD2-CB 4.38Å; L209-P285 HydrophobicContact CD2-CG 3.37Å
210	S	75.5	Confident	66.5	Low	35 Å²	35	85.8 Å²	85.8	25%	0.245	48%	0.475	C	S	.	.			trans	-63.8	135.2	175.6	72.5	0	0	0	0	110.3	D208 R212 A314	D208-S210 PolarHBondContact O-N 3.36Å; D208-S210 WeakPolarHBondContact OD1-CA 3.29Å; D208-S210 WeakPolarHBondContact OD1-CB 3.43Å; D208-S210 PolarHBondContact OD1-N 3.17Å; D208-S210 PolarHBondContact OD1-OG 3.43Å; D208-S210 PolarHBondContact OD2-OG 3.14Å; S210-R212 VanDerWaalsContact OG-CZ 3.29Å; S210-R212 PolarHBondContact OG-NH1 3.44Å; S210-R212 PolarHBondContact OG-NH2 3.03Å; S210-A314 VanDerWaalsContact O-CB 3.23Å; S210-A314 WeakPolarHBondContact O-CB 3.44Å; S210-A314 PolarHBondContact O-N 2.77Å; S210-A314 WeakPolarHBondContact OG-CB 3.42Å
211	N	78.9	Confident	69.4	Low	73 Å²	73	85.6 Å²	85.6	39%	0.39	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	139.7	-177.9	-73.1	-3.3	0	0	0	110.2	L209 H288 D311	L209-N211 PolarHBondContact O-N 2.92Å; L209-N211 PolarHBondContact O-OD1 2.91Å; N211-H288 PolarHBondContact OD1-CE1 2.82Å; N211-D311 HydrophobicContact CB-CB 4.43Å; N211-D311 PolarHBondContact ND2-OD1 2.77Å
212	R	82.8	Confident	72.4	Confident	110 Å²	110	78.7 Å²	78.7	42%	0.415	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	153.6	174	-65.7	-67.2	-176.2	-78.1	-12.8	110.4	S210 D311 V312 A314 L317	S210-R212 VanDerWaalsContact OG-CZ 3.29Å; S210-R212 PolarHBondContact OG-NH1 3.44Å; S210-R212 PolarHBondContact OG-NH2 3.03Å; R212-D311 PolarHBondContact O-N 3.42Å; R212-V312 PolarHBondContact N-O 2.83Å; R212-V312 WeakPolarHBondContact O-CB 3.32Å; R212-V312 PolarHBondContact O-N 2.93Å; R212-A314 HydrophobicContact CG-CB 3.81Å; R212-L317 HydrophobicContact CB-CD1 3.9Å; R212-L317 HydrophobicContact CB-CD2 3.78Å; R212-L317 HydrophobicContact CB-CG 4.33Å; R212-L317 HydrophobicContact CG-CD2 4.18Å
213	D	86.8	Confident	75.5	Confident	103 Å²	103	78.9 Å²	78.9	55%	0.551	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	142.4	178	-67.7	-1.8	0	0	0	110.1	Q309 K310	D213-Q309 CarbonylContact C-O 3.52Å; D213-Q309 WeakPolarHBondContact CA-O 3.17Å; D213-K310 WeakPolarHBondContact OD1-CA 3.5Å
214	L	88.7	Confident	78.6	Confident	9 Å²	9	72 Å²	72	5%	0.047	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.6	177.5	173.5	65.1	0	0	0	109.1	I216 T308 Q309 L317 T320 R321	L214-I216 HydrophobicContact CD1-CD1 4.22Å; L214-I216 HydrophobicContact CD1-CG1 4Å; L214-I216 HydrophobicContact CD2-CD1 3.99Å; L214-I216 HydrophobicContact CD2-CG1 4.49Å; L214-I216 HydrophobicContact CG-CD1 4.21Å; L214-I216 HydrophobicContact CG-CG1 4.16Å; L214-T308 CarbonylContact O-C 3.56Å; L214-T308 WeakPolarHBondContact O-CA 3.36Å; L214-Q309 HydrophobicContact CB-CB 4.28Å; L214-Q309 PolarHBondContact N-O 2.87Å; L214-Q309 PolarHBondContact O-N 3.22Å; L214-L317 HydrophobicContact CB-CD1 4.03Å; L214-T320 HydrophobicContact CD2-CG2 4.38Å; L214-R321 HydrophobicContact CD1-CB 3.72Å; L214-R321 HydrophobicContact CD1-CG 3.72Å; L214-R321 HydrophobicContact CD2-CB 4.06Å
215	S	90.6	Very high	81.1	Confident	75 Å²	75	69 Å²	69	52%	0.524	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.7	172	-173.5	0	0	0	0	109.6	L307	S215-L307 CarbonylContact C-O 3.6Å; S215-L307 VanDerWaalsContact CA-O 3.31Å; S215-L307 WeakPolarHBondContact CA-O 3.4Å
216	I	90.6	Very high	83.4	Confident	11 Å²	11	63.1 Å²	63.1	6%	0.056	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	136.3	178.2	-60.4	171.4	0	0	0	107.2	L214 L307 R321 W324 L325 L329	L214-I216 HydrophobicContact CD1-CD1 4.22Å; L214-I216 HydrophobicContact CD1-CG1 4Å; L214-I216 HydrophobicContact CD2-CD1 3.99Å; L214-I216 HydrophobicContact CD2-CG1 4.49Å; L214-I216 HydrophobicContact CG-CD1 4.21Å; L214-I216 HydrophobicContact CG-CG1 4.16Å; I216-L307 HydrophobicContact CB-CB 4.27Å; I216-L307 HydrophobicContact CB-CD2 4.46Å; I216-L307 HydrophobicContact CD1-CD2 4.43Å; I216-L307 PolarHBondContact N-O 3.13Å; I216-L307 PolarHBondContact O-N 2.9Å; I216-R321 HydrophobicContact CD1-CG 4.12Å; I216-W324 HydrophobicContact CD1-CB 3.6Å; I216-W324 HydrophobicContact CD1-CG 4.17Å; I216-L325 HydrophobicContact CD1-CG 4.37Å; I216-L325 HydrophobicContact CG2-CD2 3.73Å; I216-L329 HydrophobicContact CG2-CD1 4Å
217	T	91.2	Very high	85.8	Confident	81 Å²	81	57 Å²	57	50%	0.497	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	129.7	172	-61.8	0	0	0	0	107.9	R304 L305 I306	T217-R304 HydrophobicContact CG2-CG 3.62Å; T217-L305 WeakPolarHBondContact CA-O 2.87Å; T217-I306 HydrophobicContact CG2-CG1 4.21Å
218	D	90.8	Very high	87.6	Confident	33 Å²	33	54.6 Å²	54.6	18%	0.176	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	158.5	178.3	-158.4	0.9	0	0	0	110.8	F220 R304 L305 L329 K333	D218-F220 HydrophobicContact CB-CE2 4.15Å; D218-R304 CarbonylContact O-C 3.45Å; D218-L305 PolarHBondContact N-O 2.87Å; D218-L305 PolarHBondContact O-N 3.28Å; D218-L329 HydrophobicContact CB-CD1 4.05Å; D218-K333 IonicContact OD1-NZ 2.99Å; D218-K333 PolarHBondContact OD1-NZ 3.48Å; D218-K333 WeakPolarHBondContact OD2-CE 3.26Å; D218-K333 IonicContact OD2-NZ 3.24Å; D218-K333 PolarHBondContact OD2-NZ 3.05Å
219	E	91.3	Very high	89.2	Confident	72 Å²	72	56.2 Å²	56.2	34%	0.336	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137.5	-174.9	-62.2	-174.8	162.4	0	0	111.1	F299 R304 K333	E219-F299 HydrophobicContact CB-CE1 4.18Å; E219-F299 HydrophobicContact CB-CZ 4.17Å; E219-F299 HydrophobicContact CG-CE1 4.23Å; E219-F299 HydrophobicContact CG-CZ 4.34Å; E219-R304 HydrophobicContact CG-CG 4.32Å; E219-R304 IonicContact OE1-CZ 3.94Å; E219-R304 VanDerWaalsContact OE1-CZ 3.27Å; E219-R304 IonicContact OE1-NE 2.97Å; E219-R304 PolarHBondContact OE1-NE 3.03Å; E219-R304 IonicContact OE1-NH2 3.4Å; E219-R304 PolarHBondContact OE1-NH2 3.25Å; E219-K333 WeakPolarHBondContact O-CE 3.15Å; E219-K333 PolarHBondContact O-NZ 3.04Å
220	F	92.5	Very high	90.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130	-177.9	-69.4	-95.6	0	0	0	109.6	D218 C222 L227 G302 T303 L305 L329 L332 K333 Y338	D218-F220 HydrophobicContact CB-CE2 4.15Å; F220-C222 PolarHBondContact O-N 3.5Å; F220-L227 HydrophobicContact CB-CD2 4.34Å; F220-L227 HydrophobicContact CD1-CD1 4.34Å; F220-L227 HydrophobicContact CD2-CD2 3.98Å; F220-L227 HydrophobicContact CG-CD1 4.41Å; F220-L227 HydrophobicContact CG-CD2 4.15Å; F220-G302 CarbonylContact O-C 3.6Å; F220-G302 WeakPolarHBondContact O-CA 3.35Å; F220-T303 PolarHBondContact N-O 3.46Å; F220-T303 PolarHBondContact O-N 3.42Å; F220-L305 HydrophobicContact CD2-CB 3.99Å; F220-L305 HydrophobicContact CE2-CB 3.89Å; F220-L305 HydrophobicContact CE2-CD2 3.83Å; F220-L305 HydrophobicContact CZ-CD2 4.42Å; F220-L329 HydrophobicContact CE2-CD2 3.96Å; F220-L329 HydrophobicContact CZ-CB 4.17Å; F220-L329 HydrophobicContact CZ-CD2 3.58Å; F220-L329 HydrophobicContact CZ-CG 4.43Å; F220-L332 HydrophobicContact CE1-CB 3.78Å; F220-L332 HydrophobicContact CE1-CD1 4.39Å; F220-L332 HydrophobicContact CZ-CB 4.47Å; F220-L332 HydrophobicContact CZ-CD1 4.42Å; F220-K333 HydrophobicContact CD1-CG 3.96Å; F220-K333 HydrophobicContact CE1-CD 4.46Å; F220-K333 HydrophobicContact CE1-CG 3.63Å; F220-K333 HydrophobicContact CZ-CG 4.38Å; F220-Y338 WeakPolarHBondContact CA-O 3.43Å; F220-Y338 HydrophobicContact CD1-CD2 4.07Å; F220-Y338 HydrophobicContact CD1-CG 4.39Å
221	F	91.9	Very high	91.3	Very high	84 Å²	84	51.1 Å²	51.1	37%	0.368	26%	0.262	S	S	.	.	S	Bend	trans	-80.7	59.9	177.1	-66	-84.2	0	0	0	111.5	G301 Y338 R341	F221-G301 WeakPolarHBondContact CD1-O 3.49Å; F221-Y338 WeakPolarHBondContact CD2-O 3.31Å; F221-Y338 PolarHBondContact N-O 2.73Å; F221-R341 HydrophobicContact CE1-CG 4.34Å
222	C	92	Very high	92	Very high	15 Å²	15	48.1 Å²	48.1	10%	0.101	25%	0.246	C	C	.	.	S	Bend	trans	-148.4	171.1	175	62.3	0	0	0	0	111.2	F220 D226 G302 T303 Y338	F220-C222 PolarHBondContact O-N 3.5Å; C222-D226 HydrophobicContact CB-CB 4.21Å; C222-G302 CarbonylContact O-C 3.42Å; C222-G302 WeakPolarHBondContact O-CA 3.47Å; C222-T303 WeakPolarHBondContact O-CB 3.32Å; C222-T303 PolarHBondContact O-N 2.97Å; C222-T303 PolarHBondContact O-OG1 2.99Å; C222-Y338 HydrophobicContact CB-CD1 3.62Å; C222-Y338 HydrophobicContact CB-CD2 4.23Å; C222-Y338 HydrophobicContact CB-CE1 3.48Å; C222-Y338 VanDerWaalsContact CB-CE1 3.48Å; C222-Y338 HydrophobicContact CB-CE2 4.09Å; C222-Y338 HydrophobicContact CB-CG 4Å
223	T	93.7	Very high	92.5	Very high	67 Å²	67	44.9 Å²	44.9	41%	0.411	24%	0.239	S	C	.	.			trans	-74.9	154.6	175.1	69.9	0	0	0	0	111.4	D225 D226 L227	T223-D225 PolarHBondContact O-N 3.34Å; T223-D226 PolarHBondContact O-N 3.34Å; T223-D226 VanDerWaalsContact O-N 3.12Å; T223-D226 WeakPolarHBondContact OG1-CB 3.48Å; T223-D226 PolarHBondContact OG1-N 2.89Å; T223-D226 VanDerWaalsContact OG1-N 3.14Å; T223-D226 PolarHBondContact OG1-OD2 2.73Å; T223-L227 PolarHBondContact O-N 3.48Å
224	P	94.5	Very high	92.8	Very high	25 Å²	25	44.5 Å²	44.5	16%	0.162	23%	0.232	C	C	.	.	H	α-helix	trans	-58.3	-33.9	176.7	-27.1	35.2	0	0	0	112.7	Y228 G272 M296 A298 T303	P224-Y228 VanDerWaalsContact O-CB 3.24Å; P224-Y228 WeakPolarHBondContact O-CB 3.43Å; P224-Y228 PolarHBondContact O-N 3.32Å; P224-G272 WeakPolarHBondContact CB-O 3.27Å; P224-M296 HydrophobicContact CB-CB 4.1Å; P224-A298 HydrophobicContact CG-CB 3.89Å; P224-T303 WeakPolarHBondContact CA-OG1 3.41Å; P224-T303 HydrophobicContact CB-CG2 4.22Å; P224-T303 WeakPolarHBondContact CD-OG1 3.35Å; P224-T303 HydrophobicContact CG-CG2 4.1Å; P224-T303 WeakPolarHBondContact CG-OG1 3.36Å
225	D	94.4	Very high	93	Very high	101 Å²	101	50.1 Å²	50.1	54%	0.54	26%	0.258	S	S	.	.	H	α-helix	trans	-67.7	-39.8	176.5	-66.2	-48	0	0	0	112.4	T223 Y228 R229 G272	T223-D225 PolarHBondContact O-N 3.34Å; D225-Y228 PolarHBondContact O-N 2.76Å; D225-R229 WeakPolarHBondContact O-CB 3.28Å; D225-R229 PolarHBondContact O-N 3.15Å; D225-G272 VanDerWaalsContact OD1-CA 3.3Å; D225-G272 WeakPolarHBondContact OD1-CA 3.35Å
226	D	94	Very high	93.1	Very high	42 Å²	42	48.5 Å²	48.5	23%	0.225	24%	0.243	C	C	.	.	H	α-helix	trans	-66	-43.3	175.4	-69.4	-45.5	0	0	0	111.6	C222 T223 R229 V230	C222-D226 HydrophobicContact CB-CB 4.21Å; T223-D226 PolarHBondContact O-N 3.34Å; T223-D226 VanDerWaalsContact O-N 3.12Å; T223-D226 WeakPolarHBondContact OG1-CB 3.48Å; T223-D226 PolarHBondContact OG1-N 2.89Å; T223-D226 VanDerWaalsContact OG1-N 3.14Å; T223-D226 PolarHBondContact OG1-OD2 2.73Å; D226-R229 PolarHBondContact O-N 2.96Å; D226-R229 IonicContact OD1-CZ 2.84Å; D226-R229 VanDerWaalsContact OD1-CZ 3.24Å; D226-R229 IonicContact OD1-NH1 2.69Å; D226-R229 PolarHBondContact OD1-NH1 3.03Å; D226-R229 IonicContact OD1-NH2 2.64Å; D226-R229 PolarHBondContact OD1-NH2 2.85Å; D226-V230 WeakPolarHBondContact O-CG2 3.38Å; D226-V230 PolarHBondContact O-N 3.33Å
227	L	94.5	Very high	93.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-42.7	176.6	-172.7	54.4	0	0	0	111.3	F220 T223 R229 V230 L231 M296 T303 L305	F220-L227 HydrophobicContact CB-CD2 4.34Å; F220-L227 HydrophobicContact CD1-CD1 4.34Å; F220-L227 HydrophobicContact CD2-CD2 3.98Å; F220-L227 HydrophobicContact CG-CD1 4.41Å; F220-L227 HydrophobicContact CG-CD2 4.15Å; T223-L227 PolarHBondContact O-N 3.48Å; L227-R229 VanDerWaalsContact C-N 3.34Å; L227-R229 PolarHBondContact O-N 3.09Å; L227-V230 PolarHBondContact O-N 2.78Å; L227-L231 HydrophobicContact CD1-CD1 4.4Å; L227-L231 HydrophobicContact CG-CD1 4.26Å; L227-L231 WeakPolarHBondContact O-CG 3.44Å; L227-L231 PolarHBondContact O-N 2.7Å; L227-L231 VanDerWaalsContact O-N 3.15Å; L227-M296 HydrophobicContact CB-SD 4.29Å; L227-M296 HydrophobicContact CD2-CG 4.05Å; L227-M296 HydrophobicContact CD2-SD 4.5Å; L227-M296 HydrophobicContact CG-CG 4.41Å; L227-M296 HydrophobicContact CG-SD 4.22Å; L227-T303 HydrophobicContact CD2-CG2 3.92Å; L227-L305 HydrophobicContact CD2-CB 4.1Å; L227-L305 HydrophobicContact CD2-CD1 4.16Å; L227-L305 HydrophobicContact CD2-CD2 4.41Å; L227-L305 HydrophobicContact CD2-CG 4.46Å
228	Y	95.8	Very high	93.3	Very high	30 Å²	30	48.3 Å²	48.3	12%	0.118	24%	0.235	C	C	.	.	H	α-helix	trans	-57.9	-46.7	173.9	-178.6	-86	0	0	0	111.4	P224 D225 V230 L231 T232 D270 P271 I275 M296	P224-Y228 VanDerWaalsContact O-CB 3.24Å; P224-Y228 WeakPolarHBondContact O-CB 3.43Å; P224-Y228 PolarHBondContact O-N 3.32Å; D225-Y228 PolarHBondContact O-N 2.76Å; Y228-V230 VanDerWaalsContact C-N 3.35Å; Y228-V230 PolarHBondContact O-N 2.84Å; Y228-L231 PolarHBondContact O-N 3.24Å; Y228-T232 HydrophobicContact CD1-CG2 4.3Å; Y228-T232 HydrophobicContact CE1-CG2 3.89Å; Y228-T232 HydrophobicContact CE2-CG2 4.25Å; Y228-T232 WeakPolarHBondContact O-CG2 3.3Å; Y228-T232 PolarHBondContact O-N 2.76Å; Y228-T232 VanDerWaalsContact O-N 3.14Å; Y228-T232 PolarHBondContact O-OG1 2.91Å; Y228-D270 WeakPolarHBondContact CE2-O 3.49Å; Y228-P271 HydrophobicContact CE1-CB 4.2Å; Y228-P271 HydrophobicContact CE1-CG 4.41Å; Y228-I275 HydrophobicContact CD2-CD1 3.91Å; Y228-I275 HydrophobicContact CD2-CG1 3.85Å; Y228-I275 HydrophobicContact CE2-CD1 4Å; Y228-I275 HydrophobicContact CE2-CG1 3.62Å; Y228-M296 HydrophobicContact CD2-CE 3.81Å
229	R	94.6	Very high	93.3	Very high	118 Å²	118	49 Å²	49	45%	0.445	25%	0.246	S	C	.	.	H	α-helix	trans	-60.6	-43.6	179	-171.5	176.8	65.8	-125.8	-5.5	111.4	D225 D226 L227 L231 T232 T233 L236	D225-R229 WeakPolarHBondContact O-CB 3.28Å; D225-R229 PolarHBondContact O-N 3.15Å; D226-R229 PolarHBondContact O-N 2.96Å; D226-R229 IonicContact OD1-CZ 2.84Å; D226-R229 VanDerWaalsContact OD1-CZ 3.24Å; D226-R229 IonicContact OD1-NH1 2.69Å; D226-R229 PolarHBondContact OD1-NH1 3.03Å; D226-R229 IonicContact OD1-NH2 2.64Å; D226-R229 PolarHBondContact OD1-NH2 2.85Å; L227-R229 VanDerWaalsContact C-N 3.34Å; L227-R229 PolarHBondContact O-N 3.09Å; R229-L231 VanDerWaalsContact C-N 3.28Å; R229-L231 PolarHBondContact O-N 3.42Å; R229-T232 PolarHBondContact O-N 3.35Å; R229-T232 PolarHBondContact O-OG1 3.21Å; R229-T233 WeakPolarHBondContact CG-OG1 3.43Å; R229-T233 WeakPolarHBondContact O-CB 3.5Å; R229-T233 PolarHBondContact O-N 3.09Å; R229-T233 PolarHBondContact O-OG1 3.26Å; R229-L236 HydrophobicContact CG-CD1 3.86Å
230	V	94.1	Very high	93.3	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-63.1	-34.4	178.8	171.1	0	0	0	0	112.3	D226 L227 Y228 L236 V237 F240 L332 Y336 Y338	D226-V230 WeakPolarHBondContact O-CG2 3.38Å; D226-V230 PolarHBondContact O-N 3.33Å; L227-V230 PolarHBondContact O-N 2.78Å; Y228-V230 VanDerWaalsContact C-N 3.35Å; Y228-V230 PolarHBondContact O-N 2.84Å; V230-L236 HydrophobicContact CG1-CB 4.5Å; V230-L236 HydrophobicContact CG2-CD1 3.99Å; V230-V237 VanDerWaalsContact O-CG2 3.24Å; V230-V237 WeakPolarHBondContact O-CG2 3.47Å; V230-F240 HydrophobicContact CG1-CD1 4.07Å; V230-F240 HydrophobicContact CG1-CE1 4.29Å; V230-L332 HydrophobicContact CG1-CD2 3.27Å; V230-Y336 HydrophobicContact CB-CE2 4.34Å; V230-Y336 HydrophobicContact CG1-CD2 3.83Å; V230-Y336 HydrophobicContact CG1-CE2 3.34Å; V230-Y336 HydrophobicContact CG2-CD1 4.47Å; V230-Y336 HydrophobicContact CG2-CD2 4.13Å; V230-Y336 HydrophobicContact CG2-CE1 4.33Å; V230-Y336 HydrophobicContact CG2-CE2 3.97Å; V230-Y336 HydrophobicContact CG2-CG 4.38Å; V230-Y338 HydrophobicContact CG2-CE2 4.14Å
231	L	93.3	Very high	93.1	Very high	24 Å²	24	46.2 Å²	46.2	13%	0.126	23%	0.234	C	C	.	.	H	α-helix	trans	-81.6	-16.9	-179.8	-67.2	170.6	0	0	0	114.1	L227 Y228 R229 I275 L294 L332	L227-L231 HydrophobicContact CD1-CD1 4.4Å; L227-L231 HydrophobicContact CG-CD1 4.26Å; L227-L231 WeakPolarHBondContact O-CG 3.44Å; L227-L231 PolarHBondContact O-N 2.7Å; L227-L231 VanDerWaalsContact O-N 3.15Å; Y228-L231 PolarHBondContact O-N 3.24Å; R229-L231 VanDerWaalsContact C-N 3.28Å; R229-L231 PolarHBondContact O-N 3.42Å; L231-I275 HydrophobicContact CB-CD1 3.9Å; L231-I275 HydrophobicContact CD1-CD1 4.22Å; L231-L294 HydrophobicContact CD1-CD1 3.96Å; L231-L332 HydrophobicContact CD2-CD1 4.12Å
232	T	93.4	Very high	92.9	Very high	9 Å²	9	50.8 Å²	50.8	6%	0.055	25%	0.248	C	C	.	.	H	α-helix	trans	-115.1	-16.7	-174.1	53.9	0	0	0	0	113.8	Y228 R229 V247 P249 L269 I275	Y228-T232 HydrophobicContact CD1-CG2 4.3Å; Y228-T232 HydrophobicContact CE1-CG2 3.89Å; Y228-T232 HydrophobicContact CE2-CG2 4.25Å; Y228-T232 WeakPolarHBondContact O-CG2 3.3Å; Y228-T232 PolarHBondContact O-N 2.76Å; Y228-T232 VanDerWaalsContact O-N 3.14Å; Y228-T232 PolarHBondContact O-OG1 2.91Å; R229-T232 PolarHBondContact O-N 3.35Å; R229-T232 PolarHBondContact O-OG1 3.21Å; T232-V247 VanDerWaalsContact O-CG1 3.3Å; T232-V247 WeakPolarHBondContact O-CG1 3.42Å; T232-P249 WeakPolarHBondContact O-CB 3.2Å; T232-L269 HydrophobicContact CG2-CD2 4.01Å; T232-I275 HydrophobicContact CG2-CD1 3.79Å
233	T	93.3	Very high	92.7	Very high	43 Å²	43	51 Å²	51	26%	0.264	25%	0.25	S	S	.	.			trans	-93.2	121.1	-179.2	-52.4	0	0	0	0	110.5	R229 E235 L236 V237	R229-T233 WeakPolarHBondContact CG-OG1 3.43Å; R229-T233 WeakPolarHBondContact O-CB 3.5Å; R229-T233 PolarHBondContact O-N 3.09Å; R229-T233 PolarHBondContact O-OG1 3.26Å; T233-E235 VanDerWaalsContact C-N 3.31Å; T233-E235 WeakPolarHBondContact CG2-OE2 3.27Å; T233-E235 PolarHBondContact O-N 2.91Å; T233-L236 HydrophobicContact CG2-CD1 4.25Å; T233-L236 HydrophobicContact CG2-CG 4.01Å; T233-L236 PolarHBondContact O-N 2.82Å; T233-V237 WeakPolarHBondContact O-CG2 3.42Å; T233-V237 PolarHBondContact O-N 3.12Å
234	K	93	Very high	92.5	Very high	95 Å²	95	53.6 Å²	53.6	41%	0.413	26%	0.258	S	S	.	.	H	α-helix	trans	-50.3	-47.5	-177	179.5	-174.6	175.9	-176.6	0	113.3	L236 V237 K238 A245 V247	K234-L236 VanDerWaalsContact C-N 3.31Å; K234-L236 PolarHBondContact O-N 2.79Å; K234-V237 PolarHBondContact O-N 2.91Å; K234-K238 WeakPolarHBondContact O-CB 3.5Å; K234-K238 PolarHBondContact O-N 3Å; K234-A245 WeakPolarHBondContact CE-O 3.17Å; K234-V247 HydrophobicContact CB-CB 4.12Å
235	E	93.1	Very high	92.3	Very high	126 Å²	126	52.6 Å²	52.6	59%	0.589	25%	0.251	S	S	*	.	H	α-helix	trans	-64.7	-39	-176.8	-66.8	65.6	-148.7	0	0	110.8	T233 A239	T233-E235 VanDerWaalsContact C-N 3.31Å; T233-E235 WeakPolarHBondContact CG2-OE2 3.27Å; T233-E235 PolarHBondContact O-N 2.91Å; E235-A239 PolarHBondContact O-N 2.93Å; E235-A239 VanDerWaalsContact O-N 3.11Å
236	L	93.7	Very high	92.2	Very high	42 Å²	42	51.5 Å²	51.5	22%	0.22	25%	0.248	C	C	.	.	H	α-helix	trans	-74	-38.3	178.9	-60.8	-178	0	0	0	111.7	R229 V230 T233 K234 A239 F240 Y336	R229-L236 HydrophobicContact CG-CD1 3.86Å; V230-L236 HydrophobicContact CG1-CB 4.5Å; V230-L236 HydrophobicContact CG2-CD1 3.99Å; T233-L236 HydrophobicContact CG2-CD1 4.25Å; T233-L236 HydrophobicContact CG2-CG 4.01Å; T233-L236 PolarHBondContact O-N 2.82Å; K234-L236 VanDerWaalsContact C-N 3.31Å; K234-L236 PolarHBondContact O-N 2.79Å; L236-A239 PolarHBondContact O-N 2.96Å; L236-F240 WeakPolarHBondContact O-CD1 2.95Å; L236-F240 PolarHBondContact O-N 3.31Å; L236-Y336 VanDerWaalsContact C-OH 3.22Å; L236-Y336 WeakPolarHBondContact CA-OH 3.26Å; L236-Y336 VanDerWaalsContact CB-OH 3.23Å; L236-Y336 WeakPolarHBondContact CB-OH 3.45Å; L236-Y336 HydrophobicContact CD2-CE1 4.02Å; L236-Y336 WeakPolarHBondContact CD2-OH 3.42Å; L236-Y336 PolarHBondContact O-OH 3.41Å
237	V	92.4	Very high	92.2	Very high	6 Å²	6	50.4 Å²	50.4	4%	0.036	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-49.1	173.5	174	0	0	0	0	110.3	V230 T233 K234 A239 F240 T241 A245 V247 V257	V230-V237 VanDerWaalsContact O-CG2 3.24Å; V230-V237 WeakPolarHBondContact O-CG2 3.47Å; T233-V237 WeakPolarHBondContact O-CG2 3.42Å; T233-V237 PolarHBondContact O-N 3.12Å; K234-V237 PolarHBondContact O-N 2.91Å; V237-A239 PolarHBondContact O-N 3.17Å; V237-F240 VanDerWaalsContact CA-CE1 3.49Å; V237-F240 HydrophobicContact CB-CE1 4.08Å; V237-F240 HydrophobicContact CG1-CE1 4.12Å; V237-F240 HydrophobicContact CG1-CZ 4.27Å; V237-F240 HydrophobicContact CG2-CE1 4.01Å; V237-F240 WeakPolarHBondContact O-CD1 3.49Å; V237-F240 PolarHBondContact O-N 3.12Å; V237-T241 HydrophobicContact CG1-CG2 3.95Å; V237-T241 WeakPolarHBondContact O-CB 3.43Å; V237-T241 VanDerWaalsContact O-CG2 3.28Å; V237-T241 WeakPolarHBondContact O-CG2 3.47Å; V237-T241 PolarHBondContact O-N 3.18Å; V237-T241 PolarHBondContact O-OG1 3.02Å; V237-A245 HydrophobicContact CG1-CB 4Å; V237-V247 HydrophobicContact CB-CG2 3.93Å; V237-V247 HydrophobicContact CG1-CG2 3.98Å; V237-V247 HydrophobicContact CG2-CG2 3.97Å; V237-V257 HydrophobicContact CG1-CG1 3.48Å; V237-V257 VanDerWaalsContact CG1-CG1 3.48Å
238	K	92.5	Very high	92.2	Very high	81 Å²	81	54 Å²	54	35%	0.352	26%	0.263	S	S	.	.	H	α-helix	trans	-56.1	-36.9	176.6	-178.3	165.1	-176.4	166.2	0	112.8	K234 T241 R242 E244 A245	K234-K238 WeakPolarHBondContact O-CB 3.5Å; K234-K238 PolarHBondContact O-N 3Å; K238-T241 PolarHBondContact O-OG1 3.38Å; K238-R242 PolarHBondContact O-N 3.36Å; K238-R242 VanDerWaalsContact O-N 3.1Å; K238-E244 WeakPolarHBondContact CE-OE1 3.38Å; K238-E244 IonicContact NZ-OE1 3.27Å; K238-E244 PolarHBondContact NZ-OE1 3.33Å; K238-E244 IonicContact NZ-OE2 3Å; K238-E244 PolarHBondContact NZ-OE2 2.88Å; K238-A245 HydrophobicContact CB-CB 4.4Å
239	A	92	Very high	92	Very high	48 Å²	48	55.9 Å²	55.9	40%	0.397	28%	0.278	S	S	.	.	H	α-helix	trans	-65.6	-47.3	179.9	0	0	0	0	0	112.7	E235 L236 V237 T335	E235-A239 PolarHBondContact O-N 2.93Å; E235-A239 VanDerWaalsContact O-N 3.11Å; L236-A239 PolarHBondContact O-N 2.96Å; V237-A239 PolarHBondContact O-N 3.17Å; A239-T335 HydrophobicContact CB-CG2 4.34Å
240	F	90	Very high	91.9	Very high	5 Å²	5	53.8 Å²	53.8	2%	0.022	28%	0.278	C	S	.	.	H	α-helix	trans	-80.6	-30.4	-178.9	81.8	-101.7	0	0	0	112.9	V230 L236 V237 R242 F328 A331 L332 T335 Y336	V230-F240 HydrophobicContact CG1-CD1 4.07Å; V230-F240 HydrophobicContact CG1-CE1 4.29Å; L236-F240 WeakPolarHBondContact O-CD1 2.95Å; L236-F240 PolarHBondContact O-N 3.31Å; V237-F240 VanDerWaalsContact CA-CE1 3.49Å; V237-F240 HydrophobicContact CB-CE1 4.08Å; V237-F240 HydrophobicContact CG1-CE1 4.12Å; V237-F240 HydrophobicContact CG1-CZ 4.27Å; V237-F240 HydrophobicContact CG2-CE1 4.01Å; V237-F240 WeakPolarHBondContact O-CD1 3.49Å; V237-F240 PolarHBondContact O-N 3.12Å; F240-R242 VanDerWaalsContact C-N 3.26Å; F240-R242 PolarHBondContact O-N 3.01Å; F240-F328 AromaticContact CE2-CD1 3.75Å; F240-F328 HydrophobicContact CE2-CD1 3.75Å; F240-F328 HydrophobicContact CE2-CE1 4.2Å; F240-F328 HydrophobicContact CZ-CD1 4.08Å; F240-F328 HydrophobicContact CZ-CE1 4.27Å; F240-A331 HydrophobicContact CD2-CB 4.18Å; F240-A331 WeakPolarHBondContact O-CB 3.4Å; F240-L332 HydrophobicContact CB-CD2 4.36Å; F240-L332 HydrophobicContact CD1-CD2 3.49Å; F240-L332 VanDerWaalsContact CD1-CD2 3.49Å; F240-L332 HydrophobicContact CD1-CG 4.32Å; F240-L332 HydrophobicContact CD2-CD2 4.1Å; F240-L332 HydrophobicContact CD2-CG 4.04Å; F240-L332 HydrophobicContact CE1-CD2 3.65Å; F240-L332 HydrophobicContact CE1-CG 4.4Å; F240-L332 HydrophobicContact CE2-CD2 4.28Å; F240-L332 HydrophobicContact CE2-CG 4.17Å; F240-L332 HydrophobicContact CG-CD2 3.74Å; F240-L332 HydrophobicContact CG-CG 4.14Å; F240-L332 HydrophobicContact CZ-CD2 4.07Å; F240-L332 HydrophobicContact CZ-CG 4.36Å; F240-T335 HydrophobicContact CB-CG2 4.19Å; F240-Y336 HydrophobicContact CB-CE2 4.04Å; F240-Y336 HydrophobicContact CD1-CE2 4.29Å
241	T	88.7	Confident	91.8	Very high	9 Å²	9	58.3 Å²	58.3	6%	0.055	31%	0.306	C	S	.	.	H	α-helix	trans	-77.2	-14	177	64	0	0	0	0	113.1	V237 K238 S243 V257 F258	V237-T241 HydrophobicContact CG1-CG2 3.95Å; V237-T241 WeakPolarHBondContact O-CB 3.43Å; V237-T241 VanDerWaalsContact O-CG2 3.28Å; V237-T241 WeakPolarHBondContact O-CG2 3.47Å; V237-T241 PolarHBondContact O-N 3.18Å; V237-T241 PolarHBondContact O-OG1 3.02Å; K238-T241 PolarHBondContact O-OG1 3.38Å; T241-S243 WeakPolarHBondContact CB-OG 3.48Å; T241-S243 PolarHBondContact O-N 2.84Å; T241-S243 PolarHBondContact O-OG 2.86Å; T241-S243 PolarHBondContact OG1-O 2.85Å; T241-S243 PolarHBondContact OG1-OG 2.9Å; T241-V257 HydrophobicContact CG2-CB 4.24Å; T241-V257 HydrophobicContact CG2-CG1 4.41Å; T241-F258 HydrophobicContact CG2-CE1 4.33Å; T241-F258 HydrophobicContact CG2-CE2 4.01Å; T241-F258 HydrophobicContact CG2-CZ 3.9Å
242	R	87.5	Confident	91.7	Very high	179 Å²	179	59.7 Å²	59.7	68%	0.675	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	30.7	-176.8	-55	-176.6	-176	174.1	6.2	113.3	K238 F240 Q334	K238-R242 PolarHBondContact O-N 3.36Å; K238-R242 VanDerWaalsContact O-N 3.1Å; F240-R242 VanDerWaalsContact C-N 3.26Å; F240-R242 PolarHBondContact O-N 3.01Å; R242-Q334 VanDerWaalsContact NH2-OE1 3.11Å
243	S	88.6	Confident	91.6	Very high	20 Å²	20	59.4 Å²	59.4	14%	0.14	32%	0.324	C	S	.	.	S	Bend	trans	-149.2	161.8	-174	50.5	0	0	0	0	110.9	T241 A245 F258	T241-S243 WeakPolarHBondContact CB-OG 3.48Å; T241-S243 PolarHBondContact O-N 2.84Å; T241-S243 PolarHBondContact O-OG 2.86Å; T241-S243 PolarHBondContact OG1-O 2.85Å; T241-S243 PolarHBondContact OG1-OG 2.9Å; S243-A245 PolarHBondContact O-N 2.89Å; S243-F258 WeakPolarHBondContact OG-CA 3.13Å; S243-F258 PolarHBondContact OG-N 2.92Å
244	E	89	Confident	91.7	Very high	122 Å²	122	60 Å²	60	57%	0.57	33%	0.334	S	S	*	.			trans	-58	132.4	173.6	-73.2	-57.9	147.5	0	0	110.6	K238	K238-E244 WeakPolarHBondContact CE-OE1 3.38Å; K238-E244 IonicContact NZ-OE1 3.27Å; K238-E244 PolarHBondContact NZ-OE1 3.33Å; K238-E244 IonicContact NZ-OE2 3Å; K238-E244 PolarHBondContact NZ-OE2 2.88Å
245	A	90.2	Very high	91.7	Very high	3 Å²	3	56.2 Å²	56.2	3%	0.025	32%	0.317	C	S	.	.			trans	-136.4	138.6	-178.7	0	0	0	0	0	110.4	K234 V237 K238 S243 S256 V257	K234-A245 WeakPolarHBondContact CE-O 3.17Å; V237-A245 HydrophobicContact CG1-CB 4Å; K238-A245 HydrophobicContact CB-CB 4.4Å; S243-A245 PolarHBondContact O-N 2.89Å; A245-S256 CarbonylContact C-O 3.56Å; A245-S256 WeakPolarHBondContact CA-O 3.13Å; A245-V257 HydrophobicContact CB-CG1 4.15Å
246	T	92.6	Very high	91.8	Very high	79 Å²	79	51.5 Å²	51.5	49%	0.485	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.2	166.2	63.3	0	0	0	0	107.5	Y255 S256	T246-Y255 CarbonylContact O-C 3.48Å; T246-Y255 WeakPolarHBondContact O-CA 3.27Å; T246-Y255 WeakPolarHBondContact O-CB 3.35Å; T246-S256 PolarHBondContact N-O 3.42Å; T246-S256 PolarHBondContact O-N 2.8Å; T246-S256 WeakPolarHBondContact OG1-CB 3.39Å; T246-S256 PolarHBondContact OG1-N 2.84Å
247	V	94.2	Very high	91.7	Very high	18 Å²	18	49.8 Å²	49.8	11%	0.109	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	118	177.8	-175.3	0	0	0	0	106.5	T232 K234 V237 F266	T232-V247 VanDerWaalsContact O-CG1 3.3Å; T232-V247 WeakPolarHBondContact O-CG1 3.42Å; K234-V247 HydrophobicContact CB-CB 4.12Å; V237-V247 HydrophobicContact CB-CG2 3.93Å; V237-V247 HydrophobicContact CG1-CG2 3.98Å; V237-V247 HydrophobicContact CG2-CG2 3.97Å; V247-F266 HydrophobicContact CG1-CE2 3.96Å; V247-F266 HydrophobicContact CG1-CZ 3.99Å
248	D	94.2	Very high	91.5	Very high	77 Å²	77	51.3 Å²	51.3	41%	0.412	30%	0.296	S	S	.	.			trans	-110.4	96.7	173.4	-175.7	16.1	0	0	0	108.7	V250 G253 A254 F266	D248-V250 PolarHBondContact O-N 2.92Å; D248-G253 WeakPolarHBondContact OD2-CA 3.03Å; D248-A254 PolarHBondContact N-O 3.35Å; D248-A254 VanDerWaalsContact N-O 3.16Å; D248-F266 WeakPolarHBondContact O-CD2 3.29Å; D248-F266 WeakPolarHBondContact O-CE2 3.47Å
249	P	91.5	Very high	91.1	Very high	69 Å²	69	51.2 Å²	51.2	45%	0.448	31%	0.305	S	S	.	.			trans	-80.1	51.7	-169.3	33.6	-36.2	0	0	0	112.8	T232	T232-P249 WeakPolarHBondContact O-CB 3.2Å
250	V	91.9	Very high	90.9	Very high	73 Å²	73	49.6 Å²	49.6	44%	0.442	29%	0.293	S	S	.	.	S	Bend	trans	-124.1	154.9	173.3	-59.9	0	0	0	0	109.6	D248 G252 G253	D248-V250 PolarHBondContact O-N 2.92Å; V250-G252 PolarHBondContact O-N 3.21Å; V250-G253 WeakPolarHBondContact O-CA 3.43Å; V250-G253 PolarHBondContact O-N 2.88Å
251	V	93.3	Very high	90.8	Very high	96 Å²	96	53.2 Å²	53.2	58%	0.582	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	123.5	173.2	176.3	0	0	0	0	108.7	G253 D267 L269	V251-G253 VanDerWaalsContact C-N 3.34Å; V251-D267 WeakPolarHBondContact CG1-O 3.4Å; V251-L269 HydrophobicContact CG2-CB 4.42Å
252	G	90	Very high	90.9	Very high	53 Å²	53	53.7 Å²	53.7	55%	0.546	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	-7.3	-170.3	0	0	0	0	0	114.6	V250 I265 F266	V250-G252 PolarHBondContact O-N 3.21Å; G252-I265 WeakPolarHBondContact O-CG2 3.47Å; G252-F266 WeakPolarHBondContact CA-O 3.39Å; G252-F266 PolarHBondContact N-O 3.3Å
253	G	92.8	Very high	91.2	Very high	3 Å²	3	47.1 Å²	47.1	3%	0.031	30%	0.295	C	S	.	.			trans	-68.1	140.3	177.1	0	0	0	0	0	111.9	D248 V250 V251 I265 F266	D248-G253 WeakPolarHBondContact OD2-CA 3.03Å; V250-G253 WeakPolarHBondContact O-CA 3.43Å; V250-G253 PolarHBondContact O-N 2.88Å; V251-G253 VanDerWaalsContact C-N 3.34Å; G253-I265 WeakPolarHBondContact O-CA 3.4Å; G253-F266 WeakPolarHBondContact O-CD2 3.18Å; G253-F266 PolarHBondContact O-N 2.74Å
254	A	93.9	Very high	91.4	Very high	57 Å²	57	46.4 Å²	46.4	47%	0.471	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	149.2	179.6	0	0	0	0	0	111.6	D248 G264	D248-A254 PolarHBondContact N-O 3.35Å; D248-A254 VanDerWaalsContact N-O 3.16Å; A254-G264 WeakPolarHBondContact CA-O 3.27Å
255	Y	94.8	Very high	91.7	Very high	15 Å²	15	42.6 Å²	42.6	6%	0.059	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	152.3	169.5	71.5	-89.4	0	0	0	111.8	T246 I262 T263 G264 F266 M277 R278 W279	T246-Y255 CarbonylContact O-C 3.48Å; T246-Y255 WeakPolarHBondContact O-CA 3.27Å; T246-Y255 WeakPolarHBondContact O-CB 3.35Å; Y255-I262 HydrophobicContact CE2-CG2 4.38Å; Y255-T263 WeakPolarHBondContact O-CA 3.24Å; Y255-G264 VanDerWaalsContact CD1-C 3.5Å; Y255-G264 VanDerWaalsContact CE1-CA 3.42Å; Y255-G264 PolarHBondContact N-O 3.47Å; Y255-G264 PolarHBondContact O-N 3.35Å; Y255-F266 HydrophobicContact CD1-CD2 4.2Å; Y255-F266 HydrophobicContact CD1-CE1 4.35Å; Y255-F266 AromaticContact CD1-CE2 3.91Å; Y255-F266 HydrophobicContact CD1-CE2 3.91Å; Y255-F266 AromaticContact CD1-CZ 3.98Å; Y255-F266 HydrophobicContact CD1-CZ 3.98Å; Y255-F266 HydrophobicContact CG-CE2 4.3Å; Y255-F266 HydrophobicContact CG-CZ 4.32Å; Y255-M277 HydrophobicContact CE1-CB 3.94Å; Y255-M277 HydrophobicContact CE1-CG 4.12Å; Y255-M277 HydrophobicContact CE1-SD 3.66Å; Y255-M277 HydrophobicContact CE2-SD 4.36Å; Y255-M277 VanDerWaalsContact CZ-SD 3.53Å; Y255-M277 PolarHBondContact OH-SD 3.36Å; Y255-M277 VanDerWaalsContact OH-SD 3.34Å; Y255-R278 PolarHBondContact OH-O 3.3Å; Y255-W279 VanDerWaalsContact OH-CD1 3.31Å
256	S	93.8	Very high	91.9	Very high	27 Å²	27	42.6 Å²	42.6	19%	0.189	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	125.7	178.5	-175.1	0	0	0	0	108	A245 T246 G260 I262	A245-S256 CarbonylContact C-O 3.56Å; A245-S256 WeakPolarHBondContact CA-O 3.13Å; T246-S256 PolarHBondContact N-O 3.42Å; T246-S256 PolarHBondContact O-N 2.8Å; T246-S256 WeakPolarHBondContact OG1-CB 3.39Å; T246-S256 PolarHBondContact OG1-N 2.84Å; S256-G260 VanDerWaalsContact OG-CA 3.23Å; S256-G260 WeakPolarHBondContact OG-CA 3.39Å; S256-I262 WeakPolarHBondContact CA-O 3.25Å
257	V	91.8	Very high	91.8	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.03	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	163.4	-177.4	-65.8	0	0	0	0	110.2	V237 T241 A245 S259 G260 N261 I262 F328	V237-V257 HydrophobicContact CG1-CG1 3.48Å; V237-V257 VanDerWaalsContact CG1-CG1 3.48Å; T241-V257 HydrophobicContact CG2-CB 4.24Å; T241-V257 HydrophobicContact CG2-CG1 4.41Å; A245-V257 HydrophobicContact CB-CG1 4.15Å; V257-S259 PolarHBondContact O-N 2.86Å; V257-G260 PolarHBondContact O-N 2.83Å; V257-N261 PolarHBondContact O-N 3.16Å; V257-I262 HydrophobicContact CG2-CB 3.8Å; V257-I262 HydrophobicContact CG2-CG2 3.76Å; V257-I262 PolarHBondContact N-O 3.34Å; V257-I262 PolarHBondContact O-N 2.68Å; V257-F328 HydrophobicContact CG2-CE1 4.46Å; V257-F328 HydrophobicContact CG2-CZ 3.94Å
258	F	88.3	Confident	91.8	Very high	38 Å²	38	44.2 Å²	44.2	17%	0.167	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	50	-174.8	-61.5	-76	0	0	0	112.3	T241 S243 G260 N261 I262 I327 F328	T241-F258 HydrophobicContact CG2-CE1 4.33Å; T241-F258 HydrophobicContact CG2-CE2 4.01Å; T241-F258 HydrophobicContact CG2-CZ 3.9Å; S243-F258 WeakPolarHBondContact OG-CA 3.13Å; S243-F258 PolarHBondContact OG-N 2.92Å; F258-G260 PolarHBondContact O-N 3.11Å; F258-N261 HydrophobicContact CB-CB 4.16Å; F258-N261 VanDerWaalsContact O-CB 3.31Å; F258-N261 WeakPolarHBondContact O-CB 3.35Å; F258-N261 PolarHBondContact O-N 3.02Å; F258-I262 HydrophobicContact CD2-CD1 3.93Å; F258-I262 HydrophobicContact CE2-CD1 4.46Å; F258-I327 HydrophobicContact CD1-CG2 4.27Å; F258-I327 HydrophobicContact CE1-CG2 3.39Å; F258-I327 HydrophobicContact CE2-CG2 4.31Å; F258-I327 HydrophobicContact CZ-CG2 3.43Å; F258-I327 VanDerWaalsContact CZ-CG2 3.43Å; F258-F328 HydrophobicContact CD2-CE2 4.08Å; F258-F328 HydrophobicContact CD2-CZ 4.06Å; F258-F328 HydrophobicContact CE2-CD1 4.33Å; F258-F328 AromaticContact CE2-CD2 3.88Å; F258-F328 HydrophobicContact CE2-CD2 3.88Å; F258-F328 AromaticContact CE2-CE1 3.89Å; F258-F328 HydrophobicContact CE2-CE1 3.89Å; F258-F328 AromaticContact CE2-CE2 3.4Å; F258-F328 HydrophobicContact CE2-CE2 3.4Å; F258-F328 HydrophobicContact CE2-CG 4.34Å; F258-F328 AromaticContact CE2-CZ 3.43Å; F258-F328 HydrophobicContact CE2-CZ 3.43Å; F258-F328 VanDerWaalsContact CE2-CZ 3.43Å; F258-F328 HydrophobicContact CZ-CD2 4.38Å; F258-F328 HydrophobicContact CZ-CE2 4.31Å; F258-F328 HydrophobicContact CZ-CZ 4.49Å
259	S	84.9	Confident	91.8	Very high	80 Å²	80	41.9 Å²	41.9	56%	0.559	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	34.4	-179.3	-55.8	0	0	0	0	113.4	V257 R282	V257-S259 PolarHBondContact O-N 2.86Å; S259-R282 PolarHBondContact O-NH2 2.83Å
260	G	86.6	Confident	91.9	Very high	13 Å²	13	41.5 Å²	41.5	13%	0.134	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	18.1	-179.4	0	0	0	0	0	114.8	S256 V257 F258 R282	S256-G260 VanDerWaalsContact OG-CA 3.23Å; S256-G260 WeakPolarHBondContact OG-CA 3.39Å; V257-G260 PolarHBondContact O-N 2.83Å; F258-G260 PolarHBondContact O-N 3.11Å; G260-R282 PolarHBondContact O-NE 2.81Å; G260-R282 VanDerWaalsContact O-NE 3.14Å; G260-R282 PolarHBondContact O-NH2 2.84Å
261	N	88.2	Confident	91.9	Very high	82 Å²	82	42 Å²	42	44%	0.439	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-27.4	168	-75.7	-4.6	0	0	0	111.1	V257 F258 K281 R282	V257-N261 PolarHBondContact O-N 3.16Å; F258-N261 HydrophobicContact CB-CB 4.16Å; F258-N261 VanDerWaalsContact O-CB 3.31Å; F258-N261 WeakPolarHBondContact O-CB 3.35Å; F258-N261 PolarHBondContact O-N 3.02Å; N261-K281 CarbonylContact O-C 3.39Å; N261-K281 VanDerWaalsContact O-CA 3.28Å; N261-K281 WeakPolarHBondContact O-CA 3.48Å; N261-R282 PolarHBondContact O-N 2.77Å
262	I	92	Very high	91.7	Very high	18 Å²	18	37.9 Å²	37.9	9%	0.092	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.2	175.9	-68.3	167.3	0	0	0	108.8	Y255 S256 V257 F258 W279 R280 K281 F328	Y255-I262 HydrophobicContact CE2-CG2 4.38Å; S256-I262 WeakPolarHBondContact CA-O 3.25Å; V257-I262 HydrophobicContact CG2-CB 3.8Å; V257-I262 HydrophobicContact CG2-CG2 3.76Å; V257-I262 PolarHBondContact N-O 3.34Å; V257-I262 PolarHBondContact O-N 2.68Å; F258-I262 HydrophobicContact CD2-CD1 3.93Å; F258-I262 HydrophobicContact CE2-CD1 4.46Å; I262-W279 HydrophobicContact CB-CZ2 4.47Å; I262-W279 HydrophobicContact CD1-CH2 4.23Å; I262-W279 HydrophobicContact CD1-CZ2 3.45Å; I262-W279 VanDerWaalsContact CD1-CZ2 3.45Å; I262-W279 HydrophobicContact CG1-CH2 4.24Å; I262-W279 HydrophobicContact CG1-CZ2 3.72Å; I262-W279 HydrophobicContact CG2-CD2 4.21Å; I262-W279 HydrophobicContact CG2-CG 4.41Å; I262-W279 HydrophobicContact CG2-CZ2 3.93Å; I262-W279 VanDerWaalsContact CG2-NE1 3.31Å; I262-R280 WeakPolarHBondContact CA-O 3.47Å; I262-K281 HydrophobicContact CG1-CG 4.48Å; I262-F328 HydrophobicContact CD1-CE2 3.55Å; I262-F328 HydrophobicContact CD1-CZ 4.04Å
263	T	93.2	Very high	91.9	Very high	42 Å²	42	41.6 Å²	41.6	26%	0.258	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	159.9	179.9	60	0	0	0	0	110.9	Y255 R280	Y255-T263 WeakPolarHBondContact O-CA 3.24Å; T263-R280 PolarHBondContact N-O 3.09Å; T263-R280 VanDerWaalsContact N-O 3.09Å; T263-R280 PolarHBondContact O-N 3.13Å; T263-R280 WeakPolarHBondContact OG1-CG 3.49Å
264	G	93.4	Very high	92	Very high	5 Å²	5	42.2 Å²	42.2	5%	0.052	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	-176.6	-176.9	0	0	0	0	0	114.7	A254 Y255 R278	A254-G264 WeakPolarHBondContact CA-O 3.27Å; Y255-G264 VanDerWaalsContact CD1-C 3.5Å; Y255-G264 VanDerWaalsContact CE1-CA 3.42Å; Y255-G264 PolarHBondContact N-O 3.47Å; Y255-G264 PolarHBondContact O-N 3.35Å; G264-R278 CarbonylContact C-O 3.51Å; G264-R278 WeakPolarHBondContact CA-O 3.43Å
265	I	93.8	Very high	92.1	Very high	42 Å²	42	39.5 Å²	39.5	22%	0.215	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	135.1	-178.7	-59.4	172.7	0	0	0	108.2	G252 G253 D267 M277 R278	G252-I265 WeakPolarHBondContact O-CG2 3.47Å; G253-I265 WeakPolarHBondContact O-CA 3.4Å; I265-D267 PolarHBondContact O-N 2.95Å; I265-M277 CarbonylContact O-C 3.58Å; I265-M277 WeakPolarHBondContact O-CA 3.42Å; I265-M277 WeakPolarHBondContact O-CB 3.49Å; I265-R278 PolarHBondContact N-O 2.78Å; I265-R278 VanDerWaalsContact N-O 3.15Å; I265-R278 PolarHBondContact O-N 2.76Å
266	F	94.9	Very high	92.1	Very high	3 Å²	3	42.1 Å²	42.1	1%	0.013	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	119.9	172.8	-66.4	-73.5	0	0	0	110.3	V247 D248 G252 G253 Y255 L269 I275 M277	V247-F266 HydrophobicContact CG1-CE2 3.96Å; V247-F266 HydrophobicContact CG1-CZ 3.99Å; D248-F266 WeakPolarHBondContact O-CD2 3.29Å; D248-F266 WeakPolarHBondContact O-CE2 3.47Å; G252-F266 WeakPolarHBondContact CA-O 3.39Å; G252-F266 PolarHBondContact N-O 3.3Å; G253-F266 WeakPolarHBondContact O-CD2 3.18Å; G253-F266 PolarHBondContact O-N 2.74Å; Y255-F266 HydrophobicContact CD1-CD2 4.2Å; Y255-F266 HydrophobicContact CD1-CE1 4.35Å; Y255-F266 AromaticContact CD1-CE2 3.91Å; Y255-F266 HydrophobicContact CD1-CE2 3.91Å; Y255-F266 AromaticContact CD1-CZ 3.98Å; Y255-F266 HydrophobicContact CD1-CZ 3.98Å; Y255-F266 HydrophobicContact CG-CE2 4.3Å; Y255-F266 HydrophobicContact CG-CZ 4.32Å; F266-L269 HydrophobicContact CB-CD1 4.15Å; F266-L269 HydrophobicContact CB-CG 4.25Å; F266-L269 HydrophobicContact CD1-CD2 3.8Å; F266-L269 HydrophobicContact CD1-CG 4.35Å; F266-L269 HydrophobicContact CE1-CD2 4.24Å; F266-L269 HydrophobicContact CG-CD1 4.25Å; F266-L269 HydrophobicContact CG-CD2 4.32Å; F266-L269 HydrophobicContact CG-CG 4.43Å; F266-I275 HydrophobicContact CD1-CG2 3.83Å; F266-I275 HydrophobicContact CE1-CG2 3.99Å; F266-M277 HydrophobicContact CD1-CB 4.15Å; F266-M277 HydrophobicContact CD1-CE 4.29Å; F266-M277 HydrophobicContact CE1-CE 3.85Å; F266-M277 HydrophobicContact CE1-SD 4.41Å
267	D	91.1	Very high	92.2	Very high	53 Å²	53	41.5 Å²	41.5	28%	0.283	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-32.8	178.7	-59.9	-48.6	0	0	0	111.5	V251 I265 Q276 R278	V251-D267 WeakPolarHBondContact CG1-O 3.4Å; I265-D267 PolarHBondContact O-N 2.95Å; D267-Q276 PolarHBondContact N-O 3.09Å; D267-R278 IonicContact OD1-CZ 3.48Å; D267-R278 IonicContact OD1-NE 2.76Å; D267-R278 PolarHBondContact OD1-NE 2.65Å; D267-R278 IonicContact OD1-NH2 3.95Å; D267-R278 PolarHBondContact OD1-NH2 3.43Å; D267-R278 WeakPolarHBondContact OD2-CG 3.48Å; D267-R278 PolarHBondContact OD2-N 3.02Å; D267-R278 VanDerWaalsContact OD2-N 3.12Å; D267-R278 IonicContact OD2-NE 2.63Å
268	L	92.9	Very high	92.4	Very high	78 Å²	78	46 Å²	46	41%	0.408	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	137.9	174.9	-171.4	71.1	0	0	0	110.9	Q276	L268-Q276 HydrophobicContact CB-CB 3.93Å; L268-Q276 HydrophobicContact CB-CG 4.17Å; L268-Q276 HydrophobicContact CD2-CG 4.49Å; L268-Q276 PolarHBondContact N-O 2.95Å; L268-Q276 PolarHBondContact O-N 3.37Å
269	L	94.4	Very high	92.7	Very high	28 Å²	28	44.5 Å²	44.5	15%	0.147	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	113.2	177.4	-73.7	168.9	0	0	0	109	T232 V251 F266 I275	T232-L269 HydrophobicContact CG2-CD2 4.01Å; V251-L269 HydrophobicContact CG2-CB 4.42Å; F266-L269 HydrophobicContact CB-CD1 4.15Å; F266-L269 HydrophobicContact CB-CG 4.25Å; F266-L269 HydrophobicContact CD1-CD2 3.8Å; F266-L269 HydrophobicContact CD1-CG 4.35Å; F266-L269 HydrophobicContact CE1-CD2 4.24Å; F266-L269 HydrophobicContact CG-CD1 4.25Å; F266-L269 HydrophobicContact CG-CD2 4.32Å; F266-L269 HydrophobicContact CG-CG 4.43Å; L269-I275 HydrophobicContact CD2-CB 4.4Å; L269-I275 HydrophobicContact CD2-CG1 4.08Å; L269-I275 HydrophobicContact CD2-CG2 3.7Å
270	D	93	Very high	93	Very high	60 Å²	60	42.1 Å²	42.1	32%	0.321	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	99.1	174.2	-173.5	12.4	0	0	0	108.9	Y228 G272 K273 S274	Y228-D270 WeakPolarHBondContact CE2-O 3.49Å; D270-G272 PolarHBondContact O-N 2.97Å; D270-K273 HydrophobicContact CB-CB 4.28Å; D270-K273 PolarHBondContact O-N 2.85Å; D270-K273 WeakPolarHBondContact OD2-CB 3.43Å; D270-K273 WeakPolarHBondContact OD2-CD 3.31Å; D270-S274 PolarHBondContact N-O 3.12Å; D270-S274 PolarHBondContact O-N 2.82Å; D270-S274 VanDerWaalsContact O-O 3.13Å
271	P	92.8	Very high	93.3	Very high	83 Å²	83	43.3 Å²	43.3	54%	0.539	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	128.2	-174.9	-30.4	36.5	0	0	0	113.7	Y228 K273	Y228-P271 HydrophobicContact CE1-CB 4.2Å; Y228-P271 HydrophobicContact CE1-CG 4.41Å; P271-K273 PolarHBondContact O-N 2.83Å; P271-K273 VanDerWaalsContact O-N 3.12Å
272	G	89.7	Confident	93.3	Very high	10 Å²	10	45.8 Å²	45.8	10%	0.103	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	0.3	178.5	0	0	0	0	0	115.6	P224 D225 D270	P224-G272 WeakPolarHBondContact CB-O 3.27Å; D225-G272 VanDerWaalsContact OD1-CA 3.3Å; D225-G272 WeakPolarHBondContact OD1-CA 3.35Å; D270-G272 PolarHBondContact O-N 2.97Å
273	K	93.3	Very high	93	Very high	131 Å²	131	51 Å²	51	57%	0.57	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.5	-58.2	-174	-70.7	173.4	-179.8	170.4	0	113.5	D270 P271 M296	D270-K273 HydrophobicContact CB-CB 4.28Å; D270-K273 PolarHBondContact O-N 2.85Å; D270-K273 WeakPolarHBondContact OD2-CB 3.43Å; D270-K273 WeakPolarHBondContact OD2-CD 3.31Å; P271-K273 PolarHBondContact O-N 2.83Å; P271-K273 VanDerWaalsContact O-N 3.12Å; K273-M296 PolarHBondContact O-N 3.39Å
274	S	94.6	Very high	92.8	Very high	17 Å²	17	49.4 Å²	49.4	12%	0.119	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	153.1	-176.4	70.5	0	0	0	0	114.5	D270 L294	D270-S274 PolarHBondContact N-O 3.12Å; D270-S274 PolarHBondContact O-N 2.82Å; D270-S274 VanDerWaalsContact O-O 3.13Å; S274-L294 CarbonylContact C-O 3.53Å; S274-L294 WeakPolarHBondContact CA-O 3.39Å; S274-L294 WeakPolarHBondContact CB-O 3.43Å
275	I	96	Very high	92.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.5	173.5	-56	167.7	0	0	0	107.6	Y228 L231 T232 F266 L269 M277 T293 L294 M296	Y228-I275 HydrophobicContact CD2-CD1 3.91Å; Y228-I275 HydrophobicContact CD2-CG1 3.85Å; Y228-I275 HydrophobicContact CE2-CD1 4Å; Y228-I275 HydrophobicContact CE2-CG1 3.62Å; L231-I275 HydrophobicContact CB-CD1 3.9Å; L231-I275 HydrophobicContact CD1-CD1 4.22Å; T232-I275 HydrophobicContact CG2-CD1 3.79Å; F266-I275 HydrophobicContact CD1-CG2 3.83Å; F266-I275 HydrophobicContact CE1-CG2 3.99Å; L269-I275 HydrophobicContact CD2-CB 4.4Å; L269-I275 HydrophobicContact CD2-CG1 4.08Å; L269-I275 HydrophobicContact CD2-CG2 3.7Å; I275-M277 HydrophobicContact CB-CE 4.17Å; I275-M277 HydrophobicContact CG2-CE 3.3Å; I275-T293 WeakPolarHBondContact O-CA 3.21Å; I275-L294 HydrophobicContact CB-CB 4.35Å; I275-L294 PolarHBondContact N-O 3.42Å; I275-L294 PolarHBondContact O-N 3.24Å; I275-M296 HydrophobicContact CD1-CE 4.31Å; I275-M296 HydrophobicContact CG1-CE 4.16Å
276	Q	95.5	Very high	91.8	Very high	70 Å²	70	57.6 Å²	57.6	33%	0.327	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.6	169.5	-56	-177.9	15.5	0	0	109.1	D267 L268 L292 T293	D267-Q276 PolarHBondContact N-O 3.09Å; L268-Q276 HydrophobicContact CB-CB 3.93Å; L268-Q276 HydrophobicContact CB-CG 4.17Å; L268-Q276 HydrophobicContact CD2-CG 4.49Å; L268-Q276 PolarHBondContact N-O 2.95Å; L268-Q276 PolarHBondContact O-N 3.37Å; Q276-L292 CarbonylContact C-O 3.56Å; Q276-L292 VanDerWaalsContact CA-O 3.31Å; Q276-L292 WeakPolarHBondContact CA-O 3.45Å; Q276-T293 HydrophobicContact CG-CG2 4.15Å
277	M	96.2	Very high	91.1	Very high	14 Å²	14	63.8 Å²	63.8	7%	0.069	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	147.2	-176.5	67.3	-177.3	81.8	0	0	111.5	Y255 I265 F266 I275 L292 L294	Y255-M277 HydrophobicContact CE1-CB 3.94Å; Y255-M277 HydrophobicContact CE1-CG 4.12Å; Y255-M277 HydrophobicContact CE1-SD 3.66Å; Y255-M277 HydrophobicContact CE2-SD 4.36Å; Y255-M277 VanDerWaalsContact CZ-SD 3.53Å; Y255-M277 PolarHBondContact OH-SD 3.36Å; Y255-M277 VanDerWaalsContact OH-SD 3.34Å; I265-M277 CarbonylContact O-C 3.58Å; I265-M277 WeakPolarHBondContact O-CA 3.42Å; I265-M277 WeakPolarHBondContact O-CB 3.49Å; F266-M277 HydrophobicContact CD1-CB 4.15Å; F266-M277 HydrophobicContact CD1-CE 4.29Å; F266-M277 HydrophobicContact CE1-CE 3.85Å; F266-M277 HydrophobicContact CE1-SD 4.41Å; I275-M277 HydrophobicContact CB-CE 4.17Å; I275-M277 HydrophobicContact CG2-CE 3.3Å; M277-L292 HydrophobicContact CE-CD2 4.31Å; M277-L292 HydrophobicContact CG-CB 3.86Å; M277-L292 HydrophobicContact CG-CD2 3.81Å; M277-L292 HydrophobicContact CG-CG 4.24Å; M277-L292 PolarHBondContact N-O 2.79Å; M277-L292 WeakPolarHBondContact O-CA 3.5Å; M277-L292 WeakPolarHBondContact O-CB 3.49Å; M277-L292 PolarHBondContact O-N 3.1Å; M277-L292 HydrophobicContact SD-CD2 3.73Å; M277-L294 HydrophobicContact CE-CD1 3.79Å
278	R	95	Very high	90.9	Very high	99 Å²	99	62.8 Å²	62.8	37%	0.374	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	135.9	163.5	-86.4	173	-79.1	174.3	-3.4	109.2	Y255 G264 I265 D267 Y289 S290	Y255-R278 PolarHBondContact OH-O 3.3Å; G264-R278 CarbonylContact C-O 3.51Å; G264-R278 WeakPolarHBondContact CA-O 3.43Å; I265-R278 PolarHBondContact N-O 2.78Å; I265-R278 VanDerWaalsContact N-O 3.15Å; I265-R278 PolarHBondContact O-N 2.76Å; D267-R278 IonicContact OD1-CZ 3.48Å; D267-R278 IonicContact OD1-NE 2.76Å; D267-R278 PolarHBondContact OD1-NE 2.65Å; D267-R278 IonicContact OD1-NH2 3.95Å; D267-R278 PolarHBondContact OD1-NH2 3.43Å; D267-R278 WeakPolarHBondContact OD2-CG 3.48Å; D267-R278 PolarHBondContact OD2-N 3.02Å; D267-R278 VanDerWaalsContact OD2-N 3.12Å; D267-R278 IonicContact OD2-NE 2.63Å; R278-Y289 HydrophobicContact CB-CD1 4Å; R278-Y289 HydrophobicContact CB-CG 4.38Å; R278-S290 CarbonylContact C-O 3.48Å; R278-S290 WeakPolarHBondContact CA-O 3.16Å
279	W	94.7	Very high	90.8	Very high	6 Å²	6	62.8 Å²	62.8	2%	0.023	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	137.5	-176.1	-172.9	109.8	0	0	0	110.3	Y255 I262 K281 W284 S290 L292 T320 W324	Y255-W279 VanDerWaalsContact OH-CD1 3.31Å; I262-W279 HydrophobicContact CB-CZ2 4.47Å; I262-W279 HydrophobicContact CD1-CH2 4.23Å; I262-W279 HydrophobicContact CD1-CZ2 3.45Å; I262-W279 VanDerWaalsContact CD1-CZ2 3.45Å; I262-W279 HydrophobicContact CG1-CH2 4.24Å; I262-W279 HydrophobicContact CG1-CZ2 3.72Å; I262-W279 HydrophobicContact CG2-CD2 4.21Å; I262-W279 HydrophobicContact CG2-CG 4.41Å; I262-W279 HydrophobicContact CG2-CZ2 3.93Å; I262-W279 VanDerWaalsContact CG2-NE1 3.31Å; W279-K281 HydrophobicContact CH2-CD 4.09Å; W279-K281 HydrophobicContact CH2-CG 3.34Å; W279-K281 HydrophobicContact CZ2-CG 4.37Å; W279-K281 HydrophobicContact CZ3-CG 3.57Å; W279-W284 AromaticContact CE3-CH2 3.84Å; W279-W284 HydrophobicContact CE3-CH2 3.84Å; W279-W284 HydrophobicContact CE3-CZ2 4.25Å; W279-W284 HydrophobicContact CE3-CZ3 4.22Å; W279-W284 AromaticContact CZ3-CH2 3.64Å; W279-W284 HydrophobicContact CZ3-CH2 3.64Å; W279-W284 AromaticContact CZ3-CZ2 3.57Å; W279-W284 HydrophobicContact CZ3-CZ2 3.57Å; W279-W284 HydrophobicContact CZ3-CZ3 4.3Å; W279-S290 PolarHBondContact N-O 2.79Å; W279-S290 PolarHBondContact O-N 3.38Å; W279-S290 PolarHBondContact O-OG 3.49Å; W279-L292 HydrophobicContact CB-CB 4.17Å; W279-T320 HydrophobicContact CH2-CG2 3.9Å; W279-T320 HydrophobicContact CZ3-CG2 4.03Å; W279-W324 AromaticContact CD1-CZ2 3.68Å; W279-W324 AromaticContact CE2-CZ2 3.88Å; W279-W324 HydrophobicContact CG-CZ2 4.4Å; W279-W324 HydrophobicContact CZ2-CZ2 4.41Å; W279-W324 AromaticContact NE1-CH2 3.66Å; W279-W324 AromaticContact NE1-CZ2 3.32Å; W279-W324 VanDerWaalsContact NE1-CZ2 3.32Å
280	R	92.5	Very high	90.7	Very high	31 Å²	31	61.5 Å²	61.5	12%	0.117	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	156.5	170.4	66.2	174.4	-71.3	-169.3	2	112.2	I262 T263 W284 P285 H288 Y289	I262-R280 WeakPolarHBondContact CA-O 3.47Å; T263-R280 PolarHBondContact N-O 3.09Å; T263-R280 VanDerWaalsContact N-O 3.09Å; T263-R280 PolarHBondContact O-N 3.13Å; T263-R280 WeakPolarHBondContact OG1-CG 3.49Å; R280-W284 HydrophobicContact CB-CE3 3.95Å; R280-W284 HydrophobicContact CB-CZ3 4.47Å; R280-W284 PolarHBondContact NH2-O 2.82Å; R280-W284 VanDerWaalsContact NH2-O 3.09Å; R280-P285 PolarHBondContact NH2-O 2.82Å; R280-H288 WeakPolarHBondContact CB-O 3.42Å; R280-Y289 HydrophobicContact CB-CD1 3.96Å; R280-Y289 HydrophobicContact CB-CE1 4.29Å; R280-Y289 VanDerWaalsContact CD-CZ 3.47Å; R280-Y289 HydrophobicContact CG-CD1 3.76Å; R280-Y289 HydrophobicContact CG-CE1 3.57Å
281	K	91.4	Very high	90.8	Very high	38 Å²	38	60.7 Å²	60.7	17%	0.165	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	157.6	161.7	-57.8	-172.3	-171.4	165.1	0	110.7	N261 I262 W279 D283 W284 D316 T320	N261-K281 CarbonylContact O-C 3.39Å; N261-K281 VanDerWaalsContact O-CA 3.28Å; N261-K281 WeakPolarHBondContact O-CA 3.48Å; I262-K281 HydrophobicContact CG1-CG 4.48Å; W279-K281 HydrophobicContact CH2-CD 4.09Å; W279-K281 HydrophobicContact CH2-CG 3.34Å; W279-K281 HydrophobicContact CZ2-CG 4.37Å; W279-K281 HydrophobicContact CZ3-CG 3.57Å; K281-D283 VanDerWaalsContact C-N 3.26Å; K281-D283 PolarHBondContact O-N 3.27Å; K281-W284 HydrophobicContact CB-CD2 4.49Å; K281-W284 HydrophobicContact CB-CG 4.11Å; K281-W284 WeakPolarHBondContact O-CB 3.38Å; K281-W284 PolarHBondContact O-N 2.87Å; K281-D316 VanDerWaalsContact CD-OD2 3.27Å; K281-D316 WeakPolarHBondContact CD-OD2 3.47Å; K281-D316 WeakPolarHBondContact CE-OD2 3.39Å; K281-D316 IonicContact NZ-OD1 2.68Å; K281-D316 PolarHBondContact NZ-OD1 3.19Å; K281-D316 IonicContact NZ-OD2 2.75Å; K281-D316 PolarHBondContact NZ-OD2 2.75Å; K281-T320 WeakPolarHBondContact CE-OG1 3.33Å; K281-T320 PolarHBondContact NZ-OG1 2.77Å
282	R	89.2	Confident	90.9	Very high	134 Å²	134	56.8 Å²	56.8	51%	0.506	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-39.1	170.8	-175.9	-179.3	-63	179.9	0	112.3	S259 G260 N261 W284	S259-R282 PolarHBondContact O-NH2 2.83Å; G260-R282 PolarHBondContact O-NE 2.81Å; G260-R282 VanDerWaalsContact O-NE 3.14Å; G260-R282 PolarHBondContact O-NH2 2.84Å; N261-R282 PolarHBondContact O-N 2.77Å; R282-W284 VanDerWaalsContact C-N 3.27Å; R282-W284 PolarHBondContact O-N 2.63Å
283	D	86.2	Confident	91.2	Very high	128 Å²	128	57.4 Å²	57.4	68%	0.684	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-0.3	-175.5	-59.7	-31.1	0	0	0	114.5	K281	K281-D283 VanDerWaalsContact C-N 3.26Å; K281-D283 PolarHBondContact O-N 3.27Å
284	W	88.8	Confident	91.3	Very high	8 Å²	8	51.4 Å²	51.4	3%	0.03	25%	0.246	C	C	.	.	S	Bend	trans	-75.2	153.8	171.4	-73.2	13.7	0	0	0	110.6	W279 R280 K281 R282 H288 V312 P313 D316	W279-W284 AromaticContact CE3-CH2 3.84Å; W279-W284 HydrophobicContact CE3-CH2 3.84Å; W279-W284 HydrophobicContact CE3-CZ2 4.25Å; W279-W284 HydrophobicContact CE3-CZ3 4.22Å; W279-W284 AromaticContact CZ3-CH2 3.64Å; W279-W284 HydrophobicContact CZ3-CH2 3.64Å; W279-W284 AromaticContact CZ3-CZ2 3.57Å; W279-W284 HydrophobicContact CZ3-CZ2 3.57Å; W279-W284 HydrophobicContact CZ3-CZ3 4.3Å; R280-W284 HydrophobicContact CB-CE3 3.95Å; R280-W284 HydrophobicContact CB-CZ3 4.47Å; R280-W284 PolarHBondContact NH2-O 2.82Å; R280-W284 VanDerWaalsContact NH2-O 3.09Å; K281-W284 HydrophobicContact CB-CD2 4.49Å; K281-W284 HydrophobicContact CB-CG 4.11Å; K281-W284 WeakPolarHBondContact O-CB 3.38Å; K281-W284 PolarHBondContact O-N 2.87Å; R282-W284 VanDerWaalsContact C-N 3.27Å; R282-W284 PolarHBondContact O-N 2.63Å; W284-H288 AromaticContact CE3-CD2 3.75Å; W284-V312 HydrophobicContact CH2-CB 4.25Å; W284-V312 HydrophobicContact CH2-CG1 3.87Å; W284-V312 HydrophobicContact CH2-CG2 4.27Å; W284-V312 HydrophobicContact CZ2-CG1 3.78Å; W284-P313 HydrophobicContact CD2-CG 3.74Å; W284-P313 HydrophobicContact CE3-CG 3.92Å; W284-P313 HydrophobicContact CG-CG 4.17Å; W284-P313 HydrophobicContact CH2-CG 4.42Å; W284-P313 VanDerWaalsContact CZ2-CD 3.43Å; W284-P313 HydrophobicContact CZ2-CG 4.25Å; W284-P313 HydrophobicContact CZ3-CG 4.26Å; W284-D316 PolarHBondContact NE1-OD2 2.96Å
285	P	83.8	Confident	91.4	Very high	44 Å²	44	55.6 Å²	55.6	29%	0.286	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-50.3	150.7	176.1	-19.6	27.2	0	0	0	111.6	L209 R280 N287 H288 Y315	L209-P285 HydrophobicContact CD2-CB 4.38Å; L209-P285 HydrophobicContact CD2-CG 3.37Å; R280-P285 PolarHBondContact NH2-O 2.82Å; P285-N287 PolarHBondContact O-N 2.83Å; P285-H288 HydrophobicContact CB-CB 4.15Å; P285-H288 HydrophobicContact CG-CB 4.3Å; P285-H288 WeakPolarHBondContact O-CB 3.44Å; P285-H288 PolarHBondContact O-N 2.88Å; P285-H288 VanDerWaalsContact O-N 3.1Å; P285-Y315 WeakPolarHBondContact CD-OH 3.45Å
286	E	81.3	Confident	91.4	Very high	174 Å²	174	55.9 Å²	55.9	81%	0.813	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	136.7	175.1	-67	-170.5	169.5	0	0	110.7	H288	E286-H288 PolarHBondContact O-N 2.79Å; E286-H288 VanDerWaalsContact O-N 3.09Å
287	N	80.9	Confident	91.3	Very high	133 Å²	133	56.4 Å²	56.4	71%	0.711	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	9.9	-178.7	-53.6	-44	0	0	0	116.3	P285 Y289	P285-N287 PolarHBondContact O-N 2.83Å; N287-Y289 PolarHBondContact O-N 2.74Å
288	H	87.3	Confident	91.1	Very high	32 Å²	32	59.4 Å²	59.4	15%	0.148	30%	0.295	C	S	.	.			trans	-83.6	108.5	171.5	-161.5	111.4	0	0	0	110.4	N211 R280 W284 P285 E286 D311	N211-H288 PolarHBondContact OD1-CE1 2.82Å; R280-H288 WeakPolarHBondContact CB-O 3.42Å; W284-H288 AromaticContact CE3-CD2 3.75Å; P285-H288 HydrophobicContact CB-CB 4.15Å; P285-H288 HydrophobicContact CG-CB 4.3Å; P285-H288 WeakPolarHBondContact O-CB 3.44Å; P285-H288 PolarHBondContact O-N 2.88Å; P285-H288 VanDerWaalsContact O-N 3.1Å; E286-H288 PolarHBondContact O-N 2.79Å; E286-H288 VanDerWaalsContact O-N 3.09Å; H288-D311 PolarHBondContact NE2-O 3.05Å
289	Y	90.1	Very high	90.9	Very high	79 Å²	79	57.8 Å²	57.8	31%	0.31	29%	0.291	S	S	.	.			trans	-114.7	139.7	172.5	-67.5	-93.4	0	0	0	110	R278 R280 N287	R278-Y289 HydrophobicContact CB-CD1 4Å; R278-Y289 HydrophobicContact CB-CG 4.38Å; R280-Y289 HydrophobicContact CB-CD1 3.96Å; R280-Y289 HydrophobicContact CB-CE1 4.29Å; R280-Y289 VanDerWaalsContact CD-CZ 3.47Å; R280-Y289 HydrophobicContact CG-CD1 3.76Å; R280-Y289 HydrophobicContact CG-CE1 3.57Å; N287-Y289 PolarHBondContact O-N 2.74Å
290	S	93.3	Very high	90.5	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.007	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	153.2	165.5	58.8	0	0	0	0	110.2	R278 W279 Q309 K310	R278-S290 CarbonylContact C-O 3.48Å; R278-S290 WeakPolarHBondContact CA-O 3.16Å; W279-S290 PolarHBondContact N-O 2.79Å; W279-S290 PolarHBondContact O-N 3.38Å; W279-S290 PolarHBondContact O-OG 3.49Å; S290-Q309 PolarHBondContact OG-NE2 3.37Å; S290-K310 CarbonylContact C-O 3.49Å; S290-K310 WeakPolarHBondContact CA-O 3.48Å; S290-K310 WeakPolarHBondContact CB-O 3.05Å
291	S	93.7	Very high	89.9	Confident	43 Å²	43	67 Å²	67	30%	0.301	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	111.6	174.3	-177.4	0	0	0	0	109.8	Q309 K310	S291-Q309 CarbonylContact O-C 3.52Å; S291-Q309 VanDerWaalsContact O-CA 3.29Å; S291-Q309 WeakPolarHBondContact O-CA 3.06Å; S291-K310 PolarHBondContact N-O 3.35Å; S291-K310 PolarHBondContact O-N 2.75Å
292	L	96.4	Very high	89.9	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131	179.7	-177.4	71.1	0	0	0	110.5	Q276 M277 W279 L294 L307 T308 Q309 W324	Q276-L292 CarbonylContact C-O 3.56Å; Q276-L292 VanDerWaalsContact CA-O 3.31Å; Q276-L292 WeakPolarHBondContact CA-O 3.45Å; M277-L292 HydrophobicContact CE-CD2 4.31Å; M277-L292 HydrophobicContact CG-CB 3.86Å; M277-L292 HydrophobicContact CG-CD2 3.81Å; M277-L292 HydrophobicContact CG-CG 4.24Å; M277-L292 PolarHBondContact N-O 2.79Å; M277-L292 WeakPolarHBondContact O-CA 3.5Å; M277-L292 WeakPolarHBondContact O-CB 3.49Å; M277-L292 PolarHBondContact O-N 3.1Å; M277-L292 HydrophobicContact SD-CD2 3.73Å; W279-L292 HydrophobicContact CB-CB 4.17Å; L292-L294 HydrophobicContact CD1-CD2 4.22Å; L292-L294 HydrophobicContact CD2-CD1 4.43Å; L292-L294 HydrophobicContact CD2-CD2 4.19Å; L292-L294 HydrophobicContact CD2-CG 4.24Å; L292-L294 HydrophobicContact CG-CD2 4.17Å; L292-L294 HydrophobicContact CG-CG 4.3Å; L292-L307 HydrophobicContact CD1-CD1 4Å; L292-L307 HydrophobicContact CD1-CD2 3.69Å; L292-L307 HydrophobicContact CD1-CG 3.61Å; L292-T308 CarbonylContact C-O 3.48Å; L292-Q309 HydrophobicContact CB-CG 4.42Å; L292-Q309 HydrophobicContact CD1-CB 3.77Å; L292-Q309 HydrophobicContact CD1-CG 3.99Å; L292-W324 HydrophobicContact CD1-CH2 4.43Å; L292-W324 HydrophobicContact CD1-CZ2 3.82Å; L292-W324 HydrophobicContact CD2-CH2 3.44Å; L292-W324 VanDerWaalsContact CD2-CH2 3.44Å; L292-W324 HydrophobicContact CD2-CZ2 3.45Å; L292-W324 VanDerWaalsContact CD2-CZ2 3.45Å; L292-W324 HydrophobicContact CG-CZ2 4.29Å
293	T	95	Very high	90.1	Very high	24 Å²	24	59.6 Å²	59.6	15%	0.147	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	121	172.1	-61.8	0	0	0	0	109.4	I275 Q276 K295 T308	I275-T293 WeakPolarHBondContact O-CA 3.21Å; Q276-T293 HydrophobicContact CG-CG2 4.15Å; T293-K295 HydrophobicContact CG2-CG 4.08Å; T293-T308 PolarHBondContact N-O 3.4Å; T293-T308 PolarHBondContact O-N 2.88Å
294	L	95.8	Very high	90.4	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.8	174	-57.6	179.8	0	0	0	108.3	L231 S274 I275 M277 L292 L305 L307	L231-L294 HydrophobicContact CD1-CD1 3.96Å; S274-L294 CarbonylContact C-O 3.53Å; S274-L294 WeakPolarHBondContact CA-O 3.39Å; S274-L294 WeakPolarHBondContact CB-O 3.43Å; I275-L294 HydrophobicContact CB-CB 4.35Å; I275-L294 PolarHBondContact N-O 3.42Å; I275-L294 PolarHBondContact O-N 3.24Å; M277-L294 HydrophobicContact CE-CD1 3.79Å; L292-L294 HydrophobicContact CD1-CD2 4.22Å; L292-L294 HydrophobicContact CD2-CD1 4.43Å; L292-L294 HydrophobicContact CD2-CD2 4.19Å; L292-L294 HydrophobicContact CD2-CG 4.24Å; L292-L294 HydrophobicContact CG-CD2 4.17Å; L292-L294 HydrophobicContact CG-CG 4.3Å; L294-L305 HydrophobicContact CB-CD1 4.14Å; L294-L307 HydrophobicContact CD2-CB 3.85Å; L294-L307 HydrophobicContact CD2-CD1 3.63Å; L294-L307 HydrophobicContact CD2-CG 3.6Å
295	K	95.3	Very high	90.7	Very high	104 Å²	104	58.2 Å²	58.2	45%	0.452	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.2	174.5	-65.4	-177.7	178.8	-178.9	0	110	T293 L305 I306	T293-K295 HydrophobicContact CG2-CG 4.08Å; K295-L305 CarbonylContact O-C 3.57Å; K295-L305 WeakPolarHBondContact O-CA 3.47Å; K295-I306 HydrophobicContact CB-CB 4.34Å; K295-I306 PolarHBondContact N-O 3.44Å; K295-I306 PolarHBondContact O-N 3.19Å
296	M	96.2	Very high	91.2	Very high	7 Å²	7	58.2 Å²	58.2	3%	0.034	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	110.5	-178.9	-70.7	155.9	-74.6	0	0	108.3	P224 L227 Y228 K273 I275 T303 L305	P224-M296 HydrophobicContact CB-CB 4.1Å; L227-M296 HydrophobicContact CB-SD 4.29Å; L227-M296 HydrophobicContact CD2-CG 4.05Å; L227-M296 HydrophobicContact CD2-SD 4.5Å; L227-M296 HydrophobicContact CG-CG 4.41Å; L227-M296 HydrophobicContact CG-SD 4.22Å; Y228-M296 HydrophobicContact CD2-CE 3.81Å; K273-M296 PolarHBondContact O-N 3.39Å; I275-M296 HydrophobicContact CD1-CE 4.31Å; I275-M296 HydrophobicContact CG1-CE 4.16Å; M296-T303 HydrophobicContact CB-CG2 3.74Å; M296-T303 HydrophobicContact CG-CG2 4.1Å; M296-L305 HydrophobicContact CG-CD1 3.73Å
297	N	93.4	Very high	91.9	Very high	80 Å²	80	50 Å²	50	43%	0.428	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.5	178.5	-65.7	-29.3	0	0	0	109.1	R304 I306	N297-R304 PolarHBondContact N-O 3.48Å; N297-R304 PolarHBondContact O-N 3.45Å; N297-I306 WeakPolarHBondContact ND2-CD1 3.08Å
298	A	93.1	Very high	92.5	Very high	77 Å²	77	45.8 Å²	45.8	64%	0.636	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	142.6	173.2	0	0	0	0	0	111.2	P224 G302	P224-A298 HydrophobicContact CG-CB 3.89Å; A298-G302 WeakPolarHBondContact CA-O 3.31Å
299	F	91.3	Very high	92.8	Very high	65 Å²	65	44.2 Å²	44.2	29%	0.285	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	173.2	166.3	76.4	-83	0	0	0	109.3	E219 G301 G302 R304	E219-F299 HydrophobicContact CB-CE1 4.18Å; E219-F299 HydrophobicContact CB-CZ 4.17Å; E219-F299 HydrophobicContact CG-CE1 4.23Å; E219-F299 HydrophobicContact CG-CZ 4.34Å; F299-G301 VanDerWaalsContact CE2-CA 3.44Å; F299-G301 VanDerWaalsContact CE2-N 3.33Å; F299-G301 PolarHBondContact O-N 3.42Å; F299-G302 WeakPolarHBondContact CD1-O 3.29Å; F299-G302 PolarHBondContact N-O 2.9Å; F299-G302 PolarHBondContact O-N 2.82Å; F299-G302 VanDerWaalsContact O-O 3.05Å; F299-R304 HydrophobicContact CD1-CB 4.13Å
300	E	84.9	Confident	92.9	Very high	207 Å²	207	45.5 Å²	45.5	97%	0.967	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-28.7	-173.2	-169.7	176.7	178	0	0	114.5
301	G	80.1	Confident	92.8	Very high	25 Å²	25	48.5 Å²	48.5	26%	0.258	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-4.3	-179.9	0	0	0	0	0	115.6	F221 F299	F221-G301 WeakPolarHBondContact CD1-O 3.49Å; F299-G301 VanDerWaalsContact CE2-CA 3.44Å; F299-G301 VanDerWaalsContact CE2-N 3.33Å; F299-G301 PolarHBondContact O-N 3.42Å
302	G	91.6	Very high	92.6	Very high	16 Å²	16	46.5 Å²	46.5	17%	0.165	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	148.9	-131.9	-175.7	0	0	0	0	0	113.1	F220 C222 A298 F299	F220-G302 CarbonylContact O-C 3.6Å; F220-G302 WeakPolarHBondContact O-CA 3.35Å; C222-G302 CarbonylContact O-C 3.42Å; C222-G302 WeakPolarHBondContact O-CA 3.47Å; A298-G302 WeakPolarHBondContact CA-O 3.31Å; F299-G302 WeakPolarHBondContact CD1-O 3.29Å; F299-G302 PolarHBondContact N-O 2.9Å; F299-G302 PolarHBondContact O-N 2.82Å; F299-G302 VanDerWaalsContact O-O 3.05Å
303	T	93.2	Very high	92.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126.9	-175.6	-58.1	0	0	0	0	110.8	F220 C222 P224 L227 M296	F220-T303 PolarHBondContact N-O 3.46Å; F220-T303 PolarHBondContact O-N 3.42Å; C222-T303 WeakPolarHBondContact O-CB 3.32Å; C222-T303 PolarHBondContact O-N 2.97Å; C222-T303 PolarHBondContact O-OG1 2.99Å; P224-T303 WeakPolarHBondContact CA-OG1 3.41Å; P224-T303 HydrophobicContact CB-CG2 4.22Å; P224-T303 WeakPolarHBondContact CD-OG1 3.35Å; P224-T303 HydrophobicContact CG-CG2 4.1Å; P224-T303 WeakPolarHBondContact CG-OG1 3.36Å; L227-T303 HydrophobicContact CD2-CG2 3.92Å; M296-T303 HydrophobicContact CB-CG2 3.74Å; M296-T303 HydrophobicContact CG-CG2 4.1Å
304	R	93.4	Very high	91.6	Very high	102 Å²	102	46.5 Å²	46.5	39%	0.385	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	114.7	168.6	-174.7	174.5	-68.6	158.1	1.1	108.7	T217 D218 E219 N297 F299 I306	T217-R304 HydrophobicContact CG2-CG 3.62Å; D218-R304 CarbonylContact O-C 3.45Å; E219-R304 HydrophobicContact CG-CG 4.32Å; E219-R304 IonicContact OE1-CZ 3.94Å; E219-R304 VanDerWaalsContact OE1-CZ 3.27Å; E219-R304 IonicContact OE1-NE 2.97Å; E219-R304 PolarHBondContact OE1-NE 3.03Å; E219-R304 IonicContact OE1-NH2 3.4Å; E219-R304 PolarHBondContact OE1-NH2 3.25Å; N297-R304 PolarHBondContact N-O 3.48Å; N297-R304 PolarHBondContact O-N 3.45Å; F299-R304 HydrophobicContact CD1-CB 4.13Å; R304-I306 HydrophobicContact CG-CG1 4.47Å
305	L	94.8	Very high	91.1	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	118.1	175.3	-175.8	67.1	0	0	0	109.2	T217 D218 F220 L227 L294 K295 M296 L329	T217-L305 WeakPolarHBondContact CA-O 2.87Å; D218-L305 PolarHBondContact N-O 2.87Å; D218-L305 PolarHBondContact O-N 3.28Å; F220-L305 HydrophobicContact CD2-CB 3.99Å; F220-L305 HydrophobicContact CE2-CB 3.89Å; F220-L305 HydrophobicContact CE2-CD2 3.83Å; F220-L305 HydrophobicContact CZ-CD2 4.42Å; L227-L305 HydrophobicContact CD2-CB 4.1Å; L227-L305 HydrophobicContact CD2-CD1 4.16Å; L227-L305 HydrophobicContact CD2-CD2 4.41Å; L227-L305 HydrophobicContact CD2-CG 4.46Å; L294-L305 HydrophobicContact CB-CD1 4.14Å; K295-L305 CarbonylContact O-C 3.57Å; K295-L305 WeakPolarHBondContact O-CA 3.47Å; M296-L305 HydrophobicContact CG-CD1 3.73Å; L305-L329 HydrophobicContact CD2-CD2 3.68Å
306	I	93.6	Very high	90.6	Very high	43 Å²	43	45.2 Å²	45.2	22%	0.221	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	111.6	172.4	-54.8	174.1	0	0	0	107.5	T217 K295 N297 R304	T217-I306 HydrophobicContact CG2-CG1 4.21Å; K295-I306 HydrophobicContact CB-CB 4.34Å; K295-I306 PolarHBondContact N-O 3.44Å; K295-I306 PolarHBondContact O-N 3.19Å; N297-I306 WeakPolarHBondContact ND2-CD1 3.08Å; R304-I306 HydrophobicContact CG-CG1 4.47Å
307	L	95.8	Very high	90.2	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	123.6	176	-177.2	154.3	0	0	0	108.9	S215 I216 L292 L294 Q309 W324	S215-L307 CarbonylContact C-O 3.6Å; S215-L307 VanDerWaalsContact CA-O 3.31Å; S215-L307 WeakPolarHBondContact CA-O 3.4Å; I216-L307 HydrophobicContact CB-CB 4.27Å; I216-L307 HydrophobicContact CB-CD2 4.46Å; I216-L307 HydrophobicContact CD1-CD2 4.43Å; I216-L307 PolarHBondContact N-O 3.13Å; I216-L307 PolarHBondContact O-N 2.9Å; L292-L307 HydrophobicContact CD1-CD1 4Å; L292-L307 HydrophobicContact CD1-CD2 3.69Å; L292-L307 HydrophobicContact CD1-CG 3.61Å; L294-L307 HydrophobicContact CD2-CB 3.85Å; L294-L307 HydrophobicContact CD2-CD1 3.63Å; L294-L307 HydrophobicContact CD2-CG 3.6Å; L307-Q309 HydrophobicContact CD2-CB 4.22Å; L307-W324 HydrophobicContact CD1-CD2 3.44Å; L307-W324 VanDerWaalsContact CD1-CD2 3.44Å; L307-W324 HydrophobicContact CD1-CE3 3.5Å; L307-W324 HydrophobicContact CD1-CG 3.95Å; L307-W324 HydrophobicContact CD1-CH2 4.14Å; L307-W324 HydrophobicContact CD1-CZ2 4.07Å; L307-W324 HydrophobicContact CD1-CZ3 3.86Å
308	T	93.4	Very high	89.9	Confident	44 Å²	44	48.1 Å²	48.1	27%	0.27	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.5	173.1	-55.7	0	0	0	0	108.7	L214 L292 T293	L214-T308 CarbonylContact O-C 3.56Å; L214-T308 WeakPolarHBondContact O-CA 3.36Å; L292-T308 CarbonylContact C-O 3.48Å; T293-T308 PolarHBondContact N-O 3.4Å; T293-T308 PolarHBondContact O-N 2.88Å
309	Q	94.9	Very high	89.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	123.6	-179.1	-166.9	177.1	4.1	0	0	109.5	D213 L214 S290 S291 L292 L307 V312	D213-Q309 CarbonylContact C-O 3.52Å; D213-Q309 WeakPolarHBondContact CA-O 3.17Å; L214-Q309 HydrophobicContact CB-CB 4.28Å; L214-Q309 PolarHBondContact N-O 2.87Å; L214-Q309 PolarHBondContact O-N 3.22Å; S290-Q309 PolarHBondContact OG-NE2 3.37Å; S291-Q309 CarbonylContact O-C 3.52Å; S291-Q309 VanDerWaalsContact O-CA 3.29Å; S291-Q309 WeakPolarHBondContact O-CA 3.06Å; L292-Q309 HydrophobicContact CB-CG 4.42Å; L292-Q309 HydrophobicContact CD1-CB 3.77Å; L292-Q309 HydrophobicContact CD1-CG 3.99Å; L307-Q309 HydrophobicContact CD2-CB 4.22Å; Q309-V312 HydrophobicContact CB-CG2 4.22Å; Q309-V312 HydrophobicContact CG-CG2 3.62Å
310	K	91.7	Very high	89.6	Confident	106 Å²	106	46.1 Å²	46.1	46%	0.461	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	158.2	178.8	-61.6	-174.7	175	-178.4	0	110.8	D213 S290 S291 V312	D213-K310 WeakPolarHBondContact OD1-CA 3.5Å; S290-K310 CarbonylContact C-O 3.49Å; S290-K310 WeakPolarHBondContact CA-O 3.48Å; S290-K310 WeakPolarHBondContact CB-O 3.05Å; S291-K310 PolarHBondContact N-O 3.35Å; S291-K310 PolarHBondContact O-N 2.75Å; K310-V312 VanDerWaalsContact C-N 3.3Å; K310-V312 PolarHBondContact O-N 2.94Å
311	D	90.5	Very high	89.9	Confident	64 Å²	64	41.6 Å²	41.6	34%	0.342	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	63.2	33.3	176.4	-54.5	-55.3	0	0	0	114.3	N211 R212 H288	N211-D311 HydrophobicContact CB-CB 4.43Å; N211-D311 PolarHBondContact ND2-OD1 2.77Å; R212-D311 PolarHBondContact O-N 3.42Å; H288-D311 PolarHBondContact NE2-O 3.05Å
312	V	89.8	Confident	90.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	130.1	170.3	-176.5	0	0	0	0	108.6	R212 W284 Q309 K310 A314 L317 T320	R212-V312 PolarHBondContact N-O 2.83Å; R212-V312 WeakPolarHBondContact O-CB 3.32Å; R212-V312 PolarHBondContact O-N 2.93Å; W284-V312 HydrophobicContact CH2-CB 4.25Å; W284-V312 HydrophobicContact CH2-CG1 3.87Å; W284-V312 HydrophobicContact CH2-CG2 4.27Å; W284-V312 HydrophobicContact CZ2-CG1 3.78Å; Q309-V312 HydrophobicContact CB-CG2 4.22Å; Q309-V312 HydrophobicContact CG-CG2 3.62Å; K310-V312 VanDerWaalsContact C-N 3.3Å; K310-V312 PolarHBondContact O-N 2.94Å; V312-A314 PolarHBondContact O-N 3.39Å; V312-L317 HydrophobicContact CB-CD1 3.98Å; V312-L317 HydrophobicContact CG1-CB 4.41Å; V312-L317 HydrophobicContact CG1-CD1 3.97Å; V312-T320 HydrophobicContact CG1-CG2 4.38Å
313	P	87.5	Confident	90.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	127.8	173.5	-22.3	31.5	0	0	0	110.8	W284 Y315 D316 L317	W284-P313 HydrophobicContact CD2-CG 3.74Å; W284-P313 HydrophobicContact CE3-CG 3.92Å; W284-P313 HydrophobicContact CG-CG 4.17Å; W284-P313 HydrophobicContact CH2-CG 4.42Å; W284-P313 VanDerWaalsContact CZ2-CD 3.43Å; W284-P313 HydrophobicContact CZ2-CG 4.25Å; W284-P313 HydrophobicContact CZ3-CG 4.26Å; P313-Y315 HydrophobicContact CB-CD1 3.6Å; P313-Y315 HydrophobicContact CB-CE1 3.29Å; P313-Y315 HydrophobicContact CG-CE1 4.12Å; P313-Y315 PolarHBondContact O-N 3.19Å; P313-Y315 VanDerWaalsContact O-N 3.13Å; P313-D316 PolarHBondContact O-N 2.96Å; P313-L317 PolarHBondContact O-N 3.43Å
314	A	83.5	Confident	90.1	Very high	24 Å²	24	44.9 Å²	44.9	20%	0.198	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-53.9	-38.1	-174.8	0	0	0	0	0	112.9	D208 S210 R212 V312 D316 L317	D208-A314 HydrophobicContact CB-CB 4.48Å; S210-A314 VanDerWaalsContact O-CB 3.23Å; S210-A314 WeakPolarHBondContact O-CB 3.44Å; S210-A314 PolarHBondContact O-N 2.77Å; S210-A314 WeakPolarHBondContact OG-CB 3.42Å; R212-A314 HydrophobicContact CG-CB 3.81Å; V312-A314 PolarHBondContact O-N 3.39Å; A314-D316 PolarHBondContact O-N 3.4Å; A314-L317 PolarHBondContact O-N 2.76Å
315	Y	84.3	Confident	89.8	Confident	68 Å²	68	43.5 Å²	43.5	27%	0.267	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-63.6	-21.3	178.7	76.9	-96.5	0	0	0	114	K207 D208 P285 P313	K207-Y315 HydrophobicContact CB-CD1 3.72Å; K207-Y315 HydrophobicContact CB-CE1 3.94Å; K207-Y315 HydrophobicContact CB-CG 4.2Å; K207-Y315 HydrophobicContact CD-CD1 4.19Å; K207-Y315 HydrophobicContact CD-CD2 4.21Å; K207-Y315 HydrophobicContact CD-CE1 3.82Å; K207-Y315 HydrophobicContact CD-CE2 3.89Å; K207-Y315 HydrophobicContact CD-CG 4.38Å; K207-Y315 HydrophobicContact CG-CD1 4.4Å; K207-Y315 HydrophobicContact CG-CE1 4.46Å; D208-Y315 WeakPolarHBondContact O-CD1 3.44Å; P285-Y315 WeakPolarHBondContact CD-OH 3.45Å; P313-Y315 HydrophobicContact CB-CD1 3.6Å; P313-Y315 HydrophobicContact CB-CE1 3.29Å; P313-Y315 HydrophobicContact CG-CE1 4.12Å; P313-Y315 PolarHBondContact O-N 3.19Å; P313-Y315 VanDerWaalsContact O-N 3.13Å
316	D	86.8	Confident	89.2	Confident	15 Å²	15	45 Å²	45	8%	0.08	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-118	9.1	-176.3	-158.7	52.9	0	0	0	113.2	K281 W284 P313 A314 E318 N319 T320	K281-D316 VanDerWaalsContact CD-OD2 3.27Å; K281-D316 WeakPolarHBondContact CD-OD2 3.47Å; K281-D316 WeakPolarHBondContact CE-OD2 3.39Å; K281-D316 IonicContact NZ-OD1 2.68Å; K281-D316 PolarHBondContact NZ-OD1 3.19Å; K281-D316 IonicContact NZ-OD2 2.75Å; K281-D316 PolarHBondContact NZ-OD2 2.75Å; W284-D316 PolarHBondContact NE1-OD2 2.96Å; P313-D316 PolarHBondContact O-N 2.96Å; A314-D316 PolarHBondContact O-N 3.4Å; D316-E318 PolarHBondContact O-N 2.86Å; D316-N319 PolarHBondContact O-N 3.32Å; D316-N319 WeakPolarHBondContact OD1-CB 3.23Å; D316-N319 PolarHBondContact OD1-ND2 2.85Å; D316-T320 VanDerWaalsContact O-CB 3.29Å; D316-T320 WeakPolarHBondContact O-CB 3.48Å; D316-T320 PolarHBondContact O-N 3.37Å; D316-T320 PolarHBondContact O-OG1 2.95Å; D316-T320 PolarHBondContact OD2-OG1 3.21Å; D316-T320 VanDerWaalsContact OD2-OG1 3.13Å
317	L	87.6	Confident	88.8	Confident	31 Å²	31	47 Å²	47	16%	0.162	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-51.2	-177.3	-178.1	69.2	0	0	0	111.9	R212 L214 V312 P313 A314 T320 R321	R212-L317 HydrophobicContact CB-CD1 3.9Å; R212-L317 HydrophobicContact CB-CD2 3.78Å; R212-L317 HydrophobicContact CB-CG 4.33Å; R212-L317 HydrophobicContact CG-CD2 4.18Å; L214-L317 HydrophobicContact CB-CD1 4.03Å; V312-L317 HydrophobicContact CB-CD1 3.98Å; V312-L317 HydrophobicContact CG1-CB 4.41Å; V312-L317 HydrophobicContact CG1-CD1 3.97Å; P313-L317 PolarHBondContact O-N 3.43Å; A314-L317 PolarHBondContact O-N 2.76Å; L317-T320 PolarHBondContact O-N 2.94Å; L317-R321 WeakPolarHBondContact O-CB 3.04Å; L317-R321 PolarHBondContact O-N 3.23Å
318	E	86.7	Confident	88.5	Confident	117 Å²	117	47.7 Å²	47.7	55%	0.547	24%	0.24	S	C	.	.	H	α-helix	trans	-68.1	-41.7	-178.1	-64.1	-58.7	154.8	0	0	111.6	D316 T320 R321 D322	D316-E318 PolarHBondContact O-N 2.86Å; E318-T320 VanDerWaalsContact C-N 3.27Å; E318-T320 PolarHBondContact O-N 3.33Å; E318-R321 WeakPolarHBondContact O-CB 3.37Å; E318-R321 PolarHBondContact O-N 2.94Å; E318-D322 PolarHBondContact O-N 3.25Å
319	N	87.5	Confident	88.4	Confident	98 Å²	98	45.9 Å²	45.9	52%	0.524	23%	0.228	S	C	.	.	H	α-helix	trans	-62.1	-35.7	174.5	-69.2	-19.3	0	0	0	112.3	D316 G323	D316-N319 PolarHBondContact O-N 3.32Å; D316-N319 WeakPolarHBondContact OD1-CB 3.23Å; D316-N319 PolarHBondContact OD1-ND2 2.85Å; N319-G323 PolarHBondContact O-N 2.93Å
320	T	90.4	Very high	88.1	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.012	25%	0.247	C	C	.	.	H	α-helix	trans	-70.3	-42.6	176.5	-59.9	0	0	0	0	110.5	L214 W279 K281 V312 D316 L317 E318 G323 W324	L214-T320 HydrophobicContact CD2-CG2 4.38Å; W279-T320 HydrophobicContact CH2-CG2 3.9Å; W279-T320 HydrophobicContact CZ3-CG2 4.03Å; K281-T320 WeakPolarHBondContact CE-OG1 3.33Å; K281-T320 PolarHBondContact NZ-OG1 2.77Å; V312-T320 HydrophobicContact CG1-CG2 4.38Å; D316-T320 VanDerWaalsContact O-CB 3.29Å; D316-T320 WeakPolarHBondContact O-CB 3.48Å; D316-T320 PolarHBondContact O-N 3.37Å; D316-T320 PolarHBondContact O-OG1 2.95Å; D316-T320 PolarHBondContact OD2-OG1 3.21Å; D316-T320 VanDerWaalsContact OD2-OG1 3.13Å; L317-T320 PolarHBondContact O-N 2.94Å; E318-T320 VanDerWaalsContact C-N 3.27Å; E318-T320 PolarHBondContact O-N 3.33Å; T320-G323 PolarHBondContact O-N 2.91Å; T320-W324 PolarHBondContact O-N 3.33Å
321	R	90.6	Very high	88	Confident	112 Å²	112	44.1 Å²	44.1	42%	0.423	23%	0.23	S	C	.	.	H	α-helix	trans	-60.1	-49	174.6	-180	174.4	-164.8	176.2	2.3	112.5	L214 I216 L317 E318 W324 L325	L214-R321 HydrophobicContact CD1-CB 3.72Å; L214-R321 HydrophobicContact CD1-CG 3.72Å; L214-R321 HydrophobicContact CD2-CB 4.06Å; I216-R321 HydrophobicContact CD1-CG 4.12Å; L317-R321 WeakPolarHBondContact O-CB 3.04Å; L317-R321 PolarHBondContact O-N 3.23Å; E318-R321 WeakPolarHBondContact O-CB 3.37Å; E318-R321 PolarHBondContact O-N 2.94Å; R321-W324 PolarHBondContact O-N 2.9Å; R321-L325 HydrophobicContact CG-CD1 4.4Å; R321-L325 PolarHBondContact O-N 3.37Å
322	D	87.4	Confident	88	Confident	83 Å²	83	41.2 Å²	41.2	44%	0.444	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-48.8	178	-175	68.8	0	0	0	110.3	E318 W324 L325 T326	E318-D322 PolarHBondContact O-N 3.25Å; D322-W324 PolarHBondContact O-N 3.06Å; D322-L325 PolarHBondContact O-N 3.48Å; D322-T326 PolarHBondContact O-N 3.29Å; D322-T326 PolarHBondContact O-OG1 2.94Å; D322-T326 WeakPolarHBondContact OD1-CG2 3.47Å; D322-T326 PolarHBondContact OD2-OG1 2.91Å; D322-T326 VanDerWaalsContact OD2-OG1 3.11Å
323	G	89.1	Confident	88.1	Confident	13 Å²	13	43.5 Å²	43.5	13%	0.134	23%	0.225	C	C	.	.	H	α-helix	trans	-56.3	-36.1	177.3	0	0	0	0	0	113.7	N319 T320 I327 F328	N319-G323 PolarHBondContact O-N 2.93Å; T320-G323 PolarHBondContact O-N 2.91Å; G323-I327 WeakPolarHBondContact O-CA 3.14Å; G323-I327 VanDerWaalsContact O-CB 3.24Å; G323-I327 WeakPolarHBondContact O-CB 3.39Å; G323-I327 PolarHBondContact O-N 3.22Å; G323-F328 PolarHBondContact O-N 3.14Å; G323-F328 VanDerWaalsContact O-N 3.15Å
324	W	92.5	Very high	88.2	Confident	13 Å²	13	49.8 Å²	49.8	5%	0.049	25%	0.254	C	S	.	.	I	π-helix	trans	-62.9	-50.4	172.2	-81.9	118.4	0	0	0	112.4	I216 W279 L292 L307 T320 R321 D322 F328 L329	I216-W324 HydrophobicContact CD1-CB 3.6Å; I216-W324 HydrophobicContact CD1-CG 4.17Å; W279-W324 AromaticContact CD1-CZ2 3.68Å; W279-W324 AromaticContact CE2-CZ2 3.88Å; W279-W324 HydrophobicContact CG-CZ2 4.4Å; W279-W324 HydrophobicContact CZ2-CZ2 4.41Å; W279-W324 AromaticContact NE1-CH2 3.66Å; W279-W324 AromaticContact NE1-CZ2 3.32Å; W279-W324 VanDerWaalsContact NE1-CZ2 3.32Å; L292-W324 HydrophobicContact CD1-CH2 4.43Å; L292-W324 HydrophobicContact CD1-CZ2 3.82Å; L292-W324 HydrophobicContact CD2-CH2 3.44Å; L292-W324 VanDerWaalsContact CD2-CH2 3.44Å; L292-W324 HydrophobicContact CD2-CZ2 3.45Å; L292-W324 VanDerWaalsContact CD2-CZ2 3.45Å; L292-W324 HydrophobicContact CG-CZ2 4.29Å; L307-W324 HydrophobicContact CD1-CD2 3.44Å; L307-W324 VanDerWaalsContact CD1-CD2 3.44Å; L307-W324 HydrophobicContact CD1-CE3 3.5Å; L307-W324 HydrophobicContact CD1-CG 3.95Å; L307-W324 HydrophobicContact CD1-CH2 4.14Å; L307-W324 HydrophobicContact CD1-CZ2 4.07Å; L307-W324 HydrophobicContact CD1-CZ3 3.86Å; T320-W324 PolarHBondContact O-N 3.33Å; R321-W324 PolarHBondContact O-N 2.9Å; D322-W324 PolarHBondContact O-N 3.06Å; W324-F328 HydrophobicContact CD2-CD2 4.44Å; W324-F328 HydrophobicContact CE3-CB 3.67Å; W324-F328 HydrophobicContact CE3-CD1 4.26Å; W324-F328 AromaticContact CE3-CD2 3.79Å; W324-F328 HydrophobicContact CE3-CD2 3.79Å; W324-F328 HydrophobicContact CE3-CE2 4.4Å; W324-F328 AromaticContact CE3-CG 3.67Å; W324-F328 HydrophobicContact CE3-CG 3.67Å; W324-F328 HydrophobicContact CH2-CE1 4.45Å; W324-F328 HydrophobicContact CH2-CE2 4.43Å; W324-F328 HydrophobicContact CH2-CZ 4.35Å; W324-F328 HydrophobicContact CZ3-CB 4.01Å; W324-F328 AromaticContact CZ3-CD1 3.73Å; W324-F328 HydrophobicContact CZ3-CD1 3.73Å; W324-F328 AromaticContact CZ3-CD2 3.87Å; W324-F328 HydrophobicContact CZ3-CD2 3.87Å; W324-F328 HydrophobicContact CZ3-CE1 4.03Å; W324-F328 HydrophobicContact CZ3-CE2 4.14Å; W324-F328 AromaticContact CZ3-CG 3.62Å; W324-F328 HydrophobicContact CZ3-CG 3.62Å; W324-F328 HydrophobicContact CZ3-CZ 4.2Å; W324-F328 WeakPolarHBondContact O-CB 3.29Å; W324-F328 PolarHBondContact O-N 3.13Å; W324-L329 WeakPolarHBondContact O-CB 3.37Å; W324-L329 VanDerWaalsContact O-CG 3.29Å; W324-L329 WeakPolarHBondContact O-CG 3.49Å; W324-L329 PolarHBondContact O-N 3.48Å
325	L	87.5	Confident	88.5	Confident	74 Å²	74	51 Å²	51	39%	0.387	26%	0.259	S	S	.	.	I	π-helix	trans	-69.1	-48.7	-177	-68	170	0	0	0	112	I216 R321 D322 L329 S330	I216-L325 HydrophobicContact CD1-CG 4.37Å; I216-L325 HydrophobicContact CG2-CD2 3.73Å; R321-L325 HydrophobicContact CG-CD1 4.4Å; R321-L325 PolarHBondContact O-N 3.37Å; D322-L325 PolarHBondContact O-N 3.48Å; L325-L329 HydrophobicContact CD2-CD1 4.14Å; L325-S330 WeakPolarHBondContact O-CB 3.25Å; L325-S330 PolarHBondContact O-N 3.15Å; L325-S330 VanDerWaalsContact O-N 3.15Å
326	T	82.9	Confident	88.8	Confident	35 Å²	35	50.5 Å²	50.5	22%	0.215	26%	0.257	C	S	.	.	I	π-helix	trans	-88.1	-30	-167.8	64.4	0	0	0	0	113.6	D322 S330	D322-T326 PolarHBondContact O-N 3.29Å; D322-T326 PolarHBondContact O-OG1 2.94Å; D322-T326 WeakPolarHBondContact OD1-CG2 3.47Å; D322-T326 PolarHBondContact OD2-OG1 2.91Å; D322-T326 VanDerWaalsContact OD2-OG1 3.11Å; T326-S330 WeakPolarHBondContact O-CB 3.35Å
327	I	84.2	Confident	88.9	Confident	86 Å²	86	52.2 Å²	52.2	44%	0.441	28%	0.278	S	S	.	.	I	π-helix	trans	-105.3	-49.1	-175.9	-49.3	177.3	0	0	0	110.9	F258 G323 A331	F258-I327 HydrophobicContact CD1-CG2 4.27Å; F258-I327 HydrophobicContact CE1-CG2 3.39Å; F258-I327 HydrophobicContact CE2-CG2 4.31Å; F258-I327 HydrophobicContact CZ-CG2 3.43Å; F258-I327 VanDerWaalsContact CZ-CG2 3.43Å; G323-I327 WeakPolarHBondContact O-CA 3.14Å; G323-I327 VanDerWaalsContact O-CB 3.24Å; G323-I327 WeakPolarHBondContact O-CB 3.39Å; G323-I327 PolarHBondContact O-N 3.22Å; I327-A331 WeakPolarHBondContact O-CB 3.19Å
328	F	90	Very high	88.9	Confident	17 Å²	17	52 Å²	52	8%	0.075	28%	0.275	C	S	.	.	I	π-helix	trans	-80.2	-65	-177.7	-89.3	-91.2	0	0	0	113	F240 V257 F258 I262 G323 W324 S330 A331 L332	F240-F328 AromaticContact CE2-CD1 3.75Å; F240-F328 HydrophobicContact CE2-CD1 3.75Å; F240-F328 HydrophobicContact CE2-CE1 4.2Å; F240-F328 HydrophobicContact CZ-CD1 4.08Å; F240-F328 HydrophobicContact CZ-CE1 4.27Å; V257-F328 HydrophobicContact CG2-CE1 4.46Å; V257-F328 HydrophobicContact CG2-CZ 3.94Å; F258-F328 HydrophobicContact CD2-CE2 4.08Å; F258-F328 HydrophobicContact CD2-CZ 4.06Å; F258-F328 HydrophobicContact CE2-CD1 4.33Å; F258-F328 AromaticContact CE2-CD2 3.88Å; F258-F328 HydrophobicContact CE2-CD2 3.88Å; F258-F328 AromaticContact CE2-CE1 3.89Å; F258-F328 HydrophobicContact CE2-CE1 3.89Å; F258-F328 AromaticContact CE2-CE2 3.4Å; F258-F328 HydrophobicContact CE2-CE2 3.4Å; F258-F328 HydrophobicContact CE2-CG 4.34Å; F258-F328 AromaticContact CE2-CZ 3.43Å; F258-F328 HydrophobicContact CE2-CZ 3.43Å; F258-F328 VanDerWaalsContact CE2-CZ 3.43Å; F258-F328 HydrophobicContact CZ-CD2 4.38Å; F258-F328 HydrophobicContact CZ-CE2 4.31Å; F258-F328 HydrophobicContact CZ-CZ 4.49Å; I262-F328 HydrophobicContact CD1-CE2 3.55Å; I262-F328 HydrophobicContact CD1-CZ 4.04Å; G323-F328 PolarHBondContact O-N 3.14Å; G323-F328 VanDerWaalsContact O-N 3.15Å; W324-F328 HydrophobicContact CD2-CD2 4.44Å; W324-F328 HydrophobicContact CE3-CB 3.67Å; W324-F328 HydrophobicContact CE3-CD1 4.26Å; W324-F328 AromaticContact CE3-CD2 3.79Å; W324-F328 HydrophobicContact CE3-CD2 3.79Å; W324-F328 HydrophobicContact CE3-CE2 4.4Å; W324-F328 AromaticContact CE3-CG 3.67Å; W324-F328 HydrophobicContact CE3-CG 3.67Å; W324-F328 HydrophobicContact CH2-CE1 4.45Å; W324-F328 HydrophobicContact CH2-CE2 4.43Å; W324-F328 HydrophobicContact CH2-CZ 4.35Å; W324-F328 HydrophobicContact CZ3-CB 4.01Å; W324-F328 AromaticContact CZ3-CD1 3.73Å; W324-F328 HydrophobicContact CZ3-CD1 3.73Å; W324-F328 AromaticContact CZ3-CD2 3.87Å; W324-F328 HydrophobicContact CZ3-CD2 3.87Å; W324-F328 HydrophobicContact CZ3-CE1 4.03Å; W324-F328 HydrophobicContact CZ3-CE2 4.14Å; W324-F328 AromaticContact CZ3-CG 3.62Å; W324-F328 HydrophobicContact CZ3-CG 3.62Å; W324-F328 HydrophobicContact CZ3-CZ 4.2Å; W324-F328 WeakPolarHBondContact O-CB 3.29Å; W324-F328 PolarHBondContact O-N 3.13Å; F328-S330 PolarHBondContact O-N 3.23Å; F328-A331 PolarHBondContact O-N 3.23Å; F328-L332 WeakPolarHBondContact O-CG 3Å; F328-L332 PolarHBondContact O-N 3.17Å
329	L	90.9	Very high	88.4	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.026	27%	0.269	C	S	.	.	I	π-helix	trans	-68	-40.3	-169.7	-61.1	173.9	0	0	0	111	I216 D218 F220 L305 W324 L325 L332 K333	I216-L329 HydrophobicContact CG2-CD1 4Å; D218-L329 HydrophobicContact CB-CD1 4.05Å; F220-L329 HydrophobicContact CE2-CD2 3.96Å; F220-L329 HydrophobicContact CZ-CB 4.17Å; F220-L329 HydrophobicContact CZ-CD2 3.58Å; F220-L329 HydrophobicContact CZ-CG 4.43Å; L305-L329 HydrophobicContact CD2-CD2 3.68Å; W324-L329 WeakPolarHBondContact O-CB 3.37Å; W324-L329 VanDerWaalsContact O-CG 3.29Å; W324-L329 WeakPolarHBondContact O-CG 3.49Å; W324-L329 PolarHBondContact O-N 3.48Å; L325-L329 HydrophobicContact CD2-CD1 4.14Å; L329-L332 HydrophobicContact CD2-CD1 4.42Å; L329-L332 PolarHBondContact O-N 3.23Å; L329-K333 WeakPolarHBondContact O-CG 3.43Å; L329-K333 PolarHBondContact O-N 2.79Å
330	S	87.9	Confident	87.2	Confident	56 Å²	56	45.4 Å²	45.4	39%	0.392	26%	0.262	S	S	.	.	H	α-helix	trans	-60.7	-45.4	172.9	-173.6	0	0	0	0	112.4	L325 T326 F328 L332 K333 Q334	L325-S330 WeakPolarHBondContact O-CB 3.25Å; L325-S330 PolarHBondContact O-N 3.15Å; L325-S330 VanDerWaalsContact O-N 3.15Å; T326-S330 WeakPolarHBondContact O-CB 3.35Å; F328-S330 PolarHBondContact O-N 3.23Å; S330-L332 PolarHBondContact O-N 2.75Å; S330-K333 PolarHBondContact O-N 3.09Å; S330-Q334 WeakPolarHBondContact O-CB 3.43Å; S330-Q334 PolarHBondContact O-N 2.74Å
331	A	89.9	Confident	85.4	Confident	14 Å²	14	55 Å²	55	12%	0.116	30%	0.298	C	S	.	.	H	α-helix	trans	-67	-36.8	179.2	0	0	0	0	0	112.6	F240 I327 F328 Q334 T335	F240-A331 HydrophobicContact CD2-CB 4.18Å; F240-A331 WeakPolarHBondContact O-CB 3.4Å; I327-A331 WeakPolarHBondContact O-CB 3.19Å; F328-A331 PolarHBondContact O-N 3.23Å; A331-Q334 PolarHBondContact O-N 3.43Å; A331-T335 WeakPolarHBondContact O-CB 3.17Å; A331-T335 PolarHBondContact O-N 2.95Å; A331-T335 PolarHBondContact O-OG1 3.34Å
332	L	91.4	Very high	82.9	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-59.2	-49.3	172.6	-77.4	167.7	0	0	0	111.3	F220 V230 L231 F240 F328 L329 S330 Q334 Y336	F220-L332 HydrophobicContact CE1-CB 3.78Å; F220-L332 HydrophobicContact CE1-CD1 4.39Å; F220-L332 HydrophobicContact CZ-CB 4.47Å; F220-L332 HydrophobicContact CZ-CD1 4.42Å; V230-L332 HydrophobicContact CG1-CD2 3.27Å; L231-L332 HydrophobicContact CD2-CD1 4.12Å; F240-L332 HydrophobicContact CB-CD2 4.36Å; F240-L332 HydrophobicContact CD1-CD2 3.49Å; F240-L332 VanDerWaalsContact CD1-CD2 3.49Å; F240-L332 HydrophobicContact CD1-CG 4.32Å; F240-L332 HydrophobicContact CD2-CD2 4.1Å; F240-L332 HydrophobicContact CD2-CG 4.04Å; F240-L332 HydrophobicContact CE1-CD2 3.65Å; F240-L332 HydrophobicContact CE1-CG 4.4Å; F240-L332 HydrophobicContact CE2-CD2 4.28Å; F240-L332 HydrophobicContact CE2-CG 4.17Å; F240-L332 HydrophobicContact CG-CD2 3.74Å; F240-L332 HydrophobicContact CG-CG 4.14Å; F240-L332 HydrophobicContact CZ-CD2 4.07Å; F240-L332 HydrophobicContact CZ-CG 4.36Å; F328-L332 WeakPolarHBondContact O-CG 3Å; F328-L332 PolarHBondContact O-N 3.17Å; L329-L332 HydrophobicContact CD2-CD1 4.42Å; L329-L332 PolarHBondContact O-N 3.23Å; S330-L332 PolarHBondContact O-N 2.75Å; L332-Q334 PolarHBondContact O-N 2.82Å; L332-Y336 HydrophobicContact CD2-CD2 4.44Å; L332-Y336 HydrophobicContact CD2-CE2 4.43Å; L332-Y336 PolarHBondContact O-N 2.9Å
333	K	91	Very high	80.3	Confident	49 Å²	49	66.3 Å²	66.3	21%	0.213	35%	0.352	C	S	.	.	H	α-helix	trans	-60.8	-44.2	177.7	-76.9	177.8	171.4	173.2	0	112.3	D218 E219 F220 L329 S330 G337 Y338	D218-K333 IonicContact OD1-NZ 2.99Å; D218-K333 PolarHBondContact OD1-NZ 3.48Å; D218-K333 WeakPolarHBondContact OD2-CE 3.26Å; D218-K333 IonicContact OD2-NZ 3.24Å; D218-K333 PolarHBondContact OD2-NZ 3.05Å; E219-K333 WeakPolarHBondContact O-CE 3.15Å; E219-K333 PolarHBondContact O-NZ 3.04Å; F220-K333 HydrophobicContact CD1-CG 3.96Å; F220-K333 HydrophobicContact CE1-CD 4.46Å; F220-K333 HydrophobicContact CE1-CG 3.63Å; F220-K333 HydrophobicContact CZ-CG 4.38Å; L329-K333 WeakPolarHBondContact O-CG 3.43Å; L329-K333 PolarHBondContact O-N 2.79Å; S330-K333 PolarHBondContact O-N 3.09Å; K333-G337 CarbonylContact O-C 3.6Å; K333-G337 VanDerWaalsContact O-CA 3.24Å; K333-G337 WeakPolarHBondContact O-CA 3.44Å; K333-G337 PolarHBondContact O-N 3.18Å; K333-Y338 PolarHBondContact O-N 3.32Å; K333-Y338 VanDerWaalsContact O-N 3.11Å
334	Q	89.2	Confident	79.8	Confident	131 Å²	131	69 Å²	69	61%	0.612	36%	0.362	S	S	*	.	H	α-helix	trans	-70.3	-44	-178.7	-171.2	-177.9	31.4	0	0	112.2	R242 S330 A331 L332	R242-Q334 VanDerWaalsContact NH2-OE1 3.11Å; S330-Q334 WeakPolarHBondContact O-CB 3.43Å; S330-Q334 PolarHBondContact O-N 2.74Å; A331-Q334 PolarHBondContact O-N 3.43Å; L332-Q334 PolarHBondContact O-N 2.82Å
335	T	90.6	Very high	79.2	Confident	51 Å²	51	71.9 Å²	71.9	31%	0.313	38%	0.379	S	S	.	.	H	α-helix	trans	-73	-38.4	-172.1	-55.2	0	0	0	0	112	A239 F240 A331	A239-T335 HydrophobicContact CB-CG2 4.34Å; F240-T335 HydrophobicContact CB-CG2 4.19Å; A331-T335 WeakPolarHBondContact O-CB 3.17Å; A331-T335 PolarHBondContact O-N 2.95Å; A331-T335 PolarHBondContact O-OG1 3.34Å
336	Y	91.2	Very high	78.7	Confident	57 Å²	57	71.8 Å²	71.8	22%	0.224	38%	0.378	C	S	.	.	H	α-helix	trans	-106.3	1.5	-176.8	-62.8	-71.1	0	0	0	114.1	V230 L236 F240 L332 Y338	V230-Y336 HydrophobicContact CB-CE2 4.34Å; V230-Y336 HydrophobicContact CG1-CD2 3.83Å; V230-Y336 HydrophobicContact CG1-CE2 3.34Å; V230-Y336 HydrophobicContact CG2-CD1 4.47Å; V230-Y336 HydrophobicContact CG2-CD2 4.13Å; V230-Y336 HydrophobicContact CG2-CE1 4.33Å; V230-Y336 HydrophobicContact CG2-CE2 3.97Å; V230-Y336 HydrophobicContact CG2-CG 4.38Å; L236-Y336 VanDerWaalsContact C-OH 3.22Å; L236-Y336 WeakPolarHBondContact CA-OH 3.26Å; L236-Y336 VanDerWaalsContact CB-OH 3.23Å; L236-Y336 WeakPolarHBondContact CB-OH 3.45Å; L236-Y336 HydrophobicContact CD2-CE1 4.02Å; L236-Y336 WeakPolarHBondContact CD2-OH 3.42Å; L236-Y336 PolarHBondContact O-OH 3.41Å; F240-Y336 HydrophobicContact CB-CE2 4.04Å; F240-Y336 HydrophobicContact CD1-CE2 4.29Å; L332-Y336 HydrophobicContact CD2-CD2 4.44Å; L332-Y336 HydrophobicContact CD2-CE2 4.43Å; L332-Y336 PolarHBondContact O-N 2.9Å; Y336-Y338 VanDerWaalsContact C-N 3.25Å; Y336-Y338 VanDerWaalsContact CB-CZ 3.5Å; Y336-Y338 HydrophobicContact CD2-CE2 4.3Å; Y336-Y338 HydrophobicContact CG-CE2 4.07Å; Y336-Y338 WeakPolarHBondContact O-CD1 3.42Å; Y336-Y338 PolarHBondContact O-N 3.36Å
337	G	88.2	Confident	78.5	Confident	51 Å²	51	74 Å²	74	53%	0.526	39%	0.388	S	S	.	.	S	Bend	trans	70.5	18.1	-178.5	0	0	0	0	0	114.1	K333 G339	K333-G337 CarbonylContact O-C 3.6Å; K333-G337 VanDerWaalsContact O-CA 3.24Å; K333-G337 WeakPolarHBondContact O-CA 3.44Å; K333-G337 PolarHBondContact O-N 3.18Å; G337-G339 PolarHBondContact O-N 3.28Å
338	Y	88.6	Confident	78.1	Confident	26 Å²	26	73.3 Å²	73.3	10%	0.102	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	1.2	-177.7	-59.1	-20.9	0	0	0	114.1	F220 F221 C222 V230 K333 Y336	F220-Y338 WeakPolarHBondContact CA-O 3.43Å; F220-Y338 HydrophobicContact CD1-CD2 4.07Å; F220-Y338 HydrophobicContact CD1-CG 4.39Å; F221-Y338 WeakPolarHBondContact CD2-O 3.31Å; F221-Y338 PolarHBondContact N-O 2.73Å; C222-Y338 HydrophobicContact CB-CD1 3.62Å; C222-Y338 HydrophobicContact CB-CD2 4.23Å; C222-Y338 HydrophobicContact CB-CE1 3.48Å; C222-Y338 VanDerWaalsContact CB-CE1 3.48Å; C222-Y338 HydrophobicContact CB-CE2 4.09Å; C222-Y338 HydrophobicContact CB-CG 4Å; V230-Y338 HydrophobicContact CG2-CE2 4.14Å; K333-Y338 PolarHBondContact O-N 3.32Å; K333-Y338 VanDerWaalsContact O-N 3.11Å; Y336-Y338 VanDerWaalsContact C-N 3.25Å; Y336-Y338 VanDerWaalsContact CB-CZ 3.5Å; Y336-Y338 HydrophobicContact CD2-CE2 4.3Å; Y336-Y338 HydrophobicContact CG-CE2 4.07Å; Y336-Y338 WeakPolarHBondContact O-CD1 3.42Å; Y336-Y338 PolarHBondContact O-N 3.36Å
339	G	74.5	Confident	77.3	Confident	40 Å²	40	77 Å²	77	41%	0.412	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-14.5	-171.5	0	0	0	0	0	116.9	G337	G337-G339 PolarHBondContact O-N 3.28Å
340	G	63.2	Low	76.3	Confident	37 Å²	37	82.1 Å²	82.1	38%	0.381	43%	0.433	S	S	.	.	S	Bend	trans	-163.5	151.6	-178.1	0	0	0	0	0	112.1	M342	G340-M342 PolarHBondContact O-N 2.91Å
341	R	52.3	Low	75.4	Confident	202 Å²	202	84.2 Å²	84.2	76%	0.762	44%	0.436	S	S	*	.			trans	-57.9	110.6	154.3	-71.3	-178.7	176.2	-174.8	-1.4	105.5	F221 F343	F221-R341 HydrophobicContact CE1-CG 4.34Å; R341-F343 VanDerWaalsContact C-N 3.28Å; R341-F343 PolarHBondContact O-N 3.09Å
342	M	37.6	Very low	74.2	Confident	164 Å²	164	90 Å²	90	81%	0.808	46%	0.462	S	S	*	.			trans	-54.6	108.7	152.6	-74.1	-95.6	-102	0	0	103.7	G340	G340-M342 PolarHBondContact O-N 2.91Å
343	F	33.3	Very low	72.7	Confident	270 Å²	270	98 Å²	98	100%	1.184	50%	0.503	S	S	*	.			trans	134.6	0	170.3	-51.9	-40.6	0	0	0	111.6	R341	R341-F343 VanDerWaalsContact C-N 3.28Å; R341-F343 PolarHBondContact O-N 3.09Å

Retrieved 343 of 343 residues in 879.9 ms (Link to these results)

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