A0A087YBP0_POEFO Loading...

Semaphorin-7A-like

AlphaFold DB , UniProt , Accession A0A087YBP0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 611 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	47.1	Very low	36.4	Very low	183 Å²	183	116.8 Å²	116.8	90%	0.901	62%	0.616	S	S	*	*				0	-49.6	0	-139.7	172	94.3	0	0	111.8	L4 L5	M1-L4 PolarHBondContact O-N 3.27Å; M1-L5 PolarHBondContact O-N 3.22Å
2	F	40.5	Very low	35.8	Very low	183 Å²	183	112.7 Å²	112.7	80%	0.803	60%	0.602	S	S	*	*	H	α-helix	trans	-62.7	-40	176.8	-102.2	-91.9	0	0	0	115.2	L5 L6	F2-L5 PolarHBondContact O-N 3.48Å; F2-L6 PolarHBondContact O-N 2.89Å
3	T	40.9	Very low	35.7	Very low	104 Å²	104	110.5 Å²	110.5	64%	0.638	59%	0.59	S	S	*	*	H	α-helix	trans	-68.4	-33.7	176.3	37.2	0	0	0	0	113.1	L7	T3-L7 WeakPolarHBondContact O-CB 3.26Å; T3-L7 WeakPolarHBondContact O-CD1 3.24Å; T3-L7 WeakPolarHBondContact O-CG 3.24Å; T3-L7 PolarHBondContact O-N 3.4Å
4	L	35.9	Very low	35.7	Very low	112 Å²	112	110.6 Å²	110.6	59%	0.586	59%	0.591	S	S	*	*	H	α-helix	trans	-70.9	-39.5	174.1	-158.4	79.1	0	0	0	110.9	M1 L7 I8	M1-L4 PolarHBondContact O-N 3.27Å; L4-L7 PolarHBondContact O-N 3.01Å; L4-I8 HydrophobicContact CD2-CD1 4.5Å; L4-I8 HydrophobicContact CG-CD1 4.2Å; L4-I8 WeakPolarHBondContact O-CB 3.4Å; L4-I8 WeakPolarHBondContact O-CD1 3.01Å; L4-I8 WeakPolarHBondContact O-CG1 3.41Å; L4-I8 PolarHBondContact O-N 2.69Å
5	L	35.4	Very low	35.6	Very low	98 Å²	98	112.7 Å²	112.7	51%	0.513	60%	0.595	S	S	.	*	H	α-helix	trans	-64.5	-38.9	173.3	-103.8	116.8	0	0	0	112.6	M1 F2 I8 F9	M1-L5 PolarHBondContact O-N 3.22Å; F2-L5 PolarHBondContact O-N 3.48Å; L5-I8 PolarHBondContact O-N 2.74Å; L5-F9 WeakPolarHBondContact O-CB 3.13Å; L5-F9 PolarHBondContact O-N 2.57Å
6	L	37.8	Very low	35.8	Very low	116 Å²	116	109.6 Å²	109.6	61%	0.607	59%	0.591	S	S	*	*	H	α-helix	trans	-67.7	-39.1	174.9	-95	150.4	0	0	0	112.7	F2 F9 A10	F2-L6 PolarHBondContact O-N 2.89Å; L6-F9 PolarHBondContact O-N 3.38Å; L6-A10 VanDerWaalsContact O-CB 3.31Å; L6-A10 WeakPolarHBondContact O-CB 3.46Å; L6-A10 PolarHBondContact O-N 2.84Å
7	L	33.4	Very low	36.9	Very low	117 Å²	117	106 Å²	106	61%	0.613	57%	0.571	S	S	*	*	H	α-helix	trans	-66.9	-38.6	173.1	-83.1	158.6	0	0	0	111.9	T3 L4 C11	T3-L7 WeakPolarHBondContact O-CB 3.26Å; T3-L7 WeakPolarHBondContact O-CD1 3.24Å; T3-L7 WeakPolarHBondContact O-CG 3.24Å; T3-L7 PolarHBondContact O-N 3.4Å; L4-L7 PolarHBondContact O-N 3.01Å; L7-C11 WeakPolarHBondContact O-CB 3.03Å; L7-C11 PolarHBondContact O-N 3.17Å
8	I	36.3	Very low	38	Very low	93 Å²	93	104.7 Å²	104.7	48%	0.477	56%	0.564	S	S	.	*	H	α-helix	trans	-66.3	-42.3	173.1	-67.8	163	0	0	0	110.3	L4 L5 C11 C12	L4-I8 HydrophobicContact CD2-CD1 4.5Å; L4-I8 HydrophobicContact CG-CD1 4.2Å; L4-I8 WeakPolarHBondContact O-CB 3.4Å; L4-I8 WeakPolarHBondContact O-CD1 3.01Å; L4-I8 WeakPolarHBondContact O-CG1 3.41Å; L4-I8 PolarHBondContact O-N 2.69Å; L5-I8 PolarHBondContact O-N 2.74Å; I8-C11 PolarHBondContact O-N 3.01Å; I8-C12 WeakPolarHBondContact O-CB 3.45Å; I8-C12 PolarHBondContact O-N 3.08Å; I8-C12 PolarHBondContact O-SG 3.29Å
9	F	31.7	Very low	39.8	Very low	140 Å²	140	103.1 Å²	103.1	61%	0.614	55%	0.552	S	S	*	*	H	α-helix	trans	-66	-38.7	177.4	-131.6	-94.8	0	0	0	112.5	L5 L6 C12 L13	L5-F9 WeakPolarHBondContact O-CB 3.13Å; L5-F9 PolarHBondContact O-N 2.57Å; L6-F9 PolarHBondContact O-N 3.38Å; F9-C12 PolarHBondContact O-N 2.83Å; F9-L13 HydrophobicContact CD1-CD1 4.14Å; F9-L13 WeakPolarHBondContact O-CG 3.38Å; F9-L13 PolarHBondContact O-N 2.81Å
10	A	32.2	Very low	42.1	Very low	56 Å²	56	99.4 Å²	99.4	46%	0.463	54%	0.535	S	S	.	.	H	α-helix	trans	-69.9	-38.5	175.4	0	0	0	0	0	112.5	L6 N14	L6-A10 VanDerWaalsContact O-CB 3.31Å; L6-A10 WeakPolarHBondContact O-CB 3.46Å; L6-A10 PolarHBondContact O-N 2.84Å; A10-N14 PolarHBondContact O-N 2.04Å
11	C	28.8	Very low	44.5	Very low	83 Å²	83	95.1 Å²	95.1	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-65.4	-41.6	170.5	-90.9	0	0	0	0	111.9	L7 I8 L13 N14 E15	L7-C11 WeakPolarHBondContact O-CB 3.03Å; L7-C11 PolarHBondContact O-N 3.17Å; I8-C11 PolarHBondContact O-N 3.01Å; C11-L13 VanDerWaalsContact C-N 3.34Å; C11-L13 PolarHBondContact O-N 2.92Å; C11-N14 PolarHBondContact O-N 3.07Å; C11-E15 PolarHBondContact O-N 3.36Å
12	C	29.5	Very low	46.7	Very low	67 Å²	67	86.8 Å²	86.8	45%	0.453	47%	0.471	S	S	.	.	H	α-helix	trans	-66.2	-33	177.9	-71.3	0	0	0	0	112.8	I8 F9 A16	I8-C12 WeakPolarHBondContact O-CB 3.45Å; I8-C12 PolarHBondContact O-N 3.08Å; I8-C12 PolarHBondContact O-SG 3.29Å; F9-C12 PolarHBondContact O-N 2.83Å; C12-A16 WeakPolarHBondContact O-CB 3.21Å; C12-A16 PolarHBondContact O-N 2.98Å
13	L	34.6	Very low	49.2	Very low	84 Å²	84	79 Å²	79	44%	0.44	44%	0.437	S	S	.	.	H	α-helix	trans	-70.2	-31.3	174.5	-80.8	160.4	0	0	0	112.8	F9 C11 N17	F9-L13 HydrophobicContact CD1-CD1 4.14Å; F9-L13 WeakPolarHBondContact O-CG 3.38Å; F9-L13 PolarHBondContact O-N 2.81Å; C11-L13 VanDerWaalsContact C-N 3.34Å; C11-L13 PolarHBondContact O-N 2.92Å; L13-N17 PolarHBondContact O-ND2 3.41Å
14	N	35.2	Very low	51.6	Low	113 Å²	113	75.5 Å²	75.5	60%	0.604	42%	0.416	S	S	*	.	H	α-helix	trans	-78.3	-34	174.5	-100	-0.3	0	0	0	112.9	A10 C11	A10-N14 PolarHBondContact O-N 2.04Å; C11-N14 PolarHBondContact O-N 3.07Å
15	E	34.8	Very low	54.3	Low	141 Å²	141	71.1 Å²	71.1	66%	0.659	39%	0.392	S	S	*	.	H	α-helix	trans	-77.3	-31.6	174.4	-77.6	-174.4	163.5	0	0	113.1	C11 N17 L18	C11-E15 PolarHBondContact O-N 3.36Å; E15-N17 PolarHBondContact O-N 3.43Å; E15-L18 PolarHBondContact O-N 2.03Å
16	A	39.3	Very low	56.7	Low	63 Å²	63	70.3 Å²	70.3	52%	0.521	38%	0.384	S	S	.	.	H	α-helix	trans	-64.3	-24.6	179.9	0	0	0	0	0	113.6	C12	C12-A16 WeakPolarHBondContact O-CB 3.21Å; C12-A16 PolarHBondContact O-N 2.98Å
17	N	53.4	Low	58.6	Low	49 Å²	49	68.5 Å²	68.5	26%	0.262	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-16.2	-178.2	-73.6	-23.1	0	0	0	113.9	L13 E15 H19 S20 H531	L13-N17 PolarHBondContact O-ND2 3.41Å; E15-N17 PolarHBondContact O-N 3.43Å; N17-H19 PolarHBondContact O-N 3.21Å; N17-S20 PolarHBondContact O-OG 3.02Å; N17-H531 PolarHBondContact O-CD2 2.89Å; N17-H531 VanDerWaalsContact O-CD2 3.29Å; N17-H531 PolarHBondContact O-NE2 2.84Å
18	L	57.8	Low	60.3	Low	83 Å²	83	72.1 Å²	72.1	44%	0.435	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-22.9	-178.3	-119.2	79.8	0	0	0	113.3	E15	E15-L18 PolarHBondContact O-N 2.03Å
19	H	71.5	Confident	61.7	Low	74 Å²	74	73.9 Å²	73.9	34%	0.343	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-2.1	-174.3	-61.3	-66.5	0	0	0	113.5	N17 F361 N362 I403	N17-H19 PolarHBondContact O-N 3.21Å; H19-F361 AromaticContact CE1-CD1 3.98Å; H19-F361 PolarHBondContact CE1-O 2.74Å; H19-F361 VanDerWaalsContact CE1-O 3.26Å; H19-F361 PolarHBondContact ND1-O 3.46Å; H19-N362 PolarHBondContact O-ND2 2.73Å; H19-I403 WeakPolarHBondContact O-CD1 3.21Å
20	S	86.6	Confident	63.1	Low	29 Å²	29	68.1 Å²	68.1	20%	0.203	37%	0.365	C	S	.	.	S	Bend	trans	-97.4	150.4	174.5	61.9	0	0	0	0	111	N17 R22 H531	N17-S20 PolarHBondContact O-OG 3.02Å; S20-R22 PolarHBondContact O-N 3.02Å; S20-H531 PolarHBondContact O-NE2 2.85Å
21	P	92.6	Very high	64.6	Low	10 Å²	10	71.6 Å²	71.6	7%	0.065	38%	0.383	C	S	.	.			trans	-65.3	130.6	171.3	27.8	-34	0	0	0	110.1	M23 V24 I403 E406 H530	P21-M23 VanDerWaalsContact C-N 3.32Å; P21-M23 PolarHBondContact O-N 2.98Å; P21-V24 HydrophobicContact CG-CG2 4.27Å; P21-I403 HydrophobicContact CB-CG2 3.79Å; P21-E406 HydrophobicContact CB-CB 3.77Å; P21-E406 HydrophobicContact CG-CB 3.84Å; P21-H530 WeakPolarHBondContact O-CB 2.87Å; P21-H530 PolarHBondContact O-ND1 2.87Å; P21-H530 VanDerWaalsContact O-ND1 3.12Å
22	R	93	Very high	66.9	Low	8 Å²	8	69 Å²	69	3%	0.03	36%	0.364	C	S	.	.	S	Bend	trans	-59	-44.6	178.1	-179.3	178.6	174.1	-87.2	-4.3	111.4	S20 F402 I403 I404 L456 S529 H530 H531 E573	S20-R22 PolarHBondContact O-N 3.02Å; R22-F402 HydrophobicContact CB-CZ 4.21Å; R22-I403 PolarHBondContact N-O 2.73Å; R22-I404 WeakPolarHBondContact CB-O 2.98Å; R22-L456 PolarHBondContact NE-O 3.13Å; R22-S529 CarbonylContact O-C 3.57Å; R22-S529 VanDerWaalsContact O-CA 3.3Å; R22-S529 WeakPolarHBondContact O-CA 3.47Å; R22-H530 PolarHBondContact O-N 2.85Å; R22-H531 HydrophobicContact CG-CB 4.37Å; R22-E573 IonicContact CZ-OE1 2.98Å; R22-E573 IonicContact CZ-OE2 3.54Å; R22-E573 IonicContact NE-OE1 2.74Å; R22-E573 PolarHBondContact NE-OE1 3.3Å; R22-E573 IonicContact NE-OE2 3.57Å; R22-E573 PolarHBondContact NE-OE2 3.18Å; R22-E573 IonicContact NH2-OE1 2.63Å; R22-E573 IonicContact NH2-OE2 2.98Å; R22-E573 PolarHBondContact NH2-OE2 3.41Å
23	M	92.3	Very high	69.6	Low	19 Å²	19	69.7 Å²	69.7	9%	0.094	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153.7	178.2	-59.9	-168.8	72.3	0	0	111.4	P21 F25 I404 A405 E406 Y447	P21-M23 VanDerWaalsContact C-N 3.32Å; P21-M23 PolarHBondContact O-N 2.98Å; M23-F25 HydrophobicContact CB-CE1 4.26Å; M23-F25 HydrophobicContact CB-CE2 4.35Å; M23-F25 HydrophobicContact CB-CZ 3.88Å; M23-F25 HydrophobicContact CE-CE1 4.07Å; M23-F25 HydrophobicContact CE-CZ 4.33Å; M23-F25 HydrophobicContact SD-CE1 4.46Å; M23-F25 HydrophobicContact SD-CZ 4.12Å; M23-I404 PolarHBondContact N-O 3.46Å; M23-A405 CarbonylContact O-C 3.55Å; M23-A405 WeakPolarHBondContact O-CA 3.49Å; M23-E406 PolarHBondContact O-N 3.41Å; M23-Y447 HydrophobicContact SD-CD1 3.6Å; M23-Y447 VanDerWaalsContact SD-CD1 3.6Å; M23-Y447 HydrophobicContact SD-CE1 4.08Å
24	V	92.1	Very high	72.1	Confident	31 Å²	31	67.7 Å²	67.7	19%	0.188	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.6	174.3	179.8	0	0	0	0	108.8	P21 K26 E406 Q408 H530	P21-V24 HydrophobicContact CG-CG2 4.27Å; V24-K26 HydrophobicContact CG1-CG 4.26Å; V24-E406 CarbonylContact C-O 3.59Å; V24-E406 WeakPolarHBondContact CA-O 3.04Å; V24-E406 HydrophobicContact CG2-CB 4.17Å; V24-Q408 HydrophobicContact CG1-CG 4.21Å; V24-H530 VanDerWaalsContact CG2-CE1 3.43Å; V24-H530 WeakPolarHBondContact CG2-CE1 3.23Å
25	F	91.3	Very high	74.5	Confident	19 Å²	19	62.4 Å²	62.4	8%	0.083	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	103.2	178.1	-58.7	-57.6	0	0	0	109.7	M23 A405 E406 Y407 Q408 Q446 Y447	M23-F25 HydrophobicContact CB-CE1 4.26Å; M23-F25 HydrophobicContact CB-CE2 4.35Å; M23-F25 HydrophobicContact CB-CZ 3.88Å; M23-F25 HydrophobicContact CE-CE1 4.07Å; M23-F25 HydrophobicContact CE-CZ 4.33Å; M23-F25 HydrophobicContact SD-CE1 4.46Å; M23-F25 HydrophobicContact SD-CZ 4.12Å; F25-A405 HydrophobicContact CD2-CB 3.79Å; F25-A405 HydrophobicContact CE2-CB 3.38Å; F25-A405 HydrophobicContact CZ-CB 4.4Å; F25-E406 PolarHBondContact N-O 3.08Å; F25-Y407 HydrophobicContact CB-CD1 3.99Å; F25-Y407 HydrophobicContact CB-CE1 4.33Å; F25-Y407 AromaticContact CD2-CD1 3.88Å; F25-Y407 HydrophobicContact CD2-CD1 3.88Å; F25-Y407 AromaticContact CD2-CE1 3.52Å; F25-Y407 HydrophobicContact CD2-CE1 3.52Å; F25-Y407 HydrophobicContact CE2-CE1 4.27Å; F25-Y407 HydrophobicContact CG-CD1 4.38Å; F25-Y407 HydrophobicContact CG-CE1 4.28Å; F25-Q408 PolarHBondContact O-N 3.17Å; F25-Q446 HydrophobicContact CD1-CG 4.32Å; F25-Q446 HydrophobicContact CE1-CB 3.99Å; F25-Q446 HydrophobicContact CE1-CG 3.56Å; F25-Q446 HydrophobicContact CE2-CG 4.05Å; F25-Q446 HydrophobicContact CZ-CB 4.34Å; F25-Q446 VanDerWaalsContact CZ-CD 3.46Å; F25-Q446 HydrophobicContact CZ-CG 3.42Å; F25-Q446 VanDerWaalsContact CZ-CG 3.42Å; F25-Y447 HydrophobicContact CE2-CE1 4.21Å; F25-Y447 HydrophobicContact CZ-CD1 4.3Å; F25-Y447 AromaticContact CZ-CE1 3.82Å; F25-Y447 HydrophobicContact CZ-CE1 3.82Å
26	K	87.3	Confident	76.8	Confident	81 Å²	81	60.2 Å²	60.2	35%	0.352	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	151.4	-178.3	-63.2	179.9	-178.8	170.1	0	111.3	V24 K28 E29 A30	V24-K26 HydrophobicContact CG1-CG 4.26Å; K26-K28 PolarHBondContact O-N 2.94Å; K26-E29 HydrophobicContact CB-CG 4.49Å; K26-E29 PolarHBondContact O-N 2.76Å; K26-A30 PolarHBondContact O-N 3.29Å
27	Y	77.7	Confident	78.6	Confident	79 Å²	79	58 Å²	58	31%	0.31	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-38.4	-42.8	171.6	172.5	-75.9	0	0	0	114.6	R34 Q408 P409 N411	Y27-R34 VanDerWaalsContact CD2-NH2 3.32Å; Y27-Q408 WeakPolarHBondContact CA-O 3.32Å; Y27-Q408 PolarHBondContact N-O 3.08Å; Y27-P409 WeakPolarHBondContact CD2-O 3.11Å; Y27-N411 HydrophobicContact CD1-CB 4.41Å; Y27-N411 HydrophobicContact CD2-CB 4.06Å; Y27-N411 HydrophobicContact CE2-CB 4.29Å; Y27-N411 HydrophobicContact CG-CB 4.14Å
28	K	68.5	Low	79.2	Confident	192 Å²	192	63.8 Å²	63.8	84%	0.835	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-21.1	-173.2	-66.1	-175.1	179.9	178.3	0	113.3	K26	K26-K28 PolarHBondContact O-N 2.94Å
29	E	65.4	Low	79.4	Confident	130 Å²	130	68.5 Å²	68.5	61%	0.607	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-26.6	-170.5	-67.8	162.6	-169.2	0	0	111.2	K26	K26-E29 HydrophobicContact CB-CG 4.49Å; K26-E29 PolarHBondContact O-N 2.76Å
30	A	61.1	Low	79.1	Confident	20 Å²	20	69.1 Å²	69.1	17%	0.165	34%	0.336	C	S	.	.	S	Bend	trans	-114.8	103	171.5	0	0	0	0	0	109	K26 V32	K26-A30 PolarHBondContact O-N 3.29Å; A30-V32 HydrophobicContact CB-CG2 4.5Å; A30-V32 WeakPolarHBondContact O-CG2 3.41Å; A30-V32 PolarHBondContact O-N 2.69Å
31	P	64	Low	78.3	Confident	129 Å²	129	70 Å²	70	84%	0.838	34%	0.338	S	S	*	.			trans	-64.4	98.5	178.3	24.8	-32	0	0	0	110.1
32	V	77.4	Confident	77	Confident	27 Å²	27	70.1 Å²	70.1	16%	0.164	34%	0.339	C	S	.	.			trans	-90.2	132.3	-178	-154.6	0	0	0	0	110.4	A30 V437 Q438 I439	A30-V32 HydrophobicContact CB-CG2 4.5Å; A30-V32 WeakPolarHBondContact O-CG2 3.41Å; A30-V32 PolarHBondContact O-N 2.69Å; V32-V437 HydrophobicContact CB-CG1 3.92Å; V32-V437 HydrophobicContact CG1-CG1 3.19Å; V32-Q438 WeakPolarHBondContact CG1-O 3.44Å; V32-I439 HydrophobicContact CG1-CG1 4.03Å
33	K	85.8	Confident	75.9	Confident	82 Å²	82	71.5 Å²	71.5	36%	0.357	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	139.3	175.3	-64.1	168.2	162.2	-163.6	0	109.5	F67 N68 T70 V437 Q438	K33-F67 HydrophobicContact CB-CD1 3.74Å; K33-F67 HydrophobicContact CB-CE1 4.46Å; K33-F67 HydrophobicContact CD-CB 4.22Å; K33-F67 WeakPolarHBondContact CD-O 3.41Å; K33-F67 WeakPolarHBondContact CE-O 3.28Å; K33-F67 PolarHBondContact NZ-O 2.82Å; K33-N68 PolarHBondContact NZ-OD1 2.92Å; K33-T70 HydrophobicContact CB-CG2 4Å; K33-T70 HydrophobicContact CG-CG2 4.45Å; K33-V437 WeakPolarHBondContact O-CA 3.15Å; K33-Q438 HydrophobicContact CB-CB 4.47Å; K33-Q438 PolarHBondContact O-N 3.18Å
34	R	87.1	Confident	75.4	Confident	42 Å²	42	73.7 Å²	73.7	16%	0.158	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	155.7	-173.2	66.8	-175.1	60.2	-119.3	-12.7	113.3	Y27 T70 P409 E435 L436 V437	Y27-R34 VanDerWaalsContact CD2-NH2 3.32Å; R34-T70 WeakPolarHBondContact O-CB 3.31Å; R34-P409 PolarHBondContact NH2-O 3.34Å; R34-E435 IonicContact NH1-OE1 3.47Å; R34-E435 PolarHBondContact NH1-OE1 3.27Å; R34-E435 IonicContact NH1-OE2 2.83Å; R34-E435 PolarHBondContact NH1-OE2 3.47Å; R34-L436 CarbonylContact C-O 3.55Å; R34-L436 VanDerWaalsContact CA-O 3.23Å; R34-L436 WeakPolarHBondContact CA-O 3.4Å; R34-V437 HydrophobicContact CB-CG2 3.98Å
35	F	85.4	Confident	74.8	Confident	3 Å²	3	72.4 Å²	72.4	1%	0.013	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134.5	168.5	-77.1	-83.9	0	0	0	110.1	Y65 N66 F67 T70 E435 L436	F35-Y65 HydrophobicContact CB-CD1 3.82Å; F35-Y65 HydrophobicContact CB-CE1 3.86Å; F35-Y65 AromaticContact CD1-CD1 3.65Å; F35-Y65 HydrophobicContact CD1-CD1 3.65Å; F35-Y65 HydrophobicContact CD1-CE1 4.14Å; F35-Y65 AromaticContact CD2-CD1 3.71Å; F35-Y65 HydrophobicContact CD2-CD1 3.71Å; F35-Y65 HydrophobicContact CD2-CG 4.11Å; F35-Y65 HydrophobicContact CE1-CD1 4.05Å; F35-Y65 HydrophobicContact CE2-CD1 4.11Å; F35-Y65 HydrophobicContact CE2-CG 4.37Å; F35-Y65 AromaticContact CG-CD1 3.44Å; F35-Y65 HydrophobicContact CG-CD1 3.44Å; F35-Y65 VanDerWaalsContact CG-CD1 3.44Å; F35-Y65 AromaticContact CG-CE1 3.97Å; F35-Y65 HydrophobicContact CG-CE1 3.97Å; F35-Y65 HydrophobicContact CG-CG 4.28Å; F35-Y65 HydrophobicContact CZ-CD1 4.25Å; F35-N66 WeakPolarHBondContact CZ-O 3.37Å; F35-F67 HydrophobicContact CD2-CD1 4.07Å; F35-F67 HydrophobicContact CD2-CD2 4.42Å; F35-F67 AromaticContact CD2-CE1 3.71Å; F35-F67 HydrophobicContact CD2-CE1 3.71Å; F35-F67 HydrophobicContact CD2-CE2 4.08Å; F35-F67 HydrophobicContact CD2-CG 4.41Å; F35-F67 AromaticContact CD2-CZ 3.72Å; F35-F67 HydrophobicContact CD2-CZ 3.72Å; F35-F67 AromaticContact CE2-CD1 3.89Å; F35-F67 HydrophobicContact CE2-CD1 3.89Å; F35-F67 AromaticContact CE2-CD2 3.98Å; F35-F67 HydrophobicContact CE2-CD2 3.98Å; F35-F67 HydrophobicContact CE2-CE1 4.01Å; F35-F67 HydrophobicContact CE2-CE2 4.08Å; F35-F67 AromaticContact CE2-CG 3.88Å; F35-F67 HydrophobicContact CE2-CG 3.88Å; F35-F67 HydrophobicContact CE2-CZ 4.1Å; F35-T70 HydrophobicContact CE2-CG2 4.11Å; F35-T70 HydrophobicContact CZ-CG2 4.29Å; F35-E435 CarbonylContact O-C 3.52Å; F35-E435 WeakPolarHBondContact O-CA 3.33Å; F35-L436 PolarHBondContact N-O 3.08Å; F35-L436 PolarHBondContact O-N 2.76Å
36	P	82.6	Confident	74.2	Confident	95 Å²	95	71.9 Å²	71.9	62%	0.617	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	136.2	168.7	29.6	-32.8	0	0	0	110
37	L	77.2	Confident	73.5	Confident	16 Å²	16	69.3 Å²	69.3	8%	0.084	34%	0.337	C	S	.	.			trans	-94.5	141.5	173.3	-64.4	176.1	0	0	0	109.6	Y65 N431 T434 L436	L37-Y65 VanDerWaalsContact CD2-OH 3.25Å; L37-Y65 WeakPolarHBondContact CD2-OH 3.07Å; L37-N431 HydrophobicContact CD1-CB 4.25Å; L37-T434 PolarHBondContact N-O 3.45Å; L37-L436 HydrophobicContact CD1-CB 4.26Å; L37-L436 HydrophobicContact CD2-CB 4.03Å; L37-L436 HydrophobicContact CG-CB 4.17Å
38	R	65.8	Low	72.9	Confident	170 Å²	170	69.4 Å²	69.4	64%	0.642	34%	0.341	S	S	*	.			trans	-99.5	96.7	-177.6	-68.8	179.4	176.8	178.8	-1.5	110.1	H40	R38-H40 PolarHBondContact O-N 3.4Å
39	E	63.1	Low	72.3	Confident	183 Å²	183	65.9 Å²	65.9	86%	0.855	33%	0.327	S	S	*	.	S	Bend	trans	46.4	-9.8	170.7	-66.7	-169.2	172.8	0	0	119.2
40	H	64.9	Low	71.5	Confident	87 Å²	87	70.1 Å²	70.1	40%	0.403	34%	0.338	S	S	.	.	S	Bend	trans	-125.1	120.3	-171.2	-63.6	-27.2	0	0	0	107.6	R38	R38-H40 PolarHBondContact O-N 3.4Å
41	L	69.6	Low	71.3	Confident	46 Å²	46	70.7 Å²	70.7	24%	0.241	34%	0.34	C	S	.	.			trans	-79.6	140	-173.8	-55.5	174	0	0	0	109.4	V43 L417 Q433	L41-V43 PolarHBondContact O-N 3.33Å; L41-L417 HydrophobicContact CB-CD1 4.28Å; L41-L417 HydrophobicContact CD1-CD1 3.64Å; L41-L417 HydrophobicContact CD2-CD1 3.41Å; L41-L417 VanDerWaalsContact CD2-CD1 3.41Å; L41-L417 HydrophobicContact CG-CD1 3.93Å; L41-Q433 HydrophobicContact CD2-CB 4.23Å; L41-Q433 HydrophobicContact CD2-CG 4.35Å
42	P	64.6	Low	71.1	Confident	14 Å²	14	66.5 Å²	66.5	9%	0.091	32%	0.317	C	S	.	.			trans	-66.2	130.6	176.6	30	-35.8	0	0	0	109.5	I45 S56 V57 N431	P42-I45 HydrophobicContact CB-CG1 4.31Å; P42-I45 HydrophobicContact CG-CG1 4.47Å; P42-S56 VanDerWaalsContact CB-OG 3.29Å; P42-S56 WeakPolarHBondContact CB-OG 3.43Å; P42-V57 CarbonylContact C-O 3.5Å; P42-N431 HydrophobicContact CG-CB 4.05Å; P42-N431 VanDerWaalsContact CG-ND2 3.26Å; P42-N431 WeakPolarHBondContact CG-ND2 3.27Å
43	V	71.2	Confident	70.8	Confident	36 Å²	36	67.7 Å²	67.7	22%	0.218	32%	0.322	C	S	.	.	S	Bend	trans	-68.9	-44.9	172.1	178.9	0	0	0	0	109	L41 V57 K59 I91 V94	L41-V43 PolarHBondContact O-N 3.33Å; V43-V57 WeakPolarHBondContact CA-O 3.45Å; V43-V57 WeakPolarHBondContact CB-O 3.47Å; V43-V57 PolarHBondContact N-O 3.18Å; V43-K59 HydrophobicContact CG2-CG 4.17Å; V43-I91 WeakPolarHBondContact CG2-O 3.42Å; V43-V94 HydrophobicContact CG1-CG2 4.39Å
44	Q	81.1	Confident	70.4	Confident	65 Å²	65	63.8 Å²	63.8	30%	0.304	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	149.5	174.8	-167.4	170.2	11.9	0	0	111.1	L46 V57 V94	Q44-L46 HydrophobicContact CG-CD2 3.8Å; Q44-L46 HydrophobicContact CG-CG 4.44Å; Q44-V57 PolarHBondContact N-O 2.9Å; Q44-V57 PolarHBondContact O-N 2.95Å; Q44-V94 HydrophobicContact CB-CB 4.27Å; Q44-V94 PolarHBondContact OE1-O 2.79Å
45	I	79.1	Confident	70.1	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.026	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	124.4	171	-62.9	165.5	0	0	0	106.8	P42 F47 V54 V420 N431 L436	P42-I45 HydrophobicContact CB-CG1 4.31Å; P42-I45 HydrophobicContact CG-CG1 4.47Å; I45-F47 HydrophobicContact CG2-CE1 3.91Å; I45-F47 HydrophobicContact CG2-CZ 4.18Å; I45-V54 HydrophobicContact CG2-CG1 3.27Å; I45-V420 HydrophobicContact CB-CG2 3.59Å; I45-V420 HydrophobicContact CD1-CG2 4.22Å; I45-V420 HydrophobicContact CG2-CG2 3.64Å; I45-N431 HydrophobicContact CD1-CB 4.35Å; I45-L436 HydrophobicContact CD1-CD1 3.52Å
46	L	79.2	Confident	69.9	Low	8 Å²	8	62 Å²	62	4%	0.042	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	152.6	-178.1	-58.1	179.7	0	0	0	110.5	Q44 T55 V57 V94 Q96 L103	Q44-L46 HydrophobicContact CG-CD2 3.8Å; Q44-L46 HydrophobicContact CG-CG 4.44Å; L46-T55 PolarHBondContact N-O 2.82Å; L46-T55 PolarHBondContact O-N 2.86Å; L46-V57 HydrophobicContact CD1-CG2 4.02Å; L46-V57 HydrophobicContact CG-CG2 4.44Å; L46-V94 HydrophobicContact CD1-CG1 3.77Å; L46-V94 HydrophobicContact CD2-CG1 4.42Å; L46-V94 HydrophobicContact CG-CG1 4.41Å; L46-Q96 HydrophobicContact CD2-CB 4.13Å; L46-L103 HydrophobicContact CD1-CD1 3.71Å; L46-L103 HydrophobicContact CD1-CD2 3.54Å; L46-L103 HydrophobicContact CD1-CG 4.26Å
47	F	72.9	Confident	69.7	Low	26 Å²	26	57.4 Å²	57.4	11%	0.114	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	136	179.5	-52.3	-58.9	0	0	0	110.5	I45 V54 Q96 V420 L421 N422 Y429	I45-F47 HydrophobicContact CG2-CE1 3.91Å; I45-F47 HydrophobicContact CG2-CZ 4.18Å; F47-V54 HydrophobicContact CD1-CG1 4.28Å; F47-V54 HydrophobicContact CD1-CG2 4.08Å; F47-V54 HydrophobicContact CE1-CG1 4.08Å; F47-V54 HydrophobicContact CE1-CG2 4.14Å; F47-Q96 PolarHBondContact O-NE2 2.9Å; F47-Q96 PolarHBondContact O-OE1 2.82Å; F47-V420 HydrophobicContact CE1-CG2 4.27Å; F47-V420 HydrophobicContact CE2-CB 3.76Å; F47-V420 HydrophobicContact CE2-CG2 3.83Å; F47-V420 HydrophobicContact CZ-CB 3.76Å; F47-V420 HydrophobicContact CZ-CG2 3.32Å; F47-L421 WeakPolarHBondContact CE2-O 3.46Å; F47-N422 HydrophobicContact CD1-CB 4.36Å; F47-N422 HydrophobicContact CD2-CB 4.15Å; F47-N422 HydrophobicContact CE2-CB 4.35Å; F47-N422 HydrophobicContact CG-CB 4.12Å; F47-Y429 HydrophobicContact CD1-CD2 4.14Å; F47-Y429 AromaticContact CD1-CE2 3.85Å; F47-Y429 HydrophobicContact CD1-CE2 3.85Å; F47-Y429 AromaticContact CE1-CD2 3.05Å; F47-Y429 HydrophobicContact CE1-CD2 3.05Å; F47-Y429 AromaticContact CE1-CE2 3.19Å; F47-Y429 HydrophobicContact CE1-CE2 3.19Å; F47-Y429 AromaticContact CE1-CG 3.75Å; F47-Y429 HydrophobicContact CE1-CG 3.75Å; F47-Y429 AromaticContact CZ-CD2 3.27Å; F47-Y429 HydrophobicContact CZ-CD2 3.27Å; F47-Y429 AromaticContact CZ-CE2 3.76Å; F47-Y429 HydrophobicContact CZ-CE2 3.76Å; F47-Y429 HydrophobicContact CZ-CG 4.09Å
48	E	64.8	Low	70	Confident	81 Å²	81	56.9 Å²	56.9	38%	0.379	27%	0.267	S	S	.	.			trans	-87.1	124.3	162.1	-66.9	171.3	175.7	0	0	107	W50 S51	E48-W50 PolarHBondContact O-N 3.43Å; E48-S51 WeakPolarHBondContact CB-OG 3.49Å; E48-S51 PolarHBondContact O-N 2.74Å; E48-S51 WeakPolarHBondContact OE2-CB 3.44Å; E48-S51 PolarHBondContact OE2-OG 3.14Å
49	E	55.4	Low	70.7	Confident	118 Å²	118	50.7 Å²	50.7	55%	0.551	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-21.8	-169.4	-73.3	-176.3	154.9	0	0	114.5
50	W	49.9	Very low	71.4	Confident	220 Å²	220	43.2 Å²	43.2	83%	0.833	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125.6	8.9	-174.3	-57.4	96.7	0	0	0	114.4	E48	E48-W50 PolarHBondContact O-N 3.43Å
51	S	57.3	Low	72.1	Confident	31 Å²	31	41.8 Å²	41.8	22%	0.217	20%	0.202	C	C	.	.			trans	-116.8	145.1	-178.6	100.4	0	0	0	0	111.7	E48 N53	E48-S51 WeakPolarHBondContact CB-OG 3.49Å; E48-S51 PolarHBondContact O-N 2.74Å; E48-S51 WeakPolarHBondContact OE2-CB 3.44Å; E48-S51 PolarHBondContact OE2-OG 3.14Å; S51-N53 PolarHBondContact O-N 2.69Å; S51-N53 VanDerWaalsContact O-N 3.16Å; S51-N53 WeakPolarHBondContact OG-CB 3.4Å; S51-N53 PolarHBondContact OG-N 2.89Å; S51-N53 VanDerWaalsContact OG-N 3.17Å; S51-N53 PolarHBondContact OG-O 3.1Å
52	A	59.3	Low	72.7	Confident	42 Å²	42	39.7 Å²	39.7	35%	0.347	19%	0.191	S	C	.	.	S	Bend	trans	-73	5.7	170.2	0	0	0	0	0	112.2	N68	A52-N68 WeakPolarHBondContact CB-ND2 3.48Å
53	N	71	Confident	73.5	Confident	51 Å²	51	39 Å²	39	27%	0.273	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	138.8	-179.6	-55.4	-31.9	0	0	0	109.5	S51 Y65 N66	S51-N53 PolarHBondContact O-N 2.69Å; S51-N53 VanDerWaalsContact O-N 3.16Å; S51-N53 WeakPolarHBondContact OG-CB 3.4Å; S51-N53 PolarHBondContact OG-N 2.89Å; S51-N53 VanDerWaalsContact OG-N 3.17Å; S51-N53 PolarHBondContact OG-O 3.1Å; N53-Y65 CarbonylContact C-O 3.52Å; N53-Y65 WeakPolarHBondContact CA-O 3.18Å; N53-N66 WeakPolarHBondContact OD1-CB 3.5Å; N53-N66 PolarHBondContact OD1-ND2 2.54Å
54	V	78.1	Confident	74	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.9	173.3	177.2	0	0	0	0	107.5	I45 F47 Y65 F67 Y429	I45-V54 HydrophobicContact CG2-CG1 3.27Å; F47-V54 HydrophobicContact CD1-CG1 4.28Å; F47-V54 HydrophobicContact CD1-CG2 4.08Å; F47-V54 HydrophobicContact CE1-CG1 4.08Å; F47-V54 HydrophobicContact CE1-CG2 4.14Å; V54-Y65 PolarHBondContact N-O 3.44Å; V54-Y65 PolarHBondContact O-N 3.44Å; V54-F67 HydrophobicContact CB-CD2 4.39Å; V54-F67 HydrophobicContact CB-CE2 4.02Å; V54-F67 HydrophobicContact CG2-CD2 3.92Å; V54-F67 HydrophobicContact CG2-CE2 3.82Å; V54-Y429 HydrophobicContact CG2-CD1 3.88Å; V54-Y429 HydrophobicContact CG2-CE1 3.32Å; V54-Y429 HydrophobicContact CG2-CE2 4.12Å; V54-Y429 HydrophobicContact CG2-CG 4.48Å; V54-Y429 VanDerWaalsContact CG2-CZ 3.4Å
55	T	80.1	Confident	74	Confident	7 Å²	7	35.5 Å²	35.5	4%	0.043	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	109.7	176.3	-58	0	0	0	0	108	L46 L62 F64	L46-T55 PolarHBondContact N-O 2.82Å; L46-T55 PolarHBondContact O-N 2.86Å; T55-L62 HydrophobicContact CG2-CD2 4.39Å; T55-F64 HydrophobicContact CG2-CD1 4.1Å; T55-F64 HydrophobicContact CG2-CE1 3.78Å; T55-F64 HydrophobicContact CG2-CZ 4.17Å; T55-F64 VanDerWaalsContact OG1-CD1 3.25Å; T55-F64 WeakPolarHBondContact OG1-CD1 3.32Å; T55-F64 WeakPolarHBondContact OG1-CE1 3.28Å
56	S	80.8	Confident	74.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	123.2	169.5	175	0	0	0	0	109.2	P42 A63	P42-S56 VanDerWaalsContact CB-OG 3.29Å; P42-S56 WeakPolarHBondContact CB-OG 3.43Å; S56-A63 PolarHBondContact N-O 3.36Å; S56-A63 PolarHBondContact O-N 3.22Å
57	V	79.6	Confident	74.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	109.3	171.3	-170.6	0	0	0	0	107.6	P42 V43 Q44 L46 L62 I91 V94	P42-V57 CarbonylContact C-O 3.5Å; V43-V57 WeakPolarHBondContact CA-O 3.45Å; V43-V57 WeakPolarHBondContact CB-O 3.47Å; V43-V57 PolarHBondContact N-O 3.18Å; Q44-V57 PolarHBondContact N-O 2.9Å; Q44-V57 PolarHBondContact O-N 2.95Å; L46-V57 HydrophobicContact CD1-CG2 4.02Å; L46-V57 HydrophobicContact CG-CG2 4.44Å; V57-L62 HydrophobicContact CB-CD2 4.09Å; V57-L62 HydrophobicContact CG1-CD2 3.85Å; V57-L62 HydrophobicContact CG2-CD2 3.6Å; V57-I91 HydrophobicContact CG1-CD1 3.76Å; V57-I91 HydrophobicContact CG1-CG2 3.95Å; V57-V94 HydrophobicContact CB-CG2 3.98Å; V57-V94 HydrophobicContact CG1-CG2 3.59Å; V57-V94 HydrophobicContact CG2-CG1 3.94Å; V57-V94 HydrophobicContact CG2-CG2 4.27Å
58	E	82.7	Confident	74.6	Confident	5 Å²	5	41.6 Å²	41.6	2%	0.023	20%	0.201	C	C	.	.			trans	-89.4	179.4	173.8	-62.8	179.6	-174.1	0	0	110.3	T60 R61 Y65	E58-T60 PolarHBondContact O-N 2.93Å; E58-R61 HydrophobicContact CB-CB 4.44Å; E58-R61 PolarHBondContact N-O 3.3Å; E58-Y65 PolarHBondContact OE1-OH 2.71Å
59	K	79.3	Confident	75.2	Confident	40 Å²	40	42 Å²	42	17%	0.174	21%	0.206	C	C	.	.	S	Bend	trans	-59.5	-32.3	-177.3	-62.1	-169.9	-176.3	-163.6	0	113.3	V43 K90 I91 E139	V43-K59 HydrophobicContact CG2-CG 4.17Å; K59-K90 HydrophobicContact CB-CB 4.33Å; K59-K90 HydrophobicContact CB-CG 4.24Å; K59-K90 HydrophobicContact CD-CD 4.28Å; K59-K90 CarbonylContact O-C 3.49Å; K59-K90 VanDerWaalsContact O-CA 3.28Å; K59-K90 WeakPolarHBondContact O-CA 3.29Å; K59-I91 PolarHBondContact O-N 2.87Å; K59-E139 WeakPolarHBondContact CE-OE1 3.21Å; K59-E139 IonicContact NZ-OE1 3.34Å; K59-E139 PolarHBondContact NZ-OE1 2.04Å; K59-E139 IonicContact NZ-OE2 3.44Å; K59-E139 PolarHBondContact NZ-OE2 2.96Å
60	T	78.6	Confident	76.2	Confident	26 Å²	26	39.1 Å²	39.1	16%	0.16	20%	0.197	C	C	.	.	S	Bend	trans	-133.3	1.9	-176.2	52.2	0	0	0	0	113.2	E58 V79	E58-T60 PolarHBondContact O-N 2.93Å; T60-V79 PolarHBondContact O-N 2.79Å
61	R	80.5	Confident	77.2	Confident	57 Å²	57	39.9 Å²	39.9	22%	0.215	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	152.8	-165.4	-49	-179.1	77.6	-142.7	0.1	111.6	E58 D76 T77	E58-R61 HydrophobicContact CB-CB 4.44Å; E58-R61 PolarHBondContact N-O 3.3Å; R61-D76 IonicContact CZ-OD1 3.31Å; R61-D76 IonicContact CZ-OD2 3.83Å; R61-D76 IonicContact NE-OD1 3.15Å; R61-D76 PolarHBondContact NE-OD1 2.97Å; R61-D76 VanDerWaalsContact NH1-CG 3.26Å; R61-D76 IonicContact NH1-OD1 2.9Å; R61-D76 PolarHBondContact NH1-OD1 2.84Å; R61-D76 VanDerWaalsContact NH1-OD1 3.1Å; R61-D76 IonicContact NH1-OD2 2.86Å; R61-D76 PolarHBondContact NH1-OD2 3.36Å; R61-D76 IonicContact NH2-OD1 2.81Å; R61-D76 PolarHBondContact NH2-OD1 2.81Å; R61-D76 IonicContact NH2-OD2 2.73Å; R61-D76 PolarHBondContact NH2-OD2 3.19Å; R61-T77 CarbonylContact C-O 3.57Å; R61-T77 VanDerWaalsContact CA-O 3.32Å; R61-T77 WeakPolarHBondContact CA-O 3.34Å
62	L	81.6	Confident	78	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	113.7	165.9	-67.2	179.5	0	0	0	109.1	T55 V57 F64 D76 T77 V79 L118	T55-L62 HydrophobicContact CG2-CD2 4.39Å; V57-L62 HydrophobicContact CB-CD2 4.09Å; V57-L62 HydrophobicContact CG1-CD2 3.85Å; V57-L62 HydrophobicContact CG2-CD2 3.6Å; L62-F64 HydrophobicContact CB-CE2 3.88Å; L62-F64 HydrophobicContact CB-CZ 4.37Å; L62-F64 HydrophobicContact CD1-CZ 4.37Å; L62-D76 WeakPolarHBondContact O-CA 3.3Å; L62-T77 PolarHBondContact N-O 2.86Å; L62-T77 PolarHBondContact O-N 2.77Å; L62-V79 HydrophobicContact CG-CG2 3.95Å; L62-L118 HydrophobicContact CD1-CD1 4.02Å; L62-L118 HydrophobicContact CD1-CD2 3.57Å; L62-L118 HydrophobicContact CD1-CG 3.81Å; L62-L118 HydrophobicContact CD2-CD2 3.81Å; L62-L118 HydrophobicContact CG-CD2 3.88Å
63	A	81.8	Confident	78.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.4	175	0	0	0	0	0	109.9	S56 Y65 V73	S56-A63 PolarHBondContact N-O 3.36Å; S56-A63 PolarHBondContact O-N 3.22Å; A63-Y65 HydrophobicContact CB-CE2 3.86Å; A63-V73 HydrophobicContact CB-CG1 4.26Å
64	F	81.6	Confident	78.8	Confident	23 Å²	23	46.5 Å²	46.5	10%	0.101	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	112	177.4	-60.8	-97.2	0	0	0	108.9	T55 L62 V73 A74 K75	T55-F64 HydrophobicContact CG2-CD1 4.1Å; T55-F64 HydrophobicContact CG2-CE1 3.78Å; T55-F64 HydrophobicContact CG2-CZ 4.17Å; T55-F64 VanDerWaalsContact OG1-CD1 3.25Å; T55-F64 WeakPolarHBondContact OG1-CD1 3.32Å; T55-F64 WeakPolarHBondContact OG1-CE1 3.28Å; L62-F64 HydrophobicContact CB-CE2 3.88Å; L62-F64 HydrophobicContact CB-CZ 4.37Å; L62-F64 HydrophobicContact CD1-CZ 4.37Å; F64-V73 WeakPolarHBondContact O-CG1 3.08Å; F64-A74 WeakPolarHBondContact O-CB 3.26Å; F64-A74 PolarHBondContact O-N 2.75Å; F64-K75 HydrophobicContact CB-CB 4.04Å; F64-K75 HydrophobicContact CD2-CB 3.73Å; F64-K75 HydrophobicContact CD2-CD 3.98Å; F64-K75 HydrophobicContact CD2-CG 3.93Å; F64-K75 WeakPolarHBondContact CD2-O 3.27Å; F64-K75 HydrophobicContact CE2-CD 4Å; F64-K75 HydrophobicContact CE2-CG 4.32Å; F64-K75 HydrophobicContact CG-CB 4.14Å; F64-K75 PolarHBondContact N-O 2.82Å
65	Y	81.4	Confident	78.7	Confident	5 Å²	5	50.7 Å²	50.7	2%	0.02	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	119.2	-179.7	-62.4	-72.1	0	0	0	110.2	F35 L37 N53 V54 E58 A63 V73 L436	F35-Y65 HydrophobicContact CB-CD1 3.82Å; F35-Y65 HydrophobicContact CB-CE1 3.86Å; F35-Y65 AromaticContact CD1-CD1 3.65Å; F35-Y65 HydrophobicContact CD1-CD1 3.65Å; F35-Y65 HydrophobicContact CD1-CE1 4.14Å; F35-Y65 AromaticContact CD2-CD1 3.71Å; F35-Y65 HydrophobicContact CD2-CD1 3.71Å; F35-Y65 HydrophobicContact CD2-CG 4.11Å; F35-Y65 HydrophobicContact CE1-CD1 4.05Å; F35-Y65 HydrophobicContact CE2-CD1 4.11Å; F35-Y65 HydrophobicContact CE2-CG 4.37Å; F35-Y65 AromaticContact CG-CD1 3.44Å; F35-Y65 HydrophobicContact CG-CD1 3.44Å; F35-Y65 VanDerWaalsContact CG-CD1 3.44Å; F35-Y65 AromaticContact CG-CE1 3.97Å; F35-Y65 HydrophobicContact CG-CE1 3.97Å; F35-Y65 HydrophobicContact CG-CG 4.28Å; F35-Y65 HydrophobicContact CZ-CD1 4.25Å; L37-Y65 VanDerWaalsContact CD2-OH 3.25Å; L37-Y65 WeakPolarHBondContact CD2-OH 3.07Å; N53-Y65 CarbonylContact C-O 3.52Å; N53-Y65 WeakPolarHBondContact CA-O 3.18Å; V54-Y65 PolarHBondContact N-O 3.44Å; V54-Y65 PolarHBondContact O-N 3.44Å; E58-Y65 PolarHBondContact OE1-OH 2.71Å; A63-Y65 HydrophobicContact CB-CE2 3.86Å; Y65-V73 HydrophobicContact CD1-CG1 4.21Å; Y65-V73 HydrophobicContact CD1-CG2 4.15Å; Y65-V73 HydrophobicContact CE1-CB 4.49Å; Y65-V73 HydrophobicContact CE1-CG1 4.12Å; Y65-V73 HydrophobicContact CE1-CG2 3.7Å; Y65-L436 HydrophobicContact CD2-CD2 3.62Å; Y65-L436 HydrophobicContact CE2-CD2 3.77Å; Y65-L436 HydrophobicContact CG-CD2 4.17Å
66	N	82.2	Confident	78.8	Confident	45 Å²	45	52.8 Å²	52.8	24%	0.241	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	103.1	171.5	-177.8	-25.1	0	0	0	109.1	F35 N53 N68 N69 A74	F35-N66 WeakPolarHBondContact CZ-O 3.37Å; N53-N66 WeakPolarHBondContact OD1-CB 3.5Å; N53-N66 PolarHBondContact OD1-ND2 2.54Å; N66-N68 PolarHBondContact O-N 3.21Å; N66-N68 VanDerWaalsContact O-N 3.14Å; N66-N68 WeakPolarHBondContact OD1-CA 3.26Å; N66-N68 VanDerWaalsContact OD1-CB 3.29Å; N66-N68 WeakPolarHBondContact OD1-CB 3.23Å; N66-N68 PolarHBondContact OD1-N 2.87Å; N66-N69 CarbonylContact O-C 3.54Å; N66-N69 VanDerWaalsContact O-C 3.23Å; N66-N69 PolarHBondContact O-N 3.39Å; N66-N69 VanDerWaalsContact O-O 3.08Å; N66-A74 HydrophobicContact CB-CB 3.98Å
67	F	80.4	Confident	78.8	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.009	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-3.8	-176.6	-79.7	-95	0	0	0	114.3	K33 F35 V54 N69 Y429 L436 Q438	K33-F67 HydrophobicContact CB-CD1 3.74Å; K33-F67 HydrophobicContact CB-CE1 4.46Å; K33-F67 HydrophobicContact CD-CB 4.22Å; K33-F67 WeakPolarHBondContact CD-O 3.41Å; K33-F67 WeakPolarHBondContact CE-O 3.28Å; K33-F67 PolarHBondContact NZ-O 2.82Å; F35-F67 HydrophobicContact CD2-CD1 4.07Å; F35-F67 HydrophobicContact CD2-CD2 4.42Å; F35-F67 AromaticContact CD2-CE1 3.71Å; F35-F67 HydrophobicContact CD2-CE1 3.71Å; F35-F67 HydrophobicContact CD2-CE2 4.08Å; F35-F67 HydrophobicContact CD2-CG 4.41Å; F35-F67 AromaticContact CD2-CZ 3.72Å; F35-F67 HydrophobicContact CD2-CZ 3.72Å; F35-F67 AromaticContact CE2-CD1 3.89Å; F35-F67 HydrophobicContact CE2-CD1 3.89Å; F35-F67 AromaticContact CE2-CD2 3.98Å; F35-F67 HydrophobicContact CE2-CD2 3.98Å; F35-F67 HydrophobicContact CE2-CE1 4.01Å; F35-F67 HydrophobicContact CE2-CE2 4.08Å; F35-F67 AromaticContact CE2-CG 3.88Å; F35-F67 HydrophobicContact CE2-CG 3.88Å; F35-F67 HydrophobicContact CE2-CZ 4.1Å; V54-F67 HydrophobicContact CB-CD2 4.39Å; V54-F67 HydrophobicContact CB-CE2 4.02Å; V54-F67 HydrophobicContact CG2-CD2 3.92Å; V54-F67 HydrophobicContact CG2-CE2 3.82Å; F67-N69 VanDerWaalsContact C-N 3.32Å; F67-Y429 HydrophobicContact CD2-CD1 4.37Å; F67-Y429 AromaticContact CD2-CE1 3.74Å; F67-Y429 HydrophobicContact CD2-CE1 3.74Å; F67-Y429 HydrophobicContact CE1-CD1 4.46Å; F67-Y429 HydrophobicContact CE1-CE1 4.47Å; F67-Y429 AromaticContact CE2-CD1 3.74Å; F67-Y429 HydrophobicContact CE2-CD1 3.74Å; F67-Y429 AromaticContact CE2-CE1 3.57Å; F67-Y429 HydrophobicContact CE2-CE1 3.57Å; F67-Y429 HydrophobicContact CG-CE1 4.27Å; F67-Y429 AromaticContact CZ-CD1 3.78Å; F67-Y429 HydrophobicContact CZ-CD1 3.78Å; F67-Y429 AromaticContact CZ-CE1 3.96Å; F67-Y429 HydrophobicContact CZ-CE1 3.96Å; F67-L436 HydrophobicContact CE2-CD2 4.25Å; F67-L436 HydrophobicContact CZ-CD2 3.88Å; F67-L436 HydrophobicContact CZ-CG 3.99Å; F67-Q438 HydrophobicContact CD1-CB 3.5Å; F67-Q438 HydrophobicContact CD1-CG 4.39Å; F67-Q438 HydrophobicContact CE1-CB 3.43Å; F67-Q438 VanDerWaalsContact CE1-CB 3.43Å; F67-Q438 HydrophobicContact CG-CB 4.21Å; F67-Q438 HydrophobicContact CZ-CB 4.08Å
68	N	80.7	Confident	78.9	Confident	119 Å²	119	57.6 Å²	57.6	64%	0.636	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-20.8	166.1	-65	-23.7	0	0	0	112.2	K33 A52 N66	K33-N68 PolarHBondContact NZ-OD1 2.92Å; A52-N68 WeakPolarHBondContact CB-ND2 3.48Å; N66-N68 PolarHBondContact O-N 3.21Å; N66-N68 VanDerWaalsContact O-N 3.14Å; N66-N68 WeakPolarHBondContact OD1-CA 3.26Å; N66-N68 VanDerWaalsContact OD1-CB 3.29Å; N66-N68 WeakPolarHBondContact OD1-CB 3.23Å; N66-N68 PolarHBondContact OD1-N 2.87Å
69	N	78.1	Confident	78.8	Confident	89 Å²	89	57.7 Å²	57.7	48%	0.476	28%	0.283	S	S	.	.			trans	-133.9	88.3	174.6	-176	3.4	0	0	0	111.2	N66 F67 R71	N66-N69 CarbonylContact O-C 3.54Å; N66-N69 VanDerWaalsContact O-C 3.23Å; N66-N69 PolarHBondContact O-N 3.39Å; N66-N69 VanDerWaalsContact O-O 3.08Å; F67-N69 VanDerWaalsContact C-N 3.32Å; N69-R71 PolarHBondContact O-N 2.73Å; N69-R71 PolarHBondContact OD1-N 3.29Å
70	T	75.5	Confident	78.7	Confident	59 Å²	59	60.1 Å²	60.1	36%	0.362	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-0.4	-176.2	55	0	0	0	0	115	K33 R34 F35	K33-T70 HydrophobicContact CB-CG2 4Å; K33-T70 HydrophobicContact CG-CG2 4.45Å; R34-T70 WeakPolarHBondContact O-CB 3.31Å; F35-T70 HydrophobicContact CE2-CG2 4.11Å; F35-T70 HydrophobicContact CZ-CG2 4.29Å
71	R	71.7	Confident	78.6	Confident	235 Å²	235	59.6 Å²	59.6	89%	0.887	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-27.2	-176.5	-66	-171.4	-179	-140.1	1.8	113.6	N69	N69-R71 PolarHBondContact O-N 2.73Å; N69-R71 PolarHBondContact OD1-N 3.29Å
72	K	72.4	Confident	78	Confident	166 Å²	166	65.5 Å²	65.5	72%	0.722	32%	0.317	S	S	*	.	S	Bend	trans	-148.6	142.5	-176.9	-165.8	-175.9	173.6	-177.5	0	110.3	A74	K72-A74 PolarHBondContact O-N 2.68Å
73	V	74.9	Confident	77.2	Confident	33 Å²	33	71.1 Å²	71.1	20%	0.2	35%	0.348	C	S	.	.			trans	-60.4	126.7	167.1	-172.7	0	0	0	0	108.3	A63 F64 Y65 K75 D76	A63-V73 HydrophobicContact CB-CG1 4.26Å; F64-V73 WeakPolarHBondContact O-CG1 3.08Å; Y65-V73 HydrophobicContact CD1-CG1 4.21Å; Y65-V73 HydrophobicContact CD1-CG2 4.15Å; Y65-V73 HydrophobicContact CE1-CB 4.49Å; Y65-V73 HydrophobicContact CE1-CG1 4.12Å; Y65-V73 HydrophobicContact CE1-CG2 3.7Å; V73-K75 WeakPolarHBondContact CG1-O 3.46Å; V73-D76 HydrophobicContact CG1-CB 4.16Å
74	A	72	Confident	76.3	Confident	65 Å²	65	72 Å²	72	54%	0.537	35%	0.353	S	S	.	.	S	Bend	trans	-67.5	-43	-169.2	0	0	0	0	0	111.6	F64 N66 K72	F64-A74 WeakPolarHBondContact O-CB 3.26Å; F64-A74 PolarHBondContact O-N 2.75Å; N66-A74 HydrophobicContact CB-CB 3.98Å; K72-A74 PolarHBondContact O-N 2.68Å
75	K	77.8	Confident	74.9	Confident	88 Å²	88	75.9 Å²	75.9	38%	0.383	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	141.8	173.8	-177.4	-176.9	-177.9	-173.8	0	108.2	F64 V73 T77 S120	F64-K75 HydrophobicContact CB-CB 4.04Å; F64-K75 HydrophobicContact CD2-CB 3.73Å; F64-K75 HydrophobicContact CD2-CD 3.98Å; F64-K75 HydrophobicContact CD2-CG 3.93Å; F64-K75 WeakPolarHBondContact CD2-O 3.27Å; F64-K75 HydrophobicContact CE2-CD 4Å; F64-K75 HydrophobicContact CE2-CG 4.32Å; F64-K75 HydrophobicContact CG-CB 4.14Å; F64-K75 PolarHBondContact N-O 2.82Å; V73-K75 WeakPolarHBondContact CG1-O 3.46Å; K75-T77 VanDerWaalsContact CE-OG1 3.27Å; K75-T77 WeakPolarHBondContact CE-OG1 3.32Å; K75-S120 PolarHBondContact NZ-O 3.43Å
76	D	80.5	Confident	73.5	Confident	50 Å²	50	84.7 Å²	84.7	27%	0.267	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	107.6	-177.1	-173.9	0.6	0	0	0	108	R61 L62 V73	R61-D76 IonicContact CZ-OD1 3.31Å; R61-D76 IonicContact CZ-OD2 3.83Å; R61-D76 IonicContact NE-OD1 3.15Å; R61-D76 PolarHBondContact NE-OD1 2.97Å; R61-D76 VanDerWaalsContact NH1-CG 3.26Å; R61-D76 IonicContact NH1-OD1 2.9Å; R61-D76 PolarHBondContact NH1-OD1 2.84Å; R61-D76 VanDerWaalsContact NH1-OD1 3.1Å; R61-D76 IonicContact NH1-OD2 2.86Å; R61-D76 PolarHBondContact NH1-OD2 3.36Å; R61-D76 IonicContact NH2-OD1 2.81Å; R61-D76 PolarHBondContact NH2-OD1 2.81Å; R61-D76 IonicContact NH2-OD2 2.73Å; R61-D76 PolarHBondContact NH2-OD2 3.19Å; L62-D76 WeakPolarHBondContact O-CA 3.3Å; V73-D76 HydrophobicContact CG1-CB 4.16Å
77	T	82.1	Confident	72.2	Confident	24 Å²	24	88.5 Å²	88.5	15%	0.147	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.8	-164.9	-47.4	0	0	0	0	109.5	R61 L62 K75 S121	R61-T77 CarbonylContact C-O 3.57Å; R61-T77 VanDerWaalsContact CA-O 3.32Å; R61-T77 WeakPolarHBondContact CA-O 3.34Å; L62-T77 PolarHBondContact N-O 2.86Å; L62-T77 PolarHBondContact O-N 2.77Å; K75-T77 VanDerWaalsContact CE-OG1 3.27Å; K75-T77 WeakPolarHBondContact CE-OG1 3.32Å; T77-S121 WeakPolarHBondContact CG2-O 3.39Å
78	E	80.3	Confident	71.6	Confident	77 Å²	77	92.3 Å²	92.3	36%	0.36	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	131.1	173.2	-167.1	-179.6	175.3	0	0	109.7	Q80	E78-Q80 PolarHBondContact O-N 2.56Å; E78-Q80 PolarHBondContact OE1-NE2 3.08Å; E78-Q80 PolarHBondContact OE2-NE2 2.6Å
79	V	80.7	Confident	71.3	Confident	8 Å²	8	87.2 Å²	87.2	5%	0.048	43%	0.429	C	S	.	.			trans	-85.2	112.2	-179.5	179.8	0	0	0	0	108.6	T60 L62 I91 L118 L124	T60-V79 PolarHBondContact O-N 2.79Å; L62-V79 HydrophobicContact CG-CG2 3.95Å; V79-I91 HydrophobicContact CB-CD1 4.43Å; V79-I91 HydrophobicContact CG2-CD1 4.1Å; V79-L118 HydrophobicContact CG1-CD1 4.28Å; V79-L118 HydrophobicContact CG2-CD1 4.35Å; V79-L118 HydrophobicContact CG2-CD2 4.21Å; V79-L124 HydrophobicContact CG1-CD1 3.63Å; V79-L124 HydrophobicContact CG1-CD2 3.98Å; V79-L124 HydrophobicContact CG1-CG 3.89Å
80	Q	77.3	Confident	71.5	Confident	91 Å²	91	88.4 Å²	88.4	43%	0.425	43%	0.43	S	S	.	.			trans	-93.1	106.4	-177.1	-62.4	-65.4	-39.7	0	0	110.7	E78	E78-Q80 PolarHBondContact O-N 2.56Å; E78-Q80 PolarHBondContact OE1-NE2 3.08Å; E78-Q80 PolarHBondContact OE2-NE2 2.6Å
81	W	77.4	Confident	72	Confident	14 Å²	14	85.8 Å²	85.8	5%	0.053	41%	0.413	C	S	.	.			trans	-82	117.4	174.8	-65.6	81.4	0	0	0	109.7	D83 C84 C89 I91 V105 A107 Q114 C116 L124	W81-D83 PolarHBondContact O-N 3.36Å; W81-C84 HydrophobicContact CB-CB 3.75Å; W81-C84 CarbonylContact O-C 3.57Å; W81-C84 PolarHBondContact O-N 3.1Å; W81-C84 VanDerWaalsContact O-O 3.1Å; W81-C89 HydrophobicContact CB-CB 4.47Å; W81-C89 HydrophobicContact CD2-CB 4.42Å; W81-C89 HydrophobicContact CG-CB 4.04Å; W81-I91 HydrophobicContact CZ2-CG1 4.22Å; W81-V105 HydrophobicContact CH2-CG2 4.18Å; W81-V105 HydrophobicContact CZ2-CG2 4.32Å; W81-A107 HydrophobicContact CD2-CB 4.15Å; W81-A107 HydrophobicContact CE3-CB 4.28Å; W81-A107 HydrophobicContact CH2-CB 3.39Å; W81-A107 HydrophobicContact CZ2-CB 3.19Å; W81-A107 HydrophobicContact CZ3-CB 3.92Å; W81-Q114 HydrophobicContact CE3-CB 4.4Å; W81-Q114 HydrophobicContact CZ3-CB 4Å; W81-Q114 HydrophobicContact CZ3-CG 4.29Å; W81-Q114 WeakPolarHBondContact CZ3-O 3.12Å; W81-C116 WeakPolarHBondContact CZ3-SG 3.32Å; W81-L124 HydrophobicContact CB-CD1 4.45Å; W81-L124 HydrophobicContact CD2-CD1 3.53Å; W81-L124 HydrophobicContact CE3-CD1 3.8Å; W81-L124 HydrophobicContact CG-CD1 3.87Å; W81-L124 HydrophobicContact CH2-CD1 4.29Å; W81-L124 HydrophobicContact CZ2-CD1 4.06Å; W81-L124 HydrophobicContact CZ3-CD1 4.18Å
82	K	66.9	Low	72.7	Confident	181 Å²	181	75.5 Å²	75.5	79%	0.787	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-36.9	-176.2	-73.3	179.6	179.4	170.6	0	113.2
83	D	65.9	Low	73.5	Confident	120 Å²	120	67.8 Å²	67.8	64%	0.642	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	6.4	-179	-58.3	-42.1	0	0	0	112.9	W81 Q114	W81-D83 PolarHBondContact O-N 3.36Å; D83-Q114 PolarHBondContact OD2-NE2 3.39Å
84	C	62.8	Low	74.2	Confident	17 Å²	17	66.4 Å²	66.4	12%	0.115	34%	0.337	C	S	.	.	S	Bend	trans	-129.2	97.5	176.8	-45.1	0	0	0	0	111.6	W81 R86 C89 K109	W81-C84 HydrophobicContact CB-CB 3.75Å; W81-C84 CarbonylContact O-C 3.57Å; W81-C84 PolarHBondContact O-N 3.1Å; W81-C84 VanDerWaalsContact O-O 3.1Å; C84-R86 PolarHBondContact O-N 2.9Å; C84-C89 HydrophobicContact CB-CB 3.78Å; C84-C89 WeakPolarHBondContact CB-SG 3.49Å; C84-C89 WeakPolarHBondContact SG-CB 3.34Å; C84-C89 CovalentContact SG-SG 2.03Å; C84-C89 PolarHBondContact SG-SG 2.81Å; C84-K109 HydrophobicContact CB-CD 4.46Å
85	P	51.2	Low	75	Confident	106 Å²	106	65.1 Å²	65.1	69%	0.688	32%	0.32	S	S	*	.			trans	-60.2	135.9	167.1	22.5	-28.3	0	0	0	110.1
86	R	51.8	Low	75.4	Confident	190 Å²	190	65.5 Å²	65.5	72%	0.717	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-15.3	135.8	-168.9	-70.3	178.6	-179	173.9	-0.2	118.6	C84	C84-R86 PolarHBondContact O-N 2.9Å
87	N	55.3	Low	75.6	Confident	124 Å²	124	64.9 Å²	64.9	66%	0.663	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	-2.1	166.4	-75.5	-7.9	0	0	0	121.1
88	D	67.5	Low	75.6	Confident	83 Å²	83	70.2 Å²	70.2	44%	0.444	34%	0.34	S	S	.	.			trans	-102.3	-26.6	-175.6	-67.5	-24.9	0	0	0	115.7	K109	D88-K109 HydrophobicContact CB-CD 3.47Å; D88-K109 VanDerWaalsContact CB-CD 3.47Å; D88-K109 VanDerWaalsContact CB-CE 3.48Å; D88-K109 HydrophobicContact CB-CG 3.96Å; D88-K109 WeakPolarHBondContact OD2-CE 3.5Å; D88-K109 IonicContact OD2-NZ 2.69Å; D88-K109 PolarHBondContact OD2-NZ 3.21Å
89	C	75.4	Confident	75.3	Confident	12 Å²	12	74.7 Å²	74.7	8%	0.081	36%	0.361	C	S	.	.			trans	-91.6	115.3	-175.6	-71.8	0	0	0	0	110.9	W81 C84 A107 K109	W81-C89 HydrophobicContact CB-CB 4.47Å; W81-C89 HydrophobicContact CD2-CB 4.42Å; W81-C89 HydrophobicContact CG-CB 4.04Å; C84-C89 HydrophobicContact CB-CB 3.78Å; C84-C89 WeakPolarHBondContact CB-SG 3.49Å; C84-C89 WeakPolarHBondContact SG-CB 3.34Å; C84-C89 CovalentContact SG-SG 2.03Å; C84-C89 PolarHBondContact SG-SG 2.81Å; C89-A107 HydrophobicContact CB-CB 4.39Å; C89-K109 HydrophobicContact CB-CB 4.41Å; C89-K109 WeakPolarHBondContact SG-CB 3.35Å; C89-K109 VanDerWaalsContact SG-CD 3.53Å
90	K	81.3	Confident	75.1	Confident	113 Å²	113	78.3 Å²	78.3	49%	0.491	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.8	179.7	-66.1	173.8	-179.4	171.4	0	110.4	K59 A92 A107 T108	K59-K90 HydrophobicContact CB-CB 4.33Å; K59-K90 HydrophobicContact CB-CG 4.24Å; K59-K90 HydrophobicContact CD-CD 4.28Å; K59-K90 CarbonylContact O-C 3.49Å; K59-K90 VanDerWaalsContact O-CA 3.28Å; K59-K90 WeakPolarHBondContact O-CA 3.29Å; K90-A92 PolarHBondContact O-N 2.8Å; K90-A107 VanDerWaalsContact O-CA 3.23Å; K90-A107 WeakPolarHBondContact O-CA 3.4Å; K90-A107 VanDerWaalsContact O-CB 3.26Å; K90-A107 WeakPolarHBondContact O-CB 3.35Å; K90-T108 PolarHBondContact N-O 2.77Å; K90-T108 PolarHBondContact O-N 2.83Å
91	I	86.2	Confident	75.4	Confident	5 Å²	5	78.5 Å²	78.5	3%	0.026	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	127.2	171.4	-57.6	175.1	0	0	0	107.8	V43 V57 K59 V79 W81 V94	V43-I91 WeakPolarHBondContact CG2-O 3.42Å; V57-I91 HydrophobicContact CG1-CD1 3.76Å; V57-I91 HydrophobicContact CG1-CG2 3.95Å; K59-I91 PolarHBondContact O-N 2.87Å; V79-I91 HydrophobicContact CB-CD1 4.43Å; V79-I91 HydrophobicContact CG2-CD1 4.1Å; W81-I91 HydrophobicContact CZ2-CG1 4.22Å; I91-V94 HydrophobicContact CG2-CG2 3.52Å
92	A	86.5	Confident	75.8	Confident	18 Å²	18	80 Å²	80	15%	0.149	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	-28.5	-178.9	0	0	0	0	0	112.2	K90 C106 I137	K90-A92 PolarHBondContact O-N 2.8Å; A92-C106 PolarHBondContact N-O 3.2Å; A92-I137 HydrophobicContact CB-CB 4.04Å; A92-I137 HydrophobicContact CB-CG2 3.74Å
93	V	89.6	Confident	76.9	Confident	4 Å²	4	72.9 Å²	72.9	2%	0.024	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	138	179.8	172	0	0	0	0	109	V105 C106 I137 L156	V93-V105 CarbonylContact O-C 3.56Å; V93-V105 VanDerWaalsContact O-CA 3.3Å; V93-V105 WeakPolarHBondContact O-CA 3.01Å; V93-C106 HydrophobicContact CB-CB 4.02Å; V93-C106 PolarHBondContact N-O 3.08Å; V93-C106 PolarHBondContact O-N 2.84Å; V93-I137 HydrophobicContact CG2-CD1 4.31Å; V93-I137 HydrophobicContact CG2-CG2 3.88Å; V93-L156 HydrophobicContact CG2-CD2 3.73Å
94	V	90	Very high	78	Confident	5 Å²	5	67.4 Å²	67.4	3%	0.03	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	134.6	176.2	178.7	0	0	0	0	107.3	V43 Q44 L46 V57 I91 F104 V105	V43-V94 HydrophobicContact CG1-CG2 4.39Å; Q44-V94 HydrophobicContact CB-CB 4.27Å; Q44-V94 PolarHBondContact OE1-O 2.79Å; L46-V94 HydrophobicContact CD1-CG1 3.77Å; L46-V94 HydrophobicContact CD2-CG1 4.42Å; L46-V94 HydrophobicContact CG-CG1 4.41Å; V57-V94 HydrophobicContact CB-CG2 3.98Å; V57-V94 HydrophobicContact CG1-CG2 3.59Å; V57-V94 HydrophobicContact CG2-CG1 3.94Å; V57-V94 HydrophobicContact CG2-CG2 4.27Å; I91-V94 HydrophobicContact CG2-CG2 3.52Å; V94-F104 CarbonylContact C-O 3.59Å; V94-F104 WeakPolarHBondContact CA-O 3.33Å; V94-V105 HydrophobicContact CG1-CG1 4.39Å; V94-V105 HydrophobicContact CG2-CG1 4.16Å
95	H	89.3	Confident	79.3	Confident	37 Å²	37	66.6 Å²	66.6	17%	0.171	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	124.6	171.9	-79	-76.3	0	0	0	109.2	F104 S143 L145	H95-F104 HydrophobicContact CB-CB 4.22Å; H95-F104 HydrophobicContact CB-CD1 4.27Å; H95-F104 PolarHBondContact N-O 3.28Å; H95-F104 PolarHBondContact O-N 2.84Å; H95-S143 PolarHBondContact CE1-O 2.82Å; H95-S143 PolarHBondContact CE1-OG 2.96Å; H95-S143 WeakPolarHBondContact NE2-CB 3.33Å; H95-S143 PolarHBondContact NE2-OG 2.67Å; H95-L145 HydrophobicContact CB-CB 4.48Å; H95-L145 HydrophobicContact CB-CD2 4.17Å
96	Q	86.1	Confident	81.1	Confident	97 Å²	97	61.5 Å²	61.5	45%	0.453	31%	0.314	S	S	.	.			trans	-75.8	131.3	167.1	-176.9	168.6	2.9	0	0	109.1	L46 F47 L103	L46-Q96 HydrophobicContact CD2-CB 4.13Å; F47-Q96 PolarHBondContact O-NE2 2.9Å; F47-Q96 PolarHBondContact O-OE1 2.82Å; Q96-L103 HydrophobicContact CB-CD2 4.28Å; Q96-L103 HydrophobicContact CG-CD2 4.38Å
97	R	84.8	Confident	82.8	Confident	36 Å²	36	52.6 Å²	52.6	14%	0.136	28%	0.281	C	S	.	.			trans	-101.5	178.3	176.3	-70.7	-176	171.7	145.9	-7.7	110.5	K101 P102 D117 E147	R97-K101 HydrophobicContact CB-CB 3.72Å; R97-K101 HydrophobicContact CB-CD 4.33Å; R97-P102 WeakPolarHBondContact CD-O 3.32Å; R97-D117 IonicContact CZ-OD1 2.87Å; R97-D117 IonicContact NH1-OD1 3.1Å; R97-D117 PolarHBondContact NH1-OD1 3.47Å; R97-D117 IonicContact NH1-OD2 2.74Å; R97-D117 PolarHBondContact NH1-OD2 3.16Å; R97-D117 IonicContact NH2-OD1 3.04Å; R97-D117 PolarHBondContact NH2-OD1 3.17Å; R97-E147 VanDerWaalsContact CD-OE2 3.29Å; R97-E147 WeakPolarHBondContact CD-OE2 3.29Å; R97-E147 IonicContact CZ-OE1 2.61Å; R97-E147 VanDerWaalsContact CZ-OE1 3.28Å; R97-E147 IonicContact CZ-OE2 2.78Å; R97-E147 IonicContact NE-OE1 3.79Å; R97-E147 PolarHBondContact NE-OE1 3.31Å; R97-E147 IonicContact NE-OE2 2.6Å; R97-E147 PolarHBondContact NE-OE2 3.4Å; R97-E147 IonicContact NH2-OE1 3.65Å; R97-E147 PolarHBondContact NH2-OE1 2.83Å; R97-E147 IonicContact NH2-OE2 3.12Å
98	E	81.1	Confident	84	Confident	136 Å²	136	47.4 Å²	47.4	64%	0.636	25%	0.253	S	S	*	.	S	Bend	trans	-50.4	154.5	172.4	-63.3	171.3	164.5	0	0	111.9	G100 K101	E98-G100 PolarHBondContact O-N 3.18Å; E98-K101 HydrophobicContact CB-CD 4.24Å; E98-K101 WeakPolarHBondContact O-CB 3.42Å; E98-K101 PolarHBondContact O-N 2.87Å; E98-K101 WeakPolarHBondContact OE2-CE 3.25Å; E98-K101 IonicContact OE2-NZ 3.29Å; E98-K101 PolarHBondContact OE2-NZ 2.86Å
99	E	75	Confident	84.2	Confident	171 Å²	171	45.4 Å²	45.4	80%	0.799	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.1	134.8	-177.5	-169.4	177.6	-171.4	0	0	112.2	K101	E99-K101 PolarHBondContact O-N 3.39Å
100	G	75.1	Confident	83.8	Confident	84 Å²	84	51.1 Å²	51.1	87%	0.866	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	-11.9	-178.7	0	0	0	0	0	115.3	E98	E98-G100 PolarHBondContact O-N 3.18Å
101	K	83.4	Confident	83.1	Confident	95 Å²	95	55 Å²	55	41%	0.413	28%	0.282	S	S	.	.	S	Bend	trans	-81.5	144.9	172.1	-68.4	-178.1	177.5	164.7	0	111.1	R97 E98 E99	R97-K101 HydrophobicContact CB-CB 3.72Å; R97-K101 HydrophobicContact CB-CD 4.33Å; E98-K101 HydrophobicContact CB-CD 4.24Å; E98-K101 WeakPolarHBondContact O-CB 3.42Å; E98-K101 PolarHBondContact O-N 2.87Å; E98-K101 WeakPolarHBondContact OE2-CE 3.25Å; E98-K101 IonicContact OE2-NZ 3.29Å; E98-K101 PolarHBondContact OE2-NZ 2.86Å; E99-K101 PolarHBondContact O-N 3.39Å
102	P	87.3	Confident	82.6	Confident	47 Å²	47	58.9 Å²	58.9	31%	0.305	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-64.4	154.6	175.2	28.1	-35.1	0	0	0	111.2	R97 D117 L118	R97-P102 WeakPolarHBondContact CD-O 3.32Å; P102-D117 HydrophobicContact CB-CB 3.99Å; P102-D117 HydrophobicContact CG-CB 3.67Å; P102-L118 WeakPolarHBondContact CB-O 3.34Å
103	L	88.5	Confident	82.6	Confident	31 Å²	31	58.1 Å²	58.1	16%	0.162	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	135.4	175	-64.1	177.6	0	0	0	109.6	L46 Q96 V105 D117 L118	L46-L103 HydrophobicContact CD1-CD1 3.71Å; L46-L103 HydrophobicContact CD1-CD2 3.54Å; L46-L103 HydrophobicContact CD1-CG 4.26Å; Q96-L103 HydrophobicContact CB-CD2 4.28Å; Q96-L103 HydrophobicContact CG-CD2 4.38Å; L103-V105 HydrophobicContact CB-CG1 4.39Å; L103-D117 CarbonylContact O-C 3.59Å; L103-D117 WeakPolarHBondContact O-CA 3.33Å; L103-L118 HydrophobicContact CB-CB 4.28Å; L103-L118 PolarHBondContact N-O 2.91Å; L103-L118 PolarHBondContact O-N 3.18Å
104	F	90.1	Very high	82.5	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.018	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	122.3	171.2	177.4	-96.5	0	0	0	109.2	V94 H95 C106 C115 I129 L145 L154	V94-F104 CarbonylContact C-O 3.59Å; V94-F104 WeakPolarHBondContact CA-O 3.33Å; H95-F104 HydrophobicContact CB-CB 4.22Å; H95-F104 HydrophobicContact CB-CD1 4.27Å; H95-F104 PolarHBondContact N-O 3.28Å; H95-F104 PolarHBondContact O-N 2.84Å; F104-C106 WeakPolarHBondContact CE1-SG 3.16Å; F104-C106 VanDerWaalsContact CZ-SG 3.53Å; F104-C115 HydrophobicContact CE2-CB 3.81Å; F104-C115 HydrophobicContact CZ-CB 3.56Å; F104-I129 HydrophobicContact CE1-CD1 4.5Å; F104-I129 HydrophobicContact CE2-CD1 3.74Å; F104-I129 HydrophobicContact CE2-CG1 4.43Å; F104-I129 HydrophobicContact CZ-CD1 3.38Å; F104-I129 HydrophobicContact CZ-CG1 4.42Å; F104-L145 HydrophobicContact CB-CD2 3.99Å; F104-L145 HydrophobicContact CD1-CD1 4.12Å; F104-L145 HydrophobicContact CD1-CD2 3.99Å; F104-L145 HydrophobicContact CE1-CD1 4.02Å; F104-L145 HydrophobicContact CG-CD1 4.47Å; F104-L145 HydrophobicContact CG-CD2 3.92Å; F104-L145 HydrophobicContact CZ-CD1 4.29Å; F104-L154 HydrophobicContact CE1-CD1 4.1Å; F104-L154 HydrophobicContact CE1-CD2 4.11Å; F104-L154 HydrophobicContact CZ-CD2 4.21Å
105	V	90.2	Very high	82.4	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	146.6	-178.6	-60.3	0	0	0	0	111.5	W81 V93 V94 L103 C115 C116 L118 L124	W81-V105 HydrophobicContact CH2-CG2 4.18Å; W81-V105 HydrophobicContact CZ2-CG2 4.32Å; V93-V105 CarbonylContact O-C 3.56Å; V93-V105 VanDerWaalsContact O-CA 3.3Å; V93-V105 WeakPolarHBondContact O-CA 3.01Å; V94-V105 HydrophobicContact CG1-CG1 4.39Å; V94-V105 HydrophobicContact CG2-CG1 4.16Å; L103-V105 HydrophobicContact CB-CG1 4.39Å; V105-C115 CarbonylContact O-C 3.58Å; V105-C115 WeakPolarHBondContact O-CA 3.32Å; V105-C116 WeakPolarHBondContact CG2-O 3.44Å; V105-C116 PolarHBondContact N-O 3.34Å; V105-C116 PolarHBondContact O-N 2.73Å; V105-L118 HydrophobicContact CG1-CB 4.08Å; V105-L118 HydrophobicContact CG1-CD2 3.8Å; V105-L118 HydrophobicContact CG2-CB 3.83Å; V105-L118 HydrophobicContact CG2-CD2 4.2Å; V105-L124 HydrophobicContact CG2-CD2 3.84Å
106	C	89	Confident	82.4	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.8	166.7	-50	0	0	0	0	110.5	A92 V93 F104 Q114 C115 I137	A92-C106 PolarHBondContact N-O 3.2Å; V93-C106 HydrophobicContact CB-CB 4.02Å; V93-C106 PolarHBondContact N-O 3.08Å; V93-C106 PolarHBondContact O-N 2.84Å; F104-C106 WeakPolarHBondContact CE1-SG 3.16Å; F104-C106 VanDerWaalsContact CZ-SG 3.53Å; C106-Q114 VanDerWaalsContact CA-O 3.28Å; C106-Q114 WeakPolarHBondContact CA-O 3.38Å; C106-C115 HydrophobicContact CB-CB 4.07Å; C106-C115 WeakPolarHBondContact CB-SG 3.48Å; C106-C115 WeakPolarHBondContact SG-CB 3.38Å; C106-C115 CovalentContact SG-SG 2.04Å; C106-C115 PolarHBondContact SG-SG 2.96Å; C106-I137 HydrophobicContact CB-CD1 3.76Å
107	A	86.6	Confident	82.6	Confident	3 Å²	3	55.6 Å²	55.6	3%	0.025	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	157.9	171.2	0	0	0	0	0	111	W81 C89 K90 S113 Q114	W81-A107 HydrophobicContact CD2-CB 4.15Å; W81-A107 HydrophobicContact CE3-CB 4.28Å; W81-A107 HydrophobicContact CH2-CB 3.39Å; W81-A107 HydrophobicContact CZ2-CB 3.19Å; W81-A107 HydrophobicContact CZ3-CB 3.92Å; C89-A107 HydrophobicContact CB-CB 4.39Å; K90-A107 VanDerWaalsContact O-CA 3.23Å; K90-A107 WeakPolarHBondContact O-CA 3.4Å; K90-A107 VanDerWaalsContact O-CB 3.26Å; K90-A107 WeakPolarHBondContact O-CB 3.35Å; A107-S113 CarbonylContact O-C 3.57Å; A107-S113 VanDerWaalsContact O-CA 3.26Å; A107-S113 WeakPolarHBondContact O-CA 3.38Å; A107-Q114 PolarHBondContact N-O 2.84Å; A107-Q114 PolarHBondContact O-N 2.82Å
108	T	80.2	Confident	82.7	Confident	14 Å²	14	53.9 Å²	53.9	9%	0.086	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.8	176.6	-55.3	0	0	0	0	110.7	K90 T112 S113 N136 I137	K90-T108 PolarHBondContact N-O 2.77Å; K90-T108 PolarHBondContact O-N 2.83Å; T108-T112 CarbonylContact C-O 3.52Å; T108-T112 VanDerWaalsContact CA-O 3.27Å; T108-T112 WeakPolarHBondContact CA-O 3.18Å; T108-T112 WeakPolarHBondContact CG2-O 3.43Å; T108-S113 WeakPolarHBondContact CG2-OG 3.27Å; T108-S113 PolarHBondContact OG1-OG 2.59Å; T108-N136 HydrophobicContact CG2-CB 4.44Å; T108-N136 WeakPolarHBondContact CG2-OD1 3.5Å; T108-I137 VanDerWaalsContact OG1-CB 3.32Å; T108-I137 WeakPolarHBondContact OG1-CB 3.39Å; T108-I137 PolarHBondContact OG1-N 2.94Å
109	K	73.5	Confident	82.8	Confident	41 Å²	41	49.9 Å²	49.9	18%	0.178	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	128.7	169.9	165.4	178.9	-178.2	162.2	0	110.2	C84 D88 C89 R111 T112	C84-K109 HydrophobicContact CB-CD 4.46Å; D88-K109 HydrophobicContact CB-CD 3.47Å; D88-K109 VanDerWaalsContact CB-CD 3.47Å; D88-K109 VanDerWaalsContact CB-CE 3.48Å; D88-K109 HydrophobicContact CB-CG 3.96Å; D88-K109 WeakPolarHBondContact OD2-CE 3.5Å; D88-K109 IonicContact OD2-NZ 2.69Å; D88-K109 PolarHBondContact OD2-NZ 3.21Å; C89-K109 HydrophobicContact CB-CB 4.41Å; C89-K109 WeakPolarHBondContact SG-CB 3.35Å; C89-K109 VanDerWaalsContact SG-CD 3.53Å; K109-R111 PolarHBondContact O-N 3.17Å; K109-T112 PolarHBondContact N-O 2.93Å; K109-T112 WeakPolarHBondContact O-CA 3.46Å; K109-T112 PolarHBondContact O-N 2.82Å; K109-T112 PolarHBondContact O-OG1 2.94Å
110	D	65.2	Low	82.8	Confident	133 Å²	133	46.1 Å²	46.1	71%	0.711	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.6	42.7	171	-57	-37.3	0	0	0	114.3	T112	D110-T112 VanDerWaalsContact C-N 3.29Å; D110-T112 PolarHBondContact O-N 3.23Å
111	R	68.3	Low	82.9	Confident	195 Å²	195	45.4 Å²	45.4	74%	0.736	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.9	8.7	-176.8	-48.8	178.5	172.3	177.2	-2.3	116.3	K109 T134	K109-R111 PolarHBondContact O-N 3.17Å; R111-T134 CarbonylContact O-C 3.58Å
112	T	75.9	Confident	82.6	Confident	85 Å²	85	41.2 Å²	41.2	52%	0.521	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.1	168.8	64.3	0	0	0	0	111.1	T108 K109 D110 N133	T108-T112 CarbonylContact C-O 3.52Å; T108-T112 VanDerWaalsContact CA-O 3.27Å; T108-T112 WeakPolarHBondContact CA-O 3.18Å; T108-T112 WeakPolarHBondContact CG2-O 3.43Å; K109-T112 PolarHBondContact N-O 2.93Å; K109-T112 WeakPolarHBondContact O-CA 3.46Å; K109-T112 PolarHBondContact O-N 2.82Å; K109-T112 PolarHBondContact O-OG1 2.94Å; D110-T112 VanDerWaalsContact C-N 3.29Å; D110-T112 PolarHBondContact O-N 3.23Å; T112-N133 WeakPolarHBondContact CA-O 3.33Å
113	S	86.1	Confident	82.4	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.021	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.5	176.2	-69.7	0	0	0	0	111.6	A107 T108 N133 F135	A107-S113 CarbonylContact O-C 3.57Å; A107-S113 VanDerWaalsContact O-CA 3.26Å; A107-S113 WeakPolarHBondContact O-CA 3.38Å; T108-S113 WeakPolarHBondContact CG2-OG 3.27Å; T108-S113 PolarHBondContact OG1-OG 2.59Å; S113-N133 PolarHBondContact N-O 3.38Å; S113-N133 WeakPolarHBondContact O-CA 3.37Å; S113-F135 VanDerWaalsContact CB-O 3.31Å; S113-F135 WeakPolarHBondContact CB-O 3.48Å; S113-F135 PolarHBondContact OG-O 2.66Å
114	Q	86.6	Confident	82.4	Confident	48 Å²	48	40.8 Å²	40.8	22%	0.224	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.5	175.6	-169	175.9	44.9	0	0	108.6	W81 D83 C106 A107 C126	W81-Q114 HydrophobicContact CE3-CB 4.4Å; W81-Q114 HydrophobicContact CZ3-CB 4Å; W81-Q114 HydrophobicContact CZ3-CG 4.29Å; W81-Q114 WeakPolarHBondContact CZ3-O 3.12Å; D83-Q114 PolarHBondContact OD2-NE2 3.39Å; C106-Q114 VanDerWaalsContact CA-O 3.28Å; C106-Q114 WeakPolarHBondContact CA-O 3.38Å; A107-Q114 PolarHBondContact N-O 2.84Å; A107-Q114 PolarHBondContact O-N 2.82Å; Q114-C126 HydrophobicContact CG-CB 4.41Å
115	C	89.1	Confident	82.3	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.02	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	141.8	174.2	-60.5	0	0	0	0	109.8	F104 V105 C106 A127 I129 I132	F104-C115 HydrophobicContact CE2-CB 3.81Å; F104-C115 HydrophobicContact CZ-CB 3.56Å; V105-C115 CarbonylContact O-C 3.58Å; V105-C115 WeakPolarHBondContact O-CA 3.32Å; C106-C115 HydrophobicContact CB-CB 4.07Å; C106-C115 WeakPolarHBondContact CB-SG 3.48Å; C106-C115 WeakPolarHBondContact SG-CB 3.38Å; C106-C115 CovalentContact SG-SG 2.04Å; C106-C115 PolarHBondContact SG-SG 2.96Å; C115-A127 VanDerWaalsContact O-O 3.08Å; C115-I129 HydrophobicContact CB-CD1 4.25Å; C115-I129 HydrophobicContact CB-CG1 4.31Å; C115-I132 VanDerWaalsContact SG-CD1 3.57Å
116	C	88.6	Confident	82	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	159.9	-174.3	-48.6	0	0	0	0	110.8	W81 V105 L124 C126	W81-C116 WeakPolarHBondContact CZ3-SG 3.32Å; V105-C116 WeakPolarHBondContact CG2-O 3.44Å; V105-C116 PolarHBondContact N-O 3.34Å; V105-C116 PolarHBondContact O-N 2.73Å; C116-L124 HydrophobicContact CB-CB 4.16Å; C116-L124 HydrophobicContact CB-CD2 3.87Å; C116-L124 HydrophobicContact CB-CG 4.48Å; C116-C126 HydrophobicContact CB-CB 3.86Å; C116-C126 WeakPolarHBondContact CB-SG 3Å; C116-C126 VanDerWaalsContact SG-CA 3.56Å; C116-C126 WeakPolarHBondContact SG-CB 3.35Å; C116-C126 CovalentContact SG-SG 2.04Å; C116-C126 PolarHBondContact SG-SG 2.82Å
117	D	89.5	Confident	81.2	Confident	38 Å²	38	50.3 Å²	50.3	20%	0.203	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	123.8	167	-69.5	-6.1	0	0	0	108.6	R97 P102 L103 L124 T125	R97-D117 IonicContact CZ-OD1 2.87Å; R97-D117 IonicContact NH1-OD1 3.1Å; R97-D117 PolarHBondContact NH1-OD1 3.47Å; R97-D117 IonicContact NH1-OD2 2.74Å; R97-D117 PolarHBondContact NH1-OD2 3.16Å; R97-D117 IonicContact NH2-OD1 3.04Å; R97-D117 PolarHBondContact NH2-OD1 3.17Å; P102-D117 HydrophobicContact CB-CB 3.99Å; P102-D117 HydrophobicContact CG-CB 3.67Å; L103-D117 CarbonylContact O-C 3.59Å; L103-D117 WeakPolarHBondContact O-CA 3.33Å; D117-L124 CarbonylContact O-C 3.53Å; D117-L124 WeakPolarHBondContact O-CA 3.48Å; D117-T125 PolarHBondContact N-O 2.84Å; D117-T125 PolarHBondContact O-N 3.22Å
118	L	87.2	Confident	80.2	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.1	-178.5	177.3	57.3	0	0	0	109.2	L62 V79 P102 L103 V105 L124	L62-L118 HydrophobicContact CD1-CD1 4.02Å; L62-L118 HydrophobicContact CD1-CD2 3.57Å; L62-L118 HydrophobicContact CD1-CG 3.81Å; L62-L118 HydrophobicContact CD2-CD2 3.81Å; L62-L118 HydrophobicContact CG-CD2 3.88Å; V79-L118 HydrophobicContact CG1-CD1 4.28Å; V79-L118 HydrophobicContact CG2-CD1 4.35Å; V79-L118 HydrophobicContact CG2-CD2 4.21Å; P102-L118 WeakPolarHBondContact CB-O 3.34Å; L103-L118 HydrophobicContact CB-CB 4.28Å; L103-L118 PolarHBondContact N-O 2.91Å; L103-L118 PolarHBondContact O-N 3.18Å; V105-L118 HydrophobicContact CG1-CB 4.08Å; V105-L118 HydrophobicContact CG1-CD2 3.8Å; V105-L118 HydrophobicContact CG2-CB 3.83Å; V105-L118 HydrophobicContact CG2-CD2 4.2Å; L118-L124 HydrophobicContact CB-CD2 3.79Å; L118-L124 HydrophobicContact CD1-CD2 3.66Å; L118-L124 HydrophobicContact CD1-CG 4.3Å; L118-L124 HydrophobicContact CG-CD2 4.2Å
119	D	82.8	Confident	80.3	Confident	51 Å²	51	58.8 Å²	58.8	27%	0.273	33%	0.325	S	S	.	.			trans	-79	168.8	176.3	67.9	37.2	0	0	0	112.2	S121 G122 S123	D119-S121 VanDerWaalsContact CG-OG 3.29Å; D119-S121 PolarHBondContact O-N 2.84Å; D119-S121 VanDerWaalsContact O-N 3.17Å; D119-S121 VanDerWaalsContact OD1-CA 3.24Å; D119-S121 WeakPolarHBondContact OD1-CA 3.48Å; D119-S121 VanDerWaalsContact OD1-CB 3.26Å; D119-S121 WeakPolarHBondContact OD1-CB 3.32Å; D119-S121 PolarHBondContact OD1-N 3.36Å; D119-S121 PolarHBondContact OD1-OG 2.76Å; D119-S121 PolarHBondContact OD2-OG 3.01Å; D119-G122 PolarHBondContact O-N 2.96Å; D119-G122 VanDerWaalsContact O-N 3.08Å; D119-G122 PolarHBondContact OD1-N 3.14Å; D119-S123 VanDerWaalsContact CG-O 3.32Å; D119-S123 PolarHBondContact N-O 2.66Å; D119-S123 VanDerWaalsContact N-O 3.08Å; D119-S123 PolarHBondContact OD1-N 2.89Å; D119-S123 VanDerWaalsContact OD2-CB 3.24Å; D119-S123 WeakPolarHBondContact OD2-CB 3.09Å
120	S	75.3	Confident	80.6	Confident	92 Å²	92	61.2 Å²	61.2	64%	0.643	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-14.5	179	61.2	0	0	0	0	113.7	K75 G122	K75-S120 PolarHBondContact NZ-O 3.43Å; S120-G122 VanDerWaalsContact C-N 3.34Å
121	S	77.9	Confident	81.4	Confident	69 Å²	69	59 Å²	59	48%	0.483	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-11.9	175.4	84.3	0	0	0	0	112.9	T77 D119	T77-S121 WeakPolarHBondContact CG2-O 3.39Å; D119-S121 VanDerWaalsContact CG-OG 3.29Å; D119-S121 PolarHBondContact O-N 2.84Å; D119-S121 VanDerWaalsContact O-N 3.17Å; D119-S121 VanDerWaalsContact OD1-CA 3.24Å; D119-S121 WeakPolarHBondContact OD1-CA 3.48Å; D119-S121 VanDerWaalsContact OD1-CB 3.26Å; D119-S121 WeakPolarHBondContact OD1-CB 3.32Å; D119-S121 PolarHBondContact OD1-N 3.36Å; D119-S121 PolarHBondContact OD1-OG 2.76Å; D119-S121 PolarHBondContact OD2-OG 3.01Å
122	G	76.5	Confident	82.2	Confident	8 Å²	8	49.8 Å²	49.8	8%	0.082	29%	0.293	C	S	.	.	S	Bend	trans	90.2	8.2	-175.5	0	0	0	0	0	113.9	D119 S120	D119-G122 PolarHBondContact O-N 2.96Å; D119-G122 VanDerWaalsContact O-N 3.08Å; D119-G122 PolarHBondContact OD1-N 3.14Å; S120-G122 VanDerWaalsContact C-N 3.34Å
123	S	83.7	Confident	82.4	Confident	59 Å²	59	49.9 Å²	49.9	41%	0.413	29%	0.291	S	S	.	.			trans	-89.3	140.6	179.1	161.9	0	0	0	0	110.7	D119	D119-S123 VanDerWaalsContact CG-O 3.32Å; D119-S123 PolarHBondContact N-O 2.66Å; D119-S123 VanDerWaalsContact N-O 3.08Å; D119-S123 PolarHBondContact OD1-N 2.89Å; D119-S123 VanDerWaalsContact OD2-CB 3.24Å; D119-S123 WeakPolarHBondContact OD2-CB 3.09Å
124	L	87.6	Confident	82.1	Confident	10 Å²	10	54.9 Å²	54.9	5%	0.052	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.8	-176.4	-67.7	173.9	0	0	0	111.4	V79 W81 V105 C116 D117 L118	V79-L124 HydrophobicContact CG1-CD1 3.63Å; V79-L124 HydrophobicContact CG1-CD2 3.98Å; V79-L124 HydrophobicContact CG1-CG 3.89Å; W81-L124 HydrophobicContact CB-CD1 4.45Å; W81-L124 HydrophobicContact CD2-CD1 3.53Å; W81-L124 HydrophobicContact CE3-CD1 3.8Å; W81-L124 HydrophobicContact CG-CD1 3.87Å; W81-L124 HydrophobicContact CH2-CD1 4.29Å; W81-L124 HydrophobicContact CZ2-CD1 4.06Å; W81-L124 HydrophobicContact CZ3-CD1 4.18Å; V105-L124 HydrophobicContact CG2-CD2 3.84Å; C116-L124 HydrophobicContact CB-CB 4.16Å; C116-L124 HydrophobicContact CB-CD2 3.87Å; C116-L124 HydrophobicContact CB-CG 4.48Å; D117-L124 CarbonylContact O-C 3.53Å; D117-L124 WeakPolarHBondContact O-CA 3.48Å; L118-L124 HydrophobicContact CB-CD2 3.79Å; L118-L124 HydrophobicContact CD1-CD2 3.66Å; L118-L124 HydrophobicContact CD1-CG 4.3Å; L118-L124 HydrophobicContact CG-CD2 4.2Å
125	T	88.7	Confident	82.1	Confident	94 Å²	94	53.7 Å²	53.7	58%	0.577	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	98.7	167.8	-56.8	0	0	0	0	108.7	D117 A127	D117-T125 PolarHBondContact N-O 2.84Å; D117-T125 PolarHBondContact O-N 3.22Å; T125-A127 PolarHBondContact O-N 3.3Å
126	C	83.6	Confident	82	Confident	50 Å²	50	57.4 Å²	57.4	34%	0.338	34%	0.335	S	S	.	.			trans	-85	105.7	-171.8	-57.8	0	0	0	0	111.9	Q114 C116	Q114-C126 HydrophobicContact CG-CB 4.41Å; C116-C126 HydrophobicContact CB-CB 3.86Å; C116-C126 WeakPolarHBondContact CB-SG 3Å; C116-C126 VanDerWaalsContact SG-CA 3.56Å; C116-C126 WeakPolarHBondContact SG-CB 3.35Å; C116-C126 CovalentContact SG-SG 2.04Å; C116-C126 PolarHBondContact SG-SG 2.82Å
127	A	71.7	Confident	82	Confident	59 Å²	59	57.8 Å²	57.8	49%	0.488	34%	0.337	S	S	.	.			trans	-79.6	138.9	166.4	0	0	0	0	0	109.7	C115 T125 I129	C115-A127 VanDerWaalsContact O-O 3.08Å; T125-A127 PolarHBondContact O-N 3.3Å; A127-I129 PolarHBondContact O-N 3.5Å; A127-I129 VanDerWaalsContact O-N 3.07Å
128	K	67.2	Low	81.8	Confident	183 Å²	183	59.3 Å²	59.3	80%	0.796	34%	0.342	S	S	*	.			trans	-75.1	101.8	173.9	-73.8	-177.7	179.5	177.3	0	108.9	D130	K128-D130 PolarHBondContact O-N 3.46Å
129	I	81.3	Confident	81.5	Confident	12 Å²	12	64.9 Å²	64.9	6%	0.062	37%	0.368	C	S	.	.			trans	-70.8	115.8	154.6	-68.9	-160.9	0	0	0	106.8	F104 C115 A127 N131 I132 L154 F170	F104-I129 HydrophobicContact CE1-CD1 4.5Å; F104-I129 HydrophobicContact CE2-CD1 3.74Å; F104-I129 HydrophobicContact CE2-CG1 4.43Å; F104-I129 HydrophobicContact CZ-CD1 3.38Å; F104-I129 HydrophobicContact CZ-CG1 4.42Å; C115-I129 HydrophobicContact CB-CD1 4.25Å; C115-I129 HydrophobicContact CB-CG1 4.31Å; A127-I129 PolarHBondContact O-N 3.5Å; A127-I129 VanDerWaalsContact O-N 3.07Å; I129-N131 PolarHBondContact O-N 3.26Å; I129-I132 HydrophobicContact CB-CG2 4.09Å; I129-I132 HydrophobicContact CG2-CB 4.16Å; I129-I132 HydrophobicContact CG2-CG2 4.19Å; I129-I132 WeakPolarHBondContact O-CG2 3.29Å; I129-L154 HydrophobicContact CD1-CB 3.93Å; I129-L154 HydrophobicContact CD1-CD2 4.24Å; I129-F170 HydrophobicContact CG2-CB 3.57Å
130	D	80.9	Confident	81.6	Confident	93 Å²	93	65.2 Å²	65.2	50%	0.497	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	137.6	-178.1	-72.5	-27.3	0	0	0	111.5	K128 I132 G171	K128-D130 PolarHBondContact O-N 3.46Å; D130-I132 VanDerWaalsContact C-N 3.3Å; D130-I132 PolarHBondContact O-N 3.24Å; D130-G171 PolarHBondContact O-N 3.08Å
131	N	80.3	Confident	82.4	Confident	86 Å²	86	62 Å²	62	46%	0.46	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	11.5	172.5	-50.9	-76.1	0	0	0	117.3	I129 F170 R174	I129-N131 PolarHBondContact O-N 3.26Å; N131-F170 WeakPolarHBondContact O-CD1 3.49Å; N131-F170 WeakPolarHBondContact O-CE1 3.33Å; N131-R174 HydrophobicContact CB-CB 4.01Å; N131-R174 HydrophobicContact CB-CG 4.08Å
132	I	85.8	Confident	83.2	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	35%	0.347	C	S	.	.			trans	-83.3	-21.1	173.9	-163.3	152.3	0	0	0	113.3	C115 I129 D130 T134 F135 I137 L154 L156 F170	C115-I132 VanDerWaalsContact SG-CD1 3.57Å; I129-I132 HydrophobicContact CB-CG2 4.09Å; I129-I132 HydrophobicContact CG2-CB 4.16Å; I129-I132 HydrophobicContact CG2-CG2 4.19Å; I129-I132 WeakPolarHBondContact O-CG2 3.29Å; D130-I132 VanDerWaalsContact C-N 3.3Å; D130-I132 PolarHBondContact O-N 3.24Å; I132-T134 PolarHBondContact O-N 3.21Å; I132-F135 HydrophobicContact CG1-CB 4.43Å; I132-F135 WeakPolarHBondContact O-CB 3.06Å; I132-F135 PolarHBondContact O-N 2.79Å; I132-I137 HydrophobicContact CD1-CD1 4.43Å; I132-L154 HydrophobicContact CD1-CD2 3.64Å; I132-L156 HydrophobicContact CD1-CD1 4.02Å; I132-F170 HydrophobicContact CB-CB 4.42Å; I132-F170 HydrophobicContact CB-CD1 4.02Å; I132-F170 HydrophobicContact CB-CG 4.17Å; I132-F170 HydrophobicContact CD1-CB 4.45Å; I132-F170 HydrophobicContact CD1-CD2 4.05Å; I132-F170 HydrophobicContact CD1-CG 4.16Å; I132-F170 HydrophobicContact CG1-CD1 4.32Å; I132-F170 HydrophobicContact CG1-CD2 4.39Å; I132-F170 HydrophobicContact CG1-CG 4.26Å
133	N	80.3	Confident	84	Confident	88 Å²	88	62.5 Å²	62.5	47%	0.471	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-20.3	-167.3	-64.5	11.1	0	0	0	115.7	T112 S113	T112-N133 WeakPolarHBondContact CA-O 3.33Å; S113-N133 PolarHBondContact N-O 3.38Å; S113-N133 WeakPolarHBondContact O-CA 3.37Å
134	T	80.8	Confident	84.5	Confident	107 Å²	107	60.1 Å²	60.1	66%	0.656	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	5	179.1	64.7	0	0	0	0	112.9	R111 I132	R111-T134 CarbonylContact O-C 3.58Å; I132-T134 PolarHBondContact O-N 3.21Å
135	F	86.1	Confident	84.8	Confident	24 Å²	24	61.1 Å²	61.1	11%	0.105	34%	0.343	C	S	.	.			trans	-88.3	139.4	179.2	-170.8	-108.1	0	0	0	109.3	S113 I132 I137 L156 H168 F170	S113-F135 VanDerWaalsContact CB-O 3.31Å; S113-F135 WeakPolarHBondContact CB-O 3.48Å; S113-F135 PolarHBondContact OG-O 2.66Å; I132-F135 HydrophobicContact CG1-CB 4.43Å; I132-F135 WeakPolarHBondContact O-CB 3.06Å; I132-F135 PolarHBondContact O-N 2.79Å; F135-I137 HydrophobicContact CD1-CG1 3.77Å; F135-I137 HydrophobicContact CE1-CG1 4.1Å; F135-L156 HydrophobicContact CD1-CD1 4.07Å; F135-L156 HydrophobicContact CE1-CB 4.29Å; F135-L156 HydrophobicContact CE1-CD1 3.95Å; F135-H168 AromaticContact CE2-CD2 3.99Å; F135-H168 AromaticContact CE2-CE1 3.48Å; F135-H168 VanDerWaalsContact CE2-CE1 3.48Å; F135-H168 WeakPolarHBondContact CE2-CE1 3.46Å; F135-H168 AromaticContact CE2-CG 3.86Å; F135-H168 AromaticContact CE2-ND1 3.56Å; F135-H168 AromaticContact CE2-NE2 3.75Å; F135-H168 AromaticContact CZ-CE1 3.93Å; F135-H168 AromaticContact CZ-ND1 3.64Å; F135-F170 HydrophobicContact CB-CE1 4.12Å; F135-F170 HydrophobicContact CB-CZ 3.77Å; F135-F170 HydrophobicContact CD1-CE2 4.07Å; F135-F170 AromaticContact CD1-CZ 3.89Å; F135-F170 HydrophobicContact CD1-CZ 3.89Å; F135-F170 AromaticContact CD2-CZ 3.75Å; F135-F170 HydrophobicContact CD2-CZ 3.75Å; F135-F170 HydrophobicContact CE1-CE2 4.37Å; F135-F170 HydrophobicContact CE1-CZ 4.43Å; F135-F170 HydrophobicContact CE2-CZ 4.3Å; F135-F170 HydrophobicContact CG-CE1 4.34Å; F135-F170 HydrophobicContact CG-CE2 4.17Å; F135-F170 AromaticContact CG-CZ 3.51Å; F135-F170 HydrophobicContact CG-CZ 3.51Å
136	N	86.9	Confident	85	Confident	80 Å²	80	56.9 Å²	56.9	43%	0.428	32%	0.316	S	S	.	.			trans	-103	103.6	177.8	-178.2	46.1	0	0	0	109.1	T108 K138	T108-N136 HydrophobicContact CG2-CB 4.44Å; T108-N136 WeakPolarHBondContact CG2-OD1 3.5Å; N136-K138 PolarHBondContact O-N 2.87Å
137	I	87.6	Confident	85.2	Confident	9 Å²	9	57.5 Å²	57.5	5%	0.046	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-79.4	117	-179.4	-49.8	172.5	0	0	0	108.3	A92 V93 C106 T108 I132 F135 L156	A92-I137 HydrophobicContact CB-CB 4.04Å; A92-I137 HydrophobicContact CB-CG2 3.74Å; V93-I137 HydrophobicContact CG2-CD1 4.31Å; V93-I137 HydrophobicContact CG2-CG2 3.88Å; C106-I137 HydrophobicContact CB-CD1 3.76Å; T108-I137 VanDerWaalsContact OG1-CB 3.32Å; T108-I137 WeakPolarHBondContact OG1-CB 3.39Å; T108-I137 PolarHBondContact OG1-N 2.94Å; I132-I137 HydrophobicContact CD1-CD1 4.43Å; F135-I137 HydrophobicContact CD1-CG1 3.77Å; F135-I137 HydrophobicContact CE1-CG1 4.1Å; I137-L156 HydrophobicContact CD1-CD1 3.88Å; I137-L156 HydrophobicContact CG1-CD1 3.95Å
138	K	86.1	Confident	85.7	Confident	70 Å²	70	57.7 Å²	57.7	30%	0.304	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-81.3	148.6	176.1	-60.8	176.6	-173	176.2	0	110.1	N136 G140 E141 S159	N136-K138 PolarHBondContact O-N 2.87Å; K138-G140 PolarHBondContact O-N 2.94Å; K138-E141 HydrophobicContact CB-CG 3.8Å; K138-E141 WeakPolarHBondContact O-CG 3.49Å; K138-E141 PolarHBondContact O-N 3.42Å; K138-S159 PolarHBondContact NZ-O 2.75Å
139	E	81	Confident	86.3	Confident	117 Å²	117	57.4 Å²	57.4	55%	0.547	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	133.9	173.8	-173.5	173.7	177.5	0	0	110.6	K59	K59-E139 WeakPolarHBondContact CE-OE1 3.21Å; K59-E139 IonicContact NZ-OE1 3.34Å; K59-E139 PolarHBondContact NZ-OE1 2.04Å; K59-E139 IonicContact NZ-OE2 3.44Å; K59-E139 PolarHBondContact NZ-OE2 2.96Å
140	G	84.5	Confident	86.2	Confident	59 Å²	59	61.5 Å²	61.5	61%	0.608	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	-3.6	178.5	0	0	0	0	0	115.8	K138	K138-G140 PolarHBondContact O-N 2.94Å
141	E	91.8	Very high	86.4	Confident	23 Å²	23	60.2 Å²	60.2	11%	0.107	34%	0.342	C	S	.	.			trans	-62.9	150.2	171.6	-65.5	-65.6	168.7	0	0	111.4	K138 T157 S159	K138-E141 HydrophobicContact CB-CG 3.8Å; K138-E141 WeakPolarHBondContact O-CG 3.49Å; K138-E141 PolarHBondContact O-N 3.42Å; E141-T157 WeakPolarHBondContact CG-O 3.37Å; E141-T157 VanDerWaalsContact OE2-C 3.23Å; E141-T157 PolarHBondContact OE2-OG1 2.85Å; E141-S159 VanDerWaalsContact CD-N 3.32Å; E141-S159 WeakPolarHBondContact OE1-CA 3.35Å; E141-S159 WeakPolarHBondContact OE1-CB 3.25Å; E141-S159 PolarHBondContact OE1-N 2.8Å; E141-S159 PolarHBondContact OE1-OG 3.45Å; E141-S159 PolarHBondContact OE2-N 3.14Å; E141-S159 PolarHBondContact OE2-OG 3.02Å
142	K	94.3	Very high	86.8	Confident	58 Å²	58	58.2 Å²	58.2	25%	0.252	33%	0.333	S	S	.	.			trans	-89.7	137.5	-178.3	-53.1	-58	173.3	164.8	0	109.9	T157 L187 L189	K142-T157 HydrophobicContact CB-CG2 4.03Å; K142-T157 PolarHBondContact N-OG1 3.12Å; K142-T157 PolarHBondContact O-N 3.05Å; K142-T157 PolarHBondContact O-OG1 2.9Å; K142-L187 WeakPolarHBondContact CE-O 3.18Å; K142-L187 PolarHBondContact NZ-O 2.86Å; K142-L189 HydrophobicContact CB-CB 4.1Å
143	S	94.3	Very high	87.2	Confident	31 Å²	31	58.2 Å²	58.2	22%	0.217	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.7	-178.5	62.2	0	0	0	0	111.3	H95 Y155 L156	H95-S143 PolarHBondContact CE1-O 2.82Å; H95-S143 PolarHBondContact CE1-OG 2.96Å; H95-S143 WeakPolarHBondContact NE2-CB 3.33Å; H95-S143 PolarHBondContact NE2-OG 2.67Å; S143-Y155 CarbonylContact C-O 3.57Å; S143-Y155 VanDerWaalsContact CA-O 3.24Å; S143-Y155 WeakPolarHBondContact CA-O 3.49Å; S143-L156 VanDerWaalsContact CB-CD2 3.41Å
144	A	94.7	Very high	87.9	Confident	9 Å²	9	54 Å²	54	7%	0.074	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	134.9	169.9	0	0	0	0	0	109.7	Y155 L189 L191	A144-Y155 PolarHBondContact N-O 2.64Å; A144-Y155 PolarHBondContact O-N 3.41Å; A144-L189 HydrophobicContact CB-CD2 3.63Å; A144-L189 HydrophobicContact CB-CG 4.14Å; A144-L191 HydrophobicContact CB-CD1 3.95Å; A144-L191 HydrophobicContact CB-CD2 3.86Å; A144-L191 HydrophobicContact CB-CG 3.75Å
145	L	93.3	Very high	88.6	Confident	30 Å²	30	48.9 Å²	48.9	16%	0.157	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	120.9	-178.8	-171.4	68.4	0	0	0	109.4	H95 F104 E147 T152 L154	H95-L145 HydrophobicContact CB-CB 4.48Å; H95-L145 HydrophobicContact CB-CD2 4.17Å; F104-L145 HydrophobicContact CB-CD2 3.99Å; F104-L145 HydrophobicContact CD1-CD1 4.12Å; F104-L145 HydrophobicContact CD1-CD2 3.99Å; F104-L145 HydrophobicContact CE1-CD1 4.02Å; F104-L145 HydrophobicContact CG-CD1 4.47Å; F104-L145 HydrophobicContact CG-CD2 3.92Å; F104-L145 HydrophobicContact CZ-CD1 4.29Å; L145-E147 HydrophobicContact CG-CB 4.48Å; L145-T152 HydrophobicContact CD1-CG2 3.67Å; L145-T152 HydrophobicContact CG-CG2 4.48Å; L145-L154 HydrophobicContact CD1-CB 4.41Å; L145-L154 HydrophobicContact CD1-CD1 4.21Å
146	D	92.3	Very high	89.1	Confident	5 Å²	5	47.8 Å²	47.8	3%	0.027	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	98.3	169.3	177.4	41.5	0	0	0	109.1	K151 D153 Y155 L191 K193 M230	D146-K151 WeakPolarHBondContact OD2-CE 3.4Å; D146-K151 IonicContact OD2-NZ 2.69Å; D146-K151 PolarHBondContact OD2-NZ 3.02Å; D146-D153 HydrophobicContact CB-CB 4.28Å; D146-D153 PolarHBondContact N-O 3.32Å; D146-D153 PolarHBondContact O-N 2.81Å; D146-Y155 HydrophobicContact CB-CE2 4Å; D146-L191 HydrophobicContact CB-CD1 4.24Å; D146-K193 WeakPolarHBondContact OD1-CE 3.4Å; D146-K193 IonicContact OD1-NZ 3.28Å; D146-K193 PolarHBondContact OD1-NZ 3.03Å; D146-M230 HydrophobicContact CB-CE 3.59Å; D146-M230 WeakPolarHBondContact OD2-CE 3.34Å
147	E	87.9	Confident	89.5	Confident	64 Å²	64	44 Å²	44	30%	0.299	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	132.1	179.6	-170.7	162.8	-118.3	0	0	110.7	R97 L145 T152	R97-E147 VanDerWaalsContact CD-OE2 3.29Å; R97-E147 WeakPolarHBondContact CD-OE2 3.29Å; R97-E147 IonicContact CZ-OE1 2.61Å; R97-E147 VanDerWaalsContact CZ-OE1 3.28Å; R97-E147 IonicContact CZ-OE2 2.78Å; R97-E147 IonicContact NE-OE1 3.79Å; R97-E147 PolarHBondContact NE-OE1 3.31Å; R97-E147 IonicContact NE-OE2 2.6Å; R97-E147 PolarHBondContact NE-OE2 3.4Å; R97-E147 IonicContact NH2-OE1 3.65Å; R97-E147 PolarHBondContact NH2-OE1 2.83Å; R97-E147 IonicContact NH2-OE2 3.12Å; L145-E147 HydrophobicContact CG-CB 4.48Å; E147-T152 HydrophobicContact CB-CG2 4.46Å; E147-T152 HydrophobicContact CG-CG2 4.37Å; E147-T152 PolarHBondContact OE1-OG1 3.48Å
148	T	83.8	Confident	89.8	Confident	63 Å²	63	44.4 Å²	44.4	39%	0.387	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	167.4	170.5	72.4	0	0	0	0	108.7	A150 K151	T148-A150 PolarHBondContact O-N 2.91Å; T148-A150 PolarHBondContact OG1-N 2.74Å; T148-K151 PolarHBondContact N-O 3.29Å; T148-K151 PolarHBondContact O-N 2.92Å; T148-K151 WeakPolarHBondContact OG1-CG 3.28Å; T148-K151 PolarHBondContact OG1-N 2.73Å
149	D	78.6	Confident	90.3	Very high	177 Å²	177	41.7 Å²	41.7	95%	0.947	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.9	177.7	-59.1	-30.8	0	0	0	113.5
150	A	79.1	Confident	90.9	Very high	97 Å²	97	36.5 Å²	36.5	80%	0.802	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-20.2	-177.2	0	0	0	0	0	114.3	T148	T148-A150 PolarHBondContact O-N 2.91Å; T148-A150 PolarHBondContact OG1-N 2.74Å
151	K	84.3	Confident	91.2	Very high	66 Å²	66	36.5 Å²	36.5	29%	0.287	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	153.2	-174.5	60.7	162.4	-164.6	148.3	0	113.3	D146 T148 D153	D146-K151 WeakPolarHBondContact OD2-CE 3.4Å; D146-K151 IonicContact OD2-NZ 2.69Å; D146-K151 PolarHBondContact OD2-NZ 3.02Å; T148-K151 PolarHBondContact N-O 3.29Å; T148-K151 PolarHBondContact O-N 2.92Å; T148-K151 WeakPolarHBondContact OG1-CG 3.28Å; T148-K151 PolarHBondContact OG1-N 2.73Å; K151-D153 IonicContact NZ-OD2 2.74Å; K151-D153 PolarHBondContact NZ-OD2 3.4Å
152	T	89.8	Confident	90.8	Very high	45 Å²	45	42.1 Å²	42.1	28%	0.276	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	107.3	169.4	-51.4	0	0	0	0	108.3	L145 E147 G171	L145-T152 HydrophobicContact CD1-CG2 3.67Å; L145-T152 HydrophobicContact CG-CG2 4.48Å; E147-T152 HydrophobicContact CB-CG2 4.46Å; E147-T152 HydrophobicContact CG-CG2 4.37Å; E147-T152 PolarHBondContact OE1-OG1 3.48Å; T152-G171 WeakPolarHBondContact O-CA 3.31Å
153	D	93.3	Very high	90.3	Very high	0 Å²	0	46 Å²	46	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.1	174.9	-72.9	-27.5	0	0	0	109.9	D146 K151 Y155 K169 F170 S172	D146-D153 HydrophobicContact CB-CB 4.28Å; D146-D153 PolarHBondContact N-O 3.32Å; D146-D153 PolarHBondContact O-N 2.81Å; K151-D153 IonicContact NZ-OD2 2.74Å; K151-D153 PolarHBondContact NZ-OD2 3.4Å; D153-Y155 HydrophobicContact CB-CE2 4.02Å; D153-K169 WeakPolarHBondContact OD2-CE 3.49Å; D153-K169 IonicContact OD2-NZ 3.23Å; D153-K169 PolarHBondContact OD2-NZ 2.86Å; D153-F170 WeakPolarHBondContact CA-O 3.49Å; D153-S172 VanDerWaalsContact CG-OG 3.27Å; D153-S172 WeakPolarHBondContact OD1-CB 3.35Å; D153-S172 PolarHBondContact OD1-N 3.37Å; D153-S172 PolarHBondContact OD1-OG 3.48Å; D153-S172 PolarHBondContact OD2-OG 3.04Å
154	L	95.1	Very high	90	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.2	175.9	178.1	65.7	0	0	0	109.7	F104 I129 I132 L145 L156 K169 F170	F104-L154 HydrophobicContact CE1-CD1 4.1Å; F104-L154 HydrophobicContact CE1-CD2 4.11Å; F104-L154 HydrophobicContact CZ-CD2 4.21Å; I129-L154 HydrophobicContact CD1-CB 3.93Å; I129-L154 HydrophobicContact CD1-CD2 4.24Å; I132-L154 HydrophobicContact CD1-CD2 3.64Å; L145-L154 HydrophobicContact CD1-CB 4.41Å; L145-L154 HydrophobicContact CD1-CD1 4.21Å; L154-L156 HydrophobicContact CD1-CD2 4.21Å; L154-L156 HydrophobicContact CD1-CG 4.5Å; L154-L156 HydrophobicContact CD2-CD1 3.93Å; L154-L156 HydrophobicContact CD2-CD2 4.24Å; L154-L156 HydrophobicContact CD2-CG 4.06Å; L154-L156 HydrophobicContact CG-CD1 4.37Å; L154-L156 HydrophobicContact CG-CD2 4.19Å; L154-L156 HydrophobicContact CG-CG 3.97Å; L154-K169 WeakPolarHBondContact O-CA 3.35Å; L154-F170 PolarHBondContact N-O 3.5Å; L154-F170 PolarHBondContact O-N 3.15Å
155	Y	96.5	Very high	89.9	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.8	173.3	-60.5	-94.7	0	0	0	109.4	S143 A144 D146 D153 I167 H168 K169 L191 V203 M230 W244	S143-Y155 CarbonylContact C-O 3.57Å; S143-Y155 VanDerWaalsContact CA-O 3.24Å; S143-Y155 WeakPolarHBondContact CA-O 3.49Å; A144-Y155 PolarHBondContact N-O 2.64Å; A144-Y155 PolarHBondContact O-N 3.41Å; D146-Y155 HydrophobicContact CB-CE2 4Å; D153-Y155 HydrophobicContact CB-CE2 4.02Å; Y155-I167 HydrophobicContact CD1-CG2 4.42Å; Y155-H168 CarbonylContact C-O 3.6Å; Y155-H168 VanDerWaalsContact CA-O 3.25Å; Y155-H168 WeakPolarHBondContact CA-O 3.44Å; Y155-K169 HydrophobicContact CD1-CB 4.17Å; Y155-K169 HydrophobicContact CD1-CG 4.32Å; Y155-K169 HydrophobicContact CE1-CB 4.08Å; Y155-K169 HydrophobicContact CE1-CD 3.96Å; Y155-K169 HydrophobicContact CE1-CG 3.9Å; Y155-L191 HydrophobicContact CD2-CD2 4.04Å; Y155-L191 HydrophobicContact CE2-CD2 4.24Å; Y155-V203 HydrophobicContact CD1-CG2 3.8Å; Y155-V203 HydrophobicContact CD2-CG2 4.43Å; Y155-V203 HydrophobicContact CE1-CG2 3.57Å; Y155-V203 HydrophobicContact CE2-CG2 4.25Å; Y155-V203 HydrophobicContact CG-CG2 4.23Å; Y155-M230 HydrophobicContact CE2-CE 4.03Å; Y155-M230 WeakPolarHBondContact OH-CB 3.3Å; Y155-W244 HydrophobicContact CD1-CH2 4.48Å; Y155-W244 HydrophobicContact CE1-CH2 4.04Å
156	L	95.7	Very high	90	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138.1	179.8	-66.5	176.4	0	0	0	110.8	V93 I132 F135 I137 S143 L154 I167 H168 F170	V93-L156 HydrophobicContact CG2-CD2 3.73Å; I132-L156 HydrophobicContact CD1-CD1 4.02Å; F135-L156 HydrophobicContact CD1-CD1 4.07Å; F135-L156 HydrophobicContact CE1-CB 4.29Å; F135-L156 HydrophobicContact CE1-CD1 3.95Å; I137-L156 HydrophobicContact CD1-CD1 3.88Å; I137-L156 HydrophobicContact CG1-CD1 3.95Å; S143-L156 VanDerWaalsContact CB-CD2 3.41Å; L154-L156 HydrophobicContact CD1-CD2 4.21Å; L154-L156 HydrophobicContact CD1-CG 4.5Å; L154-L156 HydrophobicContact CD2-CD1 3.93Å; L154-L156 HydrophobicContact CD2-CD2 4.24Å; L154-L156 HydrophobicContact CD2-CG 4.06Å; L154-L156 HydrophobicContact CG-CD1 4.37Å; L154-L156 HydrophobicContact CG-CD2 4.19Å; L154-L156 HydrophobicContact CG-CG 3.97Å; L156-I167 CarbonylContact O-C 3.3Å; L156-H168 PolarHBondContact N-O 2.77Å; L156-H168 PolarHBondContact O-N 2.78Å; L156-F170 HydrophobicContact CB-CE2 4.33Å; L156-F170 HydrophobicContact CD1-CD2 4.11Å; L156-F170 HydrophobicContact CD1-CE2 3.87Å; L156-F170 HydrophobicContact CG-CD2 4.49Å; L156-F170 HydrophobicContact CG-CE2 4.38Å
157	T	95.8	Very high	90.2	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	154.6	169.1	66	0	0	0	0	111.1	E141 K142 G166 Y186 L189	E141-T157 WeakPolarHBondContact CG-O 3.37Å; E141-T157 VanDerWaalsContact OE2-C 3.23Å; E141-T157 PolarHBondContact OE2-OG1 2.85Å; K142-T157 HydrophobicContact CB-CG2 4.03Å; K142-T157 PolarHBondContact N-OG1 3.12Å; K142-T157 PolarHBondContact O-N 3.05Å; K142-T157 PolarHBondContact O-OG1 2.9Å; T157-G166 CarbonylContact C-O 3.55Å; T157-Y186 HydrophobicContact CG2-CD1 3.72Å; T157-Y186 HydrophobicContact CG2-CG 3.77Å; T157-L189 HydrophobicContact CG2-CD1 4.22Å
158	S	94.8	Very high	90.6	Very high	17 Å²	17	41.9 Å²	41.9	12%	0.119	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	109	170.2	-179.9	0	0	0	0	108.2	V165 G166	S158-V165 WeakPolarHBondContact O-CA 3.29Å; S158-V165 WeakPolarHBondContact O-CG1 3.35Å; S158-G166 PolarHBondContact N-O 3.27Å; S158-G166 PolarHBondContact O-N 2.78Å
159	S	95.3	Very high	91.2	Very high	13 Å²	13	39.1 Å²	39.1	9%	0.091	22%	0.224	C	C	.	.			trans	-95.5	153.9	-179	-58.1	0	0	0	0	111.7	K138 E141 Q184 Y186	K138-S159 PolarHBondContact NZ-O 2.75Å; E141-S159 VanDerWaalsContact CD-N 3.32Å; E141-S159 WeakPolarHBondContact OE1-CA 3.35Å; E141-S159 WeakPolarHBondContact OE1-CB 3.25Å; E141-S159 PolarHBondContact OE1-N 2.8Å; E141-S159 PolarHBondContact OE1-OG 3.45Å; E141-S159 PolarHBondContact OE2-N 3.14Å; E141-S159 PolarHBondContact OE2-OG 3.02Å; S159-Q184 CarbonylContact C-O 3.5Å; S159-Q184 VanDerWaalsContact CA-O 3.3Å; S159-Q184 WeakPolarHBondContact CA-O 3.49Å; S159-Y186 PolarHBondContact OG-N 3.28Å
160	G	94.7	Very high	92	Very high	8 Å²	8	30.7 Å²	30.7	8%	0.082	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	124.3	-153.9	177.4	0	0	0	0	0	112.8	V165 E183 Q184	G160-V165 WeakPolarHBondContact O-CG2 3.24Å; G160-E183 CarbonylContact O-C 3.36Å; G160-E183 VanDerWaalsContact O-CA 3.27Å; G160-E183 WeakPolarHBondContact O-CA 3.25Å; G160-Q184 PolarHBondContact N-O 3.03Å; G160-Q184 PolarHBondContact O-N 3.34Å
161	A	90.3	Very high	92.6	Very high	60 Å²	60	26.5 Å²	26.5	50%	0.496	15%	0.145	S	C	.	.	S	Bend	trans	-120.5	10.5	-175.5	0	0	0	0	0	113.8	E183	A161-E183 HydrophobicContact CB-CB 3.93Å; A161-E183 HydrophobicContact CB-CG 3.92Å
162	H	83.3	Confident	92.8	Very high	140 Å²	140	26 Å²	26	65%	0.648	15%	0.15	S	C	*	.	S	Bend	trans	-84.5	-175.2	-176.5	-56.3	-65.1	0	0	0	112.2	V165	H162-V165 WeakPolarHBondContact O-CG2 3.29Å
163	E	84.3	Confident	92.8	Very high	141 Å²	141	29.4 Å²	29.4	66%	0.659	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	150.3	170.7	-65.8	-169	-168.9	0	0	112.1	V165 N179	E163-V165 PolarHBondContact O-N 3.44Å; E163-N179 WeakPolarHBondContact CA-OD1 3.19Å; E163-N179 WeakPolarHBondContact CB-OD1 3.47Å; E163-N179 PolarHBondContact OE2-ND2 3.47Å
164	N	86.9	Confident	92.8	Very high	37 Å²	37	33.5 Å²	33.5	20%	0.198	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	37.2	-179.9	-49	-75.3	0	0	0	113.3	G166 H168 R176 P177 N179	N164-G166 PolarHBondContact O-N 3.26Å; N164-H168 PolarHBondContact O-CE1 3.33Å; N164-R176 PolarHBondContact OD1-NH1 2.85Å; N164-P177 HydrophobicContact CB-CG 4.06Å; N164-P177 VanDerWaalsContact O-CG 3.22Å; N164-P177 WeakPolarHBondContact O-CG 3.4Å; N164-P177 PolarHBondContact OD1-O 3.01Å; N164-N179 PolarHBondContact N-OD1 3.34Å; N164-N179 PolarHBondContact OD1-OD1 2.96Å
165	V	94	Very high	92.8	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.012	18%	0.177	C	C	.	.			trans	-62.2	131.1	166.5	166.7	0	0	0	0	108.5	S158 G160 H162 E163 P177 H180 Q184 Y186	S158-V165 WeakPolarHBondContact O-CA 3.29Å; S158-V165 WeakPolarHBondContact O-CG1 3.35Å; G160-V165 WeakPolarHBondContact O-CG2 3.24Å; H162-V165 WeakPolarHBondContact O-CG2 3.29Å; E163-V165 PolarHBondContact O-N 3.44Å; V165-P177 WeakPolarHBondContact O-CB 3.22Å; V165-P177 WeakPolarHBondContact O-CG 3.23Å; V165-H180 PolarHBondContact O-NE2 3.04Å; V165-Q184 HydrophobicContact CG1-CB 3.71Å; V165-Q184 HydrophobicContact CG1-CG 4.26Å; V165-Y186 HydrophobicContact CG1-CE2 4.32Å
166	G	95.4	Very high	92.7	Very high	2 Å²	2	37 Å²	37	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.7	-164.9	-176.9	0	0	0	0	0	115.6	T157 S158 N164 H168 Y186	T157-G166 CarbonylContact C-O 3.55Å; S158-G166 PolarHBondContact N-O 3.27Å; S158-G166 PolarHBondContact O-N 2.78Å; N164-G166 PolarHBondContact O-N 3.26Å; G166-H168 PolarHBondContact O-ND1 3.48Å; G166-Y186 WeakPolarHBondContact CA-OH 3.28Å
167	I	96.4	Very high	92.6	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.015	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	132.7	-179.4	-46.6	170.6	0	0	0	109.2	Y155 L156 P177 Y186 S205 V228 W244	Y155-I167 HydrophobicContact CD1-CG2 4.42Å; L156-I167 CarbonylContact O-C 3.3Å; I167-P177 VanDerWaalsContact O-CD 3.29Å; I167-P177 WeakPolarHBondContact O-CD 3.15Å; I167-Y186 HydrophobicContact CG1-CE1 4.23Å; I167-S205 WeakPolarHBondContact CD1-OG 3.39Å; I167-V228 HydrophobicContact CD1-CG1 4.2Å; I167-V228 HydrophobicContact CD1-CG2 4.07Å; I167-W244 HydrophobicContact CG2-CZ2 4.3Å; I167-W244 PolarHBondContact O-NE1 3.2Å
168	H	96.2	Very high	92.4	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.032	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	146.6	169.7	-65.6	88	0	0	0	110	F135 Y155 L156 N164 G166 F170 V175 P177	F135-H168 AromaticContact CE2-CD2 3.99Å; F135-H168 AromaticContact CE2-CE1 3.48Å; F135-H168 VanDerWaalsContact CE2-CE1 3.48Å; F135-H168 WeakPolarHBondContact CE2-CE1 3.46Å; F135-H168 AromaticContact CE2-CG 3.86Å; F135-H168 AromaticContact CE2-ND1 3.56Å; F135-H168 AromaticContact CE2-NE2 3.75Å; F135-H168 AromaticContact CZ-CE1 3.93Å; F135-H168 AromaticContact CZ-ND1 3.64Å; Y155-H168 CarbonylContact C-O 3.6Å; Y155-H168 VanDerWaalsContact CA-O 3.25Å; Y155-H168 WeakPolarHBondContact CA-O 3.44Å; L156-H168 PolarHBondContact N-O 2.77Å; L156-H168 PolarHBondContact O-N 2.78Å; N164-H168 PolarHBondContact O-CE1 3.33Å; G166-H168 PolarHBondContact O-ND1 3.48Å; H168-F170 HydrophobicContact CB-CD2 4.33Å; H168-F170 HydrophobicContact CB-CE2 3.48Å; H168-F170 VanDerWaalsContact CB-CE2 3.48Å; H168-F170 HydrophobicContact CB-CZ 3.75Å; H168-V175 WeakPolarHBondContact CA-O 3.45Å; H168-P177 VanDerWaalsContact NE2-CD 3.34Å; H168-P177 WeakPolarHBondContact NE2-CD 3.2Å
169	K	96.3	Very high	92.2	Very high	5 Å²	5	42 Å²	42	2%	0.022	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	131.7	170.5	-179.2	-175.2	176.4	-176.3	0	109.4	D153 L154 Y155 R174 V175 M230 W244	D153-K169 WeakPolarHBondContact OD2-CE 3.49Å; D153-K169 IonicContact OD2-NZ 3.23Å; D153-K169 PolarHBondContact OD2-NZ 2.86Å; L154-K169 WeakPolarHBondContact O-CA 3.35Å; Y155-K169 HydrophobicContact CD1-CB 4.17Å; Y155-K169 HydrophobicContact CD1-CG 4.32Å; Y155-K169 HydrophobicContact CE1-CB 4.08Å; Y155-K169 HydrophobicContact CE1-CD 3.96Å; Y155-K169 HydrophobicContact CE1-CG 3.9Å; K169-R174 WeakPolarHBondContact O-CA 3.26Å; K169-V175 HydrophobicContact CB-CB 4.19Å; K169-V175 HydrophobicContact CD-CG2 4.36Å; K169-V175 PolarHBondContact N-O 2.89Å; K169-V175 PolarHBondContact O-N 2.94Å; K169-V175 VanDerWaalsContact O-N 3.08Å; K169-M230 PolarHBondContact NZ-O 3.18Å; K169-W244 HydrophobicContact CB-CH2 3.66Å; K169-W244 HydrophobicContact CB-CZ2 3.71Å; K169-W244 HydrophobicContact CD-CH2 4.03Å; K169-W244 HydrophobicContact CG-CH2 4.42Å
170	F	94.6	Very high	91.9	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	164.5	174.5	-55.3	-81.4	0	0	0	110	I129 N131 I132 F135 D153 L154 L156 H168	I129-F170 HydrophobicContact CG2-CB 3.57Å; N131-F170 WeakPolarHBondContact O-CD1 3.49Å; N131-F170 WeakPolarHBondContact O-CE1 3.33Å; I132-F170 HydrophobicContact CB-CB 4.42Å; I132-F170 HydrophobicContact CB-CD1 4.02Å; I132-F170 HydrophobicContact CB-CG 4.17Å; I132-F170 HydrophobicContact CD1-CB 4.45Å; I132-F170 HydrophobicContact CD1-CD2 4.05Å; I132-F170 HydrophobicContact CD1-CG 4.16Å; I132-F170 HydrophobicContact CG1-CD1 4.32Å; I132-F170 HydrophobicContact CG1-CD2 4.39Å; I132-F170 HydrophobicContact CG1-CG 4.26Å; F135-F170 HydrophobicContact CB-CE1 4.12Å; F135-F170 HydrophobicContact CB-CZ 3.77Å; F135-F170 HydrophobicContact CD1-CE2 4.07Å; F135-F170 AromaticContact CD1-CZ 3.89Å; F135-F170 HydrophobicContact CD1-CZ 3.89Å; F135-F170 AromaticContact CD2-CZ 3.75Å; F135-F170 HydrophobicContact CD2-CZ 3.75Å; F135-F170 HydrophobicContact CE1-CE2 4.37Å; F135-F170 HydrophobicContact CE1-CZ 4.43Å; F135-F170 HydrophobicContact CE2-CZ 4.3Å; F135-F170 HydrophobicContact CG-CE1 4.34Å; F135-F170 HydrophobicContact CG-CE2 4.17Å; F135-F170 AromaticContact CG-CZ 3.51Å; F135-F170 HydrophobicContact CG-CZ 3.51Å; D153-F170 WeakPolarHBondContact CA-O 3.49Å; L154-F170 PolarHBondContact N-O 3.5Å; L154-F170 PolarHBondContact O-N 3.15Å; L156-F170 HydrophobicContact CB-CE2 4.33Å; L156-F170 HydrophobicContact CD1-CD2 4.11Å; L156-F170 HydrophobicContact CD1-CE2 3.87Å; L156-F170 HydrophobicContact CG-CD2 4.49Å; L156-F170 HydrophobicContact CG-CE2 4.38Å; H168-F170 HydrophobicContact CB-CD2 4.33Å; H168-F170 HydrophobicContact CB-CE2 3.48Å; H168-F170 VanDerWaalsContact CB-CE2 3.48Å; H168-F170 HydrophobicContact CB-CZ 3.75Å
171	G	91.6	Very high	91.7	Very high	8 Å²	8	46.6 Å²	46.6	8%	0.082	25%	0.251	C	S	.	.	S	Bend	trans	106	-122.3	-176.4	0	0	0	0	0	111.4	D130 T152 K173	D130-G171 PolarHBondContact O-N 3.08Å; T152-G171 WeakPolarHBondContact O-CA 3.31Å; G171-K173 PolarHBondContact O-N 3.22Å; G171-K173 VanDerWaalsContact O-N 3.14Å
172	S	88.7	Confident	91.8	Very high	55 Å²	55	47 Å²	47	39%	0.385	24%	0.241	S	C	.	.	S	Bend	trans	-54.9	-38.2	-172.9	64	0	0	0	0	113.8	D153	D153-S172 VanDerWaalsContact CG-OG 3.27Å; D153-S172 WeakPolarHBondContact OD1-CB 3.35Å; D153-S172 PolarHBondContact OD1-N 3.37Å; D153-S172 PolarHBondContact OD1-OG 3.48Å; D153-S172 PolarHBondContact OD2-OG 3.04Å
173	K	89.7	Confident	92.4	Very high	118 Å²	118	42.4 Å²	42.4	51%	0.513	22%	0.22	S	C	.	.	S	Bend	trans	-146.1	141.6	174.1	-64.3	-65	173.8	-166.4	0	109.8	G171 V233	G171-K173 PolarHBondContact O-N 3.22Å; G171-K173 VanDerWaalsContact O-N 3.14Å; K173-V233 HydrophobicContact CB-CB 4.41Å; K173-V233 HydrophobicContact CB-CG1 4.23Å; K173-V233 HydrophobicContact CG-CB 4.14Å; K173-V233 HydrophobicContact CG-CG1 3.73Å
174	R	92.5	Very high	93	Very high	85 Å²	85	35.9 Å²	35.9	32%	0.321	19%	0.189	S	C	.	.			trans	-83.4	124.2	172	-171.2	-167.7	-175.4	178.3	-2.6	110.1	N131 K169	N131-R174 HydrophobicContact CB-CB 4.01Å; N131-R174 HydrophobicContact CB-CG 4.08Å; K169-R174 WeakPolarHBondContact O-CA 3.26Å
175	V	95.6	Very high	93.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-133.8	135.4	169.7	-166.2	0	0	0	0	109.7	H168 K169 D232 F242 W244	H168-V175 WeakPolarHBondContact CA-O 3.45Å; K169-V175 HydrophobicContact CB-CB 4.19Å; K169-V175 HydrophobicContact CD-CG2 4.36Å; K169-V175 PolarHBondContact N-O 2.89Å; K169-V175 PolarHBondContact O-N 2.94Å; K169-V175 VanDerWaalsContact O-N 3.08Å; V175-D232 WeakPolarHBondContact CG2-O 3.37Å; V175-F242 CarbonylContact C-O 3.52Å; V175-F242 VanDerWaalsContact CA-O 3.27Å; V175-F242 WeakPolarHBondContact CA-O 3.24Å; V175-W244 HydrophobicContact CB-CD2 4.14Å; V175-W244 HydrophobicContact CB-CE3 4.18Å; V175-W244 HydrophobicContact CB-CH2 4.02Å; V175-W244 HydrophobicContact CB-CZ2 3.99Å; V175-W244 HydrophobicContact CB-CZ3 4.12Å; V175-W244 HydrophobicContact CG1-CB 4.33Å; V175-W244 HydrophobicContact CG1-CD2 3.37Å; V175-W244 HydrophobicContact CG1-CE3 3.52Å; V175-W244 HydrophobicContact CG1-CG 3.77Å; V175-W244 HydrophobicContact CG1-CH2 4.26Å; V175-W244 HydrophobicContact CG1-CZ2 4.15Å; V175-W244 HydrophobicContact CG1-CZ3 3.97Å; V175-W244 HydrophobicContact CG2-CZ3 4.48Å
176	R	94.7	Very high	93.6	Very high	74 Å²	74	38.3 Å²	38.3	28%	0.279	20%	0.196	S	C	.	.	B	Isolated β-bridge	trans	-127.6	160.7	-176.8	68.1	176.9	172.1	84.6	8.5	111.4	N164 F242 S243 W244	N164-R176 PolarHBondContact OD1-NH1 2.85Å; R176-F242 WeakPolarHBondContact CG-O 3.32Å; R176-F242 PolarHBondContact N-O 3.36Å; R176-S243 CarbonylContact O-C 3.56Å; R176-S243 VanDerWaalsContact O-CA 3.23Å; R176-S243 WeakPolarHBondContact O-CA 3.32Å; R176-W244 VanDerWaalsContact O-CD1 3.29Å; R176-W244 PolarHBondContact O-N 2.88Å
177	P	94	Very high	93.7	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.019	20%	0.202	C	C	.	.			trans	-72.6	155.5	171.8	31.5	-30	0	0	0	110.7	N164 V165 I167 H168	N164-P177 HydrophobicContact CB-CG 4.06Å; N164-P177 VanDerWaalsContact O-CG 3.22Å; N164-P177 WeakPolarHBondContact O-CG 3.4Å; N164-P177 PolarHBondContact OD1-O 3.01Å; V165-P177 WeakPolarHBondContact O-CB 3.22Å; V165-P177 WeakPolarHBondContact O-CG 3.23Å; I167-P177 VanDerWaalsContact O-CD 3.29Å; I167-P177 WeakPolarHBondContact O-CD 3.15Å; H168-P177 VanDerWaalsContact NE2-CD 3.34Å; H168-P177 WeakPolarHBondContact NE2-CD 3.2Å
178	V	91.4	Very high	93.6	Very high	44 Å²	44	39.6 Å²	39.6	27%	0.267	20%	0.204	S	C	.	.			trans	-80.8	144.6	171.1	-178.9	0	0	0	0	108.9	H180 L240	V178-H180 PolarHBondContact O-CD2 2.03Å; V178-H180 VanDerWaalsContact O-CD2 3.32Å; V178-H180 PolarHBondContact O-N 3.49Å; V178-H180 VanDerWaalsContact O-N 3.12Å; V178-L240 HydrophobicContact CG2-CD2 3.66Å
179	N	90.2	Very high	93.6	Very high	76 Å²	76	40.6 Å²	40.6	41%	0.406	21%	0.209	S	C	.	.			trans	-62.1	114.7	174.6	-73.8	-13.2	0	0	0	110.3	E163 N164	E163-N179 WeakPolarHBondContact CA-OD1 3.19Å; E163-N179 WeakPolarHBondContact CB-OD1 3.47Å; E163-N179 PolarHBondContact OE2-ND2 3.47Å; N164-N179 PolarHBondContact N-OD1 3.34Å; N164-N179 PolarHBondContact OD1-OD1 2.96Å
180	H	89.6	Confident	93.7	Very high	58 Å²	58	40.5 Å²	40.5	27%	0.269	21%	0.209	S	C	.	.			trans	-117.2	-5.5	-178.3	56.4	67.2	0	0	0	113.9	V165 V178 K182	V165-H180 PolarHBondContact O-NE2 3.04Å; V178-H180 PolarHBondContact O-CD2 2.03Å; V178-H180 VanDerWaalsContact O-CD2 3.32Å; V178-H180 PolarHBondContact O-N 3.49Å; V178-H180 VanDerWaalsContact O-N 3.12Å; H180-K182 VanDerWaalsContact C-N 3.26Å; H180-K182 HydrophobicContact CB-CG 4.48Å; H180-K182 PolarHBondContact CE1-O 2.87Å; H180-K182 VanDerWaalsContact CE1-O 3.29Å; H180-K182 VanDerWaalsContact ND1-CB 3.27Å; H180-K182 WeakPolarHBondContact ND1-CB 3.42Å; H180-K182 WeakPolarHBondContact ND1-CG 3.45Å; H180-K182 PolarHBondContact ND1-N 2.92Å; H180-K182 PolarHBondContact O-N 2.94Å
181	G	89.3	Confident	93.7	Very high	59 Å²	59	42.2 Å²	42.2	61%	0.608	22%	0.218	S	C	*	.			trans	57.8	36.1	177.9	0	0	0	0	0	113.8	K212	G181-K212 WeakPolarHBondContact O-CE 3.35Å; G181-K212 PolarHBondContact O-NZ 2.81Å
182	K	92.6	Very high	93.9	Very high	68 Å²	68	42 Å²	42	30%	0.296	22%	0.216	S	C	.	.			trans	-116.5	142.3	175.3	-50.3	-178.1	-177.7	177.8	0	108.2	H180 Q209	H180-K182 VanDerWaalsContact C-N 3.26Å; H180-K182 HydrophobicContact CB-CG 4.48Å; H180-K182 PolarHBondContact CE1-O 2.87Å; H180-K182 VanDerWaalsContact CE1-O 3.29Å; H180-K182 VanDerWaalsContact ND1-CB 3.27Å; H180-K182 WeakPolarHBondContact ND1-CB 3.42Å; H180-K182 WeakPolarHBondContact ND1-CG 3.45Å; H180-K182 PolarHBondContact ND1-N 2.92Å; H180-K182 PolarHBondContact O-N 2.94Å; K182-Q209 HydrophobicContact CB-CG 4.32Å
183	E	95.9	Very high	94	Very high	43 Å²	43	44.1 Å²	44.1	20%	0.201	22%	0.218	C	C	.	.			trans	-88.6	119.3	175.9	-178.5	179.3	169.4	0	0	109.4	G160 A161 Y185 Q209 K210	G160-E183 CarbonylContact O-C 3.36Å; G160-E183 VanDerWaalsContact O-CA 3.27Å; G160-E183 WeakPolarHBondContact O-CA 3.25Å; A161-E183 HydrophobicContact CB-CB 3.93Å; A161-E183 HydrophobicContact CB-CG 3.92Å; E183-Y185 HydrophobicContact CG-CE2 3.64Å; E183-Y185 VanDerWaalsContact OE1-CE2 3.25Å; E183-Y185 WeakPolarHBondContact OE1-CE2 3.36Å; E183-Y185 PolarHBondContact OE1-OH 2.87Å; E183-Q209 WeakPolarHBondContact O-CA 3.32Å; E183-Q209 WeakPolarHBondContact O-CG 3.46Å; E183-K210 HydrophobicContact CB-CB 3.99Å; E183-K210 HydrophobicContact CB-CD 4.46Å; E183-K210 HydrophobicContact CG-CB 4.36Å; E183-K210 PolarHBondContact O-N 2.95Å; E183-K210 WeakPolarHBondContact OE2-CD 3.47Å; E183-K210 IonicContact OE2-NZ 2.79Å; E183-K210 PolarHBondContact OE2-NZ 3.17Å
184	Q	96.9	Very high	94	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.019	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	143.3	-175.2	-61.8	174	-12.9	0	0	111.4	S159 G160 V165 Y186 Y207 R208 Q209	S159-Q184 CarbonylContact C-O 3.5Å; S159-Q184 VanDerWaalsContact CA-O 3.3Å; S159-Q184 WeakPolarHBondContact CA-O 3.49Å; G160-Q184 PolarHBondContact N-O 3.03Å; G160-Q184 PolarHBondContact O-N 3.34Å; V165-Q184 HydrophobicContact CG1-CB 3.71Å; V165-Q184 HydrophobicContact CG1-CG 4.26Å; Q184-Y186 HydrophobicContact CB-CE2 3.9Å; Q184-Y186 PolarHBondContact OE1-OH 2.69Å; Q184-Y207 HydrophobicContact CB-CD2 3.97Å; Q184-Y207 HydrophobicContact CB-CE2 4.38Å; Q184-Y207 HydrophobicContact CG-CD2 3.95Å; Q184-Y207 HydrophobicContact CG-CE2 3.85Å; Q184-R208 CarbonylContact C-O 3.55Å; Q184-R208 WeakPolarHBondContact CA-O 3.47Å; Q184-Q209 HydrophobicContact CG-CB 4.14Å; Q184-Q209 HydrophobicContact CG-CG 3.89Å
185	Y	97.2	Very high	93.6	Very high	78 Å²	78	43.8 Å²	43.8	31%	0.306	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	115.4	176.4	-62.9	-91.2	0	0	0	109.9	E183 Y207 R208 W221	E183-Y185 HydrophobicContact CG-CE2 3.64Å; E183-Y185 VanDerWaalsContact OE1-CE2 3.25Å; E183-Y185 WeakPolarHBondContact OE1-CE2 3.36Å; E183-Y185 PolarHBondContact OE1-OH 2.87Å; Y185-Y207 CarbonylContact O-C 3.58Å; Y185-Y207 VanDerWaalsContact O-CA 3.22Å; Y185-Y207 WeakPolarHBondContact O-CA 3.37Å; Y185-Y207 VanDerWaalsContact O-CB 3.23Å; Y185-Y207 WeakPolarHBondContact O-CB 3.33Å; Y185-R208 PolarHBondContact N-O 3.09Å; Y185-R208 PolarHBondContact O-N 2.82Å; Y185-W221 AromaticContact CD2-CH2 3.74Å; Y185-W221 HydrophobicContact CD2-CH2 3.74Å; Y185-W221 AromaticContact CD2-CZ3 3.66Å; Y185-W221 HydrophobicContact CD2-CZ3 3.66Å; Y185-W221 AromaticContact CE2-CH2 3.48Å; Y185-W221 HydrophobicContact CE2-CH2 3.48Å; Y185-W221 VanDerWaalsContact CE2-CH2 3.48Å; Y185-W221 AromaticContact CE2-CZ3 3.77Å; Y185-W221 HydrophobicContact CE2-CZ3 3.77Å
186	Y	97.3	Very high	93	Very high	13 Å²	13	47.6 Å²	47.6	5%	0.051	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.8	-174.9	-71.9	-99.2	0	0	0	111.3	T157 S159 V165 G166 I167 Q184 S205 Y207	T157-Y186 HydrophobicContact CG2-CD1 3.72Å; T157-Y186 HydrophobicContact CG2-CG 3.77Å; S159-Y186 PolarHBondContact OG-N 3.28Å; V165-Y186 HydrophobicContact CG1-CE2 4.32Å; G166-Y186 WeakPolarHBondContact CA-OH 3.28Å; I167-Y186 HydrophobicContact CG1-CE1 4.23Å; Q184-Y186 HydrophobicContact CB-CE2 3.9Å; Q184-Y186 PolarHBondContact OE1-OH 2.69Å; Y186-S205 WeakPolarHBondContact CE1-OG 3.11Å; Y186-Y207 HydrophobicContact CD1-CD1 4.17Å; Y186-Y207 HydrophobicContact CD1-CG 4.22Å; Y186-Y207 AromaticContact CE1-CD1 3.67Å; Y186-Y207 HydrophobicContact CE1-CD1 3.67Å; Y186-Y207 HydrophobicContact CE1-CE1 4.34Å; Y186-Y207 AromaticContact CE1-CG 3.95Å; Y186-Y207 HydrophobicContact CE1-CG 3.95Å
187	L	96.8	Very high	92.8	Very high	25 Å²	25	49.4 Å²	49.4	13%	0.131	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	-27.1	-169.6	-62.4	169.7	0	0	0	112.2	K142 F206 L268 V269	K142-L187 WeakPolarHBondContact CE-O 3.18Å; K142-L187 PolarHBondContact NZ-O 2.86Å; L187-F206 PolarHBondContact N-O 2.83Å; L187-L268 HydrophobicContact CD1-CB 3.99Å; L187-L268 HydrophobicContact CD1-CD2 3.82Å; L187-L268 HydrophobicContact CD1-CG 3.56Å; L187-L268 VanDerWaalsContact CD1-O 3.28Å; L187-L268 WeakPolarHBondContact CD1-O 3.17Å; L187-V269 WeakPolarHBondContact CD2-O 3.36Å
188	G	95.4	Very high	92.6	Very high	7 Å²	7	53.7 Å²	53.7	7%	0.072	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.7	176.8	0	0	0	0	0	112.9	S205 F206	G188-S205 CarbonylContact O-C 3.49Å; G188-S205 WeakPolarHBondContact O-CA 3.5Å; G188-F206 PolarHBondContact N-O 3.49Å; G188-F206 PolarHBondContact O-N 2.74Å
189	L	96.5	Very high	92.6	Very high	27 Å²	27	54.5 Å²	54.5	14%	0.141	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	125.2	175.2	-164	69.9	0	0	0	108.8	K142 A144 T157 V203 Y204	K142-L189 HydrophobicContact CB-CB 4.1Å; A144-L189 HydrophobicContact CB-CD2 3.63Å; A144-L189 HydrophobicContact CB-CG 4.14Å; T157-L189 HydrophobicContact CG2-CD1 4.22Å; L189-V203 HydrophobicContact CD1-CG1 3.5Å; L189-V203 VanDerWaalsContact CD1-CG1 3.5Å; L189-V203 HydrophobicContact CD2-CG1 4.48Å; L189-V203 HydrophobicContact CG-CG1 3.85Å; L189-Y204 CarbonylContact C-O 3.45Å; L189-Y204 WeakPolarHBondContact CA-O 3.47Å
190	V	96.6	Very high	92.8	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.018	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.7	-173.5	-178.1	0	0	0	0	109.6	V203 Y204 F206 T273 I302	V190-V203 WeakPolarHBondContact O-CA 3.45Å; V190-Y204 PolarHBondContact N-O 2.73Å; V190-Y204 PolarHBondContact O-N 3.01Å; V190-F206 HydrophobicContact CG2-CD2 4.44Å; V190-F206 HydrophobicContact CG2-CE2 3.88Å; V190-T273 HydrophobicContact CG1-CG2 4.04Å; V190-T273 HydrophobicContact CG2-CG2 3.99Å; V190-T273 VanDerWaalsContact CG2-OG1 3.24Å; V190-T273 WeakPolarHBondContact CG2-OG1 3.25Å; V190-I302 HydrophobicContact CG1-CD1 4.36Å
191	L	95.4	Very high	93	Very high	37 Å²	37	50.7 Å²	50.7	19%	0.194	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124.4	169.9	-57.7	-178.7	0	0	0	109.2	A144 D146 Y155 V203 M230	A144-L191 HydrophobicContact CB-CD1 3.95Å; A144-L191 HydrophobicContact CB-CD2 3.86Å; A144-L191 HydrophobicContact CB-CG 3.75Å; D146-L191 HydrophobicContact CB-CD1 4.24Å; Y155-L191 HydrophobicContact CD2-CD2 4.04Å; Y155-L191 HydrophobicContact CE2-CD2 4.24Å; L191-V203 HydrophobicContact CD2-CB 4.27Å; L191-V203 HydrophobicContact CD2-CG1 4.03Å; L191-V203 HydrophobicContact CD2-CG2 3.52Å; L191-M230 HydrophobicContact CD2-CE 4.37Å
192	S	95.2	Very high	93.4	Very high	5 Å²	5	48 Å²	48	4%	0.035	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	102.8	176.1	-178.3	0	0	0	0	109.1	N201 K202	S192-N201 WeakPolarHBondContact O-CA 3.25Å; S192-K202 PolarHBondContact N-O 2.9Å; S192-K202 PolarHBondContact O-N 2.77Å
193	K	92.4	Very high	93.6	Very high	99 Å²	99	44.7 Å²	44.7	43%	0.43	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-99.2	131	178.3	-64.7	-178.3	177.6	-176.9	0	109.8	D146 N201	D146-K193 WeakPolarHBondContact OD1-CE 3.4Å; D146-K193 IonicContact OD1-NZ 3.28Å; D146-K193 PolarHBondContact OD1-NZ 3.03Å; K193-N201 WeakPolarHBondContact CA-OD1 3.02Å
194	R	89.4	Confident	93.7	Very high	26 Å²	26	42.7 Å²	42.7	10%	0.098	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-101.5	127.6	179.8	-55.7	-172.9	-162.1	-142.3	-22.6	110.5	G196 E197 Q200 N201 W279 E306	R194-G196 PolarHBondContact O-N 2.72Å; R194-E197 HydrophobicContact CB-CB 4.38Å; R194-Q200 PolarHBondContact NE-O 3.41Å; R194-N201 PolarHBondContact N-OD1 3.38Å; R194-W279 HydrophobicContact CG-CD2 4.29Å; R194-W279 HydrophobicContact CG-CG 4.26Å; R194-E306 IonicContact CZ-OE1 3.03Å; R194-E306 IonicContact CZ-OE2 2.74Å; R194-E306 IonicContact NH1-OE1 2.89Å; R194-E306 PolarHBondContact NH1-OE1 3.07Å; R194-E306 IonicContact NH1-OE2 2.69Å; R194-E306 PolarHBondContact NH1-OE2 3.16Å; R194-E306 IonicContact NH2-OE1 3.44Å; R194-E306 PolarHBondContact NH2-OE1 3.4Å; R194-E306 IonicContact NH2-OE2 3.1Å; R194-E306 PolarHBondContact NH2-OE2 3.25Å
195	Q	83.1	Confident	93.8	Very high	170 Å²	170	42.5 Å²	42.5	79%	0.794	23%	0.229	S	C	*	.	S	Bend	trans	-67.5	130.1	166.9	-65.8	179.6	-4.9	0	0	109	E197	Q195-E197 VanDerWaalsContact C-N 3.32Å; Q195-E197 PolarHBondContact O-N 3.44Å
196	G	84.4	Confident	93.9	Very high	80 Å²	80	38.8 Å²	38.8	83%	0.825	22%	0.215	S	C	*	.	S	Bend	trans	85.4	-20.3	178.8	0	0	0	0	0	116.3	R194	R194-G196 PolarHBondContact O-N 2.72Å
197	E	89.6	Confident	93.9	Very high	113 Å²	113	38.1 Å²	38.1	53%	0.528	21%	0.212	S	C	.	.			trans	-134.3	63.7	-178.9	-64.9	-173.1	161.5	0	0	112.8	R194 Q195 L199 Q200	R194-E197 HydrophobicContact CB-CB 4.38Å; Q195-E197 VanDerWaalsContact C-N 3.32Å; Q195-E197 PolarHBondContact O-N 3.44Å; E197-L199 PolarHBondContact O-N 2.99Å; E197-L199 VanDerWaalsContact O-N 3.08Å; E197-Q200 HydrophobicContact CB-CB 4.42Å; E197-Q200 HydrophobicContact CB-CG 4.43Å; E197-Q200 PolarHBondContact O-N 3.36Å
198	P	89	Confident	93.9	Very high	92 Å²	92	39.6 Å²	39.6	60%	0.597	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-61.4	-24.3	-174.6	25.3	-35.1	0	0	0	113.6	Q200 N201	P198-Q200 PolarHBondContact O-N 2.91Å; P198-N201 VanDerWaalsContact O-CB 3.28Å; P198-N201 WeakPolarHBondContact O-CB 3.05Å; P198-N201 PolarHBondContact O-N 3.16Å; P198-N201 PolarHBondContact O-ND2 3.13Å
199	L	92.8	Very high	94	Very high	61 Å²	61	40 Å²	40	32%	0.319	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-61.5	-31.6	174.7	-177.9	62	0	0	0	112.3	E197 N201 A231 C327 L329	E197-L199 PolarHBondContact O-N 2.99Å; E197-L199 VanDerWaalsContact O-N 3.08Å; L199-N201 VanDerWaalsContact C-N 3.27Å; L199-N201 PolarHBondContact O-N 3.44Å; L199-A231 HydrophobicContact CD1-CB 3.87Å; L199-C327 WeakPolarHBondContact O-CB 3Å; L199-L329 HydrophobicContact CD1-CB 4.46Å; L199-L329 HydrophobicContact CD1-CD1 4.41Å
200	Q	93.2	Very high	93.9	Very high	32 Å²	32	42.8 Å²	42.8	15%	0.15	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-90.9	13.9	-179.3	-59.2	-55.2	-42.3	0	0	112.7	R194 E197 P198 K202 C327	R194-Q200 PolarHBondContact NE-O 3.41Å; E197-Q200 HydrophobicContact CB-CB 4.42Å; E197-Q200 HydrophobicContact CB-CG 4.43Å; E197-Q200 PolarHBondContact O-N 3.36Å; P198-Q200 PolarHBondContact O-N 2.91Å; Q200-K202 PolarHBondContact O-N 2.89Å; Q200-C327 PolarHBondContact NE2-O 3.03Å; Q200-C327 VanDerWaalsContact NE2-O 3.09Å; Q200-C327 VanDerWaalsContact OE1-N 3.08Å
201	N	95.1	Very high	93.8	Very high	22 Å²	22	44.5 Å²	44.5	12%	0.118	24%	0.236	C	C	.	.			trans	-63.7	134.9	171.5	-68.9	-8.8	0	0	0	110.2	S192 K193 R194 P198 L199 M230	S192-N201 WeakPolarHBondContact O-CA 3.25Å; K193-N201 WeakPolarHBondContact CA-OD1 3.02Å; R194-N201 PolarHBondContact N-OD1 3.38Å; P198-N201 VanDerWaalsContact O-CB 3.28Å; P198-N201 WeakPolarHBondContact O-CB 3.05Å; P198-N201 PolarHBondContact O-N 3.16Å; P198-N201 PolarHBondContact O-ND2 3.13Å; L199-N201 VanDerWaalsContact C-N 3.27Å; L199-N201 PolarHBondContact O-N 3.44Å; N201-M230 HydrophobicContact CB-CB 4.14Å; N201-M230 HydrophobicContact CB-CG 4.16Å; N201-M230 HydrophobicContact CB-SD 3.61Å; N201-M230 PolarHBondContact O-N 3.1Å
202	K	96.5	Very high	93.5	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.009	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	154.3	-172.7	-72.4	173.8	-178.9	-177.4	0	111.3	S192 Q200 Y204 V228 E306	S192-K202 PolarHBondContact N-O 2.9Å; S192-K202 PolarHBondContact O-N 2.77Å; Q200-K202 PolarHBondContact O-N 2.89Å; K202-Y204 HydrophobicContact CB-CD2 4.44Å; K202-Y204 HydrophobicContact CB-CE2 3.82Å; K202-Y204 WeakPolarHBondContact CD-OH 3.38Å; K202-V228 CarbonylContact C-O 3.56Å; K202-V228 VanDerWaalsContact CA-O 3.25Å; K202-V228 WeakPolarHBondContact CA-O 3.32Å; K202-E306 IonicContact NZ-OE1 2.89Å; K202-E306 PolarHBondContact NZ-OE1 2.94Å
203	V	97.6	Very high	93.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	127	166	-173.6	0	0	0	0	108	Y155 L189 V190 L191 Q227 V228 M230	Y155-V203 HydrophobicContact CD1-CG2 3.8Å; Y155-V203 HydrophobicContact CD2-CG2 4.43Å; Y155-V203 HydrophobicContact CE1-CG2 3.57Å; Y155-V203 HydrophobicContact CE2-CG2 4.25Å; Y155-V203 HydrophobicContact CG-CG2 4.23Å; L189-V203 HydrophobicContact CD1-CG1 3.5Å; L189-V203 VanDerWaalsContact CD1-CG1 3.5Å; L189-V203 HydrophobicContact CD2-CG1 4.48Å; L189-V203 HydrophobicContact CG-CG1 3.85Å; V190-V203 WeakPolarHBondContact O-CA 3.45Å; L191-V203 HydrophobicContact CD2-CB 4.27Å; L191-V203 HydrophobicContact CD2-CG1 4.03Å; L191-V203 HydrophobicContact CD2-CG2 3.52Å; V203-Q227 CarbonylContact O-C 3.41Å; V203-Q227 VanDerWaalsContact O-CA 3.32Å; V203-Q227 WeakPolarHBondContact O-CA 3.39Å; V203-V228 HydrophobicContact CB-CG2 3.73Å; V203-V228 HydrophobicContact CG2-CG2 4.3Å; V203-V228 PolarHBondContact N-O 3.2Å; V203-V228 PolarHBondContact O-N 2.63Å; V203-M230 HydrophobicContact CG2-CG 3.59Å; V203-M230 HydrophobicContact CG2-SD 4.27Å
204	Y	98.3	Very high	92.7	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.6	173.9	-64.3	-88.7	0	0	0	109.7	L189 V190 K202 V225 S226 Q227 I302 I305 F309	L189-Y204 CarbonylContact C-O 3.45Å; L189-Y204 WeakPolarHBondContact CA-O 3.47Å; V190-Y204 PolarHBondContact N-O 2.73Å; V190-Y204 PolarHBondContact O-N 3.01Å; K202-Y204 HydrophobicContact CB-CD2 4.44Å; K202-Y204 HydrophobicContact CB-CE2 3.82Å; K202-Y204 WeakPolarHBondContact CD-OH 3.38Å; Y204-V225 HydrophobicContact CD1-CG2 4.25Å; Y204-S226 CarbonylContact C-O 3.59Å; Y204-S226 VanDerWaalsContact CA-O 3.24Å; Y204-S226 WeakPolarHBondContact CA-O 3.23Å; Y204-Q227 HydrophobicContact CD1-CB 3.83Å; Y204-Q227 HydrophobicContact CE1-CB 3.71Å; Y204-I302 HydrophobicContact CD2-CD1 4.02Å; Y204-I302 HydrophobicContact CD2-CG2 4.17Å; Y204-I302 HydrophobicContact CE2-CD1 4.43Å; Y204-I302 HydrophobicContact CE2-CG2 3.54Å; Y204-I302 HydrophobicContact CG-CD1 4.21Å; Y204-I305 HydrophobicContact CD1-CG2 3.88Å; Y204-I305 HydrophobicContact CE1-CG2 3.68Å; Y204-F309 HydrophobicContact CD1-CE2 4.47Å; Y204-F309 HydrophobicContact CE1-CD2 4.3Å; Y204-F309 HydrophobicContact CE1-CE2 4.23Å
205	S	98.1	Very high	92.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.2	176.7	69	0	0	0	0	110.8	I167 Y186 G188 V225 S226	I167-S205 WeakPolarHBondContact CD1-OG 3.39Å; Y186-S205 WeakPolarHBondContact CE1-OG 3.11Å; G188-S205 CarbonylContact O-C 3.49Å; G188-S205 WeakPolarHBondContact O-CA 3.5Å; S205-V225 CarbonylContact O-C 3.56Å; S205-V225 WeakPolarHBondContact O-CA 3.14Å; S205-S226 PolarHBondContact N-O 3.09Å; S205-S226 PolarHBondContact O-N 2.91Å; S205-S226 WeakPolarHBondContact OG-CB 3.27Å
206	F	98.6	Very high	92.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.4	179.9	-60.9	-92.7	0	0	0	109.1	L187 G188 V190 F224 V225 L252 L268 V271 V284 I305	L187-F206 PolarHBondContact N-O 2.83Å; G188-F206 PolarHBondContact N-O 3.49Å; G188-F206 PolarHBondContact O-N 2.74Å; V190-F206 HydrophobicContact CG2-CD2 4.44Å; V190-F206 HydrophobicContact CG2-CE2 3.88Å; F206-F224 WeakPolarHBondContact CA-O 3.38Å; F206-V225 HydrophobicContact CD1-CB 3.98Å; F206-V225 HydrophobicContact CD1-CG2 3.98Å; F206-V225 HydrophobicContact CE1-CB 3.87Å; F206-V225 HydrophobicContact CE1-CG2 3.57Å; F206-V225 HydrophobicContact CE2-CG2 4.45Å; F206-V225 HydrophobicContact CZ-CG2 3.82Å; F206-L252 HydrophobicContact CD1-CD1 4.05Å; F206-L268 HydrophobicContact CB-CD2 4.18Å; F206-V271 HydrophobicContact CB-CG2 3.86Å; F206-V271 HydrophobicContact CD2-CG1 4.36Å; F206-V271 HydrophobicContact CG-CG1 4.35Å; F206-V271 HydrophobicContact CG-CG2 4.29Å; F206-V284 HydrophobicContact CD1-CG1 4.27Å; F206-V284 HydrophobicContact CD2-CG1 4.48Å; F206-V284 HydrophobicContact CE1-CB 4.49Å; F206-V284 HydrophobicContact CE1-CG1 3.82Å; F206-V284 HydrophobicContact CE2-CG1 4.05Å; F206-V284 HydrophobicContact CE2-CG2 4.19Å; F206-V284 HydrophobicContact CZ-CB 4.18Å; F206-V284 HydrophobicContact CZ-CG1 3.71Å; F206-V284 HydrophobicContact CZ-CG2 3.79Å; F206-I305 HydrophobicContact CE1-CD1 3.97Å; F206-I305 HydrophobicContact CZ-CD1 3.87Å
207	Y	98.2	Very high	91.9	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	160.2	-173.7	66.4	-86	0	0	0	111.8	Q184 Y185 Y186 Q209 F224 S226 N249	Q184-Y207 HydrophobicContact CB-CD2 3.97Å; Q184-Y207 HydrophobicContact CB-CE2 4.38Å; Q184-Y207 HydrophobicContact CG-CD2 3.95Å; Q184-Y207 HydrophobicContact CG-CE2 3.85Å; Y185-Y207 CarbonylContact O-C 3.58Å; Y185-Y207 VanDerWaalsContact O-CA 3.22Å; Y185-Y207 WeakPolarHBondContact O-CA 3.37Å; Y185-Y207 VanDerWaalsContact O-CB 3.23Å; Y185-Y207 WeakPolarHBondContact O-CB 3.33Å; Y186-Y207 HydrophobicContact CD1-CD1 4.17Å; Y186-Y207 HydrophobicContact CD1-CG 4.22Å; Y186-Y207 AromaticContact CE1-CD1 3.67Å; Y186-Y207 HydrophobicContact CE1-CD1 3.67Å; Y186-Y207 HydrophobicContact CE1-CE1 4.34Å; Y186-Y207 AromaticContact CE1-CG 3.95Å; Y186-Y207 HydrophobicContact CE1-CG 3.95Å; Y207-Q209 HydrophobicContact CD2-CB 4.44Å; Y207-Q209 HydrophobicContact CE2-CB 4.19Å; Y207-F224 HydrophobicContact CD1-CB 4.06Å; Y207-F224 HydrophobicContact CD2-CB 4.05Å; Y207-F224 HydrophobicContact CE1-CB 3.54Å; Y207-F224 HydrophobicContact CE2-CB 3.53Å; Y207-F224 AromaticContact CE2-CD2 3.98Å; Y207-F224 HydrophobicContact CE2-CD2 3.98Å; Y207-F224 AromaticContact CE2-CG 3.91Å; Y207-F224 HydrophobicContact CE2-CG 3.91Å; Y207-F224 HydrophobicContact CG-CB 4.28Å; Y207-F224 AromaticContact CZ-CG 3.82Å; Y207-F224 PolarHBondContact N-O 3.44Å; Y207-F224 PolarHBondContact O-N 2.97Å; Y207-F224 WeakPolarHBondContact OH-CB 3.48Å; Y207-S226 WeakPolarHBondContact CE1-OG 3.39Å; Y207-N249 PolarHBondContact OH-ND2 3.3Å
208	R	97.4	Very high	91.5	Very high	55 Å²	55	50.8 Å²	50.8	21%	0.208	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	142.9	165.8	63.8	-179.1	178.7	-169.6	10.4	110	Q184 Y185 W221 L222 E267 L268	Q184-R208 CarbonylContact C-O 3.55Å; Q184-R208 WeakPolarHBondContact CA-O 3.47Å; Y185-R208 PolarHBondContact N-O 3.09Å; Y185-R208 PolarHBondContact O-N 2.82Å; R208-W221 HydrophobicContact CB-CE3 4.23Å; R208-W221 HydrophobicContact CG-CD2 4.47Å; R208-W221 HydrophobicContact CG-CE3 3.93Å; R208-W221 HydrophobicContact CG-CZ3 4.32Å; R208-L222 CarbonylContact C-O 3.49Å; R208-L222 WeakPolarHBondContact CA-O 3.43Å; R208-E267 IonicContact CZ-OE1 3.56Å; R208-E267 IonicContact NH1-OE1 2.95Å; R208-E267 PolarHBondContact NH1-OE1 2.96Å; R208-L268 HydrophobicContact CB-CB 4.45Å; R208-L268 WeakPolarHBondContact CD-O 3.48Å
209	Q	96.6	Very high	91.3	Very high	15 Å²	15	48.1 Å²	48.1	7%	0.07	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.7	177.1	-175.1	177.8	-84.8	0	0	109.5	K182 E183 Q184 Y207 N211 L222 F224	K182-Q209 HydrophobicContact CB-CG 4.32Å; E183-Q209 WeakPolarHBondContact O-CA 3.32Å; E183-Q209 WeakPolarHBondContact O-CG 3.46Å; Q184-Q209 HydrophobicContact CG-CB 4.14Å; Q184-Q209 HydrophobicContact CG-CG 3.89Å; Y207-Q209 HydrophobicContact CD2-CB 4.44Å; Y207-Q209 HydrophobicContact CE2-CB 4.19Å; Q209-N211 PolarHBondContact O-N 3.38Å; Q209-L222 PolarHBondContact N-O 2.83Å; Q209-L222 PolarHBondContact O-N 3.38Å; Q209-F224 HydrophobicContact CB-CD2 3.88Å; Q209-F224 HydrophobicContact CB-CE2 3.87Å
210	K	95	Very high	91.1	Very high	87 Å²	87	50.4 Å²	50.4	38%	0.378	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	128.6	173.5	-167.2	172.3	-178.6	174.8	0	109.6	E183 W221	E183-K210 HydrophobicContact CB-CB 3.99Å; E183-K210 HydrophobicContact CB-CD 4.46Å; E183-K210 HydrophobicContact CG-CB 4.36Å; E183-K210 PolarHBondContact O-N 2.95Å; E183-K210 WeakPolarHBondContact OE2-CD 3.47Å; E183-K210 IonicContact OE2-NZ 2.79Å; E183-K210 PolarHBondContact OE2-NZ 3.17Å; K210-W221 HydrophobicContact CB-CE3 4.21Å; K210-W221 HydrophobicContact CB-CH2 4.26Å; K210-W221 HydrophobicContact CB-CZ3 3.72Å; K210-W221 HydrophobicContact CG-CZ3 4.39Å
211	N	93.4	Very high	91.1	Very high	39 Å²	39	50.1 Å²	50.1	21%	0.209	28%	0.284	C	S	.	.			trans	-71.2	138.4	176.1	-163.8	0.2	0	0	0	110	Q209 D213 N219 M220 L222	Q209-N211 PolarHBondContact O-N 3.38Å; N211-D213 WeakPolarHBondContact OD1-CB 3.44Å; N211-D213 PolarHBondContact OD1-N 3.22Å; N211-D213 VanDerWaalsContact OD1-N 3.08Å; N211-N219 WeakPolarHBondContact CB-O 3.31Å; N211-N219 PolarHBondContact ND2-O 2.67Å; N211-M220 WeakPolarHBondContact CB-O 3.3Å; N211-M220 PolarHBondContact N-O 2.94Å; N211-L222 HydrophobicContact CB-CD1 4.17Å; N211-L222 HydrophobicContact CB-CG 4.08Å
212	K	88.8	Confident	91.1	Very high	150 Å²	150	49.8 Å²	49.8	65%	0.652	28%	0.282	S	S	*	.			trans	-89.1	-19.7	174.3	-68.3	-170.9	178	-173.9	0	112.1	G181 T214	G181-K212 WeakPolarHBondContact O-CE 3.35Å; G181-K212 PolarHBondContact O-NZ 2.81Å; K212-T214 PolarHBondContact O-N 2.92Å
213	D	87.9	Confident	91.2	Very high	84 Å²	84	49.8 Å²	49.8	45%	0.449	28%	0.283	S	S	.	.			trans	-66.6	124.1	173	-172	1.1	0	0	0	109	N211 S215 S218	N211-D213 WeakPolarHBondContact OD1-CB 3.44Å; N211-D213 PolarHBondContact OD1-N 3.22Å; N211-D213 VanDerWaalsContact OD1-N 3.08Å; D213-S215 WeakPolarHBondContact OD1-CB 3.09Å; D213-S215 PolarHBondContact OD1-N 3.07Å; D213-S215 PolarHBondContact OD1-OG 2.81Å; D213-S215 PolarHBondContact OD2-OG 3.29Å; D213-S215 VanDerWaalsContact OD2-OG 3.06Å; D213-S218 PolarHBondContact O-OG 3.12Å; D213-S218 VanDerWaalsContact O-OG 3.05Å
214	T	82.8	Confident	91.2	Very high	136 Å²	136	49.9 Å²	49.9	83%	0.834	28%	0.283	S	S	*	.			trans	-111.3	12.1	177.9	61.6	0	0	0	0	111.4	K212	K212-T214 PolarHBondContact O-N 2.92Å
215	S	86.3	Confident	91.2	Very high	53 Å²	53	49.9 Å²	49.9	37%	0.371	28%	0.283	S	S	.	.	S	Bend	trans	-63.8	148.8	177	63.4	0	0	0	0	111	D213 G217 S218	D213-S215 WeakPolarHBondContact OD1-CB 3.09Å; D213-S215 PolarHBondContact OD1-N 3.07Å; D213-S215 PolarHBondContact OD1-OG 2.81Å; D213-S215 PolarHBondContact OD2-OG 3.29Å; D213-S215 VanDerWaalsContact OD2-OG 3.06Å; S215-G217 PolarHBondContact O-N 3.08Å; S215-S218 PolarHBondContact N-OG 2.6Å; S215-S218 WeakPolarHBondContact O-CB 3.39Å; S215-S218 PolarHBondContact O-N 3.32Å; S215-S218 PolarHBondContact O-OG 3.24Å
216	P	78.5	Confident	91.2	Very high	136 Å²	136	49.9 Å²	49.9	88%	0.883	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	126.9	176.5	-23.8	33.9	0	0	0	111.4
217	G	75.6	Confident	91.1	Very high	74 Å²	74	49.9 Å²	49.9	76%	0.763	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	4.1	-177.7	0	0	0	0	0	114.9	S215	S215-G217 PolarHBondContact O-N 3.08Å
218	S	81.1	Confident	91	Very high	28 Å²	28	49.9 Å²	49.9	20%	0.196	28%	0.283	C	S	.	.			trans	-76	134.6	169.8	62.7	0	0	0	0	111.3	D213 S215 M220	D213-S218 PolarHBondContact O-OG 3.12Å; D213-S218 VanDerWaalsContact O-OG 3.05Å; S215-S218 PolarHBondContact N-OG 2.6Å; S215-S218 WeakPolarHBondContact O-CB 3.39Å; S215-S218 PolarHBondContact O-N 3.32Å; S215-S218 PolarHBondContact O-OG 3.24Å; S218-M220 PolarHBondContact O-N 2.72Å
219	N	85.6	Confident	91	Very high	36 Å²	36	47.5 Å²	47.5	19%	0.193	28%	0.275	C	S	.	.			trans	-66.5	133.8	178.2	-63.2	-30.1	0	0	0	110.5	N211 W221 F266	N211-N219 WeakPolarHBondContact CB-O 3.31Å; N211-N219 PolarHBondContact ND2-O 2.67Å; N219-W221 VanDerWaalsContact C-N 3.34Å; N219-W221 PolarHBondContact O-N 3.14Å; N219-F266 HydrophobicContact CB-CB 4Å; N219-F266 HydrophobicContact CB-CD1 4.19Å; N219-F266 HydrophobicContact CB-CD2 3.78Å; N219-F266 HydrophobicContact CB-CE2 4.37Å; N219-F266 HydrophobicContact CB-CG 3.69Å; N219-F266 WeakPolarHBondContact OD1-CD1 3.22Å
220	M	88.3	Confident	90.9	Very high	109 Å²	109	47 Å²	47	54%	0.537	27%	0.273	S	S	.	.	S	Bend	trans	-64.5	-37.1	177.5	-179.3	-178	178.5	0	0	113.1	N211 S218	N211-M220 WeakPolarHBondContact CB-O 3.3Å; N211-M220 PolarHBondContact N-O 2.94Å; S218-M220 PolarHBondContact O-N 2.72Å
221	W	93.9	Very high	90.9	Very high	26 Å²	26	44.4 Å²	44.4	10%	0.098	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	144.3	-178.2	-63.9	106.9	0	0	0	110.6	Y185 R208 K210 N219 F266 E267	Y185-W221 AromaticContact CD2-CH2 3.74Å; Y185-W221 HydrophobicContact CD2-CH2 3.74Å; Y185-W221 AromaticContact CD2-CZ3 3.66Å; Y185-W221 HydrophobicContact CD2-CZ3 3.66Å; Y185-W221 AromaticContact CE2-CH2 3.48Å; Y185-W221 HydrophobicContact CE2-CH2 3.48Å; Y185-W221 VanDerWaalsContact CE2-CH2 3.48Å; Y185-W221 AromaticContact CE2-CZ3 3.77Å; Y185-W221 HydrophobicContact CE2-CZ3 3.77Å; R208-W221 HydrophobicContact CB-CE3 4.23Å; R208-W221 HydrophobicContact CG-CD2 4.47Å; R208-W221 HydrophobicContact CG-CE3 3.93Å; R208-W221 HydrophobicContact CG-CZ3 4.32Å; K210-W221 HydrophobicContact CB-CE3 4.21Å; K210-W221 HydrophobicContact CB-CH2 4.26Å; K210-W221 HydrophobicContact CB-CZ3 3.72Å; K210-W221 HydrophobicContact CG-CZ3 4.39Å; N219-W221 VanDerWaalsContact C-N 3.34Å; N219-W221 PolarHBondContact O-N 3.14Å; W221-F266 HydrophobicContact CB-CD2 4.39Å; W221-F266 WeakPolarHBondContact O-CD2 3.45Å; W221-E267 HydrophobicContact CB-CB 4.31Å; W221-E267 HydrophobicContact CB-CG 4.29Å; W221-E267 HydrophobicContact CG-CG 4.2Å
222	L	95.3	Very high	91	Very high	15 Å²	15	42.8 Å²	42.8	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.1	174.6	-63.2	176.8	0	0	0	109	R208 Q209 N211 F224	R208-L222 CarbonylContact C-O 3.49Å; R208-L222 WeakPolarHBondContact CA-O 3.43Å; Q209-L222 PolarHBondContact N-O 2.83Å; Q209-L222 PolarHBondContact O-N 3.38Å; N211-L222 HydrophobicContact CB-CD1 4.17Å; N211-L222 HydrophobicContact CB-CG 4.08Å; L222-F224 HydrophobicContact CB-CD2 4.21Å; L222-F224 HydrophobicContact CB-CE2 3.54Å; L222-F224 HydrophobicContact CB-CZ 4.39Å; L222-F224 HydrophobicContact CD1-CE2 4.37Å; L222-F224 WeakPolarHBondContact O-CD2 3.37Å
223	P	97.4	Very high	91.3	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.019	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.5	-176.7	37.2	-32.4	0	0	0	111	R251 L252 F266 L268 F288	P223-R251 WeakPolarHBondContact O-CA 3.37Å; P223-L252 HydrophobicContact CB-CB 4.16Å; P223-L252 HydrophobicContact CG-CB 4.18Å; P223-L252 VanDerWaalsContact CG-O 3.29Å; P223-L252 WeakPolarHBondContact CG-O 3.18Å; P223-L252 PolarHBondContact O-N 3.26Å; P223-F266 WeakPolarHBondContact CD-O 3.23Å; P223-L268 HydrophobicContact CB-CB 3.87Å; P223-F288 HydrophobicContact CB-CD1 4.4Å; P223-F288 HydrophobicContact CB-CE1 3.68Å; P223-F288 HydrophobicContact CG-CE1 3.91Å
224	F	98.1	Very high	91.7	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	151.9	-174.8	-75.4	-89.4	0	0	0	112.4	F206 Y207 Q209 L222 N249 A250 R251 E347	F206-F224 WeakPolarHBondContact CA-O 3.38Å; Y207-F224 HydrophobicContact CD1-CB 4.06Å; Y207-F224 HydrophobicContact CD2-CB 4.05Å; Y207-F224 HydrophobicContact CE1-CB 3.54Å; Y207-F224 HydrophobicContact CE2-CB 3.53Å; Y207-F224 AromaticContact CE2-CD2 3.98Å; Y207-F224 HydrophobicContact CE2-CD2 3.98Å; Y207-F224 AromaticContact CE2-CG 3.91Å; Y207-F224 HydrophobicContact CE2-CG 3.91Å; Y207-F224 HydrophobicContact CG-CB 4.28Å; Y207-F224 AromaticContact CZ-CG 3.82Å; Y207-F224 PolarHBondContact N-O 3.44Å; Y207-F224 PolarHBondContact O-N 2.97Å; Y207-F224 WeakPolarHBondContact OH-CB 3.48Å; Q209-F224 HydrophobicContact CB-CD2 3.88Å; Q209-F224 HydrophobicContact CB-CE2 3.87Å; L222-F224 HydrophobicContact CB-CD2 4.21Å; L222-F224 HydrophobicContact CB-CE2 3.54Å; L222-F224 HydrophobicContact CB-CZ 4.39Å; L222-F224 HydrophobicContact CD1-CE2 4.37Å; L222-F224 WeakPolarHBondContact O-CD2 3.37Å; F224-N249 HydrophobicContact CD1-CB 4.4Å; F224-A250 WeakPolarHBondContact CA-O 3.47Å; F224-A250 WeakPolarHBondContact CD1-O 3.44Å; F224-R251 HydrophobicContact CD1-CG 4.06Å; F224-R251 HydrophobicContact CE1-CG 3.47Å; F224-R251 VanDerWaalsContact CE1-CG 3.47Å; F224-R251 HydrophobicContact CZ-CG 3.76Å; F224-E347 HydrophobicContact CE1-CG 4.18Å
225	V	98.6	Very high	92.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	136.7	159	59.4	0	0	0	0	108.4	Y204 S205 F206 N249 A250 L252 I305 F309 V352	Y204-V225 HydrophobicContact CD1-CG2 4.25Å; S205-V225 CarbonylContact O-C 3.56Å; S205-V225 WeakPolarHBondContact O-CA 3.14Å; F206-V225 HydrophobicContact CD1-CB 3.98Å; F206-V225 HydrophobicContact CD1-CG2 3.98Å; F206-V225 HydrophobicContact CE1-CB 3.87Å; F206-V225 HydrophobicContact CE1-CG2 3.57Å; F206-V225 HydrophobicContact CE2-CG2 4.45Å; F206-V225 HydrophobicContact CZ-CG2 3.82Å; V225-N249 CarbonylContact O-C 3.58Å; V225-N249 WeakPolarHBondContact O-CA 3.49Å; V225-A250 HydrophobicContact CG1-CB 4.28Å; V225-A250 PolarHBondContact N-O 2.91Å; V225-A250 PolarHBondContact O-N 3.41Å; V225-L252 HydrophobicContact CB-CD1 4.43Å; V225-L252 HydrophobicContact CB-CD2 4.35Å; V225-L252 HydrophobicContact CB-CG 4.42Å; V225-L252 HydrophobicContact CG1-CD2 4.08Å; V225-L252 HydrophobicContact CG1-CG 4.34Å; V225-I305 HydrophobicContact CG1-CG2 4.13Å; V225-I305 HydrophobicContact CG2-CG2 4.12Å; V225-F309 HydrophobicContact CG1-CE2 4.29Å; V225-F309 HydrophobicContact CG1-CZ 4.26Å; V225-V352 HydrophobicContact CG1-CG2 3.93Å
226	S	97.6	Very high	92.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	152.2	169.4	-84	0	0	0	0	110.9	Y204 S205 Y207 M248 N249	Y204-S226 CarbonylContact C-O 3.59Å; Y204-S226 VanDerWaalsContact CA-O 3.24Å; Y204-S226 WeakPolarHBondContact CA-O 3.23Å; S205-S226 PolarHBondContact N-O 3.09Å; S205-S226 PolarHBondContact O-N 2.91Å; S205-S226 WeakPolarHBondContact OG-CB 3.27Å; Y207-S226 WeakPolarHBondContact CE1-OG 3.39Å; S226-M248 CarbonylContact C-O 3.5Å; S226-M248 WeakPolarHBondContact CA-O 3.27Å; S226-M248 WeakPolarHBondContact CB-O 3.4Å; S226-M248 PolarHBondContact OG-O 2.94Å; S226-N249 WeakPolarHBondContact OG-CB 3.45Å; S226-N249 PolarHBondContact OG-ND2 2.71Å; S226-N249 PolarHBondContact OG-OD1 2.98Å
227	Q	96.4	Very high	93.2	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.9	168.4	63.1	152.4	72.8	0	0	111.3	V203 Y204 L247 M248 F309	V203-Q227 CarbonylContact O-C 3.41Å; V203-Q227 VanDerWaalsContact O-CA 3.32Å; V203-Q227 WeakPolarHBondContact O-CA 3.39Å; Y204-Q227 HydrophobicContact CD1-CB 3.83Å; Y204-Q227 HydrophobicContact CE1-CB 3.71Å; Q227-L247 WeakPolarHBondContact O-CA 3.16Å; Q227-M248 HydrophobicContact CG-CB 4.19Å; Q227-M248 HydrophobicContact CG-CE 4.04Å; Q227-M248 PolarHBondContact N-O 2.98Å; Q227-M248 PolarHBondContact O-N 2.81Å; Q227-M248 VanDerWaalsContact O-N 3.09Å; Q227-F309 HydrophobicContact CB-CD2 4.3Å; Q227-F309 HydrophobicContact CB-CE2 4.05Å; Q227-F309 HydrophobicContact CB-CZ 4.35Å; Q227-F309 HydrophobicContact CG-CD1 3.9Å; Q227-F309 HydrophobicContact CG-CD2 3.74Å; Q227-F309 HydrophobicContact CG-CE1 3.97Å; Q227-F309 HydrophobicContact CG-CE2 3.78Å; Q227-F309 HydrophobicContact CG-CG 3.8Å; Q227-F309 HydrophobicContact CG-CZ 3.91Å; Q227-F309 VanDerWaalsContact OE1-CB 3.32Å; Q227-F309 VanDerWaalsContact OE1-CD2 3.3Å
228	V	96.9	Very high	93.8	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.4	166.7	-65.5	0	0	0	0	109.9	I167 K202 V203 W244 L247	I167-V228 HydrophobicContact CD1-CG1 4.2Å; I167-V228 HydrophobicContact CD1-CG2 4.07Å; K202-V228 CarbonylContact C-O 3.56Å; K202-V228 VanDerWaalsContact CA-O 3.25Å; K202-V228 WeakPolarHBondContact CA-O 3.32Å; V203-V228 HydrophobicContact CB-CG2 3.73Å; V203-V228 HydrophobicContact CG2-CG2 4.3Å; V203-V228 PolarHBondContact N-O 3.2Å; V203-V228 PolarHBondContact O-N 2.63Å; V228-W244 HydrophobicContact CB-CD2 4.18Å; V228-W244 HydrophobicContact CB-CE3 3.84Å; V228-W244 HydrophobicContact CB-CH2 4.4Å; V228-W244 HydrophobicContact CB-CZ3 3.96Å; V228-W244 HydrophobicContact CG1-CD2 3.83Å; V228-W244 HydrophobicContact CG1-CE3 3.98Å; V228-W244 HydrophobicContact CG1-CG 4.09Å; V228-W244 HydrophobicContact CG2-CE3 4.38Å; V228-W244 HydrophobicContact CG2-CH2 4.06Å; V228-W244 HydrophobicContact CG2-CZ2 4.31Å; V228-W244 HydrophobicContact CG2-CZ3 4.09Å; V228-L247 HydrophobicContact CG1-CB 4.01Å; V228-L247 HydrophobicContact CG1-CD1 3.51Å; V228-L247 HydrophobicContact CG1-CG 4.38Å
229	C	96.4	Very high	94.3	Very high	4 Å²	4	35.2 Å²	35.2	3%	0.027	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	132.3	175	-68.3	0	0	0	0	110.5	A231 D232 S246 C327	C229-A231 PolarHBondContact O-N 2.83Å; C229-D232 HydrophobicContact CB-CB 4.25Å; C229-D232 VanDerWaalsContact O-CB 3.29Å; C229-D232 WeakPolarHBondContact O-CB 3.4Å; C229-D232 PolarHBondContact O-N 2.82Å; C229-D232 VanDerWaalsContact O-N 3.14Å; C229-S246 PolarHBondContact N-OG 3.46Å; C229-C327 HydrophobicContact CB-CB 3.68Å; C229-C327 WeakPolarHBondContact CB-SG 3.5Å; C229-C327 WeakPolarHBondContact SG-CA 3.38Å; C229-C327 WeakPolarHBondContact SG-CB 3.37Å; C229-C327 CovalentContact SG-SG 2.03Å; C229-C327 PolarHBondContact SG-SG 3.39Å
230	M	95.5	Very high	94.7	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.03	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.6	179.5	-68.6	-178.8	70.3	0	0	112.5	D146 Y155 K169 L191 N201 V203 D232	D146-M230 HydrophobicContact CB-CE 3.59Å; D146-M230 WeakPolarHBondContact OD2-CE 3.34Å; Y155-M230 HydrophobicContact CE2-CE 4.03Å; Y155-M230 WeakPolarHBondContact OH-CB 3.3Å; K169-M230 PolarHBondContact NZ-O 3.18Å; L191-M230 HydrophobicContact CD2-CE 4.37Å; N201-M230 HydrophobicContact CB-CB 4.14Å; N201-M230 HydrophobicContact CB-CG 4.16Å; N201-M230 HydrophobicContact CB-SD 3.61Å; N201-M230 PolarHBondContact O-N 3.1Å; V203-M230 HydrophobicContact CG2-CG 3.59Å; V203-M230 HydrophobicContact CG2-SD 4.27Å; M230-D232 VanDerWaalsContact C-N 3.31Å
231	A	94.4	Very high	95	Very high	32 Å²	32	32.8 Å²	32.8	26%	0.264	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-8.6	177.3	0	0	0	0	0	114.3	L199 C229 V233	L199-A231 HydrophobicContact CD1-CB 3.87Å; C229-A231 PolarHBondContact O-N 2.83Å; A231-V233 WeakPolarHBondContact O-CG1 3.05Å; A231-V233 PolarHBondContact O-N 2.88Å
232	D	95.8	Very high	95	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	18%	0.178	C	C	.	.			trans	-65	134.1	179.2	-168.8	-10.7	0	0	0	110.3	V175 C229 M230 G234 W244 T245 S246 S331	V175-D232 WeakPolarHBondContact CG2-O 3.37Å; C229-D232 HydrophobicContact CB-CB 4.25Å; C229-D232 VanDerWaalsContact O-CB 3.29Å; C229-D232 WeakPolarHBondContact O-CB 3.4Å; C229-D232 PolarHBondContact O-N 2.82Å; C229-D232 VanDerWaalsContact O-N 3.14Å; M230-D232 VanDerWaalsContact C-N 3.31Å; D232-G234 WeakPolarHBondContact OD1-CA 3.43Å; D232-G234 PolarHBondContact OD1-N 2.81Å; D232-W244 HydrophobicContact CB-CE3 3.93Å; D232-W244 HydrophobicContact CB-CZ3 3.89Å; D232-T245 VanDerWaalsContact CG-OG1 3.22Å; D232-T245 PolarHBondContact OD1-OG1 2.9Å; D232-T245 PolarHBondContact OD2-N 2.78Å; D232-T245 PolarHBondContact OD2-OG1 2.91Å; D232-T245 VanDerWaalsContact OD2-OG1 3.05Å; D232-S246 WeakPolarHBondContact CB-OG 3.32Å; D232-S246 VanDerWaalsContact OD2-CB 3.31Å; D232-S246 WeakPolarHBondContact OD2-CB 3.3Å; D232-S246 PolarHBondContact OD2-N 2.83Å; D232-S246 PolarHBondContact OD2-OG 2.99Å; D232-S331 WeakPolarHBondContact OD1-CB 3Å; D232-S331 PolarHBondContact OD1-OG 2.98Å; D232-S331 VanDerWaalsContact OD1-OG 3.12Å
233	V	95.1	Very high	95	Very high	37 Å²	37	36 Å²	36	22%	0.224	18%	0.176	C	C	.	.			trans	-121	6.8	-179.2	-57.8	0	0	0	0	111.9	K173 A231 S331 T332	K173-V233 HydrophobicContact CB-CB 4.41Å; K173-V233 HydrophobicContact CB-CG1 4.23Å; K173-V233 HydrophobicContact CG-CB 4.14Å; K173-V233 HydrophobicContact CG-CG1 3.73Å; A231-V233 WeakPolarHBondContact O-CG1 3.05Å; A231-V233 PolarHBondContact O-N 2.88Å; V233-S331 WeakPolarHBondContact CG2-OG 3.46Å; V233-S331 PolarHBondContact N-OG 2.53Å; V233-T332 HydrophobicContact CG2-CG2 3.85Å
234	G	95.4	Very high	94.9	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.176	C	C	.	.			trans	86.9	178.4	-174.4	0	0	0	0	0	114.2	D232 S243 S331 T332	D232-G234 WeakPolarHBondContact OD1-CA 3.43Å; D232-G234 PolarHBondContact OD1-N 2.81Å; G234-S243 WeakPolarHBondContact CA-O 3.46Å; G234-S331 PolarHBondContact N-OG 2.85Å; G234-S331 CarbonylContact O-C 3.56Å; G234-S331 VanDerWaalsContact O-C 3.3Å; G234-S331 WeakPolarHBondContact O-CB 2.85Å; G234-S331 PolarHBondContact O-OG 3.39Å; G234-T332 PolarHBondContact O-N 3.09Å
235	G	95.3	Very high	94.8	Very high	5 Å²	5	36.4 Å²	36.4	5%	0.052	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-83.4	175.5	-178.5	0	0	0	0	0	114.3	N239 L240	G235-N239 CarbonylContact C-O 3.6Å; G235-N239 WeakPolarHBondContact CA-O 3.46Å; G235-L240 WeakPolarHBondContact CA-O 3.24Å; G235-L240 PolarHBondContact N-O 3.21Å
236	P	94.9	Very high	94.6	Very high	37 Å²	37	37 Å²	37	24%	0.24	18%	0.183	C	C	.	.			trans	-62.1	163.4	175.1	26.5	-33.8	0	0	0	112.3	K238 N239 T332 L339	P236-K238 PolarHBondContact O-N 3.24Å; P236-N239 WeakPolarHBondContact CD-O 3.31Å; P236-N239 HydrophobicContact CG-CB 4.44Å; P236-N239 CarbonylContact O-C 3.36Å; P236-N239 PolarHBondContact O-N 3.29Å; P236-T332 WeakPolarHBondContact CB-O 3Å; P236-L339 VanDerWaalsContact CD-CD1 3.43Å; P236-L339 HydrophobicContact CG-CD1 3.79Å
237	K	89.1	Confident	94.5	Very high	180 Å²	180	38.2 Å²	38.2	78%	0.783	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50	-32.6	-177.2	-67.7	-173.2	178.2	-178.9	0	115
238	K	89.5	Confident	94.5	Very high	210 Å²	210	38.4 Å²	38.4	91%	0.913	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-13.2	-177.5	-65	-174.3	178.7	-178.1	0	114	P236	P236-K238 PolarHBondContact O-N 3.24Å
239	N	91.8	Very high	94.4	Very high	34 Å²	34	38.9 Å²	38.9	18%	0.182	19%	0.192	C	C	.	.	S	Bend	trans	-152.4	123.7	-174.7	-165.4	3.6	0	0	0	111.6	G235 P236 Q241 L339	G235-N239 CarbonylContact C-O 3.6Å; G235-N239 WeakPolarHBondContact CA-O 3.46Å; P236-N239 WeakPolarHBondContact CD-O 3.31Å; P236-N239 HydrophobicContact CG-CB 4.44Å; P236-N239 CarbonylContact O-C 3.36Å; P236-N239 PolarHBondContact O-N 3.29Å; N239-Q241 PolarHBondContact O-N 2.85Å; N239-L339 HydrophobicContact CB-CD1 4.16Å; N239-L339 WeakPolarHBondContact ND2-CB 3.46Å
240	L	92.3	Very high	94.5	Very high	17 Å²	17	38.7 Å²	38.7	9%	0.089	19%	0.191	C	C	.	.	S	Bend	trans	53.3	33.4	-179.2	-60.2	-178	0	0	0	114.7	V178 G235 F242 S243 T245 L339 V342	V178-L240 HydrophobicContact CG2-CD2 3.66Å; G235-L240 WeakPolarHBondContact CA-O 3.24Å; G235-L240 PolarHBondContact N-O 3.21Å; L240-F242 PolarHBondContact O-N 2.89Å; L240-S243 PolarHBondContact O-N 3.39Å; L240-T245 HydrophobicContact CB-CG2 4.37Å; L240-T245 HydrophobicContact CD1-CG2 4.42Å; L240-L339 HydrophobicContact CD1-CB 4.28Å; L240-L339 HydrophobicContact CD1-CD2 4.01Å; L240-V342 HydrophobicContact CD1-CB 4.2Å; L240-V342 HydrophobicContact CD1-CG1 4.03Å
241	Q	94.6	Very high	94.6	Very high	77 Å²	77	41.5 Å²	41.5	36%	0.36	20%	0.201	S	C	.	.	B	Isolated β-bridge	trans	-58.1	124.4	178.2	-166.4	-169.6	14.7	0	0	111.2	N239 S243	N239-Q241 PolarHBondContact O-N 2.85Å; Q241-S243 PolarHBondContact O-N 3.27Å; Q241-S243 VanDerWaalsContact O-N 3.17Å
242	F	94.1	Very high	94.7	Very high	101 Å²	101	40 Å²	40	44%	0.443	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	16.2	-174.9	-46.8	-62.2	0	0	0	114.4	V175 R176 L240	V175-F242 CarbonylContact C-O 3.52Å; V175-F242 VanDerWaalsContact CA-O 3.27Å; V175-F242 WeakPolarHBondContact CA-O 3.24Å; R176-F242 WeakPolarHBondContact CG-O 3.32Å; R176-F242 PolarHBondContact N-O 3.36Å; L240-F242 PolarHBondContact O-N 2.89Å
243	S	95.6	Very high	94.6	Very high	6 Å²	6	41.2 Å²	41.2	4%	0.042	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-110.5	145.9	178.8	-61.3	0	0	0	0	110.6	R176 G234 L240 Q241 T245	R176-S243 CarbonylContact O-C 3.56Å; R176-S243 VanDerWaalsContact O-CA 3.23Å; R176-S243 WeakPolarHBondContact O-CA 3.32Å; G234-S243 WeakPolarHBondContact CA-O 3.46Å; L240-S243 PolarHBondContact O-N 3.39Å; Q241-S243 PolarHBondContact O-N 3.27Å; Q241-S243 VanDerWaalsContact O-N 3.17Å; S243-T245 PolarHBondContact O-N 2.86Å
244	W	96.1	Very high	94.5	Very high	5 Å²	5	39.4 Å²	39.4	2%	0.019	18%	0.183	C	C	.	.			trans	-53.4	130.5	179.4	-66.3	112.3	0	0	0	112	Y155 I167 K169 V175 R176 V228 D232 L247	Y155-W244 HydrophobicContact CD1-CH2 4.48Å; Y155-W244 HydrophobicContact CE1-CH2 4.04Å; I167-W244 HydrophobicContact CG2-CZ2 4.3Å; I167-W244 PolarHBondContact O-NE1 3.2Å; K169-W244 HydrophobicContact CB-CH2 3.66Å; K169-W244 HydrophobicContact CB-CZ2 3.71Å; K169-W244 HydrophobicContact CD-CH2 4.03Å; K169-W244 HydrophobicContact CG-CH2 4.42Å; V175-W244 HydrophobicContact CB-CD2 4.14Å; V175-W244 HydrophobicContact CB-CE3 4.18Å; V175-W244 HydrophobicContact CB-CH2 4.02Å; V175-W244 HydrophobicContact CB-CZ2 3.99Å; V175-W244 HydrophobicContact CB-CZ3 4.12Å; V175-W244 HydrophobicContact CG1-CB 4.33Å; V175-W244 HydrophobicContact CG1-CD2 3.37Å; V175-W244 HydrophobicContact CG1-CE3 3.52Å; V175-W244 HydrophobicContact CG1-CG 3.77Å; V175-W244 HydrophobicContact CG1-CH2 4.26Å; V175-W244 HydrophobicContact CG1-CZ2 4.15Å; V175-W244 HydrophobicContact CG1-CZ3 3.97Å; V175-W244 HydrophobicContact CG2-CZ3 4.48Å; R176-W244 VanDerWaalsContact O-CD1 3.29Å; R176-W244 PolarHBondContact O-N 2.88Å; V228-W244 HydrophobicContact CB-CD2 4.18Å; V228-W244 HydrophobicContact CB-CE3 3.84Å; V228-W244 HydrophobicContact CB-CH2 4.4Å; V228-W244 HydrophobicContact CB-CZ3 3.96Å; V228-W244 HydrophobicContact CG1-CD2 3.83Å; V228-W244 HydrophobicContact CG1-CE3 3.98Å; V228-W244 HydrophobicContact CG1-CG 4.09Å; V228-W244 HydrophobicContact CG2-CE3 4.38Å; V228-W244 HydrophobicContact CG2-CH2 4.06Å; V228-W244 HydrophobicContact CG2-CZ2 4.31Å; V228-W244 HydrophobicContact CG2-CZ3 4.09Å; D232-W244 HydrophobicContact CB-CE3 3.93Å; D232-W244 HydrophobicContact CB-CZ3 3.89Å; W244-L247 HydrophobicContact CB-CB 3.89Å
245	T	95.2	Very high	94.2	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.055	18%	0.183	C	C	.	.	S	Bend	trans	-105.2	-16.4	174.2	63.8	0	0	0	0	112.1	D232 L240 S243 S331 L334 L339 V342	D232-T245 VanDerWaalsContact CG-OG1 3.22Å; D232-T245 PolarHBondContact OD1-OG1 2.9Å; D232-T245 PolarHBondContact OD2-N 2.78Å; D232-T245 PolarHBondContact OD2-OG1 2.91Å; D232-T245 VanDerWaalsContact OD2-OG1 3.05Å; L240-T245 HydrophobicContact CB-CG2 4.37Å; L240-T245 HydrophobicContact CD1-CG2 4.42Å; S243-T245 PolarHBondContact O-N 2.86Å; T245-S331 VanDerWaalsContact OG1-CB 3.28Å; T245-S331 WeakPolarHBondContact OG1-CB 3.3Å; T245-L334 HydrophobicContact CG2-CD1 4.29Å; T245-L339 HydrophobicContact CG2-CD2 3.57Å; T245-V342 WeakPolarHBondContact O-CG2 3.45Å
246	S	95.3	Very high	93.4	Very high	13 Å²	13	44.7 Å²	44.7	9%	0.091	21%	0.206	C	C	.	.	S	Bend	trans	-105.7	2.5	-176.8	59.7	0	0	0	0	114.6	C229 D232 M248	C229-S246 PolarHBondContact N-OG 3.46Å; D232-S246 WeakPolarHBondContact CB-OG 3.32Å; D232-S246 VanDerWaalsContact OD2-CB 3.31Å; D232-S246 WeakPolarHBondContact OD2-CB 3.3Å; D232-S246 PolarHBondContact OD2-N 2.83Å; D232-S246 PolarHBondContact OD2-OG 2.99Å; S246-M248 PolarHBondContact O-N 3.09Å
247	L	95.3	Very high	91.9	Very high	25 Å²	25	47.6 Å²	47.6	13%	0.131	22%	0.219	C	C	.	.			trans	-63.7	129.6	179.9	-177.7	67.5	0	0	0	110.2	Q227 V228 W244 L346	Q227-L247 WeakPolarHBondContact O-CA 3.16Å; V228-L247 HydrophobicContact CG1-CB 4.01Å; V228-L247 HydrophobicContact CG1-CD1 3.51Å; V228-L247 HydrophobicContact CG1-CG 4.38Å; W244-L247 HydrophobicContact CB-CB 3.89Å; L247-L346 HydrophobicContact CB-CD2 4.45Å; L247-L346 HydrophobicContact CD2-CD1 4.06Å; L247-L346 WeakPolarHBondContact O-CD2 3.3Å
248	M	95.4	Very high	90.4	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.02	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	151.7	171.3	-64.7	-176.4	-68.6	0	0	109.4	S226 Q227 S246 F309 F314 K325 M348	S226-M248 CarbonylContact C-O 3.5Å; S226-M248 WeakPolarHBondContact CA-O 3.27Å; S226-M248 WeakPolarHBondContact CB-O 3.4Å; S226-M248 PolarHBondContact OG-O 2.94Å; Q227-M248 HydrophobicContact CG-CB 4.19Å; Q227-M248 HydrophobicContact CG-CE 4.04Å; Q227-M248 PolarHBondContact N-O 2.98Å; Q227-M248 PolarHBondContact O-N 2.81Å; Q227-M248 VanDerWaalsContact O-N 3.09Å; S246-M248 PolarHBondContact O-N 3.09Å; M248-F309 HydrophobicContact CB-CD1 3.8Å; M248-F309 HydrophobicContact CB-CE1 3.78Å; M248-F309 HydrophobicContact CE-CB 4.42Å; M248-F309 HydrophobicContact CE-CD1 4.43Å; M248-F314 HydrophobicContact CG-CE1 4.28Å; M248-F314 HydrophobicContact CG-CZ 4.27Å; M248-F314 HydrophobicContact SD-CE1 4.33Å; M248-F314 HydrophobicContact SD-CZ 3.82Å; M248-K325 HydrophobicContact SD-CG 4.28Å; M248-M348 HydrophobicContact CB-CE 3.76Å; M248-M348 HydrophobicContact CG-CE 3.88Å; M248-M348 HydrophobicContact SD-CE 3.46Å; M248-M348 WeakPolarHBondContact SD-CE 3.1Å
249	N	96.1	Very high	88.5	Confident	10 Å²	10	37.9 Å²	37.9	5%	0.053	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	142.8	-172	-40.3	25	0	0	0	109.5	Y207 F224 V225 S226 L346 E347 M348	Y207-N249 PolarHBondContact OH-ND2 3.3Å; F224-N249 HydrophobicContact CD1-CB 4.4Å; V225-N249 CarbonylContact O-C 3.58Å; V225-N249 WeakPolarHBondContact O-CA 3.49Å; S226-N249 WeakPolarHBondContact OG-CB 3.45Å; S226-N249 PolarHBondContact OG-ND2 2.71Å; S226-N249 PolarHBondContact OG-OD1 2.98Å; N249-L346 PolarHBondContact N-O 2.74Å; N249-L346 WeakPolarHBondContact OD1-CB 3.45Å; N249-E347 CarbonylContact O-C 3.53Å; N249-E347 VanDerWaalsContact O-CA 3.31Å; N249-E347 WeakPolarHBondContact O-CA 3.5Å; N249-M348 WeakPolarHBondContact O-CG 3.35Å; N249-M348 PolarHBondContact O-N 2.94Å
250	A	97.6	Very high	86.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.6	173	0	0	0	0	0	109.8	F224 V225 V308 F309 M348 V352	F224-A250 WeakPolarHBondContact CA-O 3.47Å; F224-A250 WeakPolarHBondContact CD1-O 3.44Å; V225-A250 HydrophobicContact CG1-CB 4.28Å; V225-A250 PolarHBondContact N-O 2.91Å; V225-A250 PolarHBondContact O-N 3.41Å; A250-V308 HydrophobicContact CB-CG1 4.11Å; A250-F309 HydrophobicContact CB-CE1 3.95Å; A250-F309 HydrophobicContact CB-CZ 3.94Å; A250-M348 HydrophobicContact CB-CB 3.96Å; A250-M348 HydrophobicContact CB-CG 4.08Å; A250-V352 HydrophobicContact CB-CG2 3.95Å
251	R	97.1	Very high	84.7	Confident	66 Å²	66	46.7 Å²	46.7	25%	0.249	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	144.9	174.7	-69.4	-173.4	-171	-168.1	1.5	110.6	P223 F224 E347 W351 V352	P223-R251 WeakPolarHBondContact O-CA 3.37Å; F224-R251 HydrophobicContact CD1-CG 4.06Å; F224-R251 HydrophobicContact CE1-CG 3.47Å; F224-R251 VanDerWaalsContact CE1-CG 3.47Å; F224-R251 HydrophobicContact CZ-CG 3.76Å; R251-E347 IonicContact CZ-OE1 3.24Å; R251-E347 IonicContact NE-OE1 3.31Å; R251-E347 PolarHBondContact NE-OE1 2.95Å; R251-E347 IonicContact NH2-OE1 3.51Å; R251-E347 PolarHBondContact NH2-OE1 2.69Å; R251-W351 HydrophobicContact CB-CB 4.34Å; R251-W351 HydrophobicContact CB-CD2 3.8Å; R251-W351 HydrophobicContact CB-CE3 4.29Å; R251-W351 HydrophobicContact CB-CG 3.75Å; R251-W351 CarbonylContact O-C 3.58Å; R251-W351 WeakPolarHBondContact O-CA 3.12Å; R251-V352 PolarHBondContact O-N 3.14Å
252	L	96.8	Very high	82.8	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-93.4	135.5	169.8	-67.6	161	0	0	0	109.3	F206 P223 V225 L268 F288 Y300 V352	F206-L252 HydrophobicContact CD1-CD1 4.05Å; P223-L252 HydrophobicContact CB-CB 4.16Å; P223-L252 HydrophobicContact CG-CB 4.18Å; P223-L252 VanDerWaalsContact CG-O 3.29Å; P223-L252 WeakPolarHBondContact CG-O 3.18Å; P223-L252 PolarHBondContact O-N 3.26Å; V225-L252 HydrophobicContact CB-CD1 4.43Å; V225-L252 HydrophobicContact CB-CD2 4.35Å; V225-L252 HydrophobicContact CB-CG 4.42Å; V225-L252 HydrophobicContact CG1-CD2 4.08Å; V225-L252 HydrophobicContact CG1-CG 4.34Å; L252-L268 HydrophobicContact CD1-CD2 4.32Å; L252-F288 HydrophobicContact CB-CE1 4.41Å; L252-F288 HydrophobicContact CB-CZ 4.15Å; L252-Y300 HydrophobicContact CD2-CD1 4.26Å; L252-Y300 HydrophobicContact CD2-CD2 4.35Å; L252-Y300 HydrophobicContact CD2-CE1 3.96Å; L252-Y300 HydrophobicContact CD2-CE2 4.09Å; L252-Y300 HydrophobicContact CD2-CG 4.42Å; L252-V352 HydrophobicContact CD2-CB 3.98Å; L252-V352 HydrophobicContact CD2-CG1 4.09Å
253	Y	94.2	Very high	81.6	Confident	29 Å²	29	53.2 Å²	53.2	11%	0.114	27%	0.273	C	S	.	.			trans	-105.9	128.9	170.2	-177	-101.8	0	0	0	109.3	G255 Y300 W351 V352 K353 P354	Y253-G255 WeakPolarHBondContact CE1-O 3.5Å; Y253-Y300 PolarHBondContact O-OH 3.08Å; Y253-W351 AromaticContact CD2-CE3 3.77Å; Y253-W351 HydrophobicContact CD2-CE3 3.77Å; Y253-W351 AromaticContact CD2-CZ3 3.86Å; Y253-W351 HydrophobicContact CD2-CZ3 3.86Å; Y253-W351 HydrophobicContact CG-CE3 4.3Å; Y253-V352 PolarHBondContact N-O 2.96Å; Y253-K353 HydrophobicContact CD1-CG 4.22Å; Y253-K353 HydrophobicContact CG-CG 4.36Å; Y253-P354 WeakPolarHBondContact O-CD 3.43Å
254	C	93.3	Very high	81	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-129.1	119.6	165.9	-173.6	0	0	0	0	109.2	H264 F265 F288 C298	C254-H264 PolarHBondContact O-ND1 3Å; C254-F265 HydrophobicContact CB-CB 4.37Å; C254-F265 PolarHBondContact O-N 2.85Å; C254-F288 HydrophobicContact CB-CD1 4.12Å; C254-F288 HydrophobicContact CB-CD2 3.55Å; C254-F288 HydrophobicContact CB-CE1 4.11Å; C254-F288 HydrophobicContact CB-CE2 3.54Å; C254-F288 HydrophobicContact CB-CG 3.86Å; C254-F288 HydrophobicContact CB-CZ 3.84Å; C254-F288 VanDerWaalsContact SG-CD2 3.55Å; C254-C298 WeakPolarHBondContact CA-SG 3.05Å; C254-C298 HydrophobicContact CB-CB 3.84Å; C254-C298 WeakPolarHBondContact CB-SG 3.49Å; C254-C298 WeakPolarHBondContact SG-CB 3.29Å; C254-C298 CovalentContact SG-SG 2.04Å; C254-C298 PolarHBondContact SG-SG 3.3Å
255	G	88.6	Confident	80.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.278	C	S	.	.	S	Bend	trans	165.2	167.6	-171.9	0	0	0	0	0	110.9	Y253 R263	Y253-G255 WeakPolarHBondContact CE1-O 3.5Å; G255-R263 WeakPolarHBondContact CA-O 3.47Å
256	H	79.8	Confident	80.6	Confident	115 Å²	115	54.7 Å²	54.7	53%	0.532	28%	0.279	S	S	.	.			trans	-85.9	133.9	177.5	-152.8	92.3	0	0	0	109.9	T258	H256-T258 VanDerWaalsContact CD2-CG2 3.46Å; H256-T258 WeakPolarHBondContact CD2-CG2 3.35Å; H256-T258 PolarHBondContact O-N 2.95Å
257	N	62.7	Low	80.6	Confident	99 Å²	99	55 Å²	55	53%	0.529	28%	0.279	S	S	.	.			trans	-77	52.4	179.9	-69.4	-34.9	0	0	0	111.7
258	T	58.3	Low	80.7	Confident	76 Å²	76	53.8 Å²	53.8	47%	0.466	27%	0.272	S	S	.	.	S	Bend	trans	-110.4	154	173.9	41.2	0	0	0	0	110.5	H256 D260	H256-T258 VanDerWaalsContact CD2-CG2 3.46Å; H256-T258 WeakPolarHBondContact CD2-CG2 3.35Å; H256-T258 PolarHBondContact O-N 2.95Å; T258-D260 PolarHBondContact O-N 3.27Å
259	A	49.6	Very low	80.7	Confident	109 Å²	109	54.6 Å²	54.6	90%	0.901	28%	0.278	S	S	*	.	S	Bend	trans	-54.7	-15.6	-177.6	0	0	0	0	0	115.1	N261	A259-N261 PolarHBondContact O-N 3.33Å
260	D	49.5	Very low	80.8	Confident	102 Å²	102	54.8 Å²	54.8	55%	0.545	28%	0.279	S	S	.	.			trans	-91.4	89.4	174.9	-144.1	-0.7	0	0	0	110.1	T258 K262	T258-D260 PolarHBondContact O-N 3.27Å; D260-K262 PolarHBondContact O-N 2.8Å; D260-K262 WeakPolarHBondContact OD1-CD 3.17Å; D260-K262 WeakPolarHBondContact OD1-CE 2.81Å; D260-K262 IonicContact OD1-NZ 2.77Å
261	N	53.3	Low	80.8	Confident	134 Å²	134	55.6 Å²	55.6	72%	0.717	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	12.3	-178.9	-79.1	-24.5	0	0	0	115.4	A259 R263	A259-N261 PolarHBondContact O-N 3.33Å; N261-R263 PolarHBondContact O-N 2.99Å
262	K	55.6	Low	80.8	Confident	148 Å²	148	53 Å²	53	64%	0.643	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	0.5	-167.1	-65.6	179.4	-174.2	162.1	0	115.3	D260	D260-K262 PolarHBondContact O-N 2.8Å; D260-K262 WeakPolarHBondContact OD1-CD 3.17Å; D260-K262 WeakPolarHBondContact OD1-CE 2.81Å; D260-K262 IonicContact OD1-NZ 2.77Å
263	R	67.6	Low	80.7	Confident	167 Å²	167	55 Å²	55	63%	0.63	29%	0.288	S	S	*	.			trans	-128.3	50.8	-177.6	-60.2	-173.2	-174	-175	3.1	112.6	G255 N261	G255-R263 WeakPolarHBondContact CA-O 3.47Å; N261-R263 PolarHBondContact O-N 2.99Å
264	H	83.1	Confident	80.6	Confident	35 Å²	35	54.1 Å²	54.1	16%	0.162	29%	0.286	C	S	.	.			trans	-91	138.8	172.1	162.3	50.7	0	0	0	110.9	C254 F266	C254-H264 PolarHBondContact O-ND1 3Å; H264-F266 WeakPolarHBondContact NE2-CB 3.41Å
265	F	91.6	Very high	80.6	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.009	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-108.6	120.7	173.3	-61	-102.1	0	0	0	110.1	C254 F288 N290 M294 A296 F361	C254-F265 HydrophobicContact CB-CB 4.37Å; C254-F265 PolarHBondContact O-N 2.85Å; F265-F288 HydrophobicContact CB-CB 3.44Å; F265-F288 VanDerWaalsContact CB-CB 3.44Å; F265-F288 HydrophobicContact CB-CD1 4.5Å; F265-F288 HydrophobicContact CB-CG 4.17Å; F265-F288 HydrophobicContact CD1-CB 4.45Å; F265-F288 HydrophobicContact CG-CB 4.25Å; F265-N290 HydrophobicContact CD1-CB 3.87Å; F265-N290 HydrophobicContact CE1-CB 4.19Å; F265-N290 WeakPolarHBondContact CE1-ND2 3.36Å; F265-N290 HydrophobicContact CG-CB 4.44Å; F265-M294 HydrophobicContact CE1-CB 4.08Å; F265-M294 WeakPolarHBondContact CE1-O 3.36Å; F265-A296 HydrophobicContact CD1-CB 3.66Å; F265-A296 HydrophobicContact CD2-CB 3.58Å; F265-A296 HydrophobicContact CE1-CB 3.59Å; F265-A296 HydrophobicContact CE2-CB 3.52Å; F265-A296 HydrophobicContact CG-CB 3.67Å; F265-A296 HydrophobicContact CZ-CB 3.53Å; F265-F361 HydrophobicContact CE2-CD2 4.06Å; F265-F361 HydrophobicContact CE2-CE2 4.32Å; F265-F361 AromaticContact CZ-CD2 3.5Å; F265-F361 HydrophobicContact CZ-CD2 3.5Å; F265-F361 AromaticContact CZ-CE2 3.6Å; F265-F361 HydrophobicContact CZ-CE2 3.6Å
266	F	91.3	Very high	80.7	Confident	15 Å²	15	62.5 Å²	62.5	7%	0.066	33%	0.33	C	S	.	.			trans	-111.8	-22.5	-170.6	55.4	-92.7	0	0	0	113.6	N219 W221 P223 H264 L268 R289 N290 E291	N219-F266 HydrophobicContact CB-CB 4Å; N219-F266 HydrophobicContact CB-CD1 4.19Å; N219-F266 HydrophobicContact CB-CD2 3.78Å; N219-F266 HydrophobicContact CB-CE2 4.37Å; N219-F266 HydrophobicContact CB-CG 3.69Å; N219-F266 WeakPolarHBondContact OD1-CD1 3.22Å; W221-F266 HydrophobicContact CB-CD2 4.39Å; W221-F266 WeakPolarHBondContact O-CD2 3.45Å; P223-F266 WeakPolarHBondContact CD-O 3.23Å; H264-F266 WeakPolarHBondContact NE2-CB 3.41Å; F266-L268 PolarHBondContact O-N 3.06Å; F266-R289 PolarHBondContact N-O 2.91Å; F266-N290 HydrophobicContact CE1-CB 4.09Å; F266-E291 HydrophobicContact CE1-CB 4.49Å; F266-E291 HydrophobicContact CE1-CG 3.54Å; F266-E291 HydrophobicContact CZ-CB 4.31Å; F266-E291 HydrophobicContact CZ-CG 3.31Å
267	E	95.2	Very high	81.1	Confident	18 Å²	18	64 Å²	64	8%	0.084	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	106.8	177.6	-173.5	-175.7	-173.9	0	0	109.1	R208 W221 V269 F288 R289	R208-E267 IonicContact CZ-OE1 3.56Å; R208-E267 IonicContact NH1-OE1 2.95Å; R208-E267 PolarHBondContact NH1-OE1 2.96Å; W221-E267 HydrophobicContact CB-CB 4.31Å; W221-E267 HydrophobicContact CB-CG 4.29Å; W221-E267 HydrophobicContact CG-CG 4.2Å; E267-V269 HydrophobicContact CG-CG2 4.48Å; E267-V269 PolarHBondContact O-N 2.85Å; E267-F288 CarbonylContact O-C 3.54Å; E267-F288 WeakPolarHBondContact O-CA 3.47Å; E267-R289 HydrophobicContact CB-CB 4.36Å; E267-R289 WeakPolarHBondContact CB-O 3.46Å; E267-R289 PolarHBondContact N-O 3.39Å; E267-R289 VanDerWaalsContact N-O 3.07Å; E267-R289 PolarHBondContact O-N 2.96Å; E267-R289 IonicContact OE1-CZ 3.82Å; E267-R289 IonicContact OE1-NH2 3.09Å; E267-R289 PolarHBondContact OE1-NH2 2.95Å; E267-R289 IonicContact OE2-CZ 3.44Å; E267-R289 VanDerWaalsContact OE2-CZ 3.23Å; E267-R289 IonicContact OE2-NE 2.99Å; E267-R289 PolarHBondContact OE2-NE 3.46Å; E267-R289 IonicContact OE2-NH2 3.3Å; E267-R289 PolarHBondContact OE2-NH2 2.85Å
268	L	97.6	Very high	82.5	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	125.2	166.8	-174.5	66.1	0	0	0	108.9	L187 F206 R208 P223 L252 F266 V271 A286 F288	L187-L268 HydrophobicContact CD1-CB 3.99Å; L187-L268 HydrophobicContact CD1-CD2 3.82Å; L187-L268 HydrophobicContact CD1-CG 3.56Å; L187-L268 VanDerWaalsContact CD1-O 3.28Å; L187-L268 WeakPolarHBondContact CD1-O 3.17Å; F206-L268 HydrophobicContact CB-CD2 4.18Å; R208-L268 HydrophobicContact CB-CB 4.45Å; R208-L268 WeakPolarHBondContact CD-O 3.48Å; P223-L268 HydrophobicContact CB-CB 3.87Å; L252-L268 HydrophobicContact CD1-CD2 4.32Å; F266-L268 PolarHBondContact O-N 3.06Å; L268-V271 HydrophobicContact CD1-CG2 3.96Å; L268-V271 HydrophobicContact CD2-CG2 4.07Å; L268-V271 HydrophobicContact CG-CG2 4.3Å; L268-A286 HydrophobicContact CD1-CB 3.71Å; L268-F288 HydrophobicContact CB-CD1 4.32Å; L268-F288 HydrophobicContact CB-CE1 4.22Å; L268-F288 HydrophobicContact CD1-CD1 4.2Å; L268-F288 HydrophobicContact CD1-CD2 4.42Å; L268-F288 HydrophobicContact CD1-CE1 3.87Å; L268-F288 HydrophobicContact CD1-CE2 4.1Å; L268-F288 HydrophobicContact CD1-CG 4.46Å; L268-F288 HydrophobicContact CD1-CZ 3.81Å
269	V	96.7	Very high	84	Confident	21 Å²	21	63.7 Å²	63.7	13%	0.127	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-48.9	-174.9	178.3	0	0	0	0	111	L187 E267 L287 R289 T367	L187-V269 WeakPolarHBondContact CD2-O 3.36Å; E267-V269 HydrophobicContact CG-CG2 4.48Å; E267-V269 PolarHBondContact O-N 2.85Å; V269-L287 HydrophobicContact CB-CD2 4.21Å; V269-L287 HydrophobicContact CB-CG 4.12Å; V269-L287 HydrophobicContact CG1-CD2 4.06Å; V269-L287 PolarHBondContact N-O 3Å; V269-R289 HydrophobicContact CG2-CB 3.7Å; V269-T367 WeakPolarHBondContact CG1-O 3.46Å
270	D	97.3	Very high	86.2	Confident	15 Å²	15	64.1 Å²	64.1	8%	0.08	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	164.1	-179	-162.6	19.1	0	0	0	111.2	L287 R368 I369	D270-L287 HydrophobicContact CB-CB 4.5Å; D270-L287 HydrophobicContact CB-CD2 4.47Å; D270-L287 PolarHBondContact N-O 2.93Å; D270-L287 PolarHBondContact O-N 3.01Å; D270-R368 WeakPolarHBondContact OD2-CA 3.36Å; D270-R368 WeakPolarHBondContact OD2-CB 3.45Å; D270-I369 HydrophobicContact CB-CG2 4.14Å; D270-I369 PolarHBondContact OD2-N 2.93Å
271	V	97.4	Very high	88.3	Confident	17 Å²	17	62.8 Å²	62.8	10%	0.103	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	131.3	-178.3	178.2	0	0	0	0	111.2	F206 L268 V284 Y285 A286	F206-V271 HydrophobicContact CB-CG2 3.86Å; F206-V271 HydrophobicContact CD2-CG1 4.36Å; F206-V271 HydrophobicContact CG-CG1 4.35Å; F206-V271 HydrophobicContact CG-CG2 4.29Å; L268-V271 HydrophobicContact CD1-CG2 3.96Å; L268-V271 HydrophobicContact CD2-CG2 4.07Å; L268-V271 HydrophobicContact CG-CG2 4.3Å; V271-V284 HydrophobicContact CG1-CG1 3.25Å; V271-Y285 WeakPolarHBondContact CA-O 2.89Å; V271-A286 HydrophobicContact CG2-CB 4.28Å
272	A	96.4	Very high	90.2	Very high	10 Å²	10	56.7 Å²	56.7	8%	0.083	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.7	169.5	0	0	0	0	0	110.5	Y285 I369 V371	A272-Y285 PolarHBondContact N-O 3.2Å; A272-Y285 PolarHBondContact O-N 3.48Å; A272-I369 HydrophobicContact CB-CG1 4.4Å; A272-I369 HydrophobicContact CB-CG2 3.99Å; A272-V371 HydrophobicContact CB-CB 4.44Å; A272-V371 HydrophobicContact CB-CG2 3.87Å
273	T	95.1	Very high	92.1	Very high	42 Å²	42	52.7 Å²	52.7	26%	0.258	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.1	-179.7	-56.1	0	0	0	0	110	V190 T282 R283	V190-T273 HydrophobicContact CG1-CG2 4.04Å; V190-T273 HydrophobicContact CG2-CG2 3.99Å; V190-T273 VanDerWaalsContact CG2-OG1 3.24Å; V190-T273 WeakPolarHBondContact CG2-OG1 3.25Å; T273-T282 HydrophobicContact CG2-CG2 3.73Å; T273-R283 WeakPolarHBondContact CA-O 3.41Å
274	V	93.8	Very high	93.6	Very high	11 Å²	11	44.8 Å²	44.8	7%	0.067	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	106.3	172.3	178.8	0	0	0	0	107.4	R283 Y285 V371 A373	V274-R283 HydrophobicContact CB-CB 4.39Å; V274-R283 PolarHBondContact N-O 3.17Å; V274-R283 PolarHBondContact O-N 2.87Å; V274-Y285 HydrophobicContact CB-CE2 4.48Å; V274-Y285 HydrophobicContact CG2-CD2 4.06Å; V274-Y285 HydrophobicContact CG2-CE2 3.9Å; V274-V371 HydrophobicContact CG2-CB 3.78Å; V274-V371 HydrophobicContact CG2-CG1 3.6Å; V274-A373 HydrophobicContact CG1-CB 3.82Å
275	H	91.6	Very high	94.2	Very high	130 Å²	130	43.3 Å²	43.3	60%	0.602	22%	0.216	S	C	*	.			trans	-70.7	147.8	180	-69.4	-74.4	0	0	0	111.3
276	S	90.9	Very high	94.5	Very high	47 Å²	47	43.2 Å²	43.2	33%	0.329	22%	0.216	S	C	.	.			trans	-130.1	152.1	175.2	176.1	0	0	0	0	109.1	H278 T282	S276-H278 WeakPolarHBondContact CB-O 3.49Å; S276-H278 PolarHBondContact O-N 2.74Å; S276-H278 PolarHBondContact OG-N 3.1Å; S276-H278 PolarHBondContact OG-O 3.35Å; S276-T282 PolarHBondContact N-OG1 3.28Å
277	D	88.3	Confident	94.9	Very high	147 Å²	147	42.5 Å²	42.5	79%	0.786	21%	0.213	S	C	*	.	S	Bend	trans	-54.7	-40.4	175	-63.4	-27	0	0	0	111.1
278	H	91.3	Very high	94.9	Very high	125 Å²	125	41.6 Å²	41.6	58%	0.579	21%	0.209	S	C	*	.	S	Bend	trans	-89.5	115.4	170.3	-67.5	-54.2	0	0	0	109.9	S276 K280 D281 T282	S276-H278 WeakPolarHBondContact CB-O 3.49Å; S276-H278 PolarHBondContact O-N 2.74Å; S276-H278 PolarHBondContact OG-N 3.1Å; S276-H278 PolarHBondContact OG-O 3.35Å; H278-K280 PolarHBondContact O-N 3.49Å; H278-D281 WeakPolarHBondContact CB-OD2 2.99Å; H278-D281 PolarHBondContact O-N 3.46Å; H278-T282 PolarHBondContact O-N 3.39Å
279	W	91.7	Very high	94.7	Very high	42 Å²	42	44.5 Å²	44.5	16%	0.159	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-54.9	-30.7	-177.3	71.4	-94.6	0	0	0	113.6	R194 D281 T282 I302 E306	R194-W279 HydrophobicContact CG-CD2 4.29Å; R194-W279 HydrophobicContact CG-CG 4.26Å; W279-D281 PolarHBondContact O-N 3.34Å; W279-T282 WeakPolarHBondContact O-CB 3.27Å; W279-T282 PolarHBondContact O-N 2.9Å; W279-T282 PolarHBondContact O-OG1 3.04Å; W279-I302 HydrophobicContact CE3-CG2 3.76Å; W279-I302 HydrophobicContact CZ3-CG2 3.91Å; W279-E306 HydrophobicContact CH2-CB 4.44Å; W279-E306 WeakPolarHBondContact CH2-OE2 3.38Å; W279-E306 HydrophobicContact CZ3-CB 4.36Å
280	K	94.3	Very high	94.4	Very high	119 Å²	119	43.8 Å²	43.8	52%	0.517	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-63	-33.2	177.6	-73.6	-176.1	178.9	177.9	0	112.4	H278 T301 G303	H278-K280 PolarHBondContact O-N 3.49Å; K280-T301 WeakPolarHBondContact O-CB 3.38Å; K280-G303 PolarHBondContact O-N 3.38Å
281	D	93.3	Very high	93.8	Very high	73 Å²	73	48.8 Å²	48.8	39%	0.39	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-94.9	2.5	-174.7	-54.9	-45.3	0	0	0	112.1	H278 W279 R283	H278-D281 WeakPolarHBondContact CB-OD2 2.99Å; H278-D281 PolarHBondContact O-N 3.46Å; W279-D281 PolarHBondContact O-N 3.34Å; D281-R283 PolarHBondContact O-N 3.46Å
282	T	95	Very high	93.1	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.043	26%	0.264	C	S	.	.			trans	-59.3	122.4	167.5	-67.5	0	0	0	0	108.8	T273 S276 H278 W279 T301 I302	T273-T282 HydrophobicContact CG2-CG2 3.73Å; S276-T282 PolarHBondContact N-OG1 3.28Å; H278-T282 PolarHBondContact O-N 3.39Å; W279-T282 WeakPolarHBondContact O-CB 3.27Å; W279-T282 PolarHBondContact O-N 2.9Å; W279-T282 PolarHBondContact O-OG1 3.04Å; T282-T301 WeakPolarHBondContact O-CA 3.4Å; T282-I302 HydrophobicContact CG2-CG1 3.77Å; T282-I302 PolarHBondContact O-N 3.04Å
283	R	95.6	Very high	92.5	Very high	64 Å²	64	56.8 Å²	56.8	24%	0.242	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	142	-175.2	-73.2	173.7	-69.9	154.7	-2.5	110.7	T273 V274 D281 Y285 V299 Y300 T301 D380	T273-R283 WeakPolarHBondContact CA-O 3.41Å; V274-R283 HydrophobicContact CB-CB 4.39Å; V274-R283 PolarHBondContact N-O 3.17Å; V274-R283 PolarHBondContact O-N 2.87Å; D281-R283 PolarHBondContact O-N 3.46Å; R283-Y285 HydrophobicContact CB-CD2 4.41Å; R283-Y285 HydrophobicContact CB-CE2 3.93Å; R283-Y285 PolarHBondContact NH1-OH 2.57Å; R283-V299 HydrophobicContact CB-CG1 4.13Å; R283-V299 HydrophobicContact CG-CG1 4.23Å; R283-Y300 CarbonylContact C-O 3.45Å; R283-Y300 WeakPolarHBondContact CA-O 3.49Å; R283-T301 HydrophobicContact CG-CG2 4.28Å; R283-D380 IonicContact CZ-OD1 2.65Å; R283-D380 VanDerWaalsContact CZ-OD1 3.31Å; R283-D380 IonicContact CZ-OD2 3.64Å; R283-D380 IonicContact NH1-OD1 2.95Å; R283-D380 PolarHBondContact NH1-OD1 2.86Å; R283-D380 IonicContact NH1-OD2 2.78Å; R283-D380 PolarHBondContact NH1-OD2 3.46Å; R283-D380 IonicContact NH2-OD1 3.27Å; R283-D380 PolarHBondContact NH2-OD1 3.34Å; R283-D380 IonicContact NH2-OD2 2.66Å; R283-D380 PolarHBondContact NH2-OD2 3.43Å; R283-D380 VanDerWaalsContact NH2-OD2 3.15Å
284	V	97.3	Very high	92.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	110.7	177.5	-177.7	0	0	0	0	107.9	F206 V271 V299 Y300 I302	F206-V284 HydrophobicContact CD1-CG1 4.27Å; F206-V284 HydrophobicContact CD2-CG1 4.48Å; F206-V284 HydrophobicContact CE1-CB 4.49Å; F206-V284 HydrophobicContact CE1-CG1 3.82Å; F206-V284 HydrophobicContact CE2-CG1 4.05Å; F206-V284 HydrophobicContact CE2-CG2 4.19Å; F206-V284 HydrophobicContact CZ-CB 4.18Å; F206-V284 HydrophobicContact CZ-CG1 3.71Å; F206-V284 HydrophobicContact CZ-CG2 3.79Å; V271-V284 HydrophobicContact CG1-CG1 3.25Å; V284-V299 WeakPolarHBondContact O-CA 3.16Å; V284-Y300 PolarHBondContact N-O 3.2Å; V284-Y300 PolarHBondContact O-N 3.49Å; V284-I302 HydrophobicContact CG2-CD1 3.94Å
285	Y	97.6	Very high	92.3	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	110.8	175.1	-72.8	-106.6	0	0	0	108.2	V271 A272 V274 R283 V297 V299 V371 D380 M382 Q396	V271-Y285 WeakPolarHBondContact CA-O 2.89Å; A272-Y285 PolarHBondContact N-O 3.2Å; A272-Y285 PolarHBondContact O-N 3.48Å; V274-Y285 HydrophobicContact CB-CE2 4.48Å; V274-Y285 HydrophobicContact CG2-CD2 4.06Å; V274-Y285 HydrophobicContact CG2-CE2 3.9Å; R283-Y285 HydrophobicContact CB-CD2 4.41Å; R283-Y285 HydrophobicContact CB-CE2 3.93Å; R283-Y285 PolarHBondContact NH1-OH 2.57Å; Y285-V297 HydrophobicContact CD1-CG1 4.07Å; Y285-V299 HydrophobicContact CD1-CG2 3.54Å; Y285-V299 HydrophobicContact CD2-CG1 4.33Å; Y285-V299 HydrophobicContact CE1-CG1 4.36Å; Y285-V299 HydrophobicContact CE1-CG2 3.39Å; Y285-V299 HydrophobicContact CE2-CG1 4.01Å; Y285-V299 HydrophobicContact CE2-CG2 4.48Å; Y285-V299 HydrophobicContact CG-CG2 4.15Å; Y285-V371 HydrophobicContact CD1-CG2 3.97Å; Y285-V371 HydrophobicContact CD2-CB 4.42Å; Y285-V371 HydrophobicContact CD2-CG1 4.29Å; Y285-V371 HydrophobicContact CD2-CG2 4Å; Y285-V371 HydrophobicContact CE1-CG1 4.5Å; Y285-V371 HydrophobicContact CE2-CG1 4.12Å; Y285-V371 HydrophobicContact CG-CG2 3.69Å; Y285-D380 WeakPolarHBondContact CE2-OD2 3.23Å; Y285-D380 PolarHBondContact OH-OD2 2.71Å; Y285-M382 HydrophobicContact CD1-CG 4.26Å; Y285-M382 HydrophobicContact CD1-SD 3.79Å; Y285-M382 HydrophobicContact CE1-CG 4.32Å; Y285-M382 HydrophobicContact CE1-SD 4.03Å; Y285-Q396 HydrophobicContact CE1-CG 4.44Å
286	A	97.8	Very high	92.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.9	-178.1	0	0	0	0	0	109.8	L268 V271 F288 V297 C298 Y300	L268-A286 HydrophobicContact CD1-CB 3.71Å; V271-A286 HydrophobicContact CG2-CB 4.28Å; A286-F288 HydrophobicContact CB-CD2 4.18Å; A286-F288 HydrophobicContact CB-CE2 3.39Å; A286-F288 HydrophobicContact CB-CZ 3.94Å; A286-F288 VanDerWaalsContact O-CD2 3.28Å; A286-F288 WeakPolarHBondContact O-CD2 3.1Å; A286-F288 WeakPolarHBondContact O-CE2 3.48Å; A286-V297 WeakPolarHBondContact O-CA 3.3Å; A286-C298 PolarHBondContact N-O 3.22Å; A286-C298 PolarHBondContact O-N 2.89Å; A286-Y300 HydrophobicContact CB-CD2 4.27Å; A286-Y300 HydrophobicContact CB-CE2 3.85Å
287	L	97.8	Very high	92.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	124.1	175.8	175.9	64.5	0	0	0	109.1	V269 D270 V297 Y366 I369 L384	V269-L287 HydrophobicContact CB-CD2 4.21Å; V269-L287 HydrophobicContact CB-CG 4.12Å; V269-L287 HydrophobicContact CG1-CD2 4.06Å; V269-L287 PolarHBondContact N-O 3Å; D270-L287 HydrophobicContact CB-CB 4.5Å; D270-L287 HydrophobicContact CB-CD2 4.47Å; D270-L287 PolarHBondContact N-O 2.93Å; D270-L287 PolarHBondContact O-N 3.01Å; L287-V297 HydrophobicContact CD1-CG2 3.93Å; L287-Y366 HydrophobicContact CD1-CD2 4.21Å; L287-I369 HydrophobicContact CB-CB 4.38Å; L287-I369 HydrophobicContact CB-CG2 4.08Å; L287-L384 HydrophobicContact CD1-CD2 4.28Å
288	F	96.8	Very high	93	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	160.2	178.5	-61.5	-102.9	0	0	0	112.4	P223 L252 C254 F265 E267 L268 A286 S295 A296 C298 Y300	P223-F288 HydrophobicContact CB-CD1 4.4Å; P223-F288 HydrophobicContact CB-CE1 3.68Å; P223-F288 HydrophobicContact CG-CE1 3.91Å; L252-F288 HydrophobicContact CB-CE1 4.41Å; L252-F288 HydrophobicContact CB-CZ 4.15Å; C254-F288 HydrophobicContact CB-CD1 4.12Å; C254-F288 HydrophobicContact CB-CD2 3.55Å; C254-F288 HydrophobicContact CB-CE1 4.11Å; C254-F288 HydrophobicContact CB-CE2 3.54Å; C254-F288 HydrophobicContact CB-CG 3.86Å; C254-F288 HydrophobicContact CB-CZ 3.84Å; C254-F288 VanDerWaalsContact SG-CD2 3.55Å; F265-F288 HydrophobicContact CB-CB 3.44Å; F265-F288 VanDerWaalsContact CB-CB 3.44Å; F265-F288 HydrophobicContact CB-CD1 4.5Å; F265-F288 HydrophobicContact CB-CG 4.17Å; F265-F288 HydrophobicContact CD1-CB 4.45Å; F265-F288 HydrophobicContact CG-CB 4.25Å; E267-F288 CarbonylContact O-C 3.54Å; E267-F288 WeakPolarHBondContact O-CA 3.47Å; L268-F288 HydrophobicContact CB-CD1 4.32Å; L268-F288 HydrophobicContact CB-CE1 4.22Å; L268-F288 HydrophobicContact CD1-CD1 4.2Å; L268-F288 HydrophobicContact CD1-CD2 4.42Å; L268-F288 HydrophobicContact CD1-CE1 3.87Å; L268-F288 HydrophobicContact CD1-CE2 4.1Å; L268-F288 HydrophobicContact CD1-CG 4.46Å; L268-F288 HydrophobicContact CD1-CZ 3.81Å; A286-F288 HydrophobicContact CB-CD2 4.18Å; A286-F288 HydrophobicContact CB-CE2 3.39Å; A286-F288 HydrophobicContact CB-CZ 3.94Å; A286-F288 VanDerWaalsContact O-CD2 3.28Å; A286-F288 WeakPolarHBondContact O-CD2 3.1Å; A286-F288 WeakPolarHBondContact O-CE2 3.48Å; F288-S295 CarbonylContact O-C 3.56Å; F288-S295 VanDerWaalsContact O-CA 3.23Å; F288-S295 WeakPolarHBondContact O-CA 3.38Å; F288-A296 PolarHBondContact N-O 2.84Å; F288-A296 PolarHBondContact O-N 2.92Å; F288-C298 HydrophobicContact CD2-CB 4.47Å; F288-C298 HydrophobicContact CE2-CB 4.05Å; F288-Y300 HydrophobicContact CE2-CE2 4.13Å; F288-Y300 HydrophobicContact CZ-CE2 4.25Å; F288-Y300 WeakPolarHBondContact CZ-OH 3.34Å
289	R	93.7	Very high	93.2	Very high	61 Å²	61	35.2 Å²	35.2	23%	0.23	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	155.5	172.3	-173.7	169.1	65.2	-169.9	1.8	111.2	F266 E267 V269 M294 N365	F266-R289 PolarHBondContact N-O 2.91Å; E267-R289 HydrophobicContact CB-CB 4.36Å; E267-R289 WeakPolarHBondContact CB-O 3.46Å; E267-R289 PolarHBondContact N-O 3.39Å; E267-R289 VanDerWaalsContact N-O 3.07Å; E267-R289 PolarHBondContact O-N 2.96Å; E267-R289 IonicContact OE1-CZ 3.82Å; E267-R289 IonicContact OE1-NH2 3.09Å; E267-R289 PolarHBondContact OE1-NH2 2.95Å; E267-R289 IonicContact OE2-CZ 3.44Å; E267-R289 VanDerWaalsContact OE2-CZ 3.23Å; E267-R289 IonicContact OE2-NE 2.99Å; E267-R289 PolarHBondContact OE2-NE 3.46Å; E267-R289 IonicContact OE2-NH2 3.3Å; E267-R289 PolarHBondContact OE2-NH2 2.85Å; V269-R289 HydrophobicContact CG2-CB 3.7Å; R289-M294 VanDerWaalsContact CA-O 3.31Å; R289-M294 WeakPolarHBondContact CA-O 3.4Å; R289-N365 WeakPolarHBondContact CD-OD1 3.29Å; R289-N365 PolarHBondContact NH1-OD1 2.84Å
290	N	89.3	Confident	93.4	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.027	15%	0.152	C	C	.	.			trans	-120.5	-178.5	173.6	68.4	17.1	0	0	0	112.4	F265 F266 W292 G293 M294	F265-N290 HydrophobicContact CD1-CB 3.87Å; F265-N290 HydrophobicContact CE1-CB 4.19Å; F265-N290 WeakPolarHBondContact CE1-ND2 3.36Å; F265-N290 HydrophobicContact CG-CB 4.44Å; F266-N290 HydrophobicContact CE1-CB 4.09Å; N290-W292 HydrophobicContact CB-CE3 4.42Å; N290-W292 PolarHBondContact O-N 2.81Å; N290-W292 PolarHBondContact OD1-N 3.11Å; N290-G293 PolarHBondContact O-N 2.87Å; N290-G293 PolarHBondContact OD1-N 3.27Å; N290-M294 PolarHBondContact N-O 2.78Å; N290-M294 VanDerWaalsContact N-O 3.15Å; N290-M294 WeakPolarHBondContact ND2-CE 3.26Å; N290-M294 WeakPolarHBondContact OD1-CB 3.47Å; N290-M294 PolarHBondContact OD1-N 2.93Å; N290-M294 VanDerWaalsContact OD1-N 3.08Å; N290-M294 PolarHBondContact OD1-O 2.81Å
291	E	84.6	Confident	93.5	Very high	120 Å²	120	28.2 Å²	28.2	56%	0.561	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-26.3	-175.3	-62.8	-176.7	147.6	0	0	113.9	F266 G293	F266-E291 HydrophobicContact CE1-CB 4.49Å; F266-E291 HydrophobicContact CE1-CG 3.54Å; F266-E291 HydrophobicContact CZ-CB 4.31Å; F266-E291 HydrophobicContact CZ-CG 3.31Å; E291-G293 VanDerWaalsContact C-N 3.27Å; E291-G293 PolarHBondContact O-N 2.79Å
292	W	83.3	Confident	93.6	Very high	172 Å²	172	24.8 Å²	24.8	65%	0.652	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	6.9	179.8	-54.8	-73.4	0	0	0	113.1	N290 M294	N290-W292 HydrophobicContact CB-CE3 4.42Å; N290-W292 PolarHBondContact O-N 2.81Å; N290-W292 PolarHBondContact OD1-N 3.11Å; W292-M294 HydrophobicContact CB-CE 4.06Å; W292-M294 HydrophobicContact CB-CG 4.29Å; W292-M294 HydrophobicContact CD2-CE 4.07Å; W292-M294 HydrophobicContact CE3-CE 3.47Å; W292-M294 VanDerWaalsContact CE3-CE 3.47Å; W292-M294 HydrophobicContact CG-CE 4.35Å; W292-M294 HydrophobicContact CZ3-CE 4.22Å; W292-M294 PolarHBondContact O-N 2.88Å
293	G	83.6	Confident	93.7	Very high	24 Å²	24	25.2 Å²	25.2	25%	0.247	12%	0.119	C	C	.	.	S	Bend	trans	71.7	12.9	-178	0	0	0	0	0	114.1	N290 E291	N290-G293 PolarHBondContact O-N 2.87Å; N290-G293 PolarHBondContact OD1-N 3.27Å; E291-G293 VanDerWaalsContact C-N 3.27Å; E291-G293 PolarHBondContact O-N 2.79Å
294	M	89.6	Confident	93.7	Very high	22 Å²	22	23.9 Å²	23.9	11%	0.108	12%	0.117	C	C	.	.			trans	-77.1	147.4	172.1	-56.4	-175.7	-75.9	0	0	109.5	F265 R289 N290 W292 F361 N362 H363	F265-M294 HydrophobicContact CE1-CB 4.08Å; F265-M294 WeakPolarHBondContact CE1-O 3.36Å; R289-M294 VanDerWaalsContact CA-O 3.31Å; R289-M294 WeakPolarHBondContact CA-O 3.4Å; N290-M294 PolarHBondContact N-O 2.78Å; N290-M294 VanDerWaalsContact N-O 3.15Å; N290-M294 WeakPolarHBondContact ND2-CE 3.26Å; N290-M294 WeakPolarHBondContact OD1-CB 3.47Å; N290-M294 PolarHBondContact OD1-N 2.93Å; N290-M294 VanDerWaalsContact OD1-N 3.08Å; N290-M294 PolarHBondContact OD1-O 2.81Å; W292-M294 HydrophobicContact CB-CE 4.06Å; W292-M294 HydrophobicContact CB-CG 4.29Å; W292-M294 HydrophobicContact CD2-CE 4.07Å; W292-M294 HydrophobicContact CE3-CE 3.47Å; W292-M294 VanDerWaalsContact CE3-CE 3.47Å; W292-M294 HydrophobicContact CG-CE 4.35Å; W292-M294 HydrophobicContact CZ3-CE 4.22Å; W292-M294 PolarHBondContact O-N 2.88Å; M294-F361 HydrophobicContact CE-CE2 4.49Å; M294-F361 HydrophobicContact SD-CE2 4Å; M294-F361 HydrophobicContact SD-CZ 3.61Å; M294-N362 CarbonylContact C-O 3.59Å; M294-N362 WeakPolarHBondContact CA-O 3.49Å; M294-H363 PolarHBondContact SD-CE1 2.83Å; M294-H363 PolarHBondContact SD-ND1 2.91Å; M294-H363 VanDerWaalsContact SD-ND1 3.41Å
295	S	94.1	Very high	93.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	149.6	178.5	-55.2	0	0	0	0	111.9	F288 N362 H364 Y366	F288-S295 CarbonylContact O-C 3.56Å; F288-S295 VanDerWaalsContact O-CA 3.23Å; F288-S295 WeakPolarHBondContact O-CA 3.38Å; S295-N362 PolarHBondContact N-O 2.79Å; S295-N362 PolarHBondContact O-N 3.21Å; S295-H364 VanDerWaalsContact CB-O 3.25Å; S295-H364 WeakPolarHBondContact CB-O 3.42Å; S295-H364 PolarHBondContact OG-O 3.23Å; S295-Y366 VanDerWaalsContact CB-CD2 3.5Å; S295-Y366 PolarHBondContact OG-N 3.49Å; S295-Y366 VanDerWaalsContact OG-N 3.11Å
296	A	94.6	Very high	93.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	146.4	174	0	0	0	0	0	111.2	F265 F288 P358 L360	F265-A296 HydrophobicContact CD1-CB 3.66Å; F265-A296 HydrophobicContact CD2-CB 3.58Å; F265-A296 HydrophobicContact CE1-CB 3.59Å; F265-A296 HydrophobicContact CE2-CB 3.52Å; F265-A296 HydrophobicContact CG-CB 3.67Å; F265-A296 HydrophobicContact CZ-CB 3.53Å; F288-A296 PolarHBondContact N-O 2.84Å; F288-A296 PolarHBondContact O-N 2.92Å; A296-P358 HydrophobicContact CB-CB 4.02Å; A296-P358 HydrophobicContact CB-CG 4.34Å; A296-L360 CarbonylContact C-O 3.5Å; A296-L360 WeakPolarHBondContact CA-O 3.45Å
297	V	95.7	Very high	93.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.9	170.4	-176.5	0	0	0	0	108.3	Y285 A286 L287 P358 V359 L360 I369 M382 L384	Y285-V297 HydrophobicContact CD1-CG1 4.07Å; A286-V297 WeakPolarHBondContact O-CA 3.3Å; L287-V297 HydrophobicContact CD1-CG2 3.93Å; V297-P358 CarbonylContact O-C 3.56Å; V297-P358 VanDerWaalsContact O-CA 3.26Å; V297-P358 WeakPolarHBondContact O-CA 3.37Å; V297-V359 HydrophobicContact CB-CG2 3.95Å; V297-V359 HydrophobicContact CG1-CG2 3.89Å; V297-V359 VanDerWaalsContact O-CG2 3.31Å; V297-V359 WeakPolarHBondContact O-CG2 3.41Å; V297-V359 PolarHBondContact O-N 2.83Å; V297-L360 HydrophobicContact CB-CB 4.17Å; V297-L360 HydrophobicContact CG2-CB 4.21Å; V297-L360 HydrophobicContact CG2-CD2 4.42Å; V297-L360 PolarHBondContact N-O 2.82Å; V297-I369 HydrophobicContact CG1-CD1 3.81Å; V297-I369 HydrophobicContact CG2-CD1 4.05Å; V297-M382 HydrophobicContact CB-SD 4.38Å; V297-M382 HydrophobicContact CG1-SD 3.89Å; V297-M382 HydrophobicContact CG2-SD 4.45Å; V297-L384 HydrophobicContact CG2-CD2 4.1Å
298	C	95.4	Very high	93.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142.6	171.6	-77.6	0	0	0	0	109.9	C254 A286 F288 Y300 P354	C254-C298 WeakPolarHBondContact CA-SG 3.05Å; C254-C298 HydrophobicContact CB-CB 3.84Å; C254-C298 WeakPolarHBondContact CB-SG 3.49Å; C254-C298 WeakPolarHBondContact SG-CB 3.29Å; C254-C298 CovalentContact SG-SG 2.04Å; C254-C298 PolarHBondContact SG-SG 3.3Å; A286-C298 PolarHBondContact N-O 3.22Å; A286-C298 PolarHBondContact O-N 2.89Å; F288-C298 HydrophobicContact CD2-CB 4.47Å; F288-C298 HydrophobicContact CE2-CB 4.05Å; C298-Y300 HydrophobicContact CB-CE2 3.92Å; C298-P354 HydrophobicContact CB-CB 4.25Å; C298-P354 HydrophobicContact CB-CG 4.24Å
299	V	95.4	Very high	93.4	Very high	27 Å²	27	28.8 Å²	28.8	16%	0.164	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.9	-178.4	-170.9	0	0	0	0	109.6	R283 V284 Y285 P354 V359	R283-V299 HydrophobicContact CB-CG1 4.13Å; R283-V299 HydrophobicContact CG-CG1 4.23Å; V284-V299 WeakPolarHBondContact O-CA 3.16Å; Y285-V299 HydrophobicContact CD1-CG2 3.54Å; Y285-V299 HydrophobicContact CD2-CG1 4.33Å; Y285-V299 HydrophobicContact CE1-CG1 4.36Å; Y285-V299 HydrophobicContact CE1-CG2 3.39Å; Y285-V299 HydrophobicContact CE2-CG1 4.01Å; Y285-V299 HydrophobicContact CE2-CG2 4.48Å; Y285-V299 HydrophobicContact CG-CG2 4.15Å; V299-P354 VanDerWaalsContact O-CB 3.31Å; V299-P354 WeakPolarHBondContact O-CB 3.33Å; V299-V359 HydrophobicContact CG2-CB 4.46Å; V299-V359 HydrophobicContact CG2-CG1 3.84Å; V299-V359 HydrophobicContact CG2-CG2 3.76Å
300	Y	96.2	Very high	93.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	153	175.7	-52	-88	0	0	0	109.6	L252 Y253 R283 V284 A286 F288 C298 V352 P354	L252-Y300 HydrophobicContact CD2-CD1 4.26Å; L252-Y300 HydrophobicContact CD2-CD2 4.35Å; L252-Y300 HydrophobicContact CD2-CE1 3.96Å; L252-Y300 HydrophobicContact CD2-CE2 4.09Å; L252-Y300 HydrophobicContact CD2-CG 4.42Å; Y253-Y300 PolarHBondContact O-OH 3.08Å; R283-Y300 CarbonylContact C-O 3.45Å; R283-Y300 WeakPolarHBondContact CA-O 3.49Å; V284-Y300 PolarHBondContact N-O 3.2Å; V284-Y300 PolarHBondContact O-N 3.49Å; A286-Y300 HydrophobicContact CB-CD2 4.27Å; A286-Y300 HydrophobicContact CB-CE2 3.85Å; F288-Y300 HydrophobicContact CE2-CE2 4.13Å; F288-Y300 HydrophobicContact CZ-CE2 4.25Å; F288-Y300 WeakPolarHBondContact CZ-OH 3.34Å; C298-Y300 HydrophobicContact CB-CE2 3.92Å; Y300-V352 HydrophobicContact CD1-CG1 3.63Å; Y300-V352 HydrophobicContact CE1-CG1 4.08Å; Y300-V352 HydrophobicContact CG-CG1 4.46Å; Y300-P354 HydrophobicContact CD1-CB 4.3Å; Y300-P354 HydrophobicContact CE1-CB 4.06Å; Y300-P354 HydrophobicContact CE1-CG 4.34Å
301	T	96.5	Very high	93.5	Very high	13 Å²	13	37.3 Å²	37.3	8%	0.08	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	148.8	166.9	70.4	0	0	0	0	110	K280 T282 R283 G303 D304 I305	K280-T301 WeakPolarHBondContact O-CB 3.38Å; T282-T301 WeakPolarHBondContact O-CA 3.4Å; R283-T301 HydrophobicContact CG-CG2 4.28Å; T301-G303 PolarHBondContact O-N 2.83Å; T301-D304 PolarHBondContact O-N 2.82Å; T301-D304 VanDerWaalsContact O-N 3.14Å; T301-D304 WeakPolarHBondContact OG1-CB 3.44Å; T301-D304 PolarHBondContact OG1-N 2.97Å; T301-D304 PolarHBondContact OG1-OD1 3.02Å; T301-D304 PolarHBondContact OG1-OD2 3.14Å; T301-I305 WeakPolarHBondContact O-CG1 3.36Å; T301-I305 PolarHBondContact O-N 3.19Å; T301-I305 VanDerWaalsContact O-N 3.07Å
302	I	96.7	Very high	93.9	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-60.4	-31.2	173.7	-62.4	-65.1	0	0	0	110.6	V190 Y204 W279 T282 V284 I305 E306	V190-I302 HydrophobicContact CG1-CD1 4.36Å; Y204-I302 HydrophobicContact CD2-CD1 4.02Å; Y204-I302 HydrophobicContact CD2-CG2 4.17Å; Y204-I302 HydrophobicContact CE2-CD1 4.43Å; Y204-I302 HydrophobicContact CE2-CG2 3.54Å; Y204-I302 HydrophobicContact CG-CD1 4.21Å; W279-I302 HydrophobicContact CE3-CG2 3.76Å; W279-I302 HydrophobicContact CZ3-CG2 3.91Å; T282-I302 HydrophobicContact CG2-CG1 3.77Å; T282-I302 PolarHBondContact O-N 3.04Å; V284-I302 HydrophobicContact CG2-CD1 3.94Å; I302-I305 HydrophobicContact CD1-CD1 4.21Å; I302-I305 PolarHBondContact O-N 2.87Å; I302-E306 WeakPolarHBondContact O-CB 3.41Å; I302-E306 PolarHBondContact O-N 3.07Å
303	G	95.9	Very high	94.3	Very high	16 Å²	16	25.4 Å²	25.4	17%	0.165	14%	0.136	C	C	.	.	H	α-helix	trans	-60.3	-46.5	172.1	0	0	0	0	0	113.4	K280 T301 E306 N307	K280-G303 PolarHBondContact O-N 3.38Å; T301-G303 PolarHBondContact O-N 2.83Å; G303-E306 PolarHBondContact O-N 2.85Å; G303-N307 PolarHBondContact O-N 2.93Å
304	D	95.9	Very high	94.7	Very high	36 Å²	36	24.2 Å²	24.2	19%	0.193	12%	0.124	C	C	.	.	H	α-helix	trans	-68.1	-37.6	178.8	-56.9	-32	0	0	0	111.5	T301 N307 V308 R355	T301-D304 PolarHBondContact O-N 2.82Å; T301-D304 VanDerWaalsContact O-N 3.14Å; T301-D304 WeakPolarHBondContact OG1-CB 3.44Å; T301-D304 PolarHBondContact OG1-N 2.97Å; T301-D304 PolarHBondContact OG1-OD1 3.02Å; T301-D304 PolarHBondContact OG1-OD2 3.14Å; D304-N307 WeakPolarHBondContact O-CB 3.37Å; D304-N307 PolarHBondContact O-N 3.43Å; D304-V308 PolarHBondContact O-N 2.61Å; D304-R355 IonicContact OD1-CZ 2.72Å; D304-R355 IonicContact OD1-NE 3.43Å; D304-R355 PolarHBondContact OD1-NE 2.9Å; D304-R355 IonicContact OD1-NH2 2.91Å; D304-R355 PolarHBondContact OD1-NH2 3.28Å; D304-R355 WeakPolarHBondContact OD2-CG 3.11Å; D304-R355 IonicContact OD2-CZ 2.67Å; D304-R355 IonicContact OD2-NE 3.32Å; D304-R355 PolarHBondContact OD2-NE 3.4Å; D304-R355 IonicContact OD2-NH2 3.63Å
305	I	97.6	Very high	94.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.8	-47.9	174.2	-68.6	163.7	0	0	0	110.4	Y204 F206 V225 T301 I302 N307 V308 F309 V352	Y204-I305 HydrophobicContact CD1-CG2 3.88Å; Y204-I305 HydrophobicContact CE1-CG2 3.68Å; F206-I305 HydrophobicContact CE1-CD1 3.97Å; F206-I305 HydrophobicContact CZ-CD1 3.87Å; V225-I305 HydrophobicContact CG1-CG2 4.13Å; V225-I305 HydrophobicContact CG2-CG2 4.12Å; T301-I305 WeakPolarHBondContact O-CG1 3.36Å; T301-I305 PolarHBondContact O-N 3.19Å; T301-I305 VanDerWaalsContact O-N 3.07Å; I302-I305 HydrophobicContact CD1-CD1 4.21Å; I302-I305 PolarHBondContact O-N 2.87Å; I305-N307 VanDerWaalsContact C-N 3.28Å; I305-N307 PolarHBondContact O-N 2.79Å; I305-V308 PolarHBondContact O-N 2.86Å; I305-F309 HydrophobicContact CG2-CD2 3.78Å; I305-F309 HydrophobicContact CG2-CE2 3.49Å; I305-F309 VanDerWaalsContact CG2-CE2 3.49Å; I305-F309 VanDerWaalsContact O-CD2 3.26Å; I305-F309 WeakPolarHBondContact O-CD2 3.39Å; I305-F309 PolarHBondContact O-N 3.3Å; I305-V352 HydrophobicContact CG1-CG1 3.68Å; I305-V352 HydrophobicContact CG1-CG2 4.45Å
306	E	95.4	Very high	93.9	Very high	24 Å²	24	33 Å²	33	11%	0.112	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-39.3	175.7	168.9	151.1	-97.4	0	0	111.9	R194 K202 W279 I302 G303 V308 F309 T310	R194-E306 IonicContact CZ-OE1 3.03Å; R194-E306 IonicContact CZ-OE2 2.74Å; R194-E306 IonicContact NH1-OE1 2.89Å; R194-E306 PolarHBondContact NH1-OE1 3.07Å; R194-E306 IonicContact NH1-OE2 2.69Å; R194-E306 PolarHBondContact NH1-OE2 3.16Å; R194-E306 IonicContact NH2-OE1 3.44Å; R194-E306 PolarHBondContact NH2-OE1 3.4Å; R194-E306 IonicContact NH2-OE2 3.1Å; R194-E306 PolarHBondContact NH2-OE2 3.25Å; K202-E306 IonicContact NZ-OE1 2.89Å; K202-E306 PolarHBondContact NZ-OE1 2.94Å; W279-E306 HydrophobicContact CH2-CB 4.44Å; W279-E306 WeakPolarHBondContact CH2-OE2 3.38Å; W279-E306 HydrophobicContact CZ3-CB 4.36Å; I302-E306 WeakPolarHBondContact O-CB 3.41Å; I302-E306 PolarHBondContact O-N 3.07Å; G303-E306 PolarHBondContact O-N 2.85Å; E306-V308 PolarHBondContact O-N 3.16Å; E306-F309 PolarHBondContact O-N 2.71Å; E306-F309 VanDerWaalsContact O-N 3.11Å; E306-T310 HydrophobicContact CG-CG2 3.79Å; E306-T310 WeakPolarHBondContact O-CB 3.45Å; E306-T310 WeakPolarHBondContact O-CG2 3.34Å; E306-T310 PolarHBondContact O-N 3.37Å; E306-T310 PolarHBondContact O-OG1 2.86Å
307	N	95.5	Very high	92.9	Very high	64 Å²	64	33.7 Å²	33.7	34%	0.342	18%	0.176	S	C	.	.	H	α-helix	trans	-57.9	-38.1	178.8	-172.1	56.7	0	0	0	111.7	G303 D304 I305 T310 R311	G303-N307 PolarHBondContact O-N 2.93Å; D304-N307 WeakPolarHBondContact O-CB 3.37Å; D304-N307 PolarHBondContact O-N 3.43Å; I305-N307 VanDerWaalsContact C-N 3.28Å; I305-N307 PolarHBondContact O-N 2.79Å; N307-T310 WeakPolarHBondContact CA-OG1 3.21Å; N307-T310 PolarHBondContact O-OG1 2.96Å; N307-T310 VanDerWaalsContact O-OG1 3.12Å; N307-R311 VanDerWaalsContact O-CB 3.29Å; N307-R311 WeakPolarHBondContact O-CB 3.42Å; N307-R311 WeakPolarHBondContact O-CG 2.89Å; N307-R311 PolarHBondContact O-N 3.47Å; N307-R311 WeakPolarHBondContact OD1-CD 3.31Å; N307-R311 PolarHBondContact OD1-NE 2.84Å
308	V	96.1	Very high	91.5	Very high	19 Å²	19	40.2 Å²	40.2	12%	0.115	21%	0.21	C	C	.	.	H	α-helix	trans	-65.6	-49.8	173	174.7	0	0	0	0	111.3	A250 D304 I305 E306 T310 R311 S312 M348 E350 V352	A250-V308 HydrophobicContact CB-CG1 4.11Å; D304-V308 PolarHBondContact O-N 2.61Å; I305-V308 PolarHBondContact O-N 2.86Å; E306-V308 PolarHBondContact O-N 3.16Å; V308-T310 PolarHBondContact O-N 3.07Å; V308-R311 PolarHBondContact O-N 3.23Å; V308-S312 WeakPolarHBondContact O-CA 3.39Å; V308-S312 WeakPolarHBondContact O-CB 3.45Å; V308-S312 PolarHBondContact O-N 3.14Å; V308-M348 HydrophobicContact CG1-CB 4.27Å; V308-M348 HydrophobicContact CG1-CG 4.46Å; V308-E350 HydrophobicContact CG1-CB 4.33Å; V308-V352 HydrophobicContact CB-CG2 4Å; V308-V352 HydrophobicContact CG1-CG2 4.11Å; V308-V352 HydrophobicContact CG2-CB 4.49Å; V308-V352 HydrophobicContact CG2-CG2 3.93Å
309	F	95.4	Very high	90.3	Very high	1 Å²	1	47.6 Å²	47.6	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-62.3	-29.3	-179.7	-74.7	-60.9	0	0	0	113.9	Y204 V225 Q227 M248 A250 I305 E306 K325 M348	Y204-F309 HydrophobicContact CD1-CE2 4.47Å; Y204-F309 HydrophobicContact CE1-CD2 4.3Å; Y204-F309 HydrophobicContact CE1-CE2 4.23Å; V225-F309 HydrophobicContact CG1-CE2 4.29Å; V225-F309 HydrophobicContact CG1-CZ 4.26Å; Q227-F309 HydrophobicContact CB-CD2 4.3Å; Q227-F309 HydrophobicContact CB-CE2 4.05Å; Q227-F309 HydrophobicContact CB-CZ 4.35Å; Q227-F309 HydrophobicContact CG-CD1 3.9Å; Q227-F309 HydrophobicContact CG-CD2 3.74Å; Q227-F309 HydrophobicContact CG-CE1 3.97Å; Q227-F309 HydrophobicContact CG-CE2 3.78Å; Q227-F309 HydrophobicContact CG-CG 3.8Å; Q227-F309 HydrophobicContact CG-CZ 3.91Å; Q227-F309 VanDerWaalsContact OE1-CB 3.32Å; Q227-F309 VanDerWaalsContact OE1-CD2 3.3Å; M248-F309 HydrophobicContact CB-CD1 3.8Å; M248-F309 HydrophobicContact CB-CE1 3.78Å; M248-F309 HydrophobicContact CE-CB 4.42Å; M248-F309 HydrophobicContact CE-CD1 4.43Å; A250-F309 HydrophobicContact CB-CE1 3.95Å; A250-F309 HydrophobicContact CB-CZ 3.94Å; I305-F309 HydrophobicContact CG2-CD2 3.78Å; I305-F309 HydrophobicContact CG2-CE2 3.49Å; I305-F309 VanDerWaalsContact CG2-CE2 3.49Å; I305-F309 VanDerWaalsContact O-CD2 3.26Å; I305-F309 WeakPolarHBondContact O-CD2 3.39Å; I305-F309 PolarHBondContact O-N 3.3Å; E306-F309 PolarHBondContact O-N 2.71Å; E306-F309 VanDerWaalsContact O-N 3.11Å; F309-K325 WeakPolarHBondContact O-CD 3.23Å; F309-M348 HydrophobicContact CD1-CE 4Å; F309-M348 HydrophobicContact CD1-CG 3.8Å; F309-M348 HydrophobicContact CD1-SD 4.4Å; F309-M348 HydrophobicContact CE1-CG 4.03Å
310	T	93.4	Very high	88.8	Confident	53 Å²	53	51.7 Å²	51.7	33%	0.325	26%	0.263	S	S	.	.	H	α-helix	trans	-86.3	-42	-179.8	51.7	0	0	0	0	112.3	E306 N307 V308 K325	E306-T310 HydrophobicContact CG-CG2 3.79Å; E306-T310 WeakPolarHBondContact O-CB 3.45Å; E306-T310 WeakPolarHBondContact O-CG2 3.34Å; E306-T310 PolarHBondContact O-N 3.37Å; E306-T310 PolarHBondContact O-OG1 2.86Å; N307-T310 WeakPolarHBondContact CA-OG1 3.21Å; N307-T310 PolarHBondContact O-OG1 2.96Å; N307-T310 VanDerWaalsContact O-OG1 3.12Å; V308-T310 PolarHBondContact O-N 3.07Å; T310-K325 VanDerWaalsContact O-CD 3.29Å; T310-K325 WeakPolarHBondContact O-CD 3.42Å; T310-K325 PolarHBondContact O-NZ 3.32Å
311	R	92.5	Very high	87.9	Confident	192 Å²	192	52.3 Å²	52.3	73%	0.725	27%	0.267	S	S	*	.	H	α-helix	trans	-96.6	-31.9	-173.3	-60.2	-169.8	-178.5	172.8	5.7	114.5	N307 V308	N307-R311 VanDerWaalsContact O-CB 3.29Å; N307-R311 WeakPolarHBondContact O-CB 3.42Å; N307-R311 WeakPolarHBondContact O-CG 2.89Å; N307-R311 PolarHBondContact O-N 3.47Å; N307-R311 WeakPolarHBondContact OD1-CD 3.31Å; N307-R311 PolarHBondContact OD1-NE 2.84Å; V308-R311 PolarHBondContact O-N 3.23Å
312	S	92.8	Very high	87	Confident	4 Å²	4	56.3 Å²	56.3	3%	0.028	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-65.2	141	-177.8	-175.8	0	0	0	0	111.1	V308 K325 K349 E350	V308-S312 WeakPolarHBondContact O-CA 3.39Å; V308-S312 WeakPolarHBondContact O-CB 3.45Å; V308-S312 PolarHBondContact O-N 3.14Å; S312-K325 WeakPolarHBondContact O-CE 3.43Å; S312-K325 PolarHBondContact O-NZ 3.18Å; S312-K349 PolarHBondContact OG-N 3.46Å; S312-E350 WeakPolarHBondContact OG-CB 3.42Å; S312-E350 PolarHBondContact OG-N 3.06Å
313	P	92.3	Very high	86.1	Confident	37 Å²	37	62.3 Å²	62.3	24%	0.24	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-69.6	166.1	159.9	29.3	-31.4	0	0	0	110.6	S317 K349	P313-S317 WeakPolarHBondContact CB-O 3.45Å; P313-K349 HydrophobicContact CG-CB 4.02Å; P313-K349 HydrophobicContact CG-CD 3.84Å; P313-K349 WeakPolarHBondContact O-CB 3.2Å; P313-K349 PolarHBondContact O-N 2.73Å
314	F	91.4	Very high	85.5	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-81.4	156.1	168.5	-69.2	-89.3	0	0	0	110	M248 D316 S317 E321 V345 E347 M348	M248-F314 HydrophobicContact CG-CE1 4.28Å; M248-F314 HydrophobicContact CG-CZ 4.27Å; M248-F314 HydrophobicContact SD-CE1 4.33Å; M248-F314 HydrophobicContact SD-CZ 3.82Å; F314-D316 VanDerWaalsContact C-N 3.28Å; F314-D316 PolarHBondContact O-N 2.86Å; F314-S317 PolarHBondContact O-N 2.81Å; F314-S317 VanDerWaalsContact O-N 3.14Å; F314-S317 VanDerWaalsContact O-O 3.13Å; F314-E321 HydrophobicContact CD2-CG 4.46Å; F314-E321 VanDerWaalsContact CD2-OE1 3.23Å; F314-E321 WeakPolarHBondContact CD2-OE1 3.36Å; F314-E321 HydrophobicContact CE2-CB 4.21Å; F314-V345 HydrophobicContact CB-CG1 3.69Å; F314-V345 HydrophobicContact CD1-CG1 4Å; F314-V345 HydrophobicContact CG-CG1 4.16Å; F314-E347 WeakPolarHBondContact CA-O 3.47Å; F314-M348 HydrophobicContact CD1-CE 3.67Å; F314-M348 HydrophobicContact CD1-SD 4.33Å; F314-M348 HydrophobicContact CE1-CE 3.13Å; F314-M348 HydrophobicContact CE1-SD 4.32Å; F314-M348 HydrophobicContact CE2-CE 4.13Å; F314-M348 HydrophobicContact CG-CE 4.38Å; F314-M348 HydrophobicContact CZ-CE 3.41Å; F314-M348 VanDerWaalsContact CZ-CE 3.41Å
315	I	88.1	Confident	85.1	Confident	71 Å²	71	61.2 Å²	61.2	36%	0.364	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-42.3	-174.5	-75.3	178.8	0	0	0	113.4	E347 K349	I315-E347 HydrophobicContact CD1-CB 3.94Å; I315-E347 VanDerWaalsContact CD1-CD 3.46Å; I315-E347 HydrophobicContact CD1-CG 3.54Å; I315-E347 WeakPolarHBondContact CD1-OE1 3.28Å; I315-E347 HydrophobicContact CG1-CB 4.48Å; I315-E347 HydrophobicContact CG1-CG 4.34Å; I315-E347 PolarHBondContact N-O 2.74Å; I315-K349 HydrophobicContact CG1-CB 4.45Å
316	D	80.1	Confident	84.7	Confident	134 Å²	134	66.7 Å²	66.7	72%	0.717	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	21.4	-176.3	-60.1	-43.1	0	0	0	113.3	F314	F314-D316 VanDerWaalsContact C-N 3.28Å; F314-D316 PolarHBondContact O-N 2.86Å
317	S	73.6	Confident	84.6	Confident	16 Å²	16	65.9 Å²	65.9	11%	0.112	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-148.9	120	177.5	-161	0	0	0	0	113.4	P313 F314 K319 R341	P313-S317 WeakPolarHBondContact CB-O 3.45Å; F314-S317 PolarHBondContact O-N 2.81Å; F314-S317 VanDerWaalsContact O-N 3.14Å; F314-S317 VanDerWaalsContact O-O 3.13Å; S317-K319 VanDerWaalsContact C-N 3.29Å; S317-K319 PolarHBondContact OG-N 2.85Å; S317-R341 PolarHBondContact OG-NH2 2.6Å
318	D	66	Low	84.5	Confident	136 Å²	136	65.1 Å²	65.1	73%	0.727	32%	0.323	S	S	*	.			trans	-85.7	-1.2	171.5	-58	-49.5	0	0	0	112.9	K349	D318-K349 IonicContact OD1-NZ 2.71Å; D318-K349 PolarHBondContact OD1-NZ 3.35Å
319	K	68.6	Low	84.3	Confident	155 Å²	155	71.4 Å²	71.4	67%	0.674	36%	0.355	S	S	*	.	S	Bend	trans	-77.2	134.1	176.3	-69	-173.3	178.7	-177.5	0	109.9	S317 E321	S317-K319 VanDerWaalsContact C-N 3.29Å; S317-K319 PolarHBondContact OG-N 2.85Å; K319-E321 PolarHBondContact O-N 3.4Å; K319-E321 VanDerWaalsContact O-N 3.08Å
320	N	65.4	Low	84.2	Confident	113 Å²	113	73.6 Å²	73.6	60%	0.604	37%	0.367	S	S	*	.			trans	-71.2	105.2	171.4	-169.5	21.3	0	0	0	109.7	E322 K325	N320-E322 VanDerWaalsContact C-N 3.34Å; N320-E322 PolarHBondContact O-N 2.81Å; N320-K325 PolarHBondContact OD1-NZ 3.06Å
321	E	76.8	Confident	84.3	Confident	14 Å²	14	71.1 Å²	71.1	7%	0.065	35%	0.352	C	S	.	.			trans	-92.8	60.1	179.9	-56.9	-170.5	-121.3	0	0	111.6	F314 K319 D323 R324 R341	F314-E321 HydrophobicContact CD2-CG 4.46Å; F314-E321 VanDerWaalsContact CD2-OE1 3.23Å; F314-E321 WeakPolarHBondContact CD2-OE1 3.36Å; F314-E321 HydrophobicContact CE2-CB 4.21Å; K319-E321 PolarHBondContact O-N 3.4Å; K319-E321 VanDerWaalsContact O-N 3.08Å; E321-D323 PolarHBondContact O-N 3.36Å; E321-R324 HydrophobicContact CB-CB 4.34Å; E321-R324 PolarHBondContact O-N 3.28Å; E321-R324 VanDerWaalsContact O-N 3.09Å; E321-R324 IonicContact OE1-NH1 2.75Å; E321-R324 PolarHBondContact OE1-NH1 2.79Å; E321-R324 WeakPolarHBondContact OE2-CD 3.44Å; E321-R324 IonicContact OE2-CZ 2.73Å; E321-R324 IonicContact OE2-NE 3.69Å; E321-R324 IonicContact OE2-NH1 3.47Å; E321-R324 PolarHBondContact OE2-NH1 3.46Å; E321-R341 IonicContact OE1-CZ 3.53Å; E321-R341 IonicContact OE1-NE 3.36Å; E321-R341 IonicContact OE1-NH1 3.19Å; E321-R341 IonicContact OE1-NH2 2.83Å; E321-R341 PolarHBondContact OE1-NH2 2.85Å; E321-R341 WeakPolarHBondContact OE2-CD 3.37Å; E321-R341 IonicContact OE2-CZ 3.3Å; E321-R341 IonicContact OE2-NE 2.81Å; E321-R341 PolarHBondContact OE2-NE 3.5Å; E321-R341 IonicContact OE2-NH1 3.59Å; E321-R341 PolarHBondContact OE2-NH1 3.37Å; E321-R341 IonicContact OE2-NH2 2.79Å; E321-R341 PolarHBondContact OE2-NH2 3.02Å
322	E	76.9	Confident	84.4	Confident	96 Å²	96	64.7 Å²	64.7	45%	0.449	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-36.4	-171.3	-153.8	178.8	153.1	0	0	112.8	N320 R324 K325 K326	N320-E322 VanDerWaalsContact C-N 3.34Å; N320-E322 PolarHBondContact O-N 2.81Å; E322-R324 PolarHBondContact O-N 3.15Å; E322-K325 PolarHBondContact O-N 3.2Å; E322-K325 VanDerWaalsContact O-N 3.1Å; E322-K326 IonicContact OE1-NZ 2.82Å; E322-K326 PolarHBondContact OE1-NZ 3.08Å
323	D	77.5	Confident	84.4	Confident	128 Å²	128	72.4 Å²	72.4	68%	0.684	37%	0.367	S	S	*	.	H	α-helix	trans	-61.9	-24.5	178.9	-61.2	-26.5	0	0	0	113.6	E321 I338	E321-D323 PolarHBondContact O-N 3.36Å; D323-I338 HydrophobicContact CB-CD1 4.33Å
324	R	84.4	Confident	84.4	Confident	19 Å²	19	72.1 Å²	72.1	7%	0.072	36%	0.363	C	S	.	.	H	α-helix	trans	-86.3	-16.3	178.5	-74.6	178.5	72.6	-154.5	-8.9	113.8	E321 E322 I338 R341 V345	E321-R324 HydrophobicContact CB-CB 4.34Å; E321-R324 PolarHBondContact O-N 3.28Å; E321-R324 VanDerWaalsContact O-N 3.09Å; E321-R324 IonicContact OE1-NH1 2.75Å; E321-R324 PolarHBondContact OE1-NH1 2.79Å; E321-R324 WeakPolarHBondContact OE2-CD 3.44Å; E321-R324 IonicContact OE2-CZ 2.73Å; E321-R324 IonicContact OE2-NE 3.69Å; E321-R324 IonicContact OE2-NH1 3.47Å; E321-R324 PolarHBondContact OE2-NH1 3.46Å; E322-R324 PolarHBondContact O-N 3.15Å; R324-I338 HydrophobicContact CG-CG1 4.3Å; R324-I338 HydrophobicContact CG-CG2 3.82Å; R324-R341 PolarHBondContact NH2-O 2.81Å; R324-V345 PolarHBondContact NH2-O 2.99Å
325	K	88.1	Confident	84.4	Confident	9 Å²	9	74.6 Å²	74.6	4%	0.039	38%	0.38	C	S	.	.	H	α-helix	trans	-91.1	-13.4	-170.7	-67	171.1	168	-178	0	113	M248 F309 T310 S312 N320 E322	M248-K325 HydrophobicContact SD-CG 4.28Å; F309-K325 WeakPolarHBondContact O-CD 3.23Å; T310-K325 VanDerWaalsContact O-CD 3.29Å; T310-K325 WeakPolarHBondContact O-CD 3.42Å; T310-K325 PolarHBondContact O-NZ 3.32Å; S312-K325 WeakPolarHBondContact O-CE 3.43Å; S312-K325 PolarHBondContact O-NZ 3.18Å; N320-K325 PolarHBondContact OD1-NZ 3.06Å; E322-K325 PolarHBondContact O-N 3.2Å; E322-K325 VanDerWaalsContact O-N 3.1Å
326	K	87.5	Confident	84.5	Confident	116 Å²	116	76.4 Å²	76.4	50%	0.504	40%	0.395	S	S	.	.	S	Bend	trans	-102.9	146.3	-177.8	-66.7	178.8	-174.6	162.3	0	111.2	E322	E322-K326 IonicContact OE1-NZ 2.82Å; E322-K326 PolarHBondContact OE1-NZ 3.08Å
327	C	93.8	Very high	84.7	Confident	7 Å²	7	73.9 Å²	73.9	5%	0.047	39%	0.388	C	S	.	.			trans	-71.7	139.9	171.6	-56.6	0	0	0	0	110.2	L199 Q200 C229	L199-C327 WeakPolarHBondContact O-CB 3Å; Q200-C327 PolarHBondContact NE2-O 3.03Å; Q200-C327 VanDerWaalsContact NE2-O 3.09Å; Q200-C327 VanDerWaalsContact OE1-N 3.08Å; C229-C327 HydrophobicContact CB-CB 3.68Å; C229-C327 WeakPolarHBondContact CB-SG 3.5Å; C229-C327 WeakPolarHBondContact SG-CA 3.38Å; C229-C327 WeakPolarHBondContact SG-CB 3.37Å; C229-C327 CovalentContact SG-SG 2.03Å; C229-C327 PolarHBondContact SG-SG 3.39Å
328	V	94.5	Very high	85.4	Confident	48 Å²	48	74.5 Å²	74.5	29%	0.291	39%	0.39	S	S	.	.			trans	-114.3	152.4	-179.2	-62.3	0	0	0	0	110.6	D330 L334	V328-D330 VanDerWaalsContact C-N 3.33Å; V328-D330 PolarHBondContact O-N 3.17Å; V328-L334 HydrophobicContact CG1-CD2 4.24Å; V328-L334 HydrophobicContact CG2-CD1 4.4Å; V328-L334 HydrophobicContact CG2-CD2 4.16Å; V328-L334 HydrophobicContact CG2-CG 4.34Å
329	L	92.1	Very high	86.5	Confident	151 Å²	151	68 Å²	68	79%	0.791	36%	0.355	S	S	*	.	S	Bend	trans	-66.2	-36.7	-178.9	-175.7	66.7	0	0	0	112.5	L199	L199-L329 HydrophobicContact CD1-CB 4.46Å; L199-L329 HydrophobicContact CD1-CD1 4.41Å
330	D	93.3	Very high	87.3	Confident	47 Å²	47	61.7 Å²	61.7	25%	0.251	33%	0.333	S	S	.	.			trans	-140.5	96.7	-177	-176.4	-3.3	0	0	0	110	V328 T332 K333	V328-D330 VanDerWaalsContact C-N 3.33Å; V328-D330 PolarHBondContact O-N 3.17Å; D330-T332 PolarHBondContact O-N 3.39Å; D330-T332 WeakPolarHBondContact OD1-CB 3.43Å; D330-T332 PolarHBondContact OD1-N 3.39Å; D330-T332 VanDerWaalsContact OD1-N 3.1Å; D330-T332 PolarHBondContact OD1-OG1 2.77Å; D330-K333 HydrophobicContact CB-CD 4.21Å; D330-K333 PolarHBondContact O-N 2.03Å; D330-K333 VanDerWaalsContact OD2-CD 3.32Å; D330-K333 WeakPolarHBondContact OD2-CD 3.44Å; D330-K333 WeakPolarHBondContact OD2-CE 3.47Å; D330-K333 IonicContact OD2-NZ 2.8Å; D330-K333 PolarHBondContact OD2-NZ 2.98Å; D330-K333 VanDerWaalsContact OD2-NZ 3.08Å
331	S	94.6	Very high	88.3	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-66.6	-16.2	-179.5	53.8	0	0	0	0	113.6	D232 V233 G234 T245 K333 L334	D232-S331 WeakPolarHBondContact OD1-CB 3Å; D232-S331 PolarHBondContact OD1-OG 2.98Å; D232-S331 VanDerWaalsContact OD1-OG 3.12Å; V233-S331 WeakPolarHBondContact CG2-OG 3.46Å; V233-S331 PolarHBondContact N-OG 2.53Å; G234-S331 PolarHBondContact N-OG 2.85Å; G234-S331 CarbonylContact O-C 3.56Å; G234-S331 VanDerWaalsContact O-C 3.3Å; G234-S331 WeakPolarHBondContact O-CB 2.85Å; G234-S331 PolarHBondContact O-OG 3.39Å; T245-S331 VanDerWaalsContact OG1-CB 3.28Å; T245-S331 WeakPolarHBondContact OG1-CB 3.3Å; S331-K333 PolarHBondContact O-N 2.97Å; S331-L334 WeakPolarHBondContact O-CB 3.49Å; S331-L334 WeakPolarHBondContact O-CG 3.47Å; S331-L334 PolarHBondContact O-N 3.13Å
332	T	94.4	Very high	88.8	Confident	58 Å²	58	60.1 Å²	60.1	36%	0.356	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-71.7	-18.2	177.6	73.9	0	0	0	0	112.6	V233 G234 P236 D330	V233-T332 HydrophobicContact CG2-CG2 3.85Å; G234-T332 PolarHBondContact O-N 3.09Å; P236-T332 WeakPolarHBondContact CB-O 3Å; D330-T332 PolarHBondContact O-N 3.39Å; D330-T332 WeakPolarHBondContact OD1-CB 3.43Å; D330-T332 PolarHBondContact OD1-N 3.39Å; D330-T332 VanDerWaalsContact OD1-N 3.1Å; D330-T332 PolarHBondContact OD1-OG1 2.77Å
333	K	93.9	Very high	89.1	Confident	166 Å²	166	61 Å²	61	72%	0.722	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-92.6	2.3	178.5	-66.9	176.2	-179.1	153.1	0	113.6	D330 S331	D330-K333 HydrophobicContact CB-CD 4.21Å; D330-K333 PolarHBondContact O-N 2.03Å; D330-K333 VanDerWaalsContact OD2-CD 3.32Å; D330-K333 WeakPolarHBondContact OD2-CD 3.44Å; D330-K333 WeakPolarHBondContact OD2-CE 3.47Å; D330-K333 IonicContact OD2-NZ 2.8Å; D330-K333 PolarHBondContact OD2-NZ 2.98Å; D330-K333 VanDerWaalsContact OD2-NZ 3.08Å; S331-K333 PolarHBondContact O-N 2.97Å
334	L	92.3	Very high	89.4	Confident	30 Å²	30	63.2 Å²	63.2	16%	0.157	33%	0.327	C	S	.	.			trans	-61.7	142.6	176	-70.8	172.5	0	0	0	110.9	T245 V328 S331 I338 L339	T245-L334 HydrophobicContact CG2-CD1 4.29Å; V328-L334 HydrophobicContact CG1-CD2 4.24Å; V328-L334 HydrophobicContact CG2-CD1 4.4Å; V328-L334 HydrophobicContact CG2-CD2 4.16Å; V328-L334 HydrophobicContact CG2-CG 4.34Å; S331-L334 WeakPolarHBondContact O-CB 3.49Å; S331-L334 WeakPolarHBondContact O-CG 3.47Å; S331-L334 PolarHBondContact O-N 3.13Å; L334-I338 HydrophobicContact CD2-CD1 4.43Å; L334-I338 HydrophobicContact CD2-CG2 4.38Å; L334-L339 HydrophobicContact CB-CD1 4.28Å; L334-L339 HydrophobicContact CB-CD2 3.91Å; L334-L339 HydrophobicContact CB-CG 3.97Å; L334-L339 HydrophobicContact CD1-CD2 4.02Å
335	S	91.3	Very high	89.3	Confident	52 Å²	52	63.8 Å²	63.8	36%	0.364	33%	0.333	S	S	.	.			trans	-66.9	151.7	179.7	68.4	0	0	0	0	111.4	S337 I338 L339	S335-S337 PolarHBondContact O-N 2.81Å; S335-S337 PolarHBondContact OG-OG 3.3Å; S335-I338 PolarHBondContact O-N 3.15Å; S335-I338 VanDerWaalsContact O-N 3.16Å; S335-I338 WeakPolarHBondContact OG-CG1 3.19Å; S335-I338 PolarHBondContact OG-N 3.17Å; S335-L339 WeakPolarHBondContact O-CG 3.02Å; S335-L339 PolarHBondContact O-N 3.07Å; S335-L339 VanDerWaalsContact O-N 3.07Å
336	T	88.4	Confident	89.3	Confident	110 Å²	110	65.5 Å²	65.5	68%	0.675	34%	0.342	S	S	*	.	H	α-helix	trans	-61.1	-30.4	177	48.8	0	0	0	0	112.6	G340	T336-G340 PolarHBondContact O-N 3.41Å
337	S	85.9	Confident	89.6	Confident	80 Å²	80	61.3 Å²	61.3	56%	0.559	32%	0.324	S	S	*	.	H	α-helix	trans	-66.6	-41.9	175.3	59.7	0	0	0	0	112.2	S335 R341	S335-S337 PolarHBondContact O-N 2.81Å; S335-S337 PolarHBondContact OG-OG 3.3Å; S337-R341 WeakPolarHBondContact O-CG 3Å; S337-R341 PolarHBondContact O-N 2.9Å
338	I	86.9	Confident	89.7	Confident	30 Å²	30	61 Å²	61	15%	0.154	32%	0.322	C	S	.	.	H	α-helix	trans	-64.2	-51.4	175	-74.9	169.8	0	0	0	110.1	D323 R324 L334 S335 G340 R341 V342	D323-I338 HydrophobicContact CB-CD1 4.33Å; R324-I338 HydrophobicContact CG-CG1 4.3Å; R324-I338 HydrophobicContact CG-CG2 3.82Å; L334-I338 HydrophobicContact CD2-CD1 4.43Å; L334-I338 HydrophobicContact CD2-CG2 4.38Å; S335-I338 PolarHBondContact O-N 3.15Å; S335-I338 VanDerWaalsContact O-N 3.16Å; S335-I338 WeakPolarHBondContact OG-CG1 3.19Å; S335-I338 PolarHBondContact OG-N 3.17Å; I338-G340 PolarHBondContact O-N 3.21Å; I338-R341 WeakPolarHBondContact O-CB 3.42Å; I338-R341 PolarHBondContact O-N 2.97Å; I338-V342 HydrophobicContact CG2-CG2 4.38Å; I338-V342 WeakPolarHBondContact O-CG2 3.38Å; I338-V342 PolarHBondContact O-N 3.03Å
339	L	89.3	Confident	89.7	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-40.9	-175.8	-64.4	169.6	0	0	0	112.2	P236 N239 L240 T245 L334 S335 R341 V342 E343	P236-L339 VanDerWaalsContact CD-CD1 3.43Å; P236-L339 HydrophobicContact CG-CD1 3.79Å; N239-L339 HydrophobicContact CB-CD1 4.16Å; N239-L339 WeakPolarHBondContact ND2-CB 3.46Å; L240-L339 HydrophobicContact CD1-CB 4.28Å; L240-L339 HydrophobicContact CD1-CD2 4.01Å; T245-L339 HydrophobicContact CG2-CD2 3.57Å; L334-L339 HydrophobicContact CB-CD1 4.28Å; L334-L339 HydrophobicContact CB-CD2 3.91Å; L334-L339 HydrophobicContact CB-CG 3.97Å; L334-L339 HydrophobicContact CD1-CD2 4.02Å; S335-L339 WeakPolarHBondContact O-CG 3.02Å; S335-L339 PolarHBondContact O-N 3.07Å; S335-L339 VanDerWaalsContact O-N 3.07Å; L339-R341 PolarHBondContact O-N 3.13Å; L339-V342 PolarHBondContact O-N 3.21Å; L339-E343 PolarHBondContact O-N 2.78Å; L339-E343 VanDerWaalsContact O-N 3.09Å
340	G	86.9	Confident	89.7	Confident	21 Å²	21	61.2 Å²	61.2	22%	0.216	31%	0.314	C	S	.	.	H	α-helix	trans	-64.7	-19.5	175.5	0	0	0	0	0	113.9	T336 I338 K344	T336-G340 PolarHBondContact O-N 3.41Å; I338-G340 PolarHBondContact O-N 3.21Å; G340-K344 WeakPolarHBondContact O-CD 3.48Å; G340-K344 VanDerWaalsContact O-CG 3.31Å; G340-K344 WeakPolarHBondContact O-CG 3.37Å
341	R	85.9	Confident	89.8	Confident	86 Å²	86	63.1 Å²	63.1	33%	0.325	32%	0.318	S	S	.	.	H	α-helix	trans	-87.2	-37.2	171.5	-66.2	-179.5	78.7	171.7	7.8	112.4	S317 E321 R324 S337 I338 L339 E343 K344 V345	S317-R341 PolarHBondContact OG-NH2 2.6Å; E321-R341 IonicContact OE1-CZ 3.53Å; E321-R341 IonicContact OE1-NE 3.36Å; E321-R341 IonicContact OE1-NH1 3.19Å; E321-R341 IonicContact OE1-NH2 2.83Å; E321-R341 PolarHBondContact OE1-NH2 2.85Å; E321-R341 WeakPolarHBondContact OE2-CD 3.37Å; E321-R341 IonicContact OE2-CZ 3.3Å; E321-R341 IonicContact OE2-NE 2.81Å; E321-R341 PolarHBondContact OE2-NE 3.5Å; E321-R341 IonicContact OE2-NH1 3.59Å; E321-R341 PolarHBondContact OE2-NH1 3.37Å; E321-R341 IonicContact OE2-NH2 2.79Å; E321-R341 PolarHBondContact OE2-NH2 3.02Å; R324-R341 PolarHBondContact NH2-O 2.81Å; S337-R341 WeakPolarHBondContact O-CG 3Å; S337-R341 PolarHBondContact O-N 2.9Å; I338-R341 WeakPolarHBondContact O-CB 3.42Å; I338-R341 PolarHBondContact O-N 2.97Å; L339-R341 PolarHBondContact O-N 3.13Å; R341-E343 PolarHBondContact O-N 2.78Å; R341-K344 PolarHBondContact O-N 2.88Å; R341-V345 PolarHBondContact O-N 2.88Å
342	V	86.6	Confident	89.9	Confident	9 Å²	9	63.2 Å²	63.2	6%	0.055	32%	0.318	C	S	.	.	H	α-helix	trans	-56.3	-42.5	173.1	173.7	0	0	0	0	110.7	L240 T245 I338 L339 K344 L346	L240-V342 HydrophobicContact CD1-CB 4.2Å; L240-V342 HydrophobicContact CD1-CG1 4.03Å; T245-V342 WeakPolarHBondContact O-CG2 3.45Å; I338-V342 HydrophobicContact CG2-CG2 4.38Å; I338-V342 WeakPolarHBondContact O-CG2 3.38Å; I338-V342 PolarHBondContact O-N 3.03Å; L339-V342 PolarHBondContact O-N 3.21Å; V342-K344 PolarHBondContact O-N 2.78Å; V342-L346 HydrophobicContact CG1-CD2 4.09Å; V342-L346 WeakPolarHBondContact O-CD2 3.44Å
343	E	84.3	Confident	89.9	Confident	115 Å²	115	65.5 Å²	65.5	54%	0.537	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-29	177.5	-169.3	173.9	-161.9	0	0	113.5	L339 R341	L339-E343 PolarHBondContact O-N 2.78Å; L339-E343 VanDerWaalsContact O-N 3.09Å; R341-E343 PolarHBondContact O-N 2.78Å
344	K	83.9	Confident	89.8	Confident	174 Å²	174	57.9 Å²	57.9	76%	0.757	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-43.9	-173.2	-68.5	178.7	-176.3	-176.7	0	113.8	G340 R341 V342	G340-K344 WeakPolarHBondContact O-CD 3.48Å; G340-K344 VanDerWaalsContact O-CG 3.31Å; G340-K344 WeakPolarHBondContact O-CG 3.37Å; R341-K344 PolarHBondContact O-N 2.88Å; V342-K344 PolarHBondContact O-N 2.78Å
345	V	82.2	Confident	89.3	Confident	31 Å²	31	64.3 Å²	64.3	19%	0.188	31%	0.313	C	S	.	.			trans	-135.8	112.3	-168.3	-170.6	0	0	0	0	110.6	F314 R324 R341	F314-V345 HydrophobicContact CB-CG1 3.69Å; F314-V345 HydrophobicContact CD1-CG1 4Å; F314-V345 HydrophobicContact CG-CG1 4.16Å; R324-V345 PolarHBondContact NH2-O 2.99Å; R341-V345 PolarHBondContact O-N 2.88Å
346	L	88.3	Confident	88.9	Confident	44 Å²	44	66.3 Å²	66.3	23%	0.23	32%	0.318	C	S	.	.			trans	-115.9	-22.4	-179.4	-60.3	172.3	0	0	0	113.1	L247 N249 V342	L247-L346 HydrophobicContact CB-CD2 4.45Å; L247-L346 HydrophobicContact CD2-CD1 4.06Å; L247-L346 WeakPolarHBondContact O-CD2 3.3Å; N249-L346 PolarHBondContact N-O 2.74Å; N249-L346 WeakPolarHBondContact OD1-CB 3.45Å; V342-L346 HydrophobicContact CG1-CD2 4.09Å; V342-L346 WeakPolarHBondContact O-CD2 3.44Å
347	E	93.8	Very high	88.8	Confident	29 Å²	29	61.9 Å²	61.9	14%	0.136	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-88.2	128.9	-169.2	-167	170.7	155.2	0	0	112.3	F224 N249 R251 F314 I315	F224-E347 HydrophobicContact CE1-CG 4.18Å; N249-E347 CarbonylContact O-C 3.53Å; N249-E347 VanDerWaalsContact O-CA 3.31Å; N249-E347 WeakPolarHBondContact O-CA 3.5Å; R251-E347 IonicContact CZ-OE1 3.24Å; R251-E347 IonicContact NE-OE1 3.31Å; R251-E347 PolarHBondContact NE-OE1 2.95Å; R251-E347 IonicContact NH2-OE1 3.51Å; R251-E347 PolarHBondContact NH2-OE1 2.69Å; F314-E347 WeakPolarHBondContact CA-O 3.47Å; I315-E347 HydrophobicContact CD1-CB 3.94Å; I315-E347 VanDerWaalsContact CD1-CD 3.46Å; I315-E347 HydrophobicContact CD1-CG 3.54Å; I315-E347 WeakPolarHBondContact CD1-OE1 3.28Å; I315-E347 HydrophobicContact CG1-CB 4.48Å; I315-E347 HydrophobicContact CG1-CG 4.34Å; I315-E347 PolarHBondContact N-O 2.74Å
348	M	95	Very high	89	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-71.6	143.3	172.6	-62.1	-61.2	140.5	0	0	110.8	M248 N249 A250 V308 F309 F314	M248-M348 HydrophobicContact CB-CE 3.76Å; M248-M348 HydrophobicContact CG-CE 3.88Å; M248-M348 HydrophobicContact SD-CE 3.46Å; M248-M348 WeakPolarHBondContact SD-CE 3.1Å; N249-M348 WeakPolarHBondContact O-CG 3.35Å; N249-M348 PolarHBondContact O-N 2.94Å; A250-M348 HydrophobicContact CB-CB 3.96Å; A250-M348 HydrophobicContact CB-CG 4.08Å; V308-M348 HydrophobicContact CG1-CB 4.27Å; V308-M348 HydrophobicContact CG1-CG 4.46Å; F309-M348 HydrophobicContact CD1-CE 4Å; F309-M348 HydrophobicContact CD1-CG 3.8Å; F309-M348 HydrophobicContact CD1-SD 4.4Å; F309-M348 HydrophobicContact CE1-CG 4.03Å; F314-M348 HydrophobicContact CD1-CE 3.67Å; F314-M348 HydrophobicContact CD1-SD 4.33Å; F314-M348 HydrophobicContact CE1-CE 3.13Å; F314-M348 HydrophobicContact CE1-SD 4.32Å; F314-M348 HydrophobicContact CE2-CE 4.13Å; F314-M348 HydrophobicContact CG-CE 4.38Å; F314-M348 HydrophobicContact CZ-CE 3.41Å; F314-M348 VanDerWaalsContact CZ-CE 3.41Å
349	K	93.5	Very high	89.3	Confident	97 Å²	97	58.3 Å²	58.3	42%	0.422	27%	0.271	S	S	.	.	S	Bend	trans	-69.7	-43.9	177.2	-165.8	176.1	-171.7	171.3	0	112	S312 P313 I315 D318	S312-K349 PolarHBondContact OG-N 3.46Å; P313-K349 HydrophobicContact CG-CB 4.02Å; P313-K349 HydrophobicContact CG-CD 3.84Å; P313-K349 WeakPolarHBondContact O-CB 3.2Å; P313-K349 PolarHBondContact O-N 2.73Å; I315-K349 HydrophobicContact CG1-CB 4.45Å; D318-K349 IonicContact OD1-NZ 2.71Å; D318-K349 PolarHBondContact OD1-NZ 3.35Å
350	E	93.9	Very high	89.4	Confident	105 Å²	105	58.7 Å²	58.7	49%	0.491	27%	0.273	S	S	.	.	S	Bend	trans	-79.8	144.1	177.6	-65.6	-64.1	156.8	0	0	111.6	V308 S312	V308-E350 HydrophobicContact CG1-CB 4.33Å; S312-E350 WeakPolarHBondContact OG-CB 3.42Å; S312-E350 PolarHBondContact OG-N 3.06Å
351	W	95.1	Very high	89.5	Confident	88 Å²	88	59.7 Å²	59.7	33%	0.333	27%	0.272	S	S	.	.			trans	-90.9	144.1	175.8	-61.6	19.7	0	0	0	109.1	R251 Y253 K353	R251-W351 HydrophobicContact CB-CB 4.34Å; R251-W351 HydrophobicContact CB-CD2 3.8Å; R251-W351 HydrophobicContact CB-CE3 4.29Å; R251-W351 HydrophobicContact CB-CG 3.75Å; R251-W351 CarbonylContact O-C 3.58Å; R251-W351 WeakPolarHBondContact O-CA 3.12Å; Y253-W351 AromaticContact CD2-CE3 3.77Å; Y253-W351 HydrophobicContact CD2-CE3 3.77Å; Y253-W351 AromaticContact CD2-CZ3 3.86Å; Y253-W351 HydrophobicContact CD2-CZ3 3.86Å; Y253-W351 HydrophobicContact CG-CE3 4.3Å; W351-K353 PolarHBondContact O-N 3.28Å
352	V	96.6	Very high	89.5	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-70.9	113.4	168.6	-179	0	0	0	0	107.8	V225 A250 R251 L252 Y253 Y300 I305 V308	V225-V352 HydrophobicContact CG1-CG2 3.93Å; A250-V352 HydrophobicContact CB-CG2 3.95Å; R251-V352 PolarHBondContact O-N 3.14Å; L252-V352 HydrophobicContact CD2-CB 3.98Å; L252-V352 HydrophobicContact CD2-CG1 4.09Å; Y253-V352 PolarHBondContact N-O 2.96Å; Y300-V352 HydrophobicContact CD1-CG1 3.63Å; Y300-V352 HydrophobicContact CE1-CG1 4.08Å; Y300-V352 HydrophobicContact CG-CG1 4.46Å; I305-V352 HydrophobicContact CG1-CG1 3.68Å; I305-V352 HydrophobicContact CG1-CG2 4.45Å; V308-V352 HydrophobicContact CB-CG2 4Å; V308-V352 HydrophobicContact CG1-CG2 4.11Å; V308-V352 HydrophobicContact CG2-CB 4.49Å; V308-V352 HydrophobicContact CG2-CG2 3.93Å
353	K	93.6	Very high	89.6	Confident	107 Å²	107	61.8 Å²	61.8	47%	0.465	28%	0.284	S	S	.	.			trans	-102.2	142.4	176.7	-63.8	178.3	-177.4	177.4	0	109.9	Y253 W351	Y253-K353 HydrophobicContact CD1-CG 4.22Å; Y253-K353 HydrophobicContact CG-CG 4.36Å; W351-K353 PolarHBondContact O-N 3.28Å
354	P	91.2	Very high	89.8	Confident	6 Å²	6	59.2 Å²	59.2	4%	0.039	27%	0.272	C	S	.	.			trans	-65.1	151.9	169.2	31.2	-37.4	0	0	0	109.2	Y253 C298 V299 Y300 M356	Y253-P354 WeakPolarHBondContact O-CD 3.43Å; C298-P354 HydrophobicContact CB-CB 4.25Å; C298-P354 HydrophobicContact CB-CG 4.24Å; V299-P354 VanDerWaalsContact O-CB 3.31Å; V299-P354 WeakPolarHBondContact O-CB 3.33Å; Y300-P354 HydrophobicContact CD1-CB 4.3Å; Y300-P354 HydrophobicContact CE1-CB 4.06Å; Y300-P354 HydrophobicContact CE1-CG 4.34Å; P354-M356 CarbonylContact C-O 3.58Å; P354-M356 WeakPolarHBondContact CB-O 3.49Å; P354-M356 WeakPolarHBondContact CG-O 3.42Å; P354-M356 PolarHBondContact O-N 3.07Å
355	R	82.5	Confident	90.1	Very high	165 Å²	165	53.5 Å²	53.5	62%	0.623	25%	0.25	S	C	*	.	S	Bend	trans	-60.8	-33.7	178.2	-69.2	-173.7	179.3	178.2	-0.2	112.1	D304	D304-R355 IonicContact OD1-CZ 2.72Å; D304-R355 IonicContact OD1-NE 3.43Å; D304-R355 PolarHBondContact OD1-NE 2.9Å; D304-R355 IonicContact OD1-NH2 2.91Å; D304-R355 PolarHBondContact OD1-NH2 3.28Å; D304-R355 WeakPolarHBondContact OD2-CG 3.11Å; D304-R355 IonicContact OD2-CZ 2.67Å; D304-R355 IonicContact OD2-NE 3.32Å; D304-R355 PolarHBondContact OD2-NE 3.4Å; D304-R355 IonicContact OD2-NH2 3.63Å
356	M	83	Confident	90.7	Very high	93 Å²	93	52 Å²	52	46%	0.458	24%	0.241	S	C	.	.	S	Bend	trans	-123.1	170.3	177.4	-60.4	178.9	73.1	0	0	108.9	P354 E398 S399	P354-M356 CarbonylContact C-O 3.58Å; P354-M356 WeakPolarHBondContact CB-O 3.49Å; P354-M356 WeakPolarHBondContact CG-O 3.42Å; P354-M356 PolarHBondContact O-N 3.07Å; M356-E398 VanDerWaalsContact CE-O 3.31Å; M356-E398 WeakPolarHBondContact CE-O 3.42Å; M356-S399 VanDerWaalsContact CE-CA 3.46Å; M356-S399 VanDerWaalsContact CE-CB 3.47Å
357	G	86.3	Confident	91	Very high	18 Å²	18	51.3 Å²	51.3	19%	0.186	24%	0.238	C	C	.	.	S	Bend	trans	-61.4	-175.1	170.5	0	0	0	0	0	112.6	V359	G357-V359 PolarHBondContact O-N 3.12Å
358	P	90.9	Very high	91.1	Very high	25 Å²	25	53.3 Å²	53.3	16%	0.162	25%	0.245	C	C	.	.			trans	-52.8	128.4	173.6	-24.3	33.5	0	0	0	111.4	A296 V297 L360	A296-P358 HydrophobicContact CB-CB 4.02Å; A296-P358 HydrophobicContact CB-CG 4.34Å; V297-P358 CarbonylContact O-C 3.56Å; V297-P358 VanDerWaalsContact O-CA 3.26Å; V297-P358 WeakPolarHBondContact O-CA 3.37Å; P358-L360 VanDerWaalsContact C-N 3.31Å
359	V	91.9	Very high	91.2	Very high	10 Å²	10	53.8 Å²	53.8	6%	0.061	25%	0.247	C	C	.	.	S	Bend	trans	-77.3	-23.8	-179.8	-65.8	0	0	0	0	112.4	V297 V299 G357 M382 H400 S401	V297-V359 HydrophobicContact CB-CG2 3.95Å; V297-V359 HydrophobicContact CG1-CG2 3.89Å; V297-V359 VanDerWaalsContact O-CG2 3.31Å; V297-V359 WeakPolarHBondContact O-CG2 3.41Å; V297-V359 PolarHBondContact O-N 2.83Å; V299-V359 HydrophobicContact CG2-CB 4.46Å; V299-V359 HydrophobicContact CG2-CG1 3.84Å; V299-V359 HydrophobicContact CG2-CG2 3.76Å; G357-V359 PolarHBondContact O-N 3.12Å; V359-M382 HydrophobicContact CG2-CE 4.4Å; V359-M382 HydrophobicContact CG2-SD 4.49Å; V359-H400 CarbonylContact O-C 3.59Å; V359-H400 WeakPolarHBondContact O-CA 3.4Å; V359-S401 WeakPolarHBondContact O-CB 3.38Å; V359-S401 PolarHBondContact O-N 3.05Å; V359-S401 PolarHBondContact O-OG 2.68Å
360	L	91.6	Very high	91.3	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.042	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	135	170.7	-174.9	147.3	0	0	0	107.7	A296 V297 P358 N362 Y366 M382 L384 A394 I403	A296-L360 CarbonylContact C-O 3.5Å; A296-L360 WeakPolarHBondContact CA-O 3.45Å; V297-L360 HydrophobicContact CB-CB 4.17Å; V297-L360 HydrophobicContact CG2-CB 4.21Å; V297-L360 HydrophobicContact CG2-CD2 4.42Å; V297-L360 PolarHBondContact N-O 2.82Å; P358-L360 VanDerWaalsContact C-N 3.31Å; L360-N362 HydrophobicContact CD2-CB 4.15Å; L360-Y366 HydrophobicContact CD2-CD2 4.45Å; L360-Y366 HydrophobicContact CD2-CE2 3.66Å; L360-M382 HydrophobicContact CB-CE 4.23Å; L360-M382 HydrophobicContact CD1-CE 4.2Å; L360-L384 HydrophobicContact CD1-CD1 3.65Å; L360-L384 HydrophobicContact CD2-CD1 4.18Å; L360-A394 HydrophobicContact CD1-CB 4.04Å; L360-I403 HydrophobicContact CD1-CG1 4.49Å
361	F	89.3	Confident	91.3	Very high	42 Å²	42	47 Å²	47	18%	0.184	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	134.8	172	166.4	-89.5	0	0	0	107.3	H19 F265 M294 H363	H19-F361 AromaticContact CE1-CD1 3.98Å; H19-F361 PolarHBondContact CE1-O 2.74Å; H19-F361 VanDerWaalsContact CE1-O 3.26Å; H19-F361 PolarHBondContact ND1-O 3.46Å; F265-F361 HydrophobicContact CE2-CD2 4.06Å; F265-F361 HydrophobicContact CE2-CE2 4.32Å; F265-F361 AromaticContact CZ-CD2 3.5Å; F265-F361 HydrophobicContact CZ-CD2 3.5Å; F265-F361 AromaticContact CZ-CE2 3.6Å; F265-F361 HydrophobicContact CZ-CE2 3.6Å; M294-F361 HydrophobicContact CE-CE2 4.49Å; M294-F361 HydrophobicContact SD-CE2 4Å; M294-F361 HydrophobicContact SD-CZ 3.61Å; F361-H363 AromaticContact CE1-NE2 3.99Å
362	N	86.9	Confident	91.2	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.027	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	155	179.1	-150.8	-47.7	0	0	0	112.5	H19 M294 S295 L360 H364 Y366 I403	H19-N362 PolarHBondContact O-ND2 2.73Å; M294-N362 CarbonylContact C-O 3.59Å; M294-N362 WeakPolarHBondContact CA-O 3.49Å; S295-N362 PolarHBondContact N-O 2.79Å; S295-N362 PolarHBondContact O-N 3.21Å; L360-N362 HydrophobicContact CD2-CB 4.15Å; N362-H364 PolarHBondContact ND2-CD2 2.85Å; N362-H364 PolarHBondContact O-N 2.94Å; N362-H364 PolarHBondContact OD1-CD2 3.45Å; N362-H364 PolarHBondContact OD1-N 3.25Å; N362-Y366 HydrophobicContact CB-CE2 3.99Å; N362-I403 WeakPolarHBondContact ND2-CD1 3.43Å
363	H	88.1	Confident	90.7	Very high	133 Å²	133	44.8 Å²	44.8	62%	0.616	22%	0.218	S	C	*	.	S	Bend	trans	-80.6	0.5	172.4	-65.2	-83.9	0	0	0	113.5	M294 F361	M294-H363 PolarHBondContact SD-CE1 2.83Å; M294-H363 PolarHBondContact SD-ND1 2.91Å; M294-H363 VanDerWaalsContact SD-ND1 3.41Å; F361-H363 AromaticContact CE1-NE2 3.99Å
364	H	88.3	Confident	89.4	Confident	62 Å²	62	39.9 Å²	39.9	29%	0.287	20%	0.197	S	C	.	.	S	Bend	trans	-77.4	147.9	171.3	-60.9	-54.5	0	0	0	112.1	S295 N362 Y366 L386 H392	S295-H364 VanDerWaalsContact CB-O 3.25Å; S295-H364 WeakPolarHBondContact CB-O 3.42Å; S295-H364 PolarHBondContact OG-O 3.23Å; N362-H364 PolarHBondContact ND2-CD2 2.85Å; N362-H364 PolarHBondContact O-N 2.94Å; N362-H364 PolarHBondContact OD1-CD2 3.45Å; N362-H364 PolarHBondContact OD1-N 3.25Å; H364-Y366 HydrophobicContact CB-CE1 4.15Å; H364-Y366 HydrophobicContact CB-CE2 4.33Å; H364-Y366 PolarHBondContact O-N 2.93Å; H364-L386 HydrophobicContact CB-CD2 4.26Å; H364-H392 AromaticContact CD2-CE1 3.47Å; H364-H392 PolarHBondContact CD2-CE1 2.79Å; H364-H392 VanDerWaalsContact CD2-CE1 3.47Å; H364-H392 AromaticContact NE2-CE1 3.68Å
365	N	89.7	Confident	87.7	Confident	54 Å²	54	43.3 Å²	43.3	29%	0.289	22%	0.219	S	C	.	.			trans	-92.1	93.1	172.9	-170.9	5.3	0	0	0	109	R289 S387	R289-N365 WeakPolarHBondContact CD-OD1 3.29Å; R289-N365 PolarHBondContact NH1-OD1 2.84Å; N365-S387 PolarHBondContact O-N 2.93Å
366	Y	95.1	Very high	86.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	143.8	175.8	-62.4	-59.8	0	0	0	110.5	L287 S295 L360 N362 H364 L384 S385 L386 H392	L287-Y366 HydrophobicContact CD1-CD2 4.21Å; S295-Y366 VanDerWaalsContact CB-CD2 3.5Å; S295-Y366 PolarHBondContact OG-N 3.49Å; S295-Y366 VanDerWaalsContact OG-N 3.11Å; L360-Y366 HydrophobicContact CD2-CD2 4.45Å; L360-Y366 HydrophobicContact CD2-CE2 3.66Å; N362-Y366 HydrophobicContact CB-CE2 3.99Å; H364-Y366 HydrophobicContact CB-CE1 4.15Å; H364-Y366 HydrophobicContact CB-CE2 4.33Å; H364-Y366 PolarHBondContact O-N 2.93Å; Y366-L384 HydrophobicContact CD1-CB 3.57Å; Y366-L384 HydrophobicContact CD2-CD1 4.28Å; Y366-L384 HydrophobicContact CD2-CD2 4.48Å; Y366-L384 HydrophobicContact CE1-CB 3.7Å; Y366-L384 HydrophobicContact CE1-CD1 4.3Å; Y366-L384 HydrophobicContact CE2-CD1 4Å; Y366-L384 HydrophobicContact CG-CB 4.01Å; Y366-L384 HydrophobicContact CG-CD2 4.39Å; Y366-S385 CarbonylContact C-O 3.56Å; Y366-S385 WeakPolarHBondContact CA-O 3.28Å; Y366-L386 HydrophobicContact CD1-CD1 4.07Å; Y366-L386 HydrophobicContact CD1-CG 3.98Å; Y366-L386 HydrophobicContact CE1-CD1 3.81Å; Y366-L386 HydrophobicContact CE1-CG 3.94Å; Y366-H392 HydrophobicContact CE1-CB 4.24Å; Y366-H392 AromaticContact CE1-ND1 3.58Å; Y366-H392 AromaticContact CZ-ND1 3.62Å; Y366-H392 PolarHBondContact OH-ND1 3.3Å
367	T	94.3	Very high	85.2	Confident	28 Å²	28	39.6 Å²	39.6	17%	0.172	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-29.1	-175.3	53.8	0	0	0	0	113.4	V269 S385	V269-T367 WeakPolarHBondContact CG1-O 3.46Å; T367-S385 PolarHBondContact N-O 2.77Å; T367-S385 PolarHBondContact OG1-O 2.94Å; T367-S385 PolarHBondContact OG1-OG 3.14Å
368	R	95.5	Very high	84.4	Confident	72 Å²	72	45.2 Å²	45.2	27%	0.272	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	160.2	-179.7	-68.5	179.4	174.1	-99.3	-0.9	111.4	D270 L384 S385 L417 F419	D270-R368 WeakPolarHBondContact OD2-CA 3.36Å; D270-R368 WeakPolarHBondContact OD2-CB 3.45Å; R368-L384 WeakPolarHBondContact O-CA 3.29Å; R368-S385 WeakPolarHBondContact CB-OG 3.4Å; R368-S385 PolarHBondContact N-OG 3.18Å; R368-S385 VanDerWaalsContact N-OG 3.16Å; R368-S385 PolarHBondContact O-N 2.91Å; R368-S385 VanDerWaalsContact O-N 3.14Å; R368-L417 PolarHBondContact NE-O 2.83Å; R368-L417 PolarHBondContact NH2-O 3.19Å; R368-F419 HydrophobicContact CB-CE1 3.57Å; R368-F419 HydrophobicContact CB-CZ 4.03Å
369	I	97	Very high	84.1	Confident	10 Å²	10	45.4 Å²	45.4	5%	0.051	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	138	178.8	-172.7	171.2	0	0	0	111	D270 A272 L287 V297 V371 M382 F383 L384	D270-I369 HydrophobicContact CB-CG2 4.14Å; D270-I369 PolarHBondContact OD2-N 2.93Å; A272-I369 HydrophobicContact CB-CG1 4.4Å; A272-I369 HydrophobicContact CB-CG2 3.99Å; L287-I369 HydrophobicContact CB-CB 4.38Å; L287-I369 HydrophobicContact CB-CG2 4.08Å; V297-I369 HydrophobicContact CG1-CD1 3.81Å; V297-I369 HydrophobicContact CG2-CD1 4.05Å; I369-V371 HydrophobicContact CD1-CG2 4.2Å; I369-V371 HydrophobicContact CG1-CG2 4.11Å; I369-M382 HydrophobicContact CD1-SD 4.29Å; I369-F383 WeakPolarHBondContact CA-O 3.49Å; I369-L384 HydrophobicContact CB-CD2 3.83Å; I369-L384 HydrophobicContact CD1-CD2 3.84Å; I369-L384 HydrophobicContact CG1-CD2 3.68Å
370	L	95.8	Very high	84	Confident	42 Å²	42	45.1 Å²	45.1	22%	0.22	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.7	165.2	-177.2	69.7	0	0	0	108	M382 F383 F419 L421 L428	L370-M382 CarbonylContact O-C 3.56Å; L370-M382 WeakPolarHBondContact O-CA 3.47Å; L370-F383 HydrophobicContact CB-CB 4.33Å; L370-F383 PolarHBondContact N-O 2.81Å; L370-F383 PolarHBondContact O-N 2.89Å; L370-F419 HydrophobicContact CB-CD2 3.76Å; L370-F419 HydrophobicContact CB-CE2 3.32Å; L370-F419 HydrophobicContact CB-CZ 4.31Å; L370-F419 HydrophobicContact CD2-CD2 3.98Å; L370-F419 HydrophobicContact CD2-CE2 4.36Å; L370-F419 HydrophobicContact CG-CE2 4.5Å; L370-L421 HydrophobicContact CD2-CB 3.5Å; L370-L421 VanDerWaalsContact CD2-CB 3.5Å; L370-L428 HydrophobicContact CD2-CD1 3.92Å
371	V	94.9	Very high	84.1	Confident	18 Å²	18	44.8 Å²	44.8	11%	0.109	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.9	178.5	-173.6	0	0	0	0	109.6	A272 V274 Y285 I369 D380 V381 M382	A272-V371 HydrophobicContact CB-CB 4.44Å; A272-V371 HydrophobicContact CB-CG2 3.87Å; V274-V371 HydrophobicContact CG2-CB 3.78Å; V274-V371 HydrophobicContact CG2-CG1 3.6Å; Y285-V371 HydrophobicContact CD1-CG2 3.97Å; Y285-V371 HydrophobicContact CD2-CB 4.42Å; Y285-V371 HydrophobicContact CD2-CG1 4.29Å; Y285-V371 HydrophobicContact CD2-CG2 4Å; Y285-V371 HydrophobicContact CE1-CG1 4.5Å; Y285-V371 HydrophobicContact CE2-CG1 4.12Å; Y285-V371 HydrophobicContact CG-CG2 3.69Å; I369-V371 HydrophobicContact CD1-CG2 4.2Å; I369-V371 HydrophobicContact CG1-CG2 4.11Å; V371-D380 HydrophobicContact CG1-CB 3.84Å; V371-V381 WeakPolarHBondContact CA-O 3.42Å; V371-M382 HydrophobicContact CG2-CG 4.01Å
372	D	92.3	Very high	84.5	Confident	13 Å²	13	42.8 Å²	42.8	7%	0.07	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	120.4	170.1	-171.2	32.6	0	0	0	108.5	S374 V381 F383 L421 K426 Y461	D372-S374 PolarHBondContact O-N 2.9Å; D372-S374 VanDerWaalsContact O-N 3.17Å; D372-V381 PolarHBondContact N-O 2.8Å; D372-V381 PolarHBondContact O-N 3.11Å; D372-F383 HydrophobicContact CB-CE2 4.26Å; D372-L421 HydrophobicContact CB-CD2 3.45Å; D372-L421 VanDerWaalsContact CB-CD2 3.45Å; D372-L421 VanDerWaalsContact CG-CD2 3.41Å; D372-K426 VanDerWaalsContact CG-NZ 3.33Å; D372-K426 IonicContact OD1-NZ 2.66Å; D372-K426 PolarHBondContact OD1-NZ 3.38Å; D372-K426 VanDerWaalsContact OD1-NZ 3.1Å; D372-K426 WeakPolarHBondContact OD2-CE 3.16Å; D372-K426 IonicContact OD2-NZ 3.08Å; D372-K426 PolarHBondContact OD2-NZ 2.91Å; D372-Y461 VanDerWaalsContact CB-OH 3.3Å; D372-Y461 WeakPolarHBondContact CB-OH 2.99Å; D372-Y461 WeakPolarHBondContact OD2-CE1 3.14Å; D372-Y461 VanDerWaalsContact OD2-CZ 3.29Å; D372-Y461 PolarHBondContact OD2-OH 3.12Å
373	A	86.3	Confident	85	Confident	29 Å²	29	42.5 Å²	42.5	24%	0.24	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	108.8	165.5	0	0	0	0	0	106.5	V274	V274-A373 HydrophobicContact CG1-CB 3.82Å
374	S	67.3	Low	85.4	Confident	5 Å²	5	36.2 Å²	36.2	4%	0.035	21%	0.206	C	C	.	.			trans	-60.1	164.6	-173.6	73.5	0	0	0	0	111.8	D372 G376 N377 H379	D372-S374 PolarHBondContact O-N 2.9Å; D372-S374 VanDerWaalsContact O-N 3.17Å; S374-G376 PolarHBondContact O-N 2.9Å; S374-N377 PolarHBondContact O-N 2.99Å; S374-H379 WeakPolarHBondContact CB-O 3.01Å; S374-H379 PolarHBondContact N-O 2.8Å; S374-H379 PolarHBondContact OG-N 2.84Å; S374-H379 PolarHBondContact OG-O 2.98Å
375	P	54.8	Low	85.8	Confident	77 Å²	77	33.2 Å²	33.2	50%	0.5	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	118	-179	-22.2	32.4	0	0	0	111.3
376	G	55.2	Low	86	Confident	66 Å²	66	31 Å²	31	68%	0.68	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.5	12.1	-179.9	0	0	0	0	0	116.1	S374 Q378	S374-G376 PolarHBondContact O-N 2.9Å; G376-Q378 PolarHBondContact O-N 2.62Å; G376-Q378 VanDerWaalsContact O-N 3.08Å
377	N	57.8	Low	85.7	Confident	114 Å²	114	34.2 Å²	34.2	61%	0.61	20%	0.203	S	C	*	.	S	Bend	trans	57.9	19.5	175.8	-72	-23	0	0	0	115.2	S374	S374-N377 PolarHBondContact O-N 2.99Å
378	Q	69.6	Low	85.5	Confident	136 Å²	136	36.1 Å²	36.1	64%	0.636	21%	0.212	S	C	*	.	S	Bend	trans	-80.3	-40	-177.4	-72.7	-175.5	-4.5	0	0	112.5	G376	G376-Q378 PolarHBondContact O-N 2.62Å; G376-Q378 VanDerWaalsContact O-N 3.08Å
379	H	83.4	Confident	85.3	Confident	30 Å²	30	32.9 Å²	32.9	14%	0.139	20%	0.201	C	C	.	.			trans	-134.9	150	179.6	-60.9	-69.8	0	0	0	111.1	S374 L395 H481	S374-H379 WeakPolarHBondContact CB-O 3.01Å; S374-H379 PolarHBondContact N-O 2.8Å; S374-H379 PolarHBondContact OG-N 2.84Å; S374-H379 PolarHBondContact OG-O 2.98Å; H379-L395 HydrophobicContact CB-CD1 3.6Å; H379-H481 AromaticContact CE1-CE1 3.59Å; H379-H481 AromaticContact CE1-NE2 3.54Å; H379-H481 AromaticContact NE2-CE1 3.53Å; H379-H481 AromaticContact NE2-NE2 3.14Å; H379-H481 PolarHBondContact NE2-NE2 2.93Å; H379-H481 VanDerWaalsContact NE2-NE2 3.14Å
380	D	90.9	Very high	85.2	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.2	173.2	-79	34.6	0	0	0	109.6	R283 Y285 V371 Q396	R283-D380 IonicContact CZ-OD1 2.65Å; R283-D380 VanDerWaalsContact CZ-OD1 3.31Å; R283-D380 IonicContact CZ-OD2 3.64Å; R283-D380 IonicContact NH1-OD1 2.95Å; R283-D380 PolarHBondContact NH1-OD1 2.86Å; R283-D380 IonicContact NH1-OD2 2.78Å; R283-D380 PolarHBondContact NH1-OD2 3.46Å; R283-D380 IonicContact NH2-OD1 3.27Å; R283-D380 PolarHBondContact NH2-OD1 3.34Å; R283-D380 IonicContact NH2-OD2 2.66Å; R283-D380 PolarHBondContact NH2-OD2 3.43Å; R283-D380 VanDerWaalsContact NH2-OD2 3.15Å; Y285-D380 WeakPolarHBondContact CE2-OD2 3.23Å; Y285-D380 PolarHBondContact OH-OD2 2.71Å; V371-D380 HydrophobicContact CG1-CB 3.84Å; D380-Q396 HydrophobicContact CB-CB 3.95Å; D380-Q396 HydrophobicContact CB-CG 4.43Å; D380-Q396 WeakPolarHBondContact O-CB 3.42Å; D380-Q396 PolarHBondContact O-N 2.86Å
381	V	94.2	Very high	85.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	119.8	174.7	-178.1	0	0	0	0	108.9	V371 D372 F383 K393 A394 P460 Y461	V371-V381 WeakPolarHBondContact CA-O 3.42Å; D372-V381 PolarHBondContact N-O 2.8Å; D372-V381 PolarHBondContact O-N 3.11Å; V381-F383 HydrophobicContact CB-CE2 4.45Å; V381-F383 HydrophobicContact CG1-CE1 4.5Å; V381-F383 HydrophobicContact CG1-CE2 3.88Å; V381-F383 HydrophobicContact CG1-CZ 3.86Å; V381-K393 HydrophobicContact CG1-CD 4.41Å; V381-K393 HydrophobicContact CG1-CG 3.73Å; V381-A394 CarbonylContact C-O 3.54Å; V381-A394 WeakPolarHBondContact CA-O 3.36Å; V381-P460 HydrophobicContact CG2-CG 3.28Å; V381-Y461 HydrophobicContact CG2-CE1 3.93Å
382	M	96.1	Very high	85.3	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	133.6	176.2	-58.8	-176.4	-77	0	0	110.4	Y285 V297 V359 L360 I369 L370 V371 K393 A394 Q396 S401	Y285-M382 HydrophobicContact CD1-CG 4.26Å; Y285-M382 HydrophobicContact CD1-SD 3.79Å; Y285-M382 HydrophobicContact CE1-CG 4.32Å; Y285-M382 HydrophobicContact CE1-SD 4.03Å; V297-M382 HydrophobicContact CB-SD 4.38Å; V297-M382 HydrophobicContact CG1-SD 3.89Å; V297-M382 HydrophobicContact CG2-SD 4.45Å; V359-M382 HydrophobicContact CG2-CE 4.4Å; V359-M382 HydrophobicContact CG2-SD 4.49Å; L360-M382 HydrophobicContact CB-CE 4.23Å; L360-M382 HydrophobicContact CD1-CE 4.2Å; I369-M382 HydrophobicContact CD1-SD 4.29Å; L370-M382 CarbonylContact O-C 3.56Å; L370-M382 WeakPolarHBondContact O-CA 3.47Å; V371-M382 HydrophobicContact CG2-CG 4.01Å; M382-K393 WeakPolarHBondContact O-CA 3.32Å; M382-A394 HydrophobicContact CB-CB 4.47Å; M382-A394 HydrophobicContact CE-CB 4.39Å; M382-A394 PolarHBondContact N-O 3.44Å; M382-A394 PolarHBondContact O-N 2.63Å; M382-Q396 HydrophobicContact CE-CB 4.44Å; M382-Q396 VanDerWaalsContact CE-OE1 3.32Å; M382-S401 WeakPolarHBondContact CE-OG 3.31Å
383	F	97.4	Very high	85.5	Confident	0 Å²	0	29 Å²	29	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	120.4	167.1	-61.4	-85.8	0	0	0	108.4	I369 L370 D372 V381 I391 H392 K393 F419 L421 L428 V441 Y461	I369-F383 WeakPolarHBondContact CA-O 3.49Å; L370-F383 HydrophobicContact CB-CB 4.33Å; L370-F383 PolarHBondContact N-O 2.81Å; L370-F383 PolarHBondContact O-N 2.89Å; D372-F383 HydrophobicContact CB-CE2 4.26Å; V381-F383 HydrophobicContact CB-CE2 4.45Å; V381-F383 HydrophobicContact CG1-CE1 4.5Å; V381-F383 HydrophobicContact CG1-CE2 3.88Å; V381-F383 HydrophobicContact CG1-CZ 3.86Å; F383-I391 HydrophobicContact CB-CG2 4.21Å; F383-I391 HydrophobicContact CD1-CG2 4.38Å; F383-H392 CarbonylContact C-O 3.53Å; F383-H392 VanDerWaalsContact CA-O 3.29Å; F383-H392 WeakPolarHBondContact CA-O 3.35Å; F383-K393 HydrophobicContact CD1-CB 4.26Å; F383-K393 HydrophobicContact CD1-CG 4.32Å; F383-K393 HydrophobicContact CE1-CB 4.07Å; F383-K393 HydrophobicContact CE1-CD 4Å; F383-K393 HydrophobicContact CE1-CG 3.74Å; F383-K393 HydrophobicContact CZ-CD 4.4Å; F383-K393 HydrophobicContact CZ-CG 4.25Å; F383-F419 HydrophobicContact CB-CD2 4.33Å; F383-F419 HydrophobicContact CB-CE2 3.7Å; F383-F419 WeakPolarHBondContact O-CE2 3.43Å; F383-F419 WeakPolarHBondContact O-CZ 3.2Å; F383-L421 HydrophobicContact CE2-CD2 3.99Å; F383-L428 HydrophobicContact CD1-CD2 3.91Å; F383-L428 HydrophobicContact CE1-CD2 4.37Å; F383-L428 HydrophobicContact CG-CD2 4.39Å; F383-V441 HydrophobicContact CE1-CB 3.98Å; F383-V441 HydrophobicContact CE1-CG1 3.6Å; F383-V441 HydrophobicContact CE1-CG2 4.31Å; F383-V441 HydrophobicContact CZ-CB 4.05Å; F383-V441 HydrophobicContact CZ-CG1 4.05Å; F383-V441 HydrophobicContact CZ-CG2 3.9Å; F383-Y461 HydrophobicContact CZ-CE2 4.14Å
384	L	97.4	Very high	86	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	118	-174.6	-66.8	161.1	0	0	0	109.5	L287 V297 L360 Y366 R368 I369 I391 H392	L287-L384 HydrophobicContact CD1-CD2 4.28Å; V297-L384 HydrophobicContact CG2-CD2 4.1Å; L360-L384 HydrophobicContact CD1-CD1 3.65Å; L360-L384 HydrophobicContact CD2-CD1 4.18Å; Y366-L384 HydrophobicContact CD1-CB 3.57Å; Y366-L384 HydrophobicContact CD2-CD1 4.28Å; Y366-L384 HydrophobicContact CD2-CD2 4.48Å; Y366-L384 HydrophobicContact CE1-CB 3.7Å; Y366-L384 HydrophobicContact CE1-CD1 4.3Å; Y366-L384 HydrophobicContact CE2-CD1 4Å; Y366-L384 HydrophobicContact CG-CB 4.01Å; Y366-L384 HydrophobicContact CG-CD2 4.39Å; R368-L384 WeakPolarHBondContact O-CA 3.29Å; I369-L384 HydrophobicContact CB-CD2 3.83Å; I369-L384 HydrophobicContact CD1-CD2 3.84Å; I369-L384 HydrophobicContact CG1-CD2 3.68Å; L384-I391 CarbonylContact O-C 3.6Å; L384-I391 WeakPolarHBondContact O-CA 3.41Å; L384-H392 HydrophobicContact CB-CB 4.36Å; L384-H392 PolarHBondContact N-O 2.83Å; L384-H392 PolarHBondContact O-N 3.45Å
385	S	96.2	Very high	87.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	143.9	176.2	58.9	0	0	0	0	111.9	Y366 T367 R368 F419	Y366-S385 CarbonylContact C-O 3.56Å; Y366-S385 WeakPolarHBondContact CA-O 3.28Å; T367-S385 PolarHBondContact N-O 2.77Å; T367-S385 PolarHBondContact OG1-O 2.94Å; T367-S385 PolarHBondContact OG1-OG 3.14Å; R368-S385 WeakPolarHBondContact CB-OG 3.4Å; R368-S385 PolarHBondContact N-OG 3.18Å; R368-S385 VanDerWaalsContact N-OG 3.16Å; R368-S385 PolarHBondContact O-N 2.91Å; R368-S385 VanDerWaalsContact O-N 3.14Å; S385-F419 VanDerWaalsContact CB-CE1 3.48Å; S385-F419 WeakPolarHBondContact OG-CE1 3.46Å
386	L	93.9	Very high	88.9	Confident	8 Å²	8	24.6 Å²	24.6	4%	0.042	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	160.6	175.3	-68.9	83.5	0	0	0	110.5	H364 Y366 N388 G389 A390 H392	H364-L386 HydrophobicContact CB-CD2 4.26Å; Y366-L386 HydrophobicContact CD1-CD1 4.07Å; Y366-L386 HydrophobicContact CD1-CG 3.98Å; Y366-L386 HydrophobicContact CE1-CD1 3.81Å; Y366-L386 HydrophobicContact CE1-CG 3.94Å; L386-N388 WeakPolarHBondContact CB-OD1 3.45Å; L386-N388 PolarHBondContact O-N 2.8Å; L386-G389 PolarHBondContact O-N 3.07Å; L386-G389 VanDerWaalsContact O-N 3.14Å; L386-A390 HydrophobicContact CB-CB 4.36Å; L386-A390 HydrophobicContact CD1-CB 4.12Å; L386-A390 WeakPolarHBondContact CD1-O 3.32Å; L386-A390 PolarHBondContact N-O 2.82Å; L386-H392 HydrophobicContact CD1-CB 4.44Å
387	S	89.1	Confident	90.4	Very high	66 Å²	66	23.2 Å²	23.2	46%	0.462	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.8	177.4	57.5	0	0	0	0	114.6	N365	N365-S387 PolarHBondContact O-N 2.93Å
388	N	90.3	Very high	91.4	Very high	69 Å²	69	26.1 Å²	26.1	37%	0.369	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-0.8	178.1	67.4	-8	0	0	0	113.8	L386 A390 S413 A414	L386-N388 WeakPolarHBondContact CB-OD1 3.45Å; L386-N388 PolarHBondContact O-N 2.8Å; N388-A390 VanDerWaalsContact OD1-CB 3.32Å; N388-A390 WeakPolarHBondContact OD1-CB 3.43Å; N388-A390 PolarHBondContact OD1-N 3.43Å; N388-S413 WeakPolarHBondContact O-CA 3.26Å; N388-A414 CarbonylContact C-O 3.55Å; N388-A414 PolarHBondContact O-N 3.08Å
389	G	91.8	Very high	91.8	Very high	3 Å²	3	23.2 Å²	23.2	3%	0.031	13%	0.129	C	C	.	.	S	Bend	trans	90.2	6.1	179.7	0	0	0	0	0	115.1	L386 A414 I416	L386-G389 PolarHBondContact O-N 3.07Å; L386-G389 VanDerWaalsContact O-N 3.14Å; G389-A414 WeakPolarHBondContact CA-O 3.39Å; G389-A414 PolarHBondContact N-O 3.22Å; G389-I416 WeakPolarHBondContact O-CD1 3.37Å
390	A	94.4	Very high	91.8	Very high	2 Å²	2	25.3 Å²	25.3	2%	0.017	14%	0.139	C	C	.	.			trans	-79.2	161.3	167.9	0	0	0	0	0	111.5	L386 N388 E406 Y407 Q408	L386-A390 HydrophobicContact CB-CB 4.36Å; L386-A390 HydrophobicContact CD1-CB 4.12Å; L386-A390 WeakPolarHBondContact CD1-O 3.32Å; L386-A390 PolarHBondContact N-O 2.82Å; N388-A390 VanDerWaalsContact OD1-CB 3.32Å; N388-A390 WeakPolarHBondContact OD1-CB 3.43Å; N388-A390 PolarHBondContact OD1-N 3.43Å; A390-E406 HydrophobicContact CB-CG 3.77Å; A390-Y407 CarbonylContact C-O 3.57Å; A390-Y407 VanDerWaalsContact CA-O 3.23Å; A390-Y407 WeakPolarHBondContact CA-O 3.36Å; A390-Q408 HydrophobicContact CB-CG 4.22Å
391	I	96.5	Very high	91.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123.4	177.4	-59.5	172.3	0	0	0	109.1	F383 L384 E406 Y407 I416 L428 V430 I439	F383-I391 HydrophobicContact CB-CG2 4.21Å; F383-I391 HydrophobicContact CD1-CG2 4.38Å; L384-I391 CarbonylContact O-C 3.6Å; L384-I391 WeakPolarHBondContact O-CA 3.41Å; I391-E406 CarbonylContact O-C 3.17Å; I391-E406 WeakPolarHBondContact O-CA 3.15Å; I391-Y407 PolarHBondContact N-O 3.48Å; I391-Y407 PolarHBondContact O-N 2.91Å; I391-I416 HydrophobicContact CD1-CD1 3.87Å; I391-I416 HydrophobicContact CG1-CD1 3.48Å; I391-I416 VanDerWaalsContact CG1-CD1 3.48Å; I391-L428 HydrophobicContact CD1-CD2 4.06Å; I391-L428 HydrophobicContact CG2-CD2 4.33Å; I391-V430 HydrophobicContact CD1-CB 4.28Å; I391-V430 HydrophobicContact CD1-CG1 3.85Å; I391-V430 HydrophobicContact CD1-CG2 3.41Å; I391-V430 VanDerWaalsContact CD1-CG2 3.41Å; I391-I439 HydrophobicContact CD1-CD1 4.21Å
392	H	97.1	Very high	91.8	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.9	169.9	-74.3	-175.5	0	0	0	110.7	H364 Y366 F383 L384 L386 I403 A405 E406	H364-H392 AromaticContact CD2-CE1 3.47Å; H364-H392 PolarHBondContact CD2-CE1 2.79Å; H364-H392 VanDerWaalsContact CD2-CE1 3.47Å; H364-H392 AromaticContact NE2-CE1 3.68Å; Y366-H392 HydrophobicContact CE1-CB 4.24Å; Y366-H392 AromaticContact CE1-ND1 3.58Å; Y366-H392 AromaticContact CZ-ND1 3.62Å; Y366-H392 PolarHBondContact OH-ND1 3.3Å; F383-H392 CarbonylContact C-O 3.53Å; F383-H392 VanDerWaalsContact CA-O 3.29Å; F383-H392 WeakPolarHBondContact CA-O 3.35Å; L384-H392 HydrophobicContact CB-CB 4.36Å; L384-H392 PolarHBondContact N-O 2.83Å; L384-H392 PolarHBondContact O-N 3.45Å; L386-H392 HydrophobicContact CD1-CB 4.44Å; H392-I403 HydrophobicContact CB-CG2 4.07Å; H392-A405 CarbonylContact C-O 3.49Å; H392-A405 WeakPolarHBondContact CA-O 3.35Å; H392-E406 IonicContact CD2-OE2 3.41Å; H392-E406 IonicContact NE2-OE2 3.32Å; H392-E406 PolarHBondContact NE2-OE2 2.85Å; H392-E406 VanDerWaalsContact NE2-OE2 3.09Å
393	K	96.3	Very high	91.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	116.4	165.3	-178	-179.2	-178.6	-174.9	0	108	V381 M382 F383 I404 A405 Y407 V441 D459	V381-K393 HydrophobicContact CG1-CD 4.41Å; V381-K393 HydrophobicContact CG1-CG 3.73Å; M382-K393 WeakPolarHBondContact O-CA 3.32Å; F383-K393 HydrophobicContact CD1-CB 4.26Å; F383-K393 HydrophobicContact CD1-CG 4.32Å; F383-K393 HydrophobicContact CE1-CB 4.07Å; F383-K393 HydrophobicContact CE1-CD 4Å; F383-K393 HydrophobicContact CE1-CG 3.74Å; F383-K393 HydrophobicContact CZ-CD 4.4Å; F383-K393 HydrophobicContact CZ-CG 4.25Å; K393-I404 HydrophobicContact CD-CD1 4.44Å; K393-I404 HydrophobicContact CG-CD1 4.29Å; K393-I404 PolarHBondContact O-N 3.05Å; K393-A405 PolarHBondContact N-O 3.45Å; K393-A405 PolarHBondContact O-N 3.28Å; K393-Y407 HydrophobicContact CB-CE2 3.97Å; K393-Y407 HydrophobicContact CD-CE2 4.21Å; K393-V441 PolarHBondContact NZ-O 3.2Å; K393-D459 WeakPolarHBondContact CE-OD2 3.45Å; K393-D459 IonicContact NZ-OD1 3.55Å; K393-D459 PolarHBondContact NZ-OD1 2.98Å; K393-D459 IonicContact NZ-OD2 3.59Å; K393-D459 PolarHBondContact NZ-OD2 3.23Å
394	A	95.4	Very high	91.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.1	-176.6	0	0	0	0	0	111.2	L360 V381 M382 F402 I403	L360-A394 HydrophobicContact CD1-CB 4.04Å; V381-A394 CarbonylContact C-O 3.54Å; V381-A394 WeakPolarHBondContact CA-O 3.36Å; M382-A394 HydrophobicContact CB-CB 4.47Å; M382-A394 HydrophobicContact CE-CB 4.39Å; M382-A394 PolarHBondContact N-O 3.44Å; M382-A394 PolarHBondContact O-N 2.63Å; A394-F402 CarbonylContact C-O 3.59Å; A394-F402 VanDerWaalsContact CA-O 3.29Å; A394-F402 WeakPolarHBondContact CA-O 3.49Å; A394-I403 HydrophobicContact CB-CG1 4.35Å
395	L	93.3	Very high	91.4	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.6	171	174.5	66.3	0	0	0	109.5	H379 L397 S401 F402 I404 P460 V480	H379-L395 HydrophobicContact CB-CD1 3.6Å; L395-L397 HydrophobicContact CD2-CD2 3.76Å; L395-L397 HydrophobicContact CD2-CG 4.26Å; L395-L397 HydrophobicContact CG-CD2 4.09Å; L395-L397 HydrophobicContact CG-CG 4.29Å; L395-S401 CarbonylContact O-C 3.59Å; L395-S401 WeakPolarHBondContact O-CA 3.16Å; L395-F402 HydrophobicContact CB-CB 4.45Å; L395-F402 PolarHBondContact N-O 3.06Å; L395-F402 PolarHBondContact O-N 3.49Å; L395-I404 HydrophobicContact CB-CD1 3.93Å; L395-I404 HydrophobicContact CB-CG1 4.29Å; L395-P460 HydrophobicContact CD1-CB 4.39Å; L395-P460 HydrophobicContact CD1-CG 3.92Å; L395-V480 HydrophobicContact CD2-CG1 3.71Å; L395-V480 HydrophobicContact CD2-CG2 4.3Å
396	Q	90.8	Very high	91.4	Very high	18 Å²	18	27.1 Å²	27.1	8%	0.084	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	117.3	169.3	178.5	64.1	40	0	0	109.5	Y285 D380 M382 S401	Y285-Q396 HydrophobicContact CE1-CG 4.44Å; D380-Q396 HydrophobicContact CB-CB 3.95Å; D380-Q396 HydrophobicContact CB-CG 4.43Å; D380-Q396 WeakPolarHBondContact O-CB 3.42Å; D380-Q396 PolarHBondContact O-N 2.86Å; M382-Q396 HydrophobicContact CE-CB 4.44Å; M382-Q396 VanDerWaalsContact CE-OE1 3.32Å; Q396-S401 PolarHBondContact OE1-OG 2.87Å
397	L	86.4	Confident	91.4	Very high	36 Å²	36	27.1 Å²	27.1	19%	0.188	15%	0.147	C	C	.	.			trans	-102.2	-178.4	168	-60.9	169.6	0	0	0	109.1	L395 S399 H400 F402 V480	L395-L397 HydrophobicContact CD2-CD2 3.76Å; L395-L397 HydrophobicContact CD2-CG 4.26Å; L395-L397 HydrophobicContact CG-CD2 4.09Å; L395-L397 HydrophobicContact CG-CG 4.29Å; L397-S399 PolarHBondContact O-N 3.46Å; L397-H400 CarbonylContact C-O 3.53Å; L397-H400 WeakPolarHBondContact CA-O 3.23Å; L397-H400 WeakPolarHBondContact CB-O 3.16Å; L397-H400 WeakPolarHBondContact CD1-NE2 3.29Å; L397-H400 PolarHBondContact N-O 3.08Å; L397-F402 HydrophobicContact CD1-CB 4.38Å; L397-V480 HydrophobicContact CD2-CG1 4.43Å
398	E	79.7	Confident	91.7	Very high	175 Å²	175	27 Å²	27	82%	0.818	14%	0.139	S	C	*	.	S	Bend	trans	-56.1	-51.2	-175.1	-66	-176.2	170.9	0	0	113.1	M356	M356-E398 VanDerWaalsContact CE-O 3.31Å; M356-E398 WeakPolarHBondContact CE-O 3.42Å
399	S	76.8	Confident	91.7	Very high	75 Å²	75	23.9 Å²	23.9	52%	0.524	12%	0.123	S	C	.	.	S	Bend	trans	-115.9	-7.3	-171.2	61.3	0	0	0	0	115.8	M356 L397	M356-S399 VanDerWaalsContact CE-CA 3.46Å; M356-S399 VanDerWaalsContact CE-CB 3.47Å; L397-S399 PolarHBondContact O-N 3.46Å
400	H	84.8	Confident	91.6	Very high	75 Å²	75	24.4 Å²	24.4	35%	0.347	12%	0.124	S	C	.	.	S	Bend	trans	-155	178	-175.5	66.8	-65	0	0	0	109.6	V359 L397	V359-H400 CarbonylContact O-C 3.59Å; V359-H400 WeakPolarHBondContact O-CA 3.4Å; L397-H400 CarbonylContact C-O 3.53Å; L397-H400 WeakPolarHBondContact CA-O 3.23Å; L397-H400 WeakPolarHBondContact CB-O 3.16Å; L397-H400 WeakPolarHBondContact CD1-NE2 3.29Å; L397-H400 PolarHBondContact N-O 3.08Å
401	S	91.5	Very high	91.3	Very high	10 Å²	10	29.6 Å²	29.6	7%	0.07	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	148.1	177	-58.3	0	0	0	0	110.6	V359 M382 L395 Q396	V359-S401 WeakPolarHBondContact O-CB 3.38Å; V359-S401 PolarHBondContact O-N 3.05Å; V359-S401 PolarHBondContact O-OG 2.68Å; M382-S401 WeakPolarHBondContact CE-OG 3.31Å; L395-S401 CarbonylContact O-C 3.59Å; L395-S401 WeakPolarHBondContact O-CA 3.16Å; Q396-S401 PolarHBondContact OE1-OG 2.87Å
402	F	91.9	Very high	90.9	Very high	9 Å²	9	33.7 Å²	33.7	4%	0.039	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	117.1	174.5	176.3	-100.3	0	0	0	109.7	R22 A394 L395 L397 I404 S457 R458 H531	R22-F402 HydrophobicContact CB-CZ 4.21Å; A394-F402 CarbonylContact C-O 3.59Å; A394-F402 VanDerWaalsContact CA-O 3.29Å; A394-F402 WeakPolarHBondContact CA-O 3.49Å; L395-F402 HydrophobicContact CB-CB 4.45Å; L395-F402 PolarHBondContact N-O 3.06Å; L395-F402 PolarHBondContact O-N 3.49Å; L397-F402 HydrophobicContact CD1-CB 4.38Å; F402-I404 HydrophobicContact CD1-CG1 3.75Å; F402-I404 HydrophobicContact CE1-CB 4.45Å; F402-I404 HydrophobicContact CE1-CG1 3.98Å; F402-I404 PolarHBondContact O-N 3.32Å; F402-I404 VanDerWaalsContact O-N 3.14Å; F402-S457 WeakPolarHBondContact CE1-O 3.05Å; F402-R458 HydrophobicContact CD1-CB 4.09Å; F402-R458 HydrophobicContact CE1-CB 3.93Å; F402-R458 HydrophobicContact CE1-CG 4.29Å; F402-H531 AromaticContact CE2-CE1 3.58Å; F402-H531 AromaticContact CE2-ND1 3.47Å; F402-H531 WeakPolarHBondContact CE2-ND1 3.43Å; F402-H531 AromaticContact CZ-ND1 3.93Å
403	I	94.9	Very high	90.5	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.015	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	97.1	179.8	-51.1	177.8	0	0	0	108.9	H19 P21 R22 L360 N362 H392 A394	H19-I403 WeakPolarHBondContact O-CD1 3.21Å; P21-I403 HydrophobicContact CB-CG2 3.79Å; R22-I403 PolarHBondContact N-O 2.73Å; L360-I403 HydrophobicContact CD1-CG1 4.49Å; N362-I403 WeakPolarHBondContact ND2-CD1 3.43Å; H392-I403 HydrophobicContact CB-CG2 4.07Å; A394-I403 HydrophobicContact CB-CG1 4.35Å
404	I	94.6	Very high	90	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	-49.7	-177.5	-61.9	162.5	0	0	0	110.3	R22 M23 K393 L395 F402 Y447 D459	R22-I404 WeakPolarHBondContact CB-O 2.98Å; M23-I404 PolarHBondContact N-O 3.46Å; K393-I404 HydrophobicContact CD-CD1 4.44Å; K393-I404 HydrophobicContact CG-CD1 4.29Å; K393-I404 PolarHBondContact O-N 3.05Å; L395-I404 HydrophobicContact CB-CD1 3.93Å; L395-I404 HydrophobicContact CB-CG1 4.29Å; F402-I404 HydrophobicContact CD1-CG1 3.75Å; F402-I404 HydrophobicContact CE1-CB 4.45Å; F402-I404 HydrophobicContact CE1-CG1 3.98Å; F402-I404 PolarHBondContact O-N 3.32Å; F402-I404 VanDerWaalsContact O-N 3.14Å; I404-Y447 HydrophobicContact CG2-CE1 4.12Å; I404-Y447 WeakPolarHBondContact CG2-OH 3.49Å; I404-D459 HydrophobicContact CD1-CB 4.36Å; I404-D459 HydrophobicContact CG2-CB 4.26Å
405	A	94.9	Very high	89.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	157.5	-173.8	0	0	0	0	0	113.6	M23 F25 H392 K393	M23-A405 CarbonylContact O-C 3.55Å; M23-A405 WeakPolarHBondContact O-CA 3.49Å; F25-A405 HydrophobicContact CD2-CB 3.79Å; F25-A405 HydrophobicContact CE2-CB 3.38Å; F25-A405 HydrophobicContact CZ-CB 4.4Å; H392-A405 CarbonylContact C-O 3.49Å; H392-A405 WeakPolarHBondContact CA-O 3.35Å; K393-A405 PolarHBondContact N-O 3.45Å; K393-A405 PolarHBondContact O-N 3.28Å
406	E	95.2	Very high	89.6	Confident	18 Å²	18	42.8 Å²	42.8	8%	0.084	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	124.7	164.1	179.8	-178.2	130.6	0	0	109.7	P21 M23 V24 F25 A390 I391 H392 Q408	P21-E406 HydrophobicContact CB-CB 3.77Å; P21-E406 HydrophobicContact CG-CB 3.84Å; M23-E406 PolarHBondContact O-N 3.41Å; V24-E406 CarbonylContact C-O 3.59Å; V24-E406 WeakPolarHBondContact CA-O 3.04Å; V24-E406 HydrophobicContact CG2-CB 4.17Å; F25-E406 PolarHBondContact N-O 3.08Å; A390-E406 HydrophobicContact CB-CG 3.77Å; I391-E406 CarbonylContact O-C 3.17Å; I391-E406 WeakPolarHBondContact O-CA 3.15Å; H392-E406 IonicContact CD2-OE2 3.41Å; H392-E406 IonicContact NE2-OE2 3.32Å; H392-E406 PolarHBondContact NE2-OE2 2.85Å; H392-E406 VanDerWaalsContact NE2-OE2 3.09Å; E406-Q408 HydrophobicContact CG-CG 4.31Å; E406-Q408 WeakPolarHBondContact OE1-CG 3.44Å; E406-Q408 PolarHBondContact OE1-NE2 2.04Å
407	Y	94.9	Very high	89.5	Confident	8 Å²	8	43.5 Å²	43.5	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.4	169	-63.9	-76.1	0	0	0	109.7	F25 A390 I391 K393 P409 I439 V441 Q446	F25-Y407 HydrophobicContact CB-CD1 3.99Å; F25-Y407 HydrophobicContact CB-CE1 4.33Å; F25-Y407 AromaticContact CD2-CD1 3.88Å; F25-Y407 HydrophobicContact CD2-CD1 3.88Å; F25-Y407 AromaticContact CD2-CE1 3.52Å; F25-Y407 HydrophobicContact CD2-CE1 3.52Å; F25-Y407 HydrophobicContact CE2-CE1 4.27Å; F25-Y407 HydrophobicContact CG-CD1 4.38Å; F25-Y407 HydrophobicContact CG-CE1 4.28Å; A390-Y407 CarbonylContact C-O 3.57Å; A390-Y407 VanDerWaalsContact CA-O 3.23Å; A390-Y407 WeakPolarHBondContact CA-O 3.36Å; I391-Y407 PolarHBondContact N-O 3.48Å; I391-Y407 PolarHBondContact O-N 2.91Å; K393-Y407 HydrophobicContact CB-CE2 3.97Å; K393-Y407 HydrophobicContact CD-CE2 4.21Å; Y407-P409 WeakPolarHBondContact O-CD 3.02Å; Y407-I439 HydrophobicContact CD1-CG2 3.74Å; Y407-I439 HydrophobicContact CD2-CG2 4.49Å; Y407-I439 HydrophobicContact CE1-CG2 3.86Å; Y407-I439 HydrophobicContact CG-CD1 4.46Å; Y407-I439 HydrophobicContact CG-CG2 4.09Å; Y407-V441 HydrophobicContact CE2-CG1 4.28Å; Y407-Q446 PolarHBondContact OH-NE2 3.26Å
408	Q	93.6	Very high	89.4	Confident	64 Å²	64	43.7 Å²	43.7	30%	0.299	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	78.4	171.4	-64	-177.4	-8.9	0	0	109.6	V24 F25 Y27 A390 E406 F410	V24-Q408 HydrophobicContact CG1-CG 4.21Å; F25-Q408 PolarHBondContact O-N 3.17Å; Y27-Q408 WeakPolarHBondContact CA-O 3.32Å; Y27-Q408 PolarHBondContact N-O 3.08Å; A390-Q408 HydrophobicContact CB-CG 4.22Å; E406-Q408 HydrophobicContact CG-CG 4.31Å; E406-Q408 WeakPolarHBondContact OE1-CG 3.44Å; E406-Q408 PolarHBondContact OE1-NE2 2.04Å; Q408-F410 VanDerWaalsContact C-N 3.25Å; Q408-F410 PolarHBondContact O-N 3.42Å
409	P	91.6	Very high	89.9	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.019	19%	0.19	C	C	.	.			trans	-70.6	-17.1	-172.2	25.2	-33.5	0	0	0	114.8	Y27 R34 Y407 V437 I439	Y27-P409 WeakPolarHBondContact CD2-O 3.11Å; R34-P409 PolarHBondContact NH2-O 3.34Å; Y407-P409 WeakPolarHBondContact O-CD 3.02Å; P409-V437 HydrophobicContact CB-CG1 3.84Å; P409-I439 HydrophobicContact CB-CD1 3.89Å; P409-I439 HydrophobicContact CB-CG1 4.3Å; P409-I439 HydrophobicContact CG-CD1 4.04Å
410	F	89.3	Confident	90.5	Very high	14 Å²	14	33.4 Å²	33.4	6%	0.061	17%	0.172	C	C	.	.			trans	-110.4	146.8	-178.6	-52	-72.2	0	0	0	110.5	Q408 Y412 A414 I416 V430 E435 V437	Q408-F410 VanDerWaalsContact C-N 3.25Å; Q408-F410 PolarHBondContact O-N 3.42Å; F410-Y412 VanDerWaalsContact C-N 3.28Å; F410-Y412 HydrophobicContact CB-CE1 4.42Å; F410-Y412 WeakPolarHBondContact CB-O 3.04Å; F410-A414 HydrophobicContact CB-CB 4.31Å; F410-A414 HydrophobicContact CD2-CB 3.73Å; F410-A414 HydrophobicContact CE2-CB 4.19Å; F410-A414 HydrophobicContact CG-CB 3.93Å; F410-I416 HydrophobicContact CE2-CG1 4.1Å; F410-V430 HydrophobicContact CE2-CG1 4.11Å; F410-V430 HydrophobicContact CZ-CG1 4.05Å; F410-E435 HydrophobicContact CE1-CB 4.44Å; F410-V437 HydrophobicContact CD1-CG2 4.39Å; F410-V437 HydrophobicContact CE1-CG2 3.82Å; F410-V437 HydrophobicContact CZ-CG2 4.49Å
411	N	87.4	Confident	90.7	Very high	112 Å²	112	30.7 Å²	30.7	60%	0.599	16%	0.16	S	C	*	.	S	Bend	trans	-88.1	5	173.3	65.3	-32	0	0	0	113	Y27	Y27-N411 HydrophobicContact CD1-CB 4.41Å; Y27-N411 HydrophobicContact CD2-CB 4.06Å; Y27-N411 HydrophobicContact CE2-CB 4.29Å; Y27-N411 HydrophobicContact CG-CB 4.14Å
412	Y	87.9	Confident	90.5	Very high	86 Å²	86	30.4 Å²	30.4	34%	0.337	16%	0.158	S	C	.	.	S	Bend	trans	-135.5	161.1	174.7	54	-87.6	0	0	0	109.1	F410 A414 S432 T434 E435	F410-Y412 VanDerWaalsContact C-N 3.28Å; F410-Y412 HydrophobicContact CB-CE1 4.42Å; F410-Y412 WeakPolarHBondContact CB-O 3.04Å; Y412-A414 HydrophobicContact CD2-CB 3.94Å; Y412-A414 HydrophobicContact CE2-CB 3.61Å; Y412-A414 PolarHBondContact O-N 3.41Å; Y412-S432 PolarHBondContact OH-OG 3.47Å; Y412-T434 PolarHBondContact OH-OG1 2.85Å; Y412-E435 WeakPolarHBondContact CE1-OE2 3.25Å; Y412-E435 PolarHBondContact OH-OE2 3.15Å
413	S	88.9	Confident	90	Very high	94 Å²	94	33.6 Å²	33.6	66%	0.657	18%	0.179	S	C	*	.			trans	-67.9	121.1	171.9	-175.9	0	0	0	0	109.5	N388	N388-S413 WeakPolarHBondContact O-CA 3.26Å
414	A	87.1	Confident	89.3	Confident	6 Å²	6	37.1 Å²	37.1	5%	0.05	20%	0.204	C	C	.	.			trans	-130.3	136.7	-175.2	0	0	0	0	0	110.8	N388 G389 F410 Y412 I416	N388-A414 CarbonylContact C-O 3.55Å; N388-A414 PolarHBondContact O-N 3.08Å; G389-A414 WeakPolarHBondContact CA-O 3.39Å; G389-A414 PolarHBondContact N-O 3.22Å; F410-A414 HydrophobicContact CB-CB 4.31Å; F410-A414 HydrophobicContact CD2-CB 3.73Å; F410-A414 HydrophobicContact CE2-CB 4.19Å; F410-A414 HydrophobicContact CG-CB 3.93Å; Y412-A414 HydrophobicContact CD2-CB 3.94Å; Y412-A414 HydrophobicContact CE2-CB 3.61Å; Y412-A414 PolarHBondContact O-N 3.41Å; A414-I416 PolarHBondContact O-N 3.06Å
415	H	88.8	Confident	88.9	Confident	91 Å²	91	39.5 Å²	39.5	42%	0.421	22%	0.219	S	C	.	.			trans	-77.8	115.7	169.3	-176.9	-78.4	0	0	0	109.4	L417	H415-L417 PolarHBondContact O-N 2.83Å
416	I	91.1	Very high	88.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.			trans	-70	118.3	174.2	-69.2	164.2	0	0	0	109.1	G389 I391 F410 A414 N418 F419 V430	G389-I416 WeakPolarHBondContact O-CD1 3.37Å; I391-I416 HydrophobicContact CD1-CD1 3.87Å; I391-I416 HydrophobicContact CG1-CD1 3.48Å; I391-I416 VanDerWaalsContact CG1-CD1 3.48Å; F410-I416 HydrophobicContact CE2-CG1 4.1Å; A414-I416 PolarHBondContact O-N 3.06Å; I416-N418 VanDerWaalsContact CG2-O 3.3Å; I416-N418 WeakPolarHBondContact CG2-O 3.32Å; I416-F419 HydrophobicContact CG2-CD1 3.68Å; I416-F419 HydrophobicContact CG2-CE1 4.38Å; I416-V430 HydrophobicContact CD1-CG1 4Å; I416-V430 HydrophobicContact CG1-CG1 3.81Å; I416-V430 HydrophobicContact CG2-CG1 3.89Å
417	L	87.2	Confident	88.2	Confident	34 Å²	34	41.6 Å²	41.6	18%	0.178	23%	0.228	C	C	.	.			trans	-85.3	-33.3	-177.7	-67.8	173.1	0	0	0	112.2	L41 R368 H415 N431 Q433	L41-L417 HydrophobicContact CB-CD1 4.28Å; L41-L417 HydrophobicContact CD1-CD1 3.64Å; L41-L417 HydrophobicContact CD2-CD1 3.41Å; L41-L417 VanDerWaalsContact CD2-CD1 3.41Å; L41-L417 HydrophobicContact CG-CD1 3.93Å; R368-L417 PolarHBondContact NE-O 2.83Å; R368-L417 PolarHBondContact NH2-O 3.19Å; H415-L417 PolarHBondContact O-N 2.83Å; L417-N431 WeakPolarHBondContact CB-ND2 3.1Å; L417-N431 PolarHBondContact N-O 2.04Å; L417-Q433 HydrophobicContact CD1-CG 3.99Å
418	N	85.8	Confident	88.1	Confident	40 Å²	40	41.2 Å²	41.2	21%	0.214	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	163	174	-161.1	15.9	0	0	0	109.3	I416 N431	I416-N418 VanDerWaalsContact CG2-O 3.3Å; I416-N418 WeakPolarHBondContact CG2-O 3.32Å; N418-N431 WeakPolarHBondContact CA-OD1 3.26Å; N418-N431 WeakPolarHBondContact CB-OD1 3.04Å; N418-N431 PolarHBondContact N-OD1 3.2Å; N418-N431 PolarHBondContact O-N 2.83Å; N418-N431 PolarHBondContact O-OD1 2.87Å
419	F	89.8	Confident	88	Confident	7 Å²	7	38.5 Å²	38.5	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	143.3	162.2	53.8	-85.9	0	0	0	110.1	R368 L370 F383 S385 I416 L428 Y429 V430	R368-F419 HydrophobicContact CB-CE1 3.57Å; R368-F419 HydrophobicContact CB-CZ 4.03Å; L370-F419 HydrophobicContact CB-CD2 3.76Å; L370-F419 HydrophobicContact CB-CE2 3.32Å; L370-F419 HydrophobicContact CB-CZ 4.31Å; L370-F419 HydrophobicContact CD2-CD2 3.98Å; L370-F419 HydrophobicContact CD2-CE2 4.36Å; L370-F419 HydrophobicContact CG-CE2 4.5Å; F383-F419 HydrophobicContact CB-CD2 4.33Å; F383-F419 HydrophobicContact CB-CE2 3.7Å; F383-F419 WeakPolarHBondContact O-CE2 3.43Å; F383-F419 WeakPolarHBondContact O-CZ 3.2Å; S385-F419 VanDerWaalsContact CB-CE1 3.48Å; S385-F419 WeakPolarHBondContact OG-CE1 3.46Å; I416-F419 HydrophobicContact CG2-CD1 3.68Å; I416-F419 HydrophobicContact CG2-CE1 4.38Å; F419-L428 HydrophobicContact CB-CD1 4.38Å; F419-L428 HydrophobicContact CD2-CD1 4.03Å; F419-Y429 CarbonylContact C-O 3.23Å; F419-Y429 WeakPolarHBondContact CA-O 3.19Å; F419-Y429 WeakPolarHBondContact CB-O 3.06Å; F419-V430 HydrophobicContact CB-CB 4.46Å; F419-V430 HydrophobicContact CB-CG1 4.49Å; F419-V430 HydrophobicContact CB-CG2 4.05Å
420	V	89.4	Confident	87.9	Confident	26 Å²	26	38.4 Å²	38.4	16%	0.158	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.3	-174	-75.6	0	0	0	0	109.1	I45 F47 Y429	I45-V420 HydrophobicContact CB-CG2 3.59Å; I45-V420 HydrophobicContact CD1-CG2 4.22Å; I45-V420 HydrophobicContact CG2-CG2 3.64Å; F47-V420 HydrophobicContact CE1-CG2 4.27Å; F47-V420 HydrophobicContact CE2-CB 3.76Å; F47-V420 HydrophobicContact CE2-CG2 3.83Å; F47-V420 HydrophobicContact CZ-CB 3.76Å; F47-V420 HydrophobicContact CZ-CG2 3.32Å; V420-Y429 PolarHBondContact N-O 2.95Å; V420-Y429 PolarHBondContact O-N 2.88Å
421	L	89.1	Confident	87.9	Confident	19 Å²	19	37.8 Å²	37.8	10%	0.099	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.9	-179.1	-178.8	72.4	0	0	0	108.7	F47 L370 D372 F383 P423 L428 V441	F47-L421 WeakPolarHBondContact CE2-O 3.46Å; L370-L421 HydrophobicContact CD2-CB 3.5Å; L370-L421 VanDerWaalsContact CD2-CB 3.5Å; D372-L421 HydrophobicContact CB-CD2 3.45Å; D372-L421 VanDerWaalsContact CB-CD2 3.45Å; D372-L421 VanDerWaalsContact CG-CD2 3.41Å; F383-L421 HydrophobicContact CE2-CD2 3.99Å; L421-P423 WeakPolarHBondContact O-CD 3.46Å; L421-L428 HydrophobicContact CB-CD1 4.04Å; L421-L428 HydrophobicContact CD1-CB 4.11Å; L421-L428 HydrophobicContact CD1-CD1 4.25Å; L421-V441 HydrophobicContact CD1-CG2 3.76Å
422	N	86.6	Confident	87.9	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	113.7	162.4	-179.6	-40.3	0	0	0	108	F47 S424 T425 K426 K427 Y429	F47-N422 HydrophobicContact CD1-CB 4.36Å; F47-N422 HydrophobicContact CD2-CB 4.15Å; F47-N422 HydrophobicContact CE2-CB 4.35Å; F47-N422 HydrophobicContact CG-CB 4.12Å; N422-S424 VanDerWaalsContact C-N 3.29Å; N422-S424 PolarHBondContact O-N 2.87Å; N422-S424 PolarHBondContact OD1-N 3.12Å; N422-T425 WeakPolarHBondContact CB-OG1 3.22Å; N422-T425 PolarHBondContact OD1-N 3.33Å; N422-T425 PolarHBondContact OD1-OG1 3.38Å; N422-K426 VanDerWaalsContact O-CA 3.3Å; N422-K426 WeakPolarHBondContact O-CA 3.31Å; N422-K426 PolarHBondContact O-N 2.72Å; N422-K427 PolarHBondContact N-O 3.3Å; N422-Y429 HydrophobicContact CB-CE2 4.22Å
423	P	81.7	Confident	87.7	Confident	75 Å²	75	34.3 Å²	34.3	49%	0.487	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-27	-174.1	27.7	-35	0	0	0	113	L421 K426	L421-P423 WeakPolarHBondContact O-CD 3.46Å; P423-K426 VanDerWaalsContact O-CD 3.32Å; P423-K426 WeakPolarHBondContact O-CD 3.33Å; P423-K426 WeakPolarHBondContact O-CE 3.22Å; P423-K426 PolarHBondContact O-NZ 3.14Å
424	S	81	Confident	87.5	Confident	77 Å²	77	33.2 Å²	33.2	54%	0.538	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-43.1	-178.9	-53.3	0	0	0	0	112.1	N422	N422-S424 VanDerWaalsContact C-N 3.29Å; N422-S424 PolarHBondContact O-N 2.87Å; N422-S424 PolarHBondContact OD1-N 3.12Å
425	T	84.5	Confident	87.4	Confident	51 Å²	51	34.6 Å²	34.6	31%	0.313	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-4.6	-176.1	69.2	0	0	0	0	113.8	N422 K427	N422-T425 WeakPolarHBondContact CB-OG1 3.22Å; N422-T425 PolarHBondContact OD1-N 3.33Å; N422-T425 PolarHBondContact OD1-OG1 3.38Å; T425-K427 WeakPolarHBondContact O-CD 3.1Å; T425-K427 VanDerWaalsContact O-CE 3.3Å; T425-K427 WeakPolarHBondContact O-CE 3.41Å; T425-K427 WeakPolarHBondContact O-CG 3.29Å; T425-K427 PolarHBondContact O-N 2.83Å; T425-K427 VanDerWaalsContact O-N 3.14Å; T425-K427 WeakPolarHBondContact OG1-CG 3.31Å
426	K	88.2	Confident	87.4	Confident	20 Å²	20	30.3 Å²	30.3	9%	0.087	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	47	43.4	-174.2	-56.7	-55.6	-176.1	-165.1	0	112.8	D372 N422 P423 V441 E442	D372-K426 VanDerWaalsContact CG-NZ 3.33Å; D372-K426 IonicContact OD1-NZ 2.66Å; D372-K426 PolarHBondContact OD1-NZ 3.38Å; D372-K426 VanDerWaalsContact OD1-NZ 3.1Å; D372-K426 WeakPolarHBondContact OD2-CE 3.16Å; D372-K426 IonicContact OD2-NZ 3.08Å; D372-K426 PolarHBondContact OD2-NZ 2.91Å; N422-K426 VanDerWaalsContact O-CA 3.3Å; N422-K426 WeakPolarHBondContact O-CA 3.31Å; N422-K426 PolarHBondContact O-N 2.72Å; P423-K426 VanDerWaalsContact O-CD 3.32Å; P423-K426 WeakPolarHBondContact O-CD 3.33Å; P423-K426 WeakPolarHBondContact O-CE 3.22Å; P423-K426 PolarHBondContact O-NZ 3.14Å; K426-V441 HydrophobicContact CB-CG2 4.07Å; K426-V441 WeakPolarHBondContact O-CG2 3.43Å; K426-V441 PolarHBondContact O-N 3.05Å; K426-E442 HydrophobicContact CB-CB 3.94Å
427	K	89.3	Confident	87.3	Confident	42 Å²	42	30.3 Å²	30.3	18%	0.183	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.1	174.4	-54.6	-52.2	174.2	-154.1	0	109.2	N422 T425 Y429 Q438 I439 D440	N422-K427 PolarHBondContact N-O 3.3Å; T425-K427 WeakPolarHBondContact O-CD 3.1Å; T425-K427 VanDerWaalsContact O-CE 3.3Å; T425-K427 WeakPolarHBondContact O-CE 3.41Å; T425-K427 WeakPolarHBondContact O-CG 3.29Å; T425-K427 PolarHBondContact O-N 2.83Å; T425-K427 VanDerWaalsContact O-N 3.14Å; T425-K427 WeakPolarHBondContact OG1-CG 3.31Å; K427-Y429 HydrophobicContact CB-CE2 3.77Å; K427-Y429 WeakPolarHBondContact O-CD2 3.41Å; K427-Y429 WeakPolarHBondContact O-CE2 3.42Å; K427-Q438 HydrophobicContact CB-CG 3.98Å; K427-Q438 HydrophobicContact CG-CG 4.5Å; K427-I439 CarbonylContact C-O 3.53Å; K427-I439 WeakPolarHBondContact CA-O 3.43Å; K427-D440 HydrophobicContact CD-CB 4.06Å; K427-D440 IonicContact NZ-OD1 3.4Å; K427-D440 PolarHBondContact NZ-OD1 2.84Å; K427-D440 IonicContact NZ-OD2 2.76Å; K427-D440 PolarHBondContact NZ-OD2 2.81Å
428	L	91.8	Very high	87.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	122	-179.1	-176	72.6	0	0	0	109.4	L370 F383 I391 F419 L421 V430 Q438 I439 V441	L370-L428 HydrophobicContact CD2-CD1 3.92Å; F383-L428 HydrophobicContact CD1-CD2 3.91Å; F383-L428 HydrophobicContact CE1-CD2 4.37Å; F383-L428 HydrophobicContact CG-CD2 4.39Å; I391-L428 HydrophobicContact CD1-CD2 4.06Å; I391-L428 HydrophobicContact CG2-CD2 4.33Å; F419-L428 HydrophobicContact CB-CD1 4.38Å; F419-L428 HydrophobicContact CD2-CD1 4.03Å; L421-L428 HydrophobicContact CB-CD1 4.04Å; L421-L428 HydrophobicContact CD1-CB 4.11Å; L421-L428 HydrophobicContact CD1-CD1 4.25Å; L428-V430 HydrophobicContact CD2-CG2 4.18Å; L428-V430 HydrophobicContact CG-CG2 4.07Å; L428-Q438 CarbonylContact O-C 3.55Å; L428-Q438 WeakPolarHBondContact O-CA 3.41Å; L428-I439 HydrophobicContact CB-CB 4.31Å; L428-I439 HydrophobicContact CD2-CD1 4.43Å; L428-I439 PolarHBondContact N-O 3.07Å; L428-I439 PolarHBondContact O-N 3.46Å; L428-V441 HydrophobicContact CB-CG1 3.67Å; L428-V441 HydrophobicContact CD2-CG1 4.16Å
429	Y	90.6	Very high	87.8	Confident	8 Å²	8	28.2 Å²	28.2	3%	0.031	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.8	-179.1	-58.2	-94.2	0	0	0	109.5	F47 V54 F67 F419 V420 N422 K427 V437 Q438	F47-Y429 HydrophobicContact CD1-CD2 4.14Å; F47-Y429 AromaticContact CD1-CE2 3.85Å; F47-Y429 HydrophobicContact CD1-CE2 3.85Å; F47-Y429 AromaticContact CE1-CD2 3.05Å; F47-Y429 HydrophobicContact CE1-CD2 3.05Å; F47-Y429 AromaticContact CE1-CE2 3.19Å; F47-Y429 HydrophobicContact CE1-CE2 3.19Å; F47-Y429 AromaticContact CE1-CG 3.75Å; F47-Y429 HydrophobicContact CE1-CG 3.75Å; F47-Y429 AromaticContact CZ-CD2 3.27Å; F47-Y429 HydrophobicContact CZ-CD2 3.27Å; F47-Y429 AromaticContact CZ-CE2 3.76Å; F47-Y429 HydrophobicContact CZ-CE2 3.76Å; F47-Y429 HydrophobicContact CZ-CG 4.09Å; V54-Y429 HydrophobicContact CG2-CD1 3.88Å; V54-Y429 HydrophobicContact CG2-CE1 3.32Å; V54-Y429 HydrophobicContact CG2-CE2 4.12Å; V54-Y429 HydrophobicContact CG2-CG 4.48Å; V54-Y429 VanDerWaalsContact CG2-CZ 3.4Å; F67-Y429 HydrophobicContact CD2-CD1 4.37Å; F67-Y429 AromaticContact CD2-CE1 3.74Å; F67-Y429 HydrophobicContact CD2-CE1 3.74Å; F67-Y429 HydrophobicContact CE1-CD1 4.46Å; F67-Y429 HydrophobicContact CE1-CE1 4.47Å; F67-Y429 AromaticContact CE2-CD1 3.74Å; F67-Y429 HydrophobicContact CE2-CD1 3.74Å; F67-Y429 AromaticContact CE2-CE1 3.57Å; F67-Y429 HydrophobicContact CE2-CE1 3.57Å; F67-Y429 HydrophobicContact CG-CE1 4.27Å; F67-Y429 AromaticContact CZ-CD1 3.78Å; F67-Y429 HydrophobicContact CZ-CD1 3.78Å; F67-Y429 AromaticContact CZ-CE1 3.96Å; F67-Y429 HydrophobicContact CZ-CE1 3.96Å; F419-Y429 CarbonylContact C-O 3.23Å; F419-Y429 WeakPolarHBondContact CA-O 3.19Å; F419-Y429 WeakPolarHBondContact CB-O 3.06Å; V420-Y429 PolarHBondContact N-O 2.95Å; V420-Y429 PolarHBondContact O-N 2.88Å; N422-Y429 HydrophobicContact CB-CE2 4.22Å; K427-Y429 HydrophobicContact CB-CE2 3.77Å; K427-Y429 WeakPolarHBondContact O-CD2 3.41Å; K427-Y429 WeakPolarHBondContact O-CE2 3.42Å; Y429-V437 CarbonylContact C-O 3.58Å; Y429-V437 VanDerWaalsContact CA-O 3.31Å; Y429-V437 WeakPolarHBondContact CA-O 3.44Å; Y429-Q438 HydrophobicContact CD1-CB 3.74Å; Y429-Q438 HydrophobicContact CD1-CG 3.9Å; Y429-Q438 HydrophobicContact CE1-CB 3.65Å; Y429-Q438 HydrophobicContact CE1-CG 3.41Å; Y429-Q438 VanDerWaalsContact CE1-CG 3.41Å
430	V	91.3	Very high	87.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	124.5	-168.6	-174.1	0	0	0	0	108.7	I391 F410 I416 F419 L428 V437 I439	I391-V430 HydrophobicContact CD1-CB 4.28Å; I391-V430 HydrophobicContact CD1-CG1 3.85Å; I391-V430 HydrophobicContact CD1-CG2 3.41Å; I391-V430 VanDerWaalsContact CD1-CG2 3.41Å; F410-V430 HydrophobicContact CE2-CG1 4.11Å; F410-V430 HydrophobicContact CZ-CG1 4.05Å; I416-V430 HydrophobicContact CD1-CG1 4Å; I416-V430 HydrophobicContact CG1-CG1 3.81Å; I416-V430 HydrophobicContact CG2-CG1 3.89Å; F419-V430 HydrophobicContact CB-CB 4.46Å; F419-V430 HydrophobicContact CB-CG1 4.49Å; F419-V430 HydrophobicContact CB-CG2 4.05Å; L428-V430 HydrophobicContact CD2-CG2 4.18Å; L428-V430 HydrophobicContact CG-CG2 4.07Å; V430-V437 PolarHBondContact N-O 3.47Å; V430-V437 PolarHBondContact O-N 3.32Å; V430-I439 HydrophobicContact CG2-CD1 3.85Å
431	N	88.2	Confident	87.9	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.011	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130	176.8	65.1	-45.8	0	0	0	112.1	L37 P42 I45 L417 N418 E435 L436	L37-N431 HydrophobicContact CD1-CB 4.25Å; P42-N431 HydrophobicContact CG-CB 4.05Å; P42-N431 VanDerWaalsContact CG-ND2 3.26Å; P42-N431 WeakPolarHBondContact CG-ND2 3.27Å; I45-N431 HydrophobicContact CD1-CB 4.35Å; L417-N431 WeakPolarHBondContact CB-ND2 3.1Å; L417-N431 PolarHBondContact N-O 2.04Å; N418-N431 WeakPolarHBondContact CA-OD1 3.26Å; N418-N431 WeakPolarHBondContact CB-OD1 3.04Å; N418-N431 PolarHBondContact N-OD1 3.2Å; N418-N431 PolarHBondContact O-N 2.83Å; N418-N431 PolarHBondContact O-OD1 2.87Å; N431-E435 WeakPolarHBondContact CA-O 3.43Å; N431-L436 HydrophobicContact CB-CD1 4.13Å
432	S	88.1	Confident	87.9	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.007	17%	0.166	C	C	.	.			trans	-94.5	-171.6	159.7	74.9	0	0	0	0	109.6	Y412 T434 E435	Y412-S432 PolarHBondContact OH-OG 3.47Å; S432-T434 PolarHBondContact O-N 3.09Å; S432-T434 PolarHBondContact OG-N 3Å; S432-T434 VanDerWaalsContact OG-N 3.16Å; S432-T434 PolarHBondContact OG-OG1 3.4Å; S432-T434 VanDerWaalsContact OG-OG1 3.13Å; S432-E435 PolarHBondContact N-O 3.4Å; S432-E435 PolarHBondContact OG-N 2.93Å; S432-E435 PolarHBondContact OG-O 2.91Å
433	Q	83.2	Confident	88.1	Confident	124 Å²	124	33.2 Å²	33.2	58%	0.579	18%	0.182	S	C	*	.	S	Bend	trans	-68.2	-19.2	172.5	-68.4	178.6	2.6	0	0	113.6	L41 L417	L41-Q433 HydrophobicContact CD2-CB 4.23Å; L41-Q433 HydrophobicContact CD2-CG 4.35Å; L417-Q433 HydrophobicContact CD1-CG 3.99Å
434	T	84.1	Confident	88.5	Confident	71 Å²	71	29.8 Å²	29.8	44%	0.436	16%	0.159	S	C	.	.	S	Bend	trans	-124.4	-21.3	-166.2	48.2	0	0	0	0	113.3	L37 Y412 S432	L37-T434 PolarHBondContact N-O 3.45Å; Y412-T434 PolarHBondContact OH-OG1 2.85Å; S432-T434 PolarHBondContact O-N 3.09Å; S432-T434 PolarHBondContact OG-N 3Å; S432-T434 VanDerWaalsContact OG-N 3.16Å; S432-T434 PolarHBondContact OG-OG1 3.4Å; S432-T434 VanDerWaalsContact OG-OG1 3.13Å
435	E	86.7	Confident	88.9	Confident	34 Å²	34	28.1 Å²	28.1	16%	0.159	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	149.1	-173.2	-63.4	178.8	108.5	0	0	111.8	R34 F35 F410 Y412 N431 S432	R34-E435 IonicContact NH1-OE1 3.47Å; R34-E435 PolarHBondContact NH1-OE1 3.27Å; R34-E435 IonicContact NH1-OE2 2.83Å; R34-E435 PolarHBondContact NH1-OE2 3.47Å; F35-E435 CarbonylContact O-C 3.52Å; F35-E435 WeakPolarHBondContact O-CA 3.33Å; F410-E435 HydrophobicContact CE1-CB 4.44Å; Y412-E435 WeakPolarHBondContact CE1-OE2 3.25Å; Y412-E435 PolarHBondContact OH-OE2 3.15Å; N431-E435 WeakPolarHBondContact CA-O 3.43Å; S432-E435 PolarHBondContact N-O 3.4Å; S432-E435 PolarHBondContact OG-N 2.93Å; S432-E435 PolarHBondContact OG-O 2.91Å
436	L	88	Confident	89.1	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.1	166.7	176.7	66.4	0	0	0	108.7	R34 F35 L37 I45 Y65 F67 N431	R34-L436 CarbonylContact C-O 3.55Å; R34-L436 VanDerWaalsContact CA-O 3.23Å; R34-L436 WeakPolarHBondContact CA-O 3.4Å; F35-L436 PolarHBondContact N-O 3.08Å; F35-L436 PolarHBondContact O-N 2.76Å; L37-L436 HydrophobicContact CD1-CB 4.26Å; L37-L436 HydrophobicContact CD2-CB 4.03Å; L37-L436 HydrophobicContact CG-CB 4.17Å; I45-L436 HydrophobicContact CD1-CD1 3.52Å; Y65-L436 HydrophobicContact CD2-CD2 3.62Å; Y65-L436 HydrophobicContact CE2-CD2 3.77Å; Y65-L436 HydrophobicContact CG-CD2 4.17Å; F67-L436 HydrophobicContact CE2-CD2 4.25Å; F67-L436 HydrophobicContact CZ-CD2 3.88Å; F67-L436 HydrophobicContact CZ-CG 3.99Å; N431-L436 HydrophobicContact CB-CD1 4.13Å
437	V	89.6	Confident	89.2	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.6	-174.5	170.8	0	0	0	0	110.4	V32 K33 R34 P409 F410 Y429 V430 I439	V32-V437 HydrophobicContact CB-CG1 3.92Å; V32-V437 HydrophobicContact CG1-CG1 3.19Å; K33-V437 WeakPolarHBondContact O-CA 3.15Å; R34-V437 HydrophobicContact CB-CG2 3.98Å; P409-V437 HydrophobicContact CB-CG1 3.84Å; F410-V437 HydrophobicContact CD1-CG2 4.39Å; F410-V437 HydrophobicContact CE1-CG2 3.82Å; F410-V437 HydrophobicContact CZ-CG2 4.49Å; Y429-V437 CarbonylContact C-O 3.58Å; Y429-V437 VanDerWaalsContact CA-O 3.31Å; Y429-V437 WeakPolarHBondContact CA-O 3.44Å; V430-V437 PolarHBondContact N-O 3.47Å; V430-V437 PolarHBondContact O-N 3.32Å; V437-I439 HydrophobicContact CG1-CG1 4.2Å
438	Q	90.5	Very high	89	Confident	23 Å²	23	25.8 Å²	25.8	11%	0.107	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	110.5	174.8	177.4	-165.6	-27.7	0	0	111.4	V32 K33 F67 K427 L428 Y429	V32-Q438 WeakPolarHBondContact CG1-O 3.44Å; K33-Q438 HydrophobicContact CB-CB 4.47Å; K33-Q438 PolarHBondContact O-N 3.18Å; F67-Q438 HydrophobicContact CD1-CB 3.5Å; F67-Q438 HydrophobicContact CD1-CG 4.39Å; F67-Q438 HydrophobicContact CE1-CB 3.43Å; F67-Q438 VanDerWaalsContact CE1-CB 3.43Å; F67-Q438 HydrophobicContact CG-CB 4.21Å; F67-Q438 HydrophobicContact CZ-CB 4.08Å; K427-Q438 HydrophobicContact CB-CG 3.98Å; K427-Q438 HydrophobicContact CG-CG 4.5Å; L428-Q438 CarbonylContact O-C 3.55Å; L428-Q438 WeakPolarHBondContact O-CA 3.41Å; Y429-Q438 HydrophobicContact CD1-CB 3.74Å; Y429-Q438 HydrophobicContact CD1-CG 3.9Å; Y429-Q438 HydrophobicContact CE1-CB 3.65Å; Y429-Q438 HydrophobicContact CE1-CG 3.41Å; Y429-Q438 VanDerWaalsContact CE1-CG 3.41Å
439	I	91.6	Very high	88.6	Confident	7 Å²	7	32.1 Å²	32.1	4%	0.036	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133	176	-54.4	169.8	0	0	0	109.5	V32 I391 Y407 P409 K427 L428 V430 V437 V441	V32-I439 HydrophobicContact CG1-CG1 4.03Å; I391-I439 HydrophobicContact CD1-CD1 4.21Å; Y407-I439 HydrophobicContact CD1-CG2 3.74Å; Y407-I439 HydrophobicContact CD2-CG2 4.49Å; Y407-I439 HydrophobicContact CE1-CG2 3.86Å; Y407-I439 HydrophobicContact CG-CD1 4.46Å; Y407-I439 HydrophobicContact CG-CG2 4.09Å; P409-I439 HydrophobicContact CB-CD1 3.89Å; P409-I439 HydrophobicContact CB-CG1 4.3Å; P409-I439 HydrophobicContact CG-CD1 4.04Å; K427-I439 CarbonylContact C-O 3.53Å; K427-I439 WeakPolarHBondContact CA-O 3.43Å; L428-I439 HydrophobicContact CB-CB 4.31Å; L428-I439 HydrophobicContact CD2-CD1 4.43Å; L428-I439 PolarHBondContact N-O 3.07Å; L428-I439 PolarHBondContact O-N 3.46Å; V430-I439 HydrophobicContact CG2-CD1 3.85Å; V437-I439 HydrophobicContact CG1-CG1 4.2Å; I439-V441 HydrophobicContact CG2-CG1 4.13Å; I439-V441 PolarHBondContact O-N 3.4Å
440	D	90.8	Very high	88.4	Confident	57 Å²	57	33.8 Å²	33.8	31%	0.305	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	103.5	169.3	-171.5	-2.2	0	0	0	109.8	K427 E442 N443	K427-D440 HydrophobicContact CD-CB 4.06Å; K427-D440 IonicContact NZ-OD1 3.4Å; K427-D440 PolarHBondContact NZ-OD1 2.84Å; K427-D440 IonicContact NZ-OD2 2.76Å; K427-D440 PolarHBondContact NZ-OD2 2.81Å; D440-E442 PolarHBondContact O-N 3.19Å; D440-E442 PolarHBondContact OD1-N 3.27Å; D440-N443 HydrophobicContact CB-CB 4.16Å
441	V	91.7	Very high	88.3	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-3.1	-176.2	-60	0	0	0	0	112.7	F383 K393 Y407 L421 K426 L428 I439 Y461	F383-V441 HydrophobicContact CE1-CB 3.98Å; F383-V441 HydrophobicContact CE1-CG1 3.6Å; F383-V441 HydrophobicContact CE1-CG2 4.31Å; F383-V441 HydrophobicContact CZ-CB 4.05Å; F383-V441 HydrophobicContact CZ-CG1 4.05Å; F383-V441 HydrophobicContact CZ-CG2 3.9Å; K393-V441 PolarHBondContact NZ-O 3.2Å; Y407-V441 HydrophobicContact CE2-CG1 4.28Å; L421-V441 HydrophobicContact CD1-CG2 3.76Å; K426-V441 HydrophobicContact CB-CG2 4.07Å; K426-V441 WeakPolarHBondContact O-CG2 3.43Å; K426-V441 PolarHBondContact O-N 3.05Å; L428-V441 HydrophobicContact CB-CG1 3.67Å; L428-V441 HydrophobicContact CD2-CG1 4.16Å; I439-V441 HydrophobicContact CG2-CG1 4.13Å; I439-V441 PolarHBondContact O-N 3.4Å; V441-Y461 HydrophobicContact CB-CE2 4.32Å; V441-Y461 HydrophobicContact CG2-CD2 4.22Å; V441-Y461 HydrophobicContact CG2-CE2 3.74Å; V441-Y461 WeakPolarHBondContact O-CD2 3.5Å
442	E	89.3	Confident	88.3	Confident	38 Å²	38	35.4 Å²	35.4	18%	0.178	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	17.2	176.7	-169.9	175.9	-152.8	0	0	111.6	K426 D440 C444 S471	K426-E442 HydrophobicContact CB-CB 3.94Å; D440-E442 PolarHBondContact O-N 3.19Å; D440-E442 PolarHBondContact OD1-N 3.27Å; E442-C444 PolarHBondContact O-N 2.73Å; E442-C444 PolarHBondContact O-SG 3.23Å; E442-C444 VanDerWaalsContact O-SG 3.39Å; E442-S471 VanDerWaalsContact CD-CB 3.49Å; E442-S471 WeakPolarHBondContact CG-OG 3.5Å; E442-S471 PolarHBondContact O-OG 3.43Å; E442-S471 VanDerWaalsContact OE1-CB 3.27Å; E442-S471 WeakPolarHBondContact OE1-CB 3.4Å
443	N	90.3	Very high	88.3	Confident	66 Å²	66	36.1 Å²	36.1	35%	0.353	20%	0.203	S	C	.	.			trans	-73.5	65.1	179.1	-176	29.7	0	0	0	112.7	D440 G445 Q446	D440-N443 HydrophobicContact CB-CB 4.16Å; N443-G445 PolarHBondContact O-N 3.3Å; N443-G445 VanDerWaalsContact O-N 3.17Å; N443-Q446 PolarHBondContact ND2-OE1 3.14Å; N443-Q446 WeakPolarHBondContact O-CB 3.36Å; N443-Q446 WeakPolarHBondContact O-CG 3.29Å; N443-Q446 PolarHBondContact O-N 3.26Å; N443-Q446 VanDerWaalsContact O-N 3.13Å; N443-Q446 PolarHBondContact O-NE2 3.39Å
444	C	90.9	Very high	88.7	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.02	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-62.2	-26	-170.9	-61.7	0	0	0	0	114.5	E442 Q446 Y447 Y461 C462 C469	E442-C444 PolarHBondContact O-N 2.73Å; E442-C444 PolarHBondContact O-SG 3.23Å; E442-C444 VanDerWaalsContact O-SG 3.39Å; C444-Q446 PolarHBondContact O-N 2.61Å; C444-Q446 VanDerWaalsContact O-N 3.07Å; C444-Y447 VanDerWaalsContact O-CD2 3.32Å; C444-Y447 WeakPolarHBondContact O-CD2 3Å; C444-Y447 PolarHBondContact O-N 3.41Å; C444-Y447 VanDerWaalsContact O-N 3.08Å; C444-Y461 PolarHBondContact SG-O 3.42Å; C444-Y461 VanDerWaalsContact SG-O 3.39Å; C444-C462 VanDerWaalsContact CA-SG 3.53Å; C444-C462 HydrophobicContact CB-CB 3.75Å; C444-C462 WeakPolarHBondContact CB-SG 3.33Å; C444-C462 WeakPolarHBondContact SG-CA 3.02Å; C444-C462 WeakPolarHBondContact SG-CB 3.25Å; C444-C462 CovalentContact SG-SG 2.03Å; C444-C462 PolarHBondContact SG-SG 2.92Å; C444-C469 CarbonylContact C-O 3.6Å; C444-C469 HydrophobicContact CB-CB 4.46Å; C444-C469 WeakPolarHBondContact CB-O 3.29Å; C444-C469 PolarHBondContact O-SG 2.76Å; C444-C469 VanDerWaalsContact O-SG 3.42Å
445	G	88.8	Confident	89	Confident	42 Å²	42	27.1 Å²	27.1	43%	0.433	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-60.6	-18.6	176.2	0	0	0	0	0	114	N443 Y447 C469	N443-G445 PolarHBondContact O-N 3.3Å; N443-G445 VanDerWaalsContact O-N 3.17Å; G445-Y447 VanDerWaalsContact C-N 3.26Å; G445-Y447 PolarHBondContact O-N 2.86Å; G445-C469 PolarHBondContact N-O 3.26Å
446	Q	89.4	Confident	89.2	Confident	38 Å²	38	26 Å²	26	18%	0.178	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-71.7	-18	176.6	77.6	-163.6	-12.9	0	0	113.8	F25 Y407 N443 C444	F25-Q446 HydrophobicContact CD1-CG 4.32Å; F25-Q446 HydrophobicContact CE1-CB 3.99Å; F25-Q446 HydrophobicContact CE1-CG 3.56Å; F25-Q446 HydrophobicContact CE2-CG 4.05Å; F25-Q446 HydrophobicContact CZ-CB 4.34Å; F25-Q446 VanDerWaalsContact CZ-CD 3.46Å; F25-Q446 HydrophobicContact CZ-CG 3.42Å; F25-Q446 VanDerWaalsContact CZ-CG 3.42Å; Y407-Q446 PolarHBondContact OH-NE2 3.26Å; N443-Q446 PolarHBondContact ND2-OE1 3.14Å; N443-Q446 WeakPolarHBondContact O-CB 3.36Å; N443-Q446 WeakPolarHBondContact O-CG 3.29Å; N443-Q446 PolarHBondContact O-N 3.26Å; N443-Q446 VanDerWaalsContact O-N 3.13Å; N443-Q446 PolarHBondContact O-NE2 3.39Å; C444-Q446 PolarHBondContact O-N 2.61Å; C444-Q446 VanDerWaalsContact O-N 3.07Å
447	Y	89.8	Confident	89.4	Confident	10 Å²	10	26 Å²	26	4%	0.039	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-75.7	-28.6	179	-65.9	-60.3	0	0	0	112.6	M23 F25 I404 C444 G445 D453 S457 D459	M23-Y447 HydrophobicContact SD-CD1 3.6Å; M23-Y447 VanDerWaalsContact SD-CD1 3.6Å; M23-Y447 HydrophobicContact SD-CE1 4.08Å; F25-Y447 HydrophobicContact CE2-CE1 4.21Å; F25-Y447 HydrophobicContact CZ-CD1 4.3Å; F25-Y447 AromaticContact CZ-CE1 3.82Å; F25-Y447 HydrophobicContact CZ-CE1 3.82Å; I404-Y447 HydrophobicContact CG2-CE1 4.12Å; I404-Y447 WeakPolarHBondContact CG2-OH 3.49Å; C444-Y447 VanDerWaalsContact O-CD2 3.32Å; C444-Y447 WeakPolarHBondContact O-CD2 3Å; C444-Y447 PolarHBondContact O-N 3.41Å; C444-Y447 VanDerWaalsContact O-N 3.08Å; G445-Y447 VanDerWaalsContact C-N 3.26Å; G445-Y447 PolarHBondContact O-N 2.86Å; Y447-D453 WeakPolarHBondContact O-CB 3.3Å; Y447-S457 VanDerWaalsContact CD1-CB 3.49Å; Y447-D459 HydrophobicContact CE2-CB 3.98Å; Y447-D459 PolarHBondContact OH-OD2 3.05Å
448	G	85.6	Confident	89.4	Confident	16 Å²	16	29.4 Å²	29.4	17%	0.165	16%	0.164	C	C	.	.			trans	143.6	175.5	178.8	0	0	0	0	0	112.7
449	N	83.3	Confident	89.4	Confident	133 Å²	133	28.3 Å²	28.3	71%	0.711	16%	0.159	S	C	*	.	S	Bend	trans	-108	18.6	-176.5	-59.8	-37.4	0	0	0	112.7
450	N	85.4	Confident	89.4	Confident	44 Å²	44	28.1 Å²	28.1	24%	0.235	16%	0.158	C	C	.	.	S	Bend	trans	-133.1	157.9	176.6	64.3	56.2	0	0	0	110.7	P452 D453 C454 W464	N450-P452 WeakPolarHBondContact OD1-CD 3.31Å; N450-D453 VanDerWaalsContact CG-OD2 3.29Å; N450-D453 PolarHBondContact ND2-OD2 3.16Å; N450-D453 PolarHBondContact O-N 3.05Å; N450-D453 WeakPolarHBondContact OD1-CB 3.46Å; N450-D453 PolarHBondContact OD1-N 3.04Å; N450-D453 PolarHBondContact OD1-OD2 3.23Å; N450-C454 PolarHBondContact O-N 2.88Å; N450-W464 VanDerWaalsContact O-CZ3 3.25Å; N450-W464 WeakPolarHBondContact O-CZ3 3.17Å
451	C	88.4	Confident	89.4	Confident	19 Å²	19	25.5 Å²	25.5	13%	0.128	14%	0.144	C	C	.	.	H	α-helix	trans	-59	-47.6	-175.6	179.1	0	0	0	0	112.7	D453 C454 V455 W464 C487	C451-D453 PolarHBondContact O-N 2.93Å; C451-C454 PolarHBondContact O-N 2.65Å; C451-V455 WeakPolarHBondContact O-CG2 3.33Å; C451-V455 PolarHBondContact O-N 3.37Å; C451-W464 HydrophobicContact CB-CD2 3.76Å; C451-W464 VanDerWaalsContact CB-CE2 3.41Å; C451-W464 HydrophobicContact CB-CE3 4.43Å; C451-W464 HydrophobicContact CB-CG 4.03Å; C451-W464 HydrophobicContact CB-CZ2 3.81Å; C451-W464 VanDerWaalsContact N-CZ2 3.28Å; C451-C487 HydrophobicContact CB-CB 3.57Å; C451-C487 WeakPolarHBondContact CB-SG 3.47Å; C451-C487 VanDerWaalsContact SG-CA 3.53Å; C451-C487 WeakPolarHBondContact SG-CB 3.35Å; C451-C487 CovalentContact SG-SG 2.03Å; C451-C487 PolarHBondContact SG-SG 3.2Å
452	P	89.1	Confident	89.3	Confident	17 Å²	17	25.5 Å²	25.5	11%	0.11	14%	0.144	C	C	.	.	H	α-helix	trans	-59.2	-45	179.8	-28.1	37.6	0	0	0	113.7	N450 C454 V455 L456 H484 C487 Y576	N450-P452 WeakPolarHBondContact OD1-CD 3.31Å; P452-C454 VanDerWaalsContact C-N 3.31Å; P452-C454 PolarHBondContact O-N 3.36Å; P452-V455 PolarHBondContact O-N 2.94Å; P452-L456 VanDerWaalsContact O-CB 3.29Å; P452-L456 WeakPolarHBondContact O-CB 3.37Å; P452-L456 WeakPolarHBondContact O-CG 3.43Å; P452-L456 PolarHBondContact O-N 2.88Å; P452-H484 HydrophobicContact CB-CB 4.35Å; P452-C487 HydrophobicContact CG-CB 4.43Å; P452-Y576 HydrophobicContact CB-CD1 3.75Å; P452-Y576 HydrophobicContact CB-CD2 3.8Å; P452-Y576 HydrophobicContact CB-CE1 3.54Å; P452-Y576 HydrophobicContact CB-CE2 3.62Å; P452-Y576 HydrophobicContact CB-CG 3.87Å; P452-Y576 VanDerWaalsContact CB-CZ 3.48Å; P452-Y576 HydrophobicContact CG-CD2 4.01Å; P452-Y576 HydrophobicContact CG-CE1 4.31Å; P452-Y576 HydrophobicContact CG-CE2 3.55Å
453	D	88.9	Confident	89.2	Confident	15 Å²	15	23.7 Å²	23.7	8%	0.08	14%	0.136	C	C	.	.	H	α-helix	trans	-60.9	-41.1	179.4	-72.5	-23.3	0	0	0	111.4	Y447 N450 C451 S457 K578	Y447-D453 WeakPolarHBondContact O-CB 3.3Å; N450-D453 VanDerWaalsContact CG-OD2 3.29Å; N450-D453 PolarHBondContact ND2-OD2 3.16Å; N450-D453 PolarHBondContact O-N 3.05Å; N450-D453 WeakPolarHBondContact OD1-CB 3.46Å; N450-D453 PolarHBondContact OD1-N 3.04Å; N450-D453 PolarHBondContact OD1-OD2 3.23Å; C451-D453 PolarHBondContact O-N 2.93Å; D453-S457 PolarHBondContact O-N 3.12Å; D453-K578 IonicContact OD1-NZ 3.5Å; D453-K578 PolarHBondContact OD1-NZ 3.2Å; D453-K578 IonicContact OD2-NZ 3.69Å; D453-K578 PolarHBondContact OD2-NZ 3.33Å
454	C	90.8	Very high	89.1	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.9	-46.1	177.2	-169.4	0	0	0	0	111.9	N450 C451 P452 S457 S463 W464 C469	N450-C454 PolarHBondContact O-N 2.88Å; C451-C454 PolarHBondContact O-N 2.65Å; P452-C454 VanDerWaalsContact C-N 3.31Å; P452-C454 PolarHBondContact O-N 3.36Å; C454-S457 VanDerWaalsContact O-CB 3.29Å; C454-S457 WeakPolarHBondContact O-CB 3.47Å; C454-S457 PolarHBondContact O-N 2.95Å; C454-S457 PolarHBondContact O-OG 3.33Å; C454-S463 PolarHBondContact SG-O 2.93Å; C454-W464 HydrophobicContact CB-CD2 4.46Å; C454-W464 HydrophobicContact CB-CE3 3.55Å; C454-W464 HydrophobicContact CB-CZ3 4.17Å; C454-C469 VanDerWaalsContact CA-SG 3.59Å; C454-C469 HydrophobicContact CB-CB 3.58Å; C454-C469 WeakPolarHBondContact CB-SG 3.14Å; C454-C469 VanDerWaalsContact SG-CA 3.5Å; C454-C469 WeakPolarHBondContact SG-CB 3.21Å; C454-C469 CovalentContact SG-SG 2.04Å; C454-C469 PolarHBondContact SG-SG 3.24Å
455	V	89.9	Confident	88.7	Confident	6 Å²	6	26.1 Å²	26.1	4%	0.036	14%	0.143	C	C	.	.	H	α-helix	trans	-66.7	-41.3	-179	171.9	0	0	0	0	111.7	C451 P452 S457 R458 V479 R482	C451-V455 WeakPolarHBondContact O-CG2 3.33Å; C451-V455 PolarHBondContact O-N 3.37Å; P452-V455 PolarHBondContact O-N 2.94Å; V455-S457 PolarHBondContact O-N 3.39Å; V455-R458 PolarHBondContact O-N 2.67Å; V455-R458 VanDerWaalsContact O-N 3.16Å; V455-V479 HydrophobicContact CG2-CG1 4.19Å; V455-R482 HydrophobicContact CG1-CB 3.91Å; V455-R482 WeakPolarHBondContact CG1-O 3.38Å; V455-R482 HydrophobicContact CG2-CB 4.33Å
456	L	90.8	Very high	88.4	Confident	10 Å²	10	31.6 Å²	31.6	5%	0.052	16%	0.162	C	C	.	.	H	α-helix	trans	-66.5	-17.7	177.6	-71.4	170.8	0	0	0	113.4	R22 P452 R458 E573 M574 Y576	R22-L456 PolarHBondContact NE-O 3.13Å; P452-L456 VanDerWaalsContact O-CB 3.29Å; P452-L456 WeakPolarHBondContact O-CB 3.37Å; P452-L456 WeakPolarHBondContact O-CG 3.43Å; P452-L456 PolarHBondContact O-N 2.88Å; L456-R458 PolarHBondContact O-N 2.78Å; L456-E573 HydrophobicContact CD1-CB 4.37Å; L456-M574 HydrophobicContact CD2-CB 4.05Å; L456-M574 HydrophobicContact CD2-CG 4.3Å; L456-Y576 HydrophobicContact CD1-CD1 3.87Å; L456-Y576 HydrophobicContact CD1-CG 4.38Å
457	S	91.7	Very high	88.1	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.007	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-31	172.6	76.9	0	0	0	0	112.6	F402 Y447 D453 C454 V455 D459	F402-S457 WeakPolarHBondContact CE1-O 3.05Å; Y447-S457 VanDerWaalsContact CD1-CB 3.49Å; D453-S457 PolarHBondContact O-N 3.12Å; C454-S457 VanDerWaalsContact O-CB 3.29Å; C454-S457 WeakPolarHBondContact O-CB 3.47Å; C454-S457 PolarHBondContact O-N 2.95Å; C454-S457 PolarHBondContact O-OG 3.33Å; V455-S457 PolarHBondContact O-N 3.39Å; S457-D459 PolarHBondContact O-N 3.3Å; S457-D459 PolarHBondContact OG-N 3Å
458	R	90.3	Very high	88	Confident	73 Å²	73	41.9 Å²	41.9	28%	0.275	21%	0.211	S	C	.	.			trans	51.4	23.2	-172.3	-55.5	177	-177.1	171.1	1.4	113.4	F402 V455 L456 P460	F402-R458 HydrophobicContact CD1-CB 4.09Å; F402-R458 HydrophobicContact CE1-CB 3.93Å; F402-R458 HydrophobicContact CE1-CG 4.29Å; V455-R458 PolarHBondContact O-N 2.67Å; V455-R458 VanDerWaalsContact O-N 3.16Å; L456-R458 PolarHBondContact O-N 2.78Å; R458-P460 WeakPolarHBondContact O-CD 3.48Å
459	D	91.8	Very high	88.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.			trans	-76.6	118.3	-177.8	-165.1	-35.6	0	0	0	110.2	K393 I404 Y447 S457 Y461 C462 V479	K393-D459 WeakPolarHBondContact CE-OD2 3.45Å; K393-D459 IonicContact NZ-OD1 3.55Å; K393-D459 PolarHBondContact NZ-OD1 2.98Å; K393-D459 IonicContact NZ-OD2 3.59Å; K393-D459 PolarHBondContact NZ-OD2 3.23Å; I404-D459 HydrophobicContact CD1-CB 4.36Å; I404-D459 HydrophobicContact CG2-CB 4.26Å; Y447-D459 HydrophobicContact CE2-CB 3.98Å; Y447-D459 PolarHBondContact OH-OD2 3.05Å; S457-D459 PolarHBondContact O-N 3.3Å; S457-D459 PolarHBondContact OG-N 3Å; D459-Y461 PolarHBondContact O-N 3.22Å; D459-Y461 VanDerWaalsContact O-N 3.13Å; D459-Y461 WeakPolarHBondContact OD1-CB 3.47Å; D459-Y461 PolarHBondContact OD1-N 3.45Å; D459-C462 HydrophobicContact CB-CB 4.06Å; D459-C462 PolarHBondContact O-N 2.77Å; D459-V479 VanDerWaalsContact O-CG2 3.26Å; D459-V479 WeakPolarHBondContact O-CG2 2.93Å
460	P	90.3	Very high	88.5	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.019	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.6	-179	28.6	-36.7	0	0	0	113.6	V381 L395 R458 C462 V480	V381-P460 HydrophobicContact CG2-CG 3.28Å; L395-P460 HydrophobicContact CD1-CB 4.39Å; L395-P460 HydrophobicContact CD1-CG 3.92Å; R458-P460 WeakPolarHBondContact O-CD 3.48Å; P460-C462 VanDerWaalsContact C-N 3.29Å; P460-V480 HydrophobicContact CB-CG2 3.76Å
461	Y	90.1	Very high	88.6	Confident	1 Å²	1	37.7 Å²	37.7	0%	0.004	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-0.7	174.7	-50.2	-26.9	0	0	0	112.7	D372 V381 F383 V441 C444 D459 S471 A472	D372-Y461 VanDerWaalsContact CB-OH 3.3Å; D372-Y461 WeakPolarHBondContact CB-OH 2.99Å; D372-Y461 WeakPolarHBondContact OD2-CE1 3.14Å; D372-Y461 VanDerWaalsContact OD2-CZ 3.29Å; D372-Y461 PolarHBondContact OD2-OH 3.12Å; V381-Y461 HydrophobicContact CG2-CE1 3.93Å; F383-Y461 HydrophobicContact CZ-CE2 4.14Å; V441-Y461 HydrophobicContact CB-CE2 4.32Å; V441-Y461 HydrophobicContact CG2-CD2 4.22Å; V441-Y461 HydrophobicContact CG2-CE2 3.74Å; V441-Y461 WeakPolarHBondContact O-CD2 3.5Å; C444-Y461 PolarHBondContact SG-O 3.42Å; C444-Y461 VanDerWaalsContact SG-O 3.39Å; D459-Y461 PolarHBondContact O-N 3.22Å; D459-Y461 VanDerWaalsContact O-N 3.13Å; D459-Y461 WeakPolarHBondContact OD1-CB 3.47Å; D459-Y461 PolarHBondContact OD1-N 3.45Å; Y461-S471 CarbonylContact O-C 3.6Å; Y461-S471 WeakPolarHBondContact O-CA 3.17Å; Y461-A472 PolarHBondContact O-N 2.82Å
462	C	90.1	Very high	88	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	146.5	-175.6	-58.5	0	0	0	0	112.7	C444 D459 P460 T470 V479	C444-C462 VanDerWaalsContact CA-SG 3.53Å; C444-C462 HydrophobicContact CB-CB 3.75Å; C444-C462 WeakPolarHBondContact CB-SG 3.33Å; C444-C462 WeakPolarHBondContact SG-CA 3.02Å; C444-C462 WeakPolarHBondContact SG-CB 3.25Å; C444-C462 CovalentContact SG-SG 2.03Å; C444-C462 PolarHBondContact SG-SG 2.92Å; D459-C462 HydrophobicContact CB-CB 4.06Å; D459-C462 PolarHBondContact O-N 2.77Å; P460-C462 VanDerWaalsContact C-N 3.29Å; C462-T470 CarbonylContact C-O 3.53Å; C462-T470 WeakPolarHBondContact CA-O 3.47Å; C462-V479 HydrophobicContact CB-CG2 4.45Å; C462-V479 PolarHBondContact O-N 3.45Å; C462-V479 VanDerWaalsContact O-N 3.17Å
463	S	88.4	Confident	87.1	Confident	1 Å²	1	41 Å²	41	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	157.5	175.9	66.5	0	0	0	0	109.6	C454 T470	C454-S463 PolarHBondContact SG-O 2.93Å; S463-T470 PolarHBondContact N-O 3.09Å; S463-T470 PolarHBondContact O-N 3Å; S463-T470 PolarHBondContact OG-O 2.7Å; S463-T470 PolarHBondContact OG-OG1 3.33Å
464	W	87.1	Confident	85.3	Confident	46 Å²	46	46.7 Å²	46.7	17%	0.174	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	106.1	172.6	-179.1	-96.8	0	0	0	108.8	N450 C451 C454 Q467 C469	N450-W464 VanDerWaalsContact O-CZ3 3.25Å; N450-W464 WeakPolarHBondContact O-CZ3 3.17Å; C451-W464 HydrophobicContact CB-CD2 3.76Å; C451-W464 VanDerWaalsContact CB-CE2 3.41Å; C451-W464 HydrophobicContact CB-CE3 4.43Å; C451-W464 HydrophobicContact CB-CG 4.03Å; C451-W464 HydrophobicContact CB-CZ2 3.81Å; C451-W464 VanDerWaalsContact N-CZ2 3.28Å; C454-W464 HydrophobicContact CB-CD2 4.46Å; C454-W464 HydrophobicContact CB-CE3 3.55Å; C454-W464 HydrophobicContact CB-CZ3 4.17Å; W464-Q467 WeakPolarHBondContact CH2-O 3.38Å; W464-Q467 HydrophobicContact CZ2-CB 4.11Å; W464-Q467 WeakPolarHBondContact CZ2-O 3.2Å; W464-C469 HydrophobicContact CE3-CB 4.12Å; W464-C469 HydrophobicContact CZ3-CB 4.2Å
465	E	83.3	Confident	83.4	Confident	74 Å²	74	50.5 Å²	50.5	35%	0.346	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.8	-177.4	-64.5	-170.7	161.1	0	0	109.7	Q467 Q468 A476	E465-Q467 PolarHBondContact O-N 3.42Å; E465-Q468 PolarHBondContact N-O 3.24Å; E465-Q468 VanDerWaalsContact N-O 3.08Å; E465-Q468 PolarHBondContact O-N 3.43Å; E465-A476 WeakPolarHBondContact OE1-CB 3.4Å
466	D	81.3	Confident	82	Confident	156 Å²	156	50.9 Å²	50.9	83%	0.834	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	36.1	178.2	-61.7	-31.4	0	0	0	114.9	Q468	D466-Q468 PolarHBondContact O-N 2.84Å
467	Q	82.8	Confident	80.6	Confident	137 Å²	137	53.9 Å²	53.9	64%	0.64	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	27.4	-175.7	-52.2	-179.4	35.8	0	0	114.4	W464 E465	W464-Q467 WeakPolarHBondContact CH2-O 3.38Å; W464-Q467 HydrophobicContact CZ2-CB 4.11Å; W464-Q467 WeakPolarHBondContact CZ2-O 3.2Å; E465-Q467 PolarHBondContact O-N 3.42Å
468	Q	88	Confident	79.5	Confident	128 Å²	128	55.7 Å²	55.7	60%	0.598	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.9	176	-64.1	-173	6.2	0	0	110.9	E465 D466 T470	E465-Q468 PolarHBondContact N-O 3.24Å; E465-Q468 VanDerWaalsContact N-O 3.08Å; E465-Q468 PolarHBondContact O-N 3.43Å; D466-Q468 PolarHBondContact O-N 2.84Å; Q468-T470 HydrophobicContact CB-CG2 3.99Å; Q468-T470 PolarHBondContact O-N 3.31Å
469	C	90	Very high	78.8	Confident	10 Å²	10	52.3 Å²	52.3	7%	0.068	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	104.7	171.5	-161.1	0	0	0	0	108.3	C444 G445 C454 W464	C444-C469 CarbonylContact C-O 3.6Å; C444-C469 HydrophobicContact CB-CB 4.46Å; C444-C469 WeakPolarHBondContact CB-O 3.29Å; C444-C469 PolarHBondContact O-SG 2.76Å; C444-C469 VanDerWaalsContact O-SG 3.42Å; G445-C469 PolarHBondContact N-O 3.26Å; C454-C469 VanDerWaalsContact CA-SG 3.59Å; C454-C469 HydrophobicContact CB-CB 3.58Å; C454-C469 WeakPolarHBondContact CB-SG 3.14Å; C454-C469 VanDerWaalsContact SG-CA 3.5Å; C454-C469 WeakPolarHBondContact SG-CB 3.21Å; C454-C469 CovalentContact SG-SG 2.04Å; C454-C469 PolarHBondContact SG-SG 3.24Å; W464-C469 HydrophobicContact CE3-CB 4.12Å; W464-C469 HydrophobicContact CZ3-CB 4.2Å
470	T	89.7	Confident	77.7	Confident	44 Å²	44	53.1 Å²	53.1	27%	0.27	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	157.9	-171.9	54.1	0	0	0	0	111.1	C462 S463 Q468 A472	C462-T470 CarbonylContact C-O 3.53Å; C462-T470 WeakPolarHBondContact CA-O 3.47Å; S463-T470 PolarHBondContact N-O 3.09Å; S463-T470 PolarHBondContact O-N 3Å; S463-T470 PolarHBondContact OG-O 2.7Å; S463-T470 PolarHBondContact OG-OG1 3.33Å; Q468-T470 HydrophobicContact CB-CG2 3.99Å; Q468-T470 PolarHBondContact O-N 3.31Å; T470-A472 PolarHBondContact O-N 3.27Å
471	S	86.9	Confident	76.6	Confident	50 Å²	50	59.7 Å²	59.7	35%	0.35	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.3	129.3	168.6	-55	0	0	0	0	111.2	E442 Y461 T473	E442-S471 VanDerWaalsContact CD-CB 3.49Å; E442-S471 WeakPolarHBondContact CG-OG 3.5Å; E442-S471 PolarHBondContact O-OG 3.43Å; E442-S471 VanDerWaalsContact OE1-CB 3.27Å; E442-S471 WeakPolarHBondContact OE1-CB 3.4Å; Y461-S471 CarbonylContact O-C 3.6Å; Y461-S471 WeakPolarHBondContact O-CA 3.17Å; S471-T473 PolarHBondContact O-N 3.41Å
472	A	77.6	Confident	75.5	Confident	17 Å²	17	64.5 Å²	64.5	14%	0.14	37%	0.37	C	S	.	.			trans	-70.8	111.4	-177.6	0	0	0	0	0	110.5	Y461 T470	Y461-A472 PolarHBondContact O-N 2.82Å; T470-A472 PolarHBondContact O-N 3.27Å
473	T	68.6	Low	74.5	Confident	88 Å²	88	68.6 Å²	68.6	54%	0.54	39%	0.392	S	S	.	.			trans	-83.1	160.7	176.3	61.2	0	0	0	0	111.7	S471 G475 A476	S471-T473 PolarHBondContact O-N 3.41Å; T473-G475 VanDerWaalsContact C-N 3.35Å; T473-G475 PolarHBondContact O-N 3.31Å; T473-A476 PolarHBondContact O-N 2.81Å
474	S	52.8	Low	73.8	Confident	135 Å²	135	70.7 Å²	70.7	94%	0.944	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	90.2	176.2	-52.9	0	0	0	0	111.1
475	G	50.3	Low	72.9	Confident	80 Å²	80	72.5 Å²	72.5	83%	0.825	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	140.9	-21.9	-176.4	0	0	0	0	0	113.8	T473	T473-G475 VanDerWaalsContact C-N 3.35Å; T473-G475 PolarHBondContact O-N 3.31Å
476	A	59.3	Low	72.3	Confident	15 Å²	15	76 Å²	76	12%	0.124	44%	0.439	C	S	.	.	S	Bend	trans	-79	138	175	0	0	0	0	0	111	E465 T473 P478	E465-A476 WeakPolarHBondContact OE1-CB 3.4Å; T473-A476 PolarHBondContact O-N 2.81Å; A476-P478 WeakPolarHBondContact O-CD 2.99Å
477	S	62.3	Low	72.1	Confident	72 Å²	72	69.5 Å²	69.5	50%	0.503	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-78.8	121.1	172	-42.6	0	0	0	0	110.2
478	P	69	Low	71.2	Confident	40 Å²	40	67.5 Å²	67.5	26%	0.26	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-57.3	155.7	178.1	-24.4	33.9	0	0	0	112.9	A476 V480	A476-P478 WeakPolarHBondContact O-CD 2.99Å; P478-V480 HydrophobicContact CB-CG2 4.17Å; P478-V480 PolarHBondContact O-N 2.03Å
479	V	75.9	Confident	69.6	Low	1 Å²	1	70.7 Å²	70.7	1%	0.006	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-68.7	-12.8	179.7	-67.2	0	0	0	0	114.6	V455 D459 C462 H481 R482	V455-V479 HydrophobicContact CG2-CG1 4.19Å; D459-V479 VanDerWaalsContact O-CG2 3.26Å; D459-V479 WeakPolarHBondContact O-CG2 2.93Å; C462-V479 HydrophobicContact CB-CG2 4.45Å; C462-V479 PolarHBondContact O-N 3.45Å; C462-V479 VanDerWaalsContact O-N 3.17Å; V479-H481 PolarHBondContact O-N 3.03Å; V479-R482 PolarHBondContact O-N 3.12Å
480	V	67.8	Low	67.3	Low	17 Å²	17	76.2 Å²	76.2	10%	0.103	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-51.6	-35.3	-171	-177.4	0	0	0	0	114.4	L395 L397 P460 P478	L395-V480 HydrophobicContact CD2-CG1 3.71Å; L395-V480 HydrophobicContact CD2-CG2 4.3Å; L397-V480 HydrophobicContact CD2-CG1 4.43Å; P460-V480 HydrophobicContact CB-CG2 3.76Å; P478-V480 HydrophobicContact CB-CG2 4.17Å; P478-V480 PolarHBondContact O-N 2.03Å
481	H	67	Low	64.9	Low	141 Å²	141	81.1 Å²	81.1	65%	0.653	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-110.8	3.4	-179.4	-60.8	-36.4	0	0	0	113.8	H379 V479	H379-H481 AromaticContact CE1-CE1 3.59Å; H379-H481 AromaticContact CE1-NE2 3.54Å; H379-H481 AromaticContact NE2-CE1 3.53Å; H379-H481 AromaticContact NE2-NE2 3.14Å; H379-H481 PolarHBondContact NE2-NE2 2.93Å; H379-H481 VanDerWaalsContact NE2-NE2 3.14Å; V479-H481 PolarHBondContact O-N 3.03Å
482	R	66.7	Low	62.6	Low	103 Å²	103	84.2 Å²	84.2	39%	0.389	50%	0.503	S	S	.	.			trans	-82.2	140.9	179.1	-67.7	-170.2	176.5	-165.2	0.3	109.7	V455 V479	V455-R482 HydrophobicContact CG1-CB 3.91Å; V455-R482 WeakPolarHBondContact CG1-O 3.38Å; V455-R482 HydrophobicContact CG2-CB 4.33Å; V479-R482 PolarHBondContact O-N 3.12Å
483	N	70.4	Confident	60.3	Low	86 Å²	86	87.5 Å²	87.5	46%	0.46	53%	0.525	S	S	.	.			trans	-96.5	144.8	170.3	-165.1	-14.7	0	0	0	109	S485 M486	N483-S485 VanDerWaalsContact CG-OG 3.27Å; N483-S485 PolarHBondContact ND2-OG 3.31Å; N483-S485 PolarHBondContact O-N 2.98Å; N483-S485 VanDerWaalsContact O-N 3.12Å; N483-M486 HydrophobicContact CB-CG 4.45Å; N483-M486 WeakPolarHBondContact O-CB 3.46Å; N483-M486 PolarHBondContact O-N 3.18Å
484	H	72.6	Confident	58.9	Low	45 Å²	45	89.3 Å²	89.3	21%	0.208	54%	0.539	C	S	.	.	G	3₁₀ helix	trans	-57.9	-25	175.2	73.2	-85.1	0	0	0	112	P452 M486 C487 M574	P452-H484 HydrophobicContact CB-CB 4.35Å; H484-M486 PolarHBondContact O-N 3.1Å; H484-C487 WeakPolarHBondContact O-CB 3.22Å; H484-C487 PolarHBondContact O-N 3.3Å; H484-C487 PolarHBondContact O-SG 2.97Å; H484-M574 PolarHBondContact CE1-O 3.5Å
485	S	68.6	Low	58	Low	84 Å²	84	89.1 Å²	89.1	59%	0.587	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-65.1	-15.1	173.7	60.1	0	0	0	0	114.4	N483 C487	N483-S485 VanDerWaalsContact CG-OG 3.27Å; N483-S485 PolarHBondContact ND2-OG 3.31Å; N483-S485 PolarHBondContact O-N 2.98Å; N483-S485 VanDerWaalsContact O-N 3.12Å; S485-C487 VanDerWaalsContact C-N 3.34Å
486	M	71.3	Confident	57	Low	147 Å²	147	96.8 Å²	96.8	72%	0.724	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-88.7	-4.1	173.4	-52.4	-158.7	97.3	0	0	112.7	N483 H484 S488	N483-M486 HydrophobicContact CB-CG 4.45Å; N483-M486 WeakPolarHBondContact O-CB 3.46Å; N483-M486 PolarHBondContact O-N 3.18Å; H484-M486 PolarHBondContact O-N 3.1Å; M486-S488 PolarHBondContact O-N 2.86Å
487	C	76.1	Confident	56	Low	19 Å²	19	107.5 Å²	107.5	13%	0.128	57%	0.567	C	S	.	*	S	Bend	trans	-71.5	114.3	167.3	-63.6	0	0	0	0	108.1	C451 P452 H484 S485 E489	C451-C487 HydrophobicContact CB-CB 3.57Å; C451-C487 WeakPolarHBondContact CB-SG 3.47Å; C451-C487 VanDerWaalsContact SG-CA 3.53Å; C451-C487 WeakPolarHBondContact SG-CB 3.35Å; C451-C487 CovalentContact SG-SG 2.03Å; C451-C487 PolarHBondContact SG-SG 3.2Å; P452-C487 HydrophobicContact CG-CB 4.43Å; H484-C487 WeakPolarHBondContact O-CB 3.22Å; H484-C487 PolarHBondContact O-N 3.3Å; H484-C487 PolarHBondContact O-SG 2.97Å; S485-C487 VanDerWaalsContact C-N 3.34Å; C487-E489 PolarHBondContact O-N 3.5Å
488	S	63.8	Low	54.4	Low	96 Å²	96	108.7 Å²	108.7	67%	0.671	58%	0.576	S	S	*	*			trans	-54.8	128.8	169.3	-57.1	0	0	0	0	108.9	M486 D490	M486-S488 PolarHBondContact O-N 2.86Å; S488-D490 PolarHBondContact O-N 2.64Å
489	E	55.5	Low	52.6	Low	195 Å²	195	111.9 Å²	111.9	91%	0.911	61%	0.606	S	S	*	*			trans	-70.3	71.5	167.3	-73.6	-160.9	160.4	0	0	109.3	C487 L491	C487-E489 PolarHBondContact O-N 3.5Å; E489-L491 PolarHBondContact O-N 3.38Å
490	D	42.2	Very low	50.5	Low	126 Å²	126	115.8 Å²	115.8	67%	0.674	65%	0.646	S	S	*	*			trans	-85.6	98.9	171.5	-80.5	-34.2	0	0	0	109.3	S488	S488-D490 PolarHBondContact O-N 2.64Å
491	L	38.2	Very low	48.5	Very low	147 Å²	147	117.6 Å²	117.6	77%	0.77	67%	0.668	S	S	*	*			trans	13.8	110.6	150	-79.9	143	0	0	0	114.6	E489 S493	E489-L491 PolarHBondContact O-N 3.38Å; L491-S493 PolarHBondContact O-N 3.27Å
492	A	38.6	Very low	46.8	Very low	115 Å²	115	118.4 Å²	118.4	95%	0.95	68%	0.683	S	S	*	*			trans	-40	103	161.3	0	0	0	0	0	110.4
493	S	30.6	Very low	45.3	Very low	86 Å²	86	120 Å²	120	60%	0.601	69%	0.693	S	S	*	*			trans	-120.1	148.9	176.9	60.4	0	0	0	0	109.9	L491 L495	L491-S493 PolarHBondContact O-N 3.27Å; S493-L495 PolarHBondContact O-N 2.81Å
494	P	37.8	Very low	43.5	Very low	126 Å²	126	121.5 Å²	121.5	82%	0.818	71%	0.71	S	S	*	*			trans	-77.2	126.3	-151.2	-10.9	27.2	0	0	0	112.2	R496	P494-R496 PolarHBondContact O-N 2.01Å
495	L	35	Very low	42	Very low	130 Å²	130	124 Å²	124	68%	0.681	72%	0.722	S	S	*	*			trans	-6.5	105.3	158.7	-66.3	162.5	0	0	0	115.5	S493 R497	S493-L495 PolarHBondContact O-N 2.81Å; L495-R497 PolarHBondContact O-N 2.74Å
496	R	29.1	Very low	40.9	Very low	241 Å²	241	122.4 Å²	122.4	91%	0.909	71%	0.708	S	S	*	*			trans	-76.7	117.2	154.3	-83.8	-159.6	172.8	-162	0.7	109.2	P494 S498	P494-R496 PolarHBondContact O-N 2.01Å; R496-S498 PolarHBondContact O-N 3.29Å; R496-S498 VanDerWaalsContact O-N 3.15Å
497	R	37.3	Very low	39.9	Very low	240 Å²	240	118.7 Å²	118.7	91%	0.906	69%	0.691	S	S	*	*			trans	-69.2	102.8	173.5	-67.9	178.6	-174.5	179.8	1.3	109.3	L495	L495-R497 PolarHBondContact O-N 2.74Å
498	S	28.4	Very low	38.9	Very low	98 Å²	98	122.6 Å²	122.6	69%	0.685	71%	0.711	S	S	*	*			trans	-108.2	129.4	155.2	-66	0	0	0	0	109.1	R496	R496-S498 PolarHBondContact O-N 3.29Å; R496-S498 VanDerWaalsContact O-N 3.15Å
499	A	31.8	Very low	39.2	Very low	107 Å²	107	120.7 Å²	120.7	88%	0.884	70%	0.698	S	S	*	*			trans	-81.3	146.8	-173.9	0	0	0	0	0	111.5
500	G	32.3	Very low	40.6	Very low	83 Å²	83	113.9 Å²	113.9	86%	0.856	67%	0.67	S	S	*	*			trans	98.1	92.2	165.8	0	0	0	0	0	114.8
501	G	26	Very low	42.8	Very low	55 Å²	55	112.7 Å²	112.7	57%	0.567	66%	0.658	S	S	*	*	S	Bend	trans	151.6	113.7	172.3	0	0	0	0	0	109.8	K503	G501-K503 WeakPolarHBondContact O-CG 3.38Å; G501-K503 PolarHBondContact O-N 3.33Å
502	T	29.8	Very low	45.3	Very low	157 Å²	157	109 Å²	109	96%	0.963	64%	0.644	S	S	*	*			trans	-57.1	107.1	-179.2	29.3	0	0	0	0	110.6
503	K	35.1	Very low	47.9	Very low	136 Å²	136	105.1 Å²	105.1	59%	0.591	61%	0.607	S	S	*	*			trans	-85.1	126.3	-169.8	-57.1	-173.8	176.3	179.5	0	111.5	G501 H505	G501-K503 WeakPolarHBondContact O-CG 3.38Å; G501-K503 PolarHBondContact O-N 3.33Å; K503-H505 HydrophobicContact CB-CB 4.35Å; K503-H505 PolarHBondContact O-N 3.24Å; K503-H505 VanDerWaalsContact O-N 3.12Å
504	S	33.7	Very low	50.8	Low	119 Å²	119	105.3 Å²	105.3	83%	0.832	61%	0.605	S	S	*	*			trans	-78	69.4	149.4	50.9	0	0	0	0	108.5	V506	S504-V506 PolarHBondContact O-N 2.85Å
505	H	40.7	Very low	53.3	Low	97 Å²	97	99.4 Å²	99.4	45%	0.449	57%	0.567	S	S	.	*			trans	-69.4	122.9	170.5	-139.4	-82.7	0	0	0	107.4	K503 D507	K503-H505 HydrophobicContact CB-CB 4.35Å; K503-H505 PolarHBondContact O-N 3.24Å; K503-H505 VanDerWaalsContact O-N 3.12Å; H505-D507 PolarHBondContact O-N 2.82Å
506	V	45.5	Very low	56	Low	50 Å²	50	97 Å²	97	30%	0.303	56%	0.559	S	S	.	*			trans	-65	96.2	156.4	179.8	0	0	0	0	104.7	S504 N508	S504-V506 PolarHBondContact O-N 2.85Å; V506-N508 WeakPolarHBondContact CG1-OD1 3.39Å; V506-N508 PolarHBondContact O-N 2.95Å; V506-N508 VanDerWaalsContact O-N 3.12Å
507	D	50.8	Low	58.9	Low	69 Å²	69	87.9 Å²	87.9	37%	0.369	53%	0.532	S	S	.	.			trans	-76.2	94.3	174.3	-175.6	18.1	0	0	0	107.1	H505 S509	H505-D507 PolarHBondContact O-N 2.82Å; D507-S509 PolarHBondContact O-N 3.4Å; D507-S509 VanDerWaalsContact O-N 3.1Å; D507-S509 WeakPolarHBondContact OD1-CB 3.46Å; D507-S509 PolarHBondContact OD1-N 2.88Å; D507-S509 PolarHBondContact OD1-OG 2.91Å; D507-S509 PolarHBondContact OD2-OG 2.89Å
508	N	54.9	Low	61.3	Low	101 Å²	101	82.7 Å²	82.7	54%	0.54	52%	0.518	S	S	.	.			trans	-67.7	4.6	170.5	-79.4	-10.8	0	0	0	112	V506 V510	V506-N508 WeakPolarHBondContact CG1-OD1 3.39Å; V506-N508 PolarHBondContact O-N 2.95Å; V506-N508 VanDerWaalsContact O-N 3.12Å; N508-V510 PolarHBondContact O-N 2.81Å
509	S	69.9	Low	64.3	Low	56 Å²	56	79.6 Å²	79.6	39%	0.392	50%	0.497	S	S	.	.	S	Bend	trans	-65.4	134.5	168.4	88	0	0	0	0	110.2	D507 K511	D507-S509 PolarHBondContact O-N 3.4Å; D507-S509 VanDerWaalsContact O-N 3.1Å; D507-S509 WeakPolarHBondContact OD1-CB 3.46Å; D507-S509 PolarHBondContact OD1-N 2.88Å; D507-S509 PolarHBondContact OD1-OG 2.91Å; D507-S509 PolarHBondContact OD2-OG 2.89Å; S509-K511 PolarHBondContact O-N 3.43Å
510	V	84.4	Confident	67.2	Low	53 Å²	53	78.4 Å²	78.4	32%	0.321	48%	0.482	S	S	.	.			trans	-74.7	110.9	178.6	178.1	0	0	0	0	107.5	N508 S512 Q582 E584	N508-V510 PolarHBondContact O-N 2.81Å; V510-S512 PolarHBondContact O-N 3.13Å; V510-Q582 HydrophobicContact CB-CG 4.44Å; V510-Q582 HydrophobicContact CG1-CG 4.33Å; V510-Q582 HydrophobicContact CG2-CB 4.5Å; V510-Q582 HydrophobicContact CG2-CG 3.85Å; V510-E584 HydrophobicContact CG1-CB 3.7Å
511	K	90	Very high	70.1	Confident	101 Å²	101	78.5 Å²	78.5	44%	0.439	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	108.9	178.5	-68.1	178.5	-176.4	174.5	0	109.7	S509 Q582 Y583 E584	S509-K511 PolarHBondContact O-N 3.43Å; K511-Q582 PolarHBondContact N-O 3.23Å; K511-Y583 HydrophobicContact CB-CD1 3.9Å; K511-Y583 HydrophobicContact CB-CE1 4.2Å; K511-Y583 HydrophobicContact CD-CE1 4.16Å; K511-Y583 CarbonylContact O-C 3.6Å; K511-Y583 VanDerWaalsContact O-CA 3.32Å; K511-Y583 WeakPolarHBondContact O-CA 3.4Å; K511-E584 PolarHBondContact O-N 3.27Å
512	S	90.6	Very high	73.2	Confident	68 Å²	68	80 Å²	80	48%	0.476	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	124.1	174.9	-172	0	0	0	0	110.2	V510 E584	V510-S512 PolarHBondContact O-N 3.13Å; S512-E584 CarbonylContact C-O 3.59Å; S512-E584 WeakPolarHBondContact CA-O 3.5Å
513	I	91.9	Very high	76.2	Confident	34 Å²	34	72.7 Å²	72.7	17%	0.174	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.5	-179.9	-55.9	175.3	0	0	0	108.7	V515 Y521 L523 Y583 E584 L585 R586	I513-V515 HydrophobicContact CG2-CG2 3.9Å; I513-Y521 HydrophobicContact CD1-CE1 4.11Å; I513-Y521 HydrophobicContact CG2-CE1 3.91Å; I513-L523 HydrophobicContact CD1-CD2 4.14Å; I513-Y583 HydrophobicContact CD1-CD1 3.55Å; I513-Y583 HydrophobicContact CD1-CE1 4Å; I513-Y583 HydrophobicContact CG1-CD1 4.44Å; I513-E584 PolarHBondContact N-O 3.27Å; I513-L585 HydrophobicContact CB-CD2 3.82Å; I513-L585 HydrophobicContact CG2-CD2 4.3Å; I513-L585 WeakPolarHBondContact O-CA 3Å; I513-R586 PolarHBondContact O-N 3.23Å
514	T	91.3	Very high	78.9	Confident	91 Å²	91	71.9 Å²	71.9	56%	0.558	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.4	172.5	-55.5	0	0	0	0	108.8	R586 P588	T514-R586 WeakPolarHBondContact CA-O 3.2Å; T514-P588 HydrophobicContact CG2-CG 4.2Å
515	V	91.3	Very high	81.7	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.012	36%	0.357	C	S	.	.			trans	-114	125.7	-179.1	-179.5	0	0	0	0	108.3	I513 S519 Y521 M559 L585 R586 P588	I513-V515 HydrophobicContact CG2-CG2 3.9Å; V515-S519 WeakPolarHBondContact CG1-OG 3.32Å; V515-Y521 HydrophobicContact CG1-CD2 4.37Å; V515-Y521 HydrophobicContact CG1-CG 4.15Å; V515-Y521 HydrophobicContact CG2-CD1 3.82Å; V515-Y521 HydrophobicContact CG2-CD2 4.08Å; V515-Y521 HydrophobicContact CG2-CE1 4.27Å; V515-Y521 HydrophobicContact CG2-CG 3.72Å; V515-M559 HydrophobicContact CB-CB 4.29Å; V515-M559 HydrophobicContact CB-CG 3.84Å; V515-M559 HydrophobicContact CB-SD 4.12Å; V515-M559 HydrophobicContact CG1-CB 3.67Å; V515-M559 HydrophobicContact CG1-CG 3.81Å; V515-M559 HydrophobicContact CG1-SD 4.35Å; V515-L585 HydrophobicContact CG2-CD2 4.19Å; V515-R586 PolarHBondContact N-O 3.02Å; V515-P588 WeakPolarHBondContact O-CD 3.3Å
516	P	90.6	Very high	84	Confident	80 Å²	80	65 Å²	65	52%	0.519	36%	0.358	S	S	.	.			trans	-56.6	146.2	178.4	-25	33.9	0	0	0	113.2	S519 M559	P516-S519 WeakPolarHBondContact CD-OG 3.47Å; P516-S519 WeakPolarHBondContact O-CB 3.49Å; P516-S519 PolarHBondContact O-N 3.4Å; P516-S519 PolarHBondContact O-OG 3Å; P516-M559 WeakPolarHBondContact O-CB 3.32Å
517	S	90.6	Very high	86	Confident	49 Å²	49	63.7 Å²	63.7	34%	0.343	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	141.3	176.7	-162.8	0	0	0	0	111.3	S519 C587	S517-S519 PolarHBondContact O-N 3.18Å; S517-S519 VanDerWaalsContact O-N 3.1Å; S517-C587 VanDerWaalsContact CA-SG 3.59Å
518	E	88.8	Confident	87.6	Confident	130 Å²	130	62.9 Å²	62.9	61%	0.607	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	10	-179.3	-51.7	-54.5	138.4	0	0	115.7	S558 M559	E518-S558 WeakPolarHBondContact CA-OG 3.41Å; E518-S558 PolarHBondContact OE2-OG 2.77Å; E518-M559 PolarHBondContact N-O 3.38Å
519	S	90.9	Very high	89.3	Confident	34 Å²	34	58.2 Å²	58.2	24%	0.238	32%	0.324	C	S	.	.			trans	-91.7	148.2	172.5	70.7	0	0	0	0	111.4	V515 P516 S517 M559	V515-S519 WeakPolarHBondContact CG1-OG 3.32Å; P516-S519 WeakPolarHBondContact CD-OG 3.47Å; P516-S519 WeakPolarHBondContact O-CB 3.49Å; P516-S519 PolarHBondContact O-N 3.4Å; P516-S519 PolarHBondContact O-OG 3Å; S517-S519 PolarHBondContact O-N 3.18Å; S517-S519 VanDerWaalsContact O-N 3.1Å; S519-M559 WeakPolarHBondContact O-CB 3.43Å; S519-M559 PolarHBondContact O-N 2.9Å
520	S	92.2	Very high	90.2	Very high	82 Å²	82	58.4 Å²	58.4	57%	0.573	32%	0.319	S	S	*	.			trans	-82.2	145.9	171.1	61.8	0	0	0	0	110.6	I556 D557	S520-I556 CarbonylContact C-O 3.54Å; S520-I556 VanDerWaalsContact CA-O 3.24Å; S520-I556 WeakPolarHBondContact CA-O 3.4Å; S520-D557 WeakPolarHBondContact CB-O 3.3Å
521	Y	92.9	Very high	90.5	Very high	84 Å²	84	57.3 Å²	57.3	33%	0.329	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	164	178	-159.9	-106.2	0	0	0	110.6	I513 V515 L523 I556	I513-Y521 HydrophobicContact CD1-CE1 4.11Å; I513-Y521 HydrophobicContact CG2-CE1 3.91Å; V515-Y521 HydrophobicContact CG1-CD2 4.37Å; V515-Y521 HydrophobicContact CG1-CG 4.15Å; V515-Y521 HydrophobicContact CG2-CD1 3.82Å; V515-Y521 HydrophobicContact CG2-CD2 4.08Å; V515-Y521 HydrophobicContact CG2-CE1 4.27Å; V515-Y521 HydrophobicContact CG2-CG 3.72Å; Y521-L523 HydrophobicContact CD1-CD2 4.22Å; Y521-L523 HydrophobicContact CE1-CD2 4.02Å; Y521-I556 PolarHBondContact N-O 3.38Å; Y521-I556 PolarHBondContact O-N 2.82Å
522	F	91.8	Very high	90.5	Very high	88 Å²	88	53 Å²	53	39%	0.386	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	140.6	174.9	65.6	-83.5	0	0	0	111.7	R524 L553 L554 L555	F522-R524 HydrophobicContact CD2-CG 4.07Å; F522-R524 HydrophobicContact CE2-CG 3.98Å; F522-R524 VanDerWaalsContact CE2-NE 3.33Å; F522-L553 HydrophobicContact CD2-CD2 4.14Å; F522-L553 HydrophobicContact CE2-CD2 4.49Å; F522-L554 CarbonylContact C-O 3.59Å; F522-L554 WeakPolarHBondContact CA-O 3.31Å; F522-L555 HydrophobicContact CB-CD1 4.46Å
523	L	92.4	Very high	90.6	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	145.4	172.8	-59.6	-179.3	0	0	0	109.7	I513 Y521 W536 L553 L554 Y567 Y583 L585	I513-L523 HydrophobicContact CD1-CD2 4.14Å; Y521-L523 HydrophobicContact CD1-CD2 4.22Å; Y521-L523 HydrophobicContact CE1-CD2 4.02Å; L523-W536 HydrophobicContact CB-CH2 3.53Å; L523-W536 HydrophobicContact CB-CZ2 3.98Å; L523-W536 HydrophobicContact CB-CZ3 4.1Å; L523-W536 HydrophobicContact CD1-CH2 4.37Å; L523-W536 HydrophobicContact CD1-CZ3 4.1Å; L523-L553 WeakPolarHBondContact O-CA 3.39Å; L523-L554 HydrophobicContact CB-CB 4.35Å; L523-L554 HydrophobicContact CD1-CD2 4.41Å; L523-L554 PolarHBondContact N-O 3.08Å; L523-L554 PolarHBondContact O-N 2.91Å; L523-Y567 HydrophobicContact CD1-CD1 3.81Å; L523-Y567 HydrophobicContact CD1-CD2 4.37Å; L523-Y567 HydrophobicContact CD1-CG 3.68Å; L523-Y583 HydrophobicContact CB-CD2 4.36Å; L523-Y583 HydrophobicContact CB-CE2 4.35Å; L523-Y583 HydrophobicContact CD1-CD2 4.01Å; L523-Y583 HydrophobicContact CD1-CG 4.15Å; L523-Y583 HydrophobicContact CD2-CD1 3.95Å; L523-Y583 HydrophobicContact CD2-CD2 4.17Å; L523-Y583 HydrophobicContact CD2-CE1 4.36Å; L523-Y583 HydrophobicContact CD2-CG 3.83Å; L523-Y583 HydrophobicContact CG-CD2 4.43Å; L523-L585 HydrophobicContact CD1-CD1 4.29Å; L523-L585 HydrophobicContact CD2-CD2 4.17Å
524	R	92.1	Very high	90.6	Very high	119 Å²	119	54.4 Å²	54.4	45%	0.449	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	140.6	-179.2	-54.1	-171.1	-173	-155.3	-1.7	110.2	F522 E551 L553 Y583	F522-R524 HydrophobicContact CD2-CG 4.07Å; F522-R524 HydrophobicContact CE2-CG 3.98Å; F522-R524 VanDerWaalsContact CE2-NE 3.33Å; R524-E551 IonicContact NH1-OE1 3.38Å; R524-E551 PolarHBondContact NH1-OE1 2.64Å; R524-E551 IonicContact NH1-OE2 2.94Å; R524-L553 HydrophobicContact CB-CD2 4.19Å; R524-L553 HydrophobicContact CG-CD2 3.79Å; R524-Y583 WeakPolarHBondContact O-CE2 3.36Å; R524-Y583 PolarHBondContact O-OH 3.49Å
525	C	91.2	Very high	90.7	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.007	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	124	169.9	-178.8	0	0	0	0	109.3	V527 W536 C552 C569	C525-V527 PolarHBondContact O-N 2.88Å; C525-W536 HydrophobicContact CB-CH2 4.17Å; C525-W536 HydrophobicContact CB-CZ2 3.54Å; C525-C552 HydrophobicContact CB-CB 3.88Å; C525-C552 WeakPolarHBondContact CB-O 3.32Å; C525-C552 PolarHBondContact N-O 3.1Å; C525-C552 PolarHBondContact O-N 3.23Å; C525-C569 HydrophobicContact CB-CB 3.51Å; C525-C569 WeakPolarHBondContact CB-SG 3.43Å; C525-C569 WeakPolarHBondContact SG-CB 3.41Å; C525-C569 CovalentContact SG-SG 2.01Å; C525-C569 PolarHBondContact SG-SG 3.05Å
526	P	88.8	Confident	90.9	Very high	72 Å²	72	51.8 Å²	51.8	47%	0.468	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	130.3	179.2	28	-33.1	0	0	0	110.2	L580	P526-L580 HydrophobicContact CG-CB 4.41Å
527	V	87.5	Confident	91.1	Very high	22 Å²	22	51.7 Å²	51.7	13%	0.133	27%	0.267	C	S	.	.			trans	-99.3	117.8	174.5	175.4	0	0	0	0	108	C525 Y534 G550 C552	C525-V527 PolarHBondContact O-N 2.88Å; V527-Y534 HydrophobicContact CB-CE1 4.25Å; V527-Y534 HydrophobicContact CG1-CE1 4.34Å; V527-Y534 HydrophobicContact CG1-CE2 3.83Å; V527-Y534 WeakPolarHBondContact CG1-OH 3.37Å; V527-Y534 HydrophobicContact CG2-CD1 4.24Å; V527-Y534 HydrophobicContact CG2-CE1 3.95Å; V527-Y534 HydrophobicContact CG2-CE2 4.37Å; V527-G550 WeakPolarHBondContact CB-O 3.36Å; V527-G550 PolarHBondContact N-O 2.85Å; V527-C552 HydrophobicContact CG2-CB 3.72Å
528	S	84.5	Confident	91.2	Very high	51 Å²	51	51 Å²	51	36%	0.357	26%	0.26	S	S	.	.			trans	-105.7	-49.6	-179.9	50	0	0	0	0	111.5	Y534	S528-Y534 PolarHBondContact N-OH 2.86Å
529	S	90.5	Very high	91.1	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.021	25%	0.252	C	S	.	.			trans	-100.7	126.3	174.7	176.3	0	0	0	0	110.8	R22 H531 A532 Y534 E573	R22-S529 CarbonylContact O-C 3.57Å; R22-S529 VanDerWaalsContact O-CA 3.3Å; R22-S529 WeakPolarHBondContact O-CA 3.47Å; S529-H531 VanDerWaalsContact C-N 3.27Å; S529-H531 PolarHBondContact OG-N 2.88Å; S529-A532 PolarHBondContact OG-N 2.92Å; S529-Y534 PolarHBondContact N-OH 2.87Å; S529-Y534 VanDerWaalsContact N-OH 3.13Å; S529-Y534 VanDerWaalsContact O-CE2 3.22Å; S529-Y534 WeakPolarHBondContact O-CE2 3.33Å; S529-Y534 PolarHBondContact O-OH 2.98Å; S529-E573 WeakPolarHBondContact CB-OE2 3.38Å; S529-E573 VanDerWaalsContact OG-CD 3.32Å; S529-E573 PolarHBondContact OG-OE2 3.16Å
530	H	90.8	Very high	90.7	Very high	61 Å²	61	50 Å²	50	28%	0.282	28%	0.279	S	S	.	.	S	Bend	trans	-80.7	-8.1	171.1	-63.8	152.8	0	0	0	113.2	P21 R22 V24	P21-H530 WeakPolarHBondContact O-CB 2.87Å; P21-H530 PolarHBondContact O-ND1 2.87Å; P21-H530 VanDerWaalsContact O-ND1 3.12Å; R22-H530 PolarHBondContact O-N 2.85Å; V24-H530 VanDerWaalsContact CG2-CE1 3.43Å; V24-H530 WeakPolarHBondContact CG2-CE1 3.23Å
531	H	90.1	Very high	90.6	Very high	30 Å²	30	47.8 Å²	47.8	14%	0.139	27%	0.268	C	S	.	.	S	Bend	trans	-92.5	-8.9	174.4	-62.6	-179.5	0	0	0	111.9	N17 S20 R22 F402 S529	N17-H531 PolarHBondContact O-CD2 2.89Å; N17-H531 VanDerWaalsContact O-CD2 3.29Å; N17-H531 PolarHBondContact O-NE2 2.84Å; S20-H531 PolarHBondContact O-NE2 2.85Å; R22-H531 HydrophobicContact CG-CB 4.37Å; F402-H531 AromaticContact CE2-CE1 3.58Å; F402-H531 AromaticContact CE2-ND1 3.47Å; F402-H531 WeakPolarHBondContact CE2-ND1 3.43Å; F402-H531 AromaticContact CZ-ND1 3.93Å; S529-H531 VanDerWaalsContact C-N 3.27Å; S529-H531 PolarHBondContact OG-N 2.88Å
532	A	90.4	Very high	90.5	Very high	11 Å²	11	47.4 Å²	47.4	9%	0.091	28%	0.278	C	S	.	.	S	Bend	trans	-85.3	148.3	177.1	0	0	0	0	0	112.4	S529 Y534 E572 E573	S529-A532 PolarHBondContact OG-N 2.92Å; A532-Y534 HydrophobicContact CB-CE2 3.82Å; A532-Y534 WeakPolarHBondContact O-CD2 3.48Å; A532-Y534 WeakPolarHBondContact O-CE2 3.07Å; A532-E572 WeakPolarHBondContact CA-O 3.11Å; A532-E573 HydrophobicContact CB-CB 3.9Å; A532-E573 HydrophobicContact CB-CG 4.45Å
533	Q	91.4	Very high	90.4	Very high	119 Å²	119	45.4 Å²	45.4	56%	0.556	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	132.6	169	-65.2	-176.4	-0.4	0	0	110.1	S571 E572	Q533-S571 CarbonylContact O-C 3.57Å; Q533-S571 VanDerWaalsContact O-CA 3.31Å; Q533-S571 WeakPolarHBondContact O-CA 3.47Å; Q533-E572 PolarHBondContact N-O 2.91Å; Q533-E572 PolarHBondContact O-N 2.83Å
534	Y	92.3	Very high	90.3	Very high	12 Å²	12	49.5 Å²	49.5	5%	0.047	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.7	-177.4	-66.3	-104.2	0	0	0	110.7	V527 S528 S529 A532 C545 E570 L580	V527-Y534 HydrophobicContact CB-CE1 4.25Å; V527-Y534 HydrophobicContact CG1-CE1 4.34Å; V527-Y534 HydrophobicContact CG1-CE2 3.83Å; V527-Y534 WeakPolarHBondContact CG1-OH 3.37Å; V527-Y534 HydrophobicContact CG2-CD1 4.24Å; V527-Y534 HydrophobicContact CG2-CE1 3.95Å; V527-Y534 HydrophobicContact CG2-CE2 4.37Å; S528-Y534 PolarHBondContact N-OH 2.86Å; S529-Y534 PolarHBondContact N-OH 2.87Å; S529-Y534 VanDerWaalsContact N-OH 3.13Å; S529-Y534 VanDerWaalsContact O-CE2 3.22Å; S529-Y534 WeakPolarHBondContact O-CE2 3.33Å; S529-Y534 PolarHBondContact O-OH 2.98Å; A532-Y534 HydrophobicContact CB-CE2 3.82Å; A532-Y534 WeakPolarHBondContact O-CD2 3.48Å; A532-Y534 WeakPolarHBondContact O-CE2 3.07Å; Y534-C545 PolarHBondContact O-N 3.37Å; Y534-E570 CarbonylContact C-O 3.56Å; Y534-E570 WeakPolarHBondContact CA-O 3.32Å; Y534-L580 HydrophobicContact CD1-CD1 3.74Å; Y534-L580 HydrophobicContact CE1-CD1 3.33Å
535	T	94.6	Very high	90	Very high	35 Å²	35	44.5 Å²	44.5	22%	0.215	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	132.9	-178.7	-58.4	0	0	0	0	110.6	K537 S543 E570	T535-K537 HydrophobicContact CG2-CD 4.39Å; T535-S543 WeakPolarHBondContact CA-O 3.37Å; T535-E570 PolarHBondContact N-O 2.86Å; T535-E570 PolarHBondContact O-N 2.91Å
536	W	94.7	Very high	89.5	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.008	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.9	166.1	-78.8	102.5	0	0	0	110.2	L523 C525 T538 S542 S543 C552 L554 K568 C569 Y583	L523-W536 HydrophobicContact CB-CH2 3.53Å; L523-W536 HydrophobicContact CB-CZ2 3.98Å; L523-W536 HydrophobicContact CB-CZ3 4.1Å; L523-W536 HydrophobicContact CD1-CH2 4.37Å; L523-W536 HydrophobicContact CD1-CZ3 4.1Å; C525-W536 HydrophobicContact CB-CH2 4.17Å; C525-W536 HydrophobicContact CB-CZ2 3.54Å; W536-T538 HydrophobicContact CB-CG2 4.38Å; W536-S542 CarbonylContact O-C 3.41Å; W536-S542 VanDerWaalsContact O-CA 3.26Å; W536-S542 WeakPolarHBondContact O-CA 3.46Å; W536-S543 PolarHBondContact N-O 3.25Å; W536-S543 PolarHBondContact O-N 3.29Å; W536-C552 PolarHBondContact NE1-SG 2.96Å; W536-L554 HydrophobicContact CB-CD1 4.37Å; W536-L554 HydrophobicContact CB-CD2 4.24Å; W536-L554 HydrophobicContact CD2-CB 3.87Å; W536-L554 HydrophobicContact CD2-CD2 3.97Å; W536-L554 HydrophobicContact CD2-CG 4.45Å; W536-L554 HydrophobicContact CE3-CD2 4.1Å; W536-L554 HydrophobicContact CG-CB 4Å; W536-L554 HydrophobicContact CG-CD1 4.26Å; W536-L554 HydrophobicContact CG-CD2 4.04Å; W536-L554 HydrophobicContact CG-CG 4.34Å; W536-L554 HydrophobicContact CZ2-CB 4.1Å; W536-K568 CarbonylContact C-O 3.51Å; W536-K568 WeakPolarHBondContact CA-O 3.44Å; W536-C569 HydrophobicContact CD2-CB 4.11Å; W536-C569 HydrophobicContact CE3-CB 3.94Å; W536-C569 HydrophobicContact CH2-CB 3.89Å; W536-C569 HydrophobicContact CZ2-CB 4.06Å; W536-C569 HydrophobicContact CZ3-CB 3.83Å; W536-Y583 HydrophobicContact CH2-CD2 4.03Å; W536-Y583 AromaticContact CH2-CE2 3.73Å; W536-Y583 HydrophobicContact CH2-CE2 3.73Å; W536-Y583 AromaticContact CZ3-CD2 3.98Å; W536-Y583 HydrophobicContact CZ3-CD2 3.98Å; W536-Y583 HydrophobicContact CZ3-CE2 4.13Å
537	K	94.6	Very high	89	Confident	79 Å²	79	52.2 Å²	52.2	34%	0.343	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	117.6	164.8	-56.3	-61.5	-177.9	176.3	0	108.1	T535 S542 Y567 K568 E570	T535-K537 HydrophobicContact CG2-CD 4.39Å; K537-S542 WeakPolarHBondContact CD-OG 3.24Å; K537-S542 PolarHBondContact NZ-OG 2.78Å; K537-Y567 CarbonylContact O-C 3.58Å; K537-Y567 WeakPolarHBondContact O-CA 3.39Å; K537-K568 HydrophobicContact CB-CB 4.19Å; K537-K568 PolarHBondContact N-O 3.08Å; K537-K568 PolarHBondContact O-N 3.44Å; K537-E570 WeakPolarHBondContact CE-OE2 3.42Å
538	T	92.4	Very high	88.2	Confident	33 Å²	33	60.5 Å²	60.5	20%	0.202	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	165.4	178.9	75.4	0	0	0	0	109.5	W536 G540 G541 L554 Y567	W536-T538 HydrophobicContact CB-CG2 4.38Å; T538-G540 PolarHBondContact O-N 2.94Å; T538-G540 PolarHBondContact OG1-N 2Å; T538-G541 PolarHBondContact N-O 2.91Å; T538-G541 PolarHBondContact O-N 3.19Å; T538-G541 PolarHBondContact OG1-N 2.9Å; T538-G541 PolarHBondContact OG1-O 2.99Å; T538-L554 HydrophobicContact CG2-CD2 3.82Å; T538-Y567 HydrophobicContact CG2-CD1 3.62Å; T538-Y567 HydrophobicContact CG2-CE1 3.57Å
539	P	86.4	Confident	87.6	Confident	66 Å²	66	64.8 Å²	64.8	43%	0.429	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.2	172.3	-25.1	35	0	0	0	113.3	Q564 Y567	P539-Q564 WeakPolarHBondContact CG-O 3.26Å; P539-Y567 VanDerWaalsContact CD-CZ 3.47Å; P539-Y567 HydrophobicContact CG-CE2 3.92Å
540	G	83.6	Confident	86.8	Confident	78 Å²	78	65.8 Å²	65.8	80%	0.804	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-0.5	-179.4	0	0	0	0	0	115.4	T538	T538-G540 PolarHBondContact O-N 2.94Å; T538-G540 PolarHBondContact OG1-N 2Å
541	G	88.8	Confident	86.4	Confident	35 Å²	35	66.1 Å²	66.1	36%	0.361	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	141.2	-149.8	178.8	0	0	0	0	0	114.2	T538	T538-G541 PolarHBondContact N-O 2.91Å; T538-G541 PolarHBondContact O-N 3.19Å; T538-G541 PolarHBondContact OG1-N 2.9Å; T538-G541 PolarHBondContact OG1-O 2.99Å
542	S	92.5	Very high	86.4	Confident	76 Å²	76	64.7 Å²	64.7	53%	0.531	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140	177.3	-58.6	0	0	0	0	110.8	W536 K537	W536-S542 CarbonylContact O-C 3.41Å; W536-S542 VanDerWaalsContact O-CA 3.26Å; W536-S542 WeakPolarHBondContact O-CA 3.46Å; K537-S542 WeakPolarHBondContact CD-OG 3.24Å; K537-S542 PolarHBondContact NZ-OG 2.78Å
543	S	89.6	Confident	86.4	Confident	46 Å²	46	68 Å²	68	32%	0.322	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.5	174.6	54.3	0	0	0	0	111.2	T535 W536	T535-S543 WeakPolarHBondContact CA-O 3.37Å; W536-S543 PolarHBondContact N-O 3.25Å; W536-S543 PolarHBondContact O-N 3.29Å
544	S	89.1	Confident	86.4	Confident	88 Å²	88	63.6 Å²	63.6	62%	0.615	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	145.4	171.6	-56.3	0	0	0	0	110.1
545	C	86.3	Confident	86.4	Confident	15 Å²	15	68.1 Å²	68.1	10%	0.101	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.7	-179.6	-168.8	0	0	0	0	110.9	Y534 C552	Y534-C545 PolarHBondContact O-N 3.37Å; C545-C552 HydrophobicContact CB-CB 4.16Å; C545-C552 WeakPolarHBondContact CB-SG 3.49Å; C545-C552 VanDerWaalsContact SG-C 3.59Å; C545-C552 WeakPolarHBondContact SG-CA 3.32Å; C545-C552 WeakPolarHBondContact SG-CB 3.21Å; C545-C552 CovalentContact SG-SG 2Å; C545-C552 PolarHBondContact SG-SG 2.91Å
546	Y	81.2	Confident	86.2	Confident	181 Å²	181	66.8 Å²	66.8	71%	0.71	38%	0.382	S	S	*	.			trans	-104.6	131.1	175	-57.7	-80.5	0	0	0	108.8
547	S	77.8	Confident	85.9	Confident	54 Å²	54	72.8 Å²	72.8	38%	0.378	41%	0.414	S	S	.	.			trans	-65.6	133.9	178.6	-178.2	0	0	0	0	110.7
548	R	71.7	Confident	85.8	Confident	195 Å²	195	70.9 Å²	70.9	74%	0.736	41%	0.41	S	S	*	.	B	Isolated β-bridge	trans	-129.4	124	167.1	-170.8	175.4	179	175.9	1.7	108.4	G550 E551	R548-G550 PolarHBondContact O-N 2.9Å; R548-G550 VanDerWaalsContact O-N 3.09Å; R548-E551 PolarHBondContact N-O 3.21Å; R548-E551 PolarHBondContact O-N 3.06Å
549	D	70.3	Confident	85.7	Confident	141 Å²	141	69.3 Å²	69.3	75%	0.754	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	22.6	-179	-57.3	-46.6	0	0	0	115.5
550	G	74.9	Confident	85.8	Confident	24 Å²	24	67.9 Å²	67.9	25%	0.247	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	7.5	-177.6	0	0	0	0	0	114.2	V527 R548	V527-G550 WeakPolarHBondContact CB-O 3.36Å; V527-G550 PolarHBondContact N-O 2.85Å; R548-G550 PolarHBondContact O-N 2.9Å; R548-G550 VanDerWaalsContact O-N 3.09Å
551	E	82.8	Confident	86	Confident	68 Å²	68	68.7 Å²	68.7	32%	0.318	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	139.9	171.9	-64.9	-168.7	147	0	0	110.8	R524 R548 L553	R524-E551 IonicContact NH1-OE1 3.38Å; R524-E551 PolarHBondContact NH1-OE1 2.64Å; R524-E551 IonicContact NH1-OE2 2.94Å; R548-E551 PolarHBondContact N-O 3.21Å; R548-E551 PolarHBondContact O-N 3.06Å; E551-L553 HydrophobicContact CB-CD2 4Å; E551-L553 HydrophobicContact CB-CG 4.39Å
552	C	89.2	Confident	85.9	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	109.5	168.9	153.8	0	0	0	0	107.9	C525 V527 W536 C545	C525-C552 HydrophobicContact CB-CB 3.88Å; C525-C552 WeakPolarHBondContact CB-O 3.32Å; C525-C552 PolarHBondContact N-O 3.1Å; C525-C552 PolarHBondContact O-N 3.23Å; V527-C552 HydrophobicContact CG2-CB 3.72Å; W536-C552 PolarHBondContact NE1-SG 2.96Å; C545-C552 HydrophobicContact CB-CB 4.16Å; C545-C552 WeakPolarHBondContact CB-SG 3.49Å; C545-C552 VanDerWaalsContact SG-C 3.59Å; C545-C552 WeakPolarHBondContact SG-CA 3.32Å; C545-C552 WeakPolarHBondContact SG-CB 3.21Å; C545-C552 CovalentContact SG-SG 2Å; C545-C552 PolarHBondContact SG-SG 2.91Å
553	L	90.9	Very high	85.8	Confident	82 Å²	82	77.2 Å²	77.2	43%	0.429	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.8	-173.7	-57.7	-178.3	0	0	0	111.4	F522 L523 R524 E551	F522-L553 HydrophobicContact CD2-CD2 4.14Å; F522-L553 HydrophobicContact CE2-CD2 4.49Å; L523-L553 WeakPolarHBondContact O-CA 3.39Å; R524-L553 HydrophobicContact CB-CD2 4.19Å; R524-L553 HydrophobicContact CG-CD2 3.79Å; E551-L553 HydrophobicContact CB-CD2 4Å; E551-L553 HydrophobicContact CB-CG 4.39Å
554	L	91.6	Very high	85.8	Confident	25 Å²	25	79 Å²	79	13%	0.131	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	112.4	167.5	-178.8	70.2	0	0	0	109.1	F522 L523 W536 T538 Y567	F522-L554 CarbonylContact C-O 3.59Å; F522-L554 WeakPolarHBondContact CA-O 3.31Å; L523-L554 HydrophobicContact CB-CB 4.35Å; L523-L554 HydrophobicContact CD1-CD2 4.41Å; L523-L554 PolarHBondContact N-O 3.08Å; L523-L554 PolarHBondContact O-N 2.91Å; W536-L554 HydrophobicContact CB-CD1 4.37Å; W536-L554 HydrophobicContact CB-CD2 4.24Å; W536-L554 HydrophobicContact CD2-CB 3.87Å; W536-L554 HydrophobicContact CD2-CD2 3.97Å; W536-L554 HydrophobicContact CD2-CG 4.45Å; W536-L554 HydrophobicContact CE3-CD2 4.1Å; W536-L554 HydrophobicContact CG-CB 4Å; W536-L554 HydrophobicContact CG-CD1 4.26Å; W536-L554 HydrophobicContact CG-CD2 4.04Å; W536-L554 HydrophobicContact CG-CG 4.34Å; W536-L554 HydrophobicContact CZ2-CB 4.1Å; T538-L554 HydrophobicContact CG2-CD2 3.82Å; L554-Y567 HydrophobicContact CD2-CD1 3.6Å; L554-Y567 HydrophobicContact CD2-CE1 3.84Å
555	L	91.2	Very high	86	Confident	108 Å²	108	75.7 Å²	75.7	57%	0.565	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	136.5	174.3	-175.2	64.8	0	0	0	110.3	F522 D557	F522-L555 HydrophobicContact CB-CD1 4.46Å; L555-D557 WeakPolarHBondContact CD2-OD1 3.22Å; L555-D557 WeakPolarHBondContact CG-OD1 3.48Å
556	I	90.9	Very high	86.3	Confident	7 Å²	7	80.8 Å²	80.8	4%	0.036	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	105.1	170.5	-58.9	172	0	0	0	105.6	S520 Y521 Q563 L585	S520-I556 CarbonylContact C-O 3.54Å; S520-I556 VanDerWaalsContact CA-O 3.24Å; S520-I556 WeakPolarHBondContact CA-O 3.4Å; Y521-I556 PolarHBondContact N-O 3.38Å; Y521-I556 PolarHBondContact O-N 2.82Å; I556-Q563 HydrophobicContact CG2-CB 4.48Å; I556-Q563 HydrophobicContact CG2-CG 4.31Å; I556-L585 HydrophobicContact CD1-CD1 3.2Å
557	D	89.2	Confident	86.9	Confident	128 Å²	128	72.2 Å²	72.2	68%	0.684	36%	0.361	S	S	*	.	S	Bend	trans	-65.4	-41.3	-172	-62.6	-36.8	0	0	0	112.6	S520 L555	S520-D557 WeakPolarHBondContact CB-O 3.3Å; L555-D557 WeakPolarHBondContact CD2-OD1 3.22Å; L555-D557 WeakPolarHBondContact CG-OD1 3.48Å
558	S	90.8	Very high	87.7	Confident	38 Å²	38	72.9 Å²	72.9	27%	0.266	36%	0.357	S	S	.	.	S	Bend	trans	-145.4	126.8	173.9	168.9	0	0	0	0	110.5	E518 T560	E518-S558 WeakPolarHBondContact CA-OG 3.41Å; E518-S558 PolarHBondContact OE2-OG 2.77Å; S558-T560 PolarHBondContact O-N 3.07Å
559	M	90.7	Very high	88.8	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.322	C	S	.	.			trans	-75	110.1	176.1	-172.4	67	-168.8	0	0	111.3	V515 P516 E518 S519 Q563 Q564 L585 C587	V515-M559 HydrophobicContact CB-CB 4.29Å; V515-M559 HydrophobicContact CB-CG 3.84Å; V515-M559 HydrophobicContact CB-SD 4.12Å; V515-M559 HydrophobicContact CG1-CB 3.67Å; V515-M559 HydrophobicContact CG1-CG 3.81Å; V515-M559 HydrophobicContact CG1-SD 4.35Å; P516-M559 WeakPolarHBondContact O-CB 3.32Å; E518-M559 PolarHBondContact N-O 3.38Å; S519-M559 WeakPolarHBondContact O-CB 3.43Å; S519-M559 PolarHBondContact O-N 2.9Å; M559-Q563 HydrophobicContact CE-CB 4.42Å; M559-Q563 HydrophobicContact SD-CB 4.04Å; M559-Q564 HydrophobicContact CE-CG 3.9Å; M559-L585 HydrophobicContact CE-CB 4.03Å; M559-C587 HydrophobicContact CE-CB 3.65Å; M559-C587 HydrophobicContact CG-CB 3.86Å
560	T	89.6	Confident	89.9	Confident	37 Å²	37	59.1 Å²	59.1	23%	0.227	30%	0.297	C	S	.	.			trans	-121.8	165.8	175.5	63.1	0	0	0	0	110.5	S558 R562 Q563	S558-T560 PolarHBondContact O-N 3.07Å; T560-R562 PolarHBondContact O-N 2.92Å; T560-Q563 PolarHBondContact O-N 3.08Å
561	P	87.4	Confident	90.7	Very high	94 Å²	94	58.6 Å²	58.6	61%	0.61	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-54.7	-24.3	174.6	-28.3	36.5	0	0	0	114.4	Q563 Q564	P561-Q563 VanDerWaalsContact C-N 3.31Å; P561-Q563 PolarHBondContact O-N 2.88Å; P561-Q564 WeakPolarHBondContact O-CB 3.08Å; P561-Q564 PolarHBondContact O-N 2.86Å
562	R	87.1	Confident	91.1	Very high	222 Å²	222	58.5 Å²	58.5	84%	0.838	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-71.5	-23.8	176.5	-62.8	-176.5	-177.9	-172.8	1.2	113.7	T560 Q564	T560-R562 PolarHBondContact O-N 2.92Å; R562-Q564 VanDerWaalsContact C-N 3.34Å
563	Q	88.9	Confident	91.2	Very high	69 Å²	69	59.3 Å²	59.3	32%	0.322	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-92.4	4.7	177.8	-60.6	-63.8	-27.1	0	0	112	I556 M559 T560 P561 Y567	I556-Q563 HydrophobicContact CG2-CB 4.48Å; I556-Q563 HydrophobicContact CG2-CG 4.31Å; M559-Q563 HydrophobicContact CE-CB 4.42Å; M559-Q563 HydrophobicContact SD-CB 4.04Å; T560-Q563 PolarHBondContact O-N 3.08Å; P561-Q563 VanDerWaalsContact C-N 3.31Å; P561-Q563 PolarHBondContact O-N 2.88Å; Q563-Y567 WeakPolarHBondContact CA-OH 3.35Å; Q563-Y567 WeakPolarHBondContact O-CE2 3.5Å; Q563-Y567 PolarHBondContact O-OH 2.95Å; Q563-Y567 PolarHBondContact OE1-OH 2.85Å
564	Q	90.8	Very high	90.9	Very high	83 Å²	83	61.5 Å²	61.5	39%	0.388	30%	0.302	S	S	.	.			trans	-73.2	148.8	173.1	-71.2	-174.2	-9.5	0	0	111.4	P539 M559 P561 R562 C587	P539-Q564 WeakPolarHBondContact CG-O 3.26Å; M559-Q564 HydrophobicContact CE-CG 3.9Å; P561-Q564 WeakPolarHBondContact O-CB 3.08Å; P561-Q564 PolarHBondContact O-N 2.86Å; R562-Q564 VanDerWaalsContact C-N 3.34Å; Q564-C587 HydrophobicContact CG-CB 3.95Å; Q564-C587 VanDerWaalsContact NE2-N 3.16Å; Q564-C587 PolarHBondContact NE2-O 2.77Å
565	G	91.8	Very high	90.6	Very high	18 Å²	18	62.7 Å²	62.7	19%	0.186	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	121.2	-157	172.4	0	0	0	0	0	112.9	Y567 L585	G565-Y567 WeakPolarHBondContact O-CD2 3.47Å; G565-L585 PolarHBondContact N-O 2.84Å; G565-L585 VanDerWaalsContact N-O 3.08Å; G565-L585 PolarHBondContact O-N 3.39Å
566	R	93.8	Very high	90.4	Very high	122 Å²	122	60.1 Å²	60.1	46%	0.46	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.3	-167	-175.1	170.6	-98.6	-164.5	-13.3	112.1	Q582 Y583 E584	R566-Q582 HydrophobicContact CG-CG 4.42Å; R566-Y583 WeakPolarHBondContact CA-O 3.46Å; R566-E584 WeakPolarHBondContact CB-OE2 3.5Å; R566-E584 IonicContact NE-OE2 3.38Å; R566-E584 PolarHBondContact NE-OE2 3.3Å
567	Y	94.6	Very high	90.3	Very high	1 Å²	1	67.8 Å²	67.8	0%	0.004	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.6	174.8	-69	-108.4	0	0	0	109.3	L523 K537 T538 P539 L554 Q563 G565 Q582 Y583 L585	L523-Y567 HydrophobicContact CD1-CD1 3.81Å; L523-Y567 HydrophobicContact CD1-CD2 4.37Å; L523-Y567 HydrophobicContact CD1-CG 3.68Å; K537-Y567 CarbonylContact O-C 3.58Å; K537-Y567 WeakPolarHBondContact O-CA 3.39Å; T538-Y567 HydrophobicContact CG2-CD1 3.62Å; T538-Y567 HydrophobicContact CG2-CE1 3.57Å; P539-Y567 VanDerWaalsContact CD-CZ 3.47Å; P539-Y567 HydrophobicContact CG-CE2 3.92Å; L554-Y567 HydrophobicContact CD2-CD1 3.6Å; L554-Y567 HydrophobicContact CD2-CE1 3.84Å; Q563-Y567 WeakPolarHBondContact CA-OH 3.35Å; Q563-Y567 WeakPolarHBondContact O-CE2 3.5Å; Q563-Y567 PolarHBondContact O-OH 2.95Å; Q563-Y567 PolarHBondContact OE1-OH 2.85Å; G565-Y567 WeakPolarHBondContact O-CD2 3.47Å; Y567-Q582 WeakPolarHBondContact O-CA 3.41Å; Y567-Y583 PolarHBondContact N-O 3.36Å; Y567-Y583 PolarHBondContact O-N 2.89Å; Y567-L585 HydrophobicContact CD2-CB 4.36Å; Y567-L585 HydrophobicContact CD2-CD1 3.9Å; Y567-L585 HydrophobicContact CD2-CG 3.89Å; Y567-L585 HydrophobicContact CE2-CB 4.12Å; Y567-L585 HydrophobicContact CE2-CD1 3.58Å; Y567-L585 HydrophobicContact CE2-CG 3.92Å
568	K	94.4	Very high	90.3	Very high	68 Å²	68	63.4 Å²	63.4	30%	0.296	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136	174.7	-61.3	179.3	177.9	-178.1	0	110.1	W536 K537 A581 Q582	W536-K568 CarbonylContact C-O 3.51Å; W536-K568 WeakPolarHBondContact CA-O 3.44Å; K537-K568 HydrophobicContact CB-CB 4.19Å; K537-K568 PolarHBondContact N-O 3.08Å; K537-K568 PolarHBondContact O-N 3.44Å; K568-A581 WeakPolarHBondContact CA-O 3.14Å; K568-Q582 HydrophobicContact CG-CG 4.01Å
569	C	94.1	Very high	90.3	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.7	164.2	-176.2	0	0	0	0	109.6	C525 W536 L580 A581	C525-C569 HydrophobicContact CB-CB 3.51Å; C525-C569 WeakPolarHBondContact CB-SG 3.43Å; C525-C569 WeakPolarHBondContact SG-CB 3.41Å; C525-C569 CovalentContact SG-SG 2.01Å; C525-C569 PolarHBondContact SG-SG 3.05Å; W536-C569 HydrophobicContact CD2-CB 4.11Å; W536-C569 HydrophobicContact CE3-CB 3.94Å; W536-C569 HydrophobicContact CH2-CB 3.89Å; W536-C569 HydrophobicContact CZ2-CB 4.06Å; W536-C569 HydrophobicContact CZ3-CB 3.83Å; C569-L580 PolarHBondContact O-N 2.9Å; C569-A581 HydrophobicContact CB-CB 4.34Å; C569-A581 PolarHBondContact N-O 3.32Å
570	E	93.4	Very high	90.2	Very high	47 Å²	47	64.1 Å²	64.1	22%	0.22	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	140.3	-179	-65.5	175.9	165.1	0	0	109.9	Y534 T535 K537 K578 V579	Y534-E570 CarbonylContact C-O 3.56Å; Y534-E570 WeakPolarHBondContact CA-O 3.32Å; T535-E570 PolarHBondContact N-O 2.86Å; T535-E570 PolarHBondContact O-N 2.91Å; K537-E570 WeakPolarHBondContact CE-OE2 3.42Å; E570-K578 CarbonylContact C-O 3.53Å; E570-K578 VanDerWaalsContact CA-O 3.3Å; E570-K578 WeakPolarHBondContact CA-O 3.31Å; E570-V579 HydrophobicContact CG-CG2 4.12Å
571	S	92.2	Very high	90.3	Very high	13 Å²	13	62.7 Å²	62.7	9%	0.091	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.9	169.2	59.5	0	0	0	0	110.9	Q533 R577 K578	Q533-S571 CarbonylContact O-C 3.57Å; Q533-S571 VanDerWaalsContact O-CA 3.31Å; Q533-S571 WeakPolarHBondContact O-CA 3.47Å; S571-R577 CarbonylContact O-C 3.59Å; S571-R577 VanDerWaalsContact O-CA 3.3Å; S571-R577 WeakPolarHBondContact O-CA 3.38Å; S571-K578 PolarHBondContact N-O 3.19Å; S571-K578 PolarHBondContact O-N 2.76Å; S571-K578 PolarHBondContact OG-O 3.45Å
572	E	91	Very high	90.6	Very high	66 Å²	66	59.4 Å²	59.4	31%	0.308	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	121.8	173.1	-173.8	166.9	-178.1	0	0	110.5	A532 Q533 Y576 R577	A532-E572 WeakPolarHBondContact CA-O 3.11Å; Q533-E572 PolarHBondContact N-O 2.91Å; Q533-E572 PolarHBondContact O-N 2.83Å; E572-Y576 VanDerWaalsContact CA-O 3.32Å; E572-Y576 WeakPolarHBondContact CA-O 3.46Å; E572-R577 HydrophobicContact CB-CG 4.02Å; E572-R577 HydrophobicContact CG-CG 3.84Å; E572-R577 IonicContact OE1-CZ 3.26Å; E572-R577 IonicContact OE1-NE 3.2Å; E572-R577 PolarHBondContact OE1-NE 3.29Å; E572-R577 IonicContact OE1-NH2 3.08Å; E572-R577 PolarHBondContact OE1-NH2 3.4Å; E572-R577 VanDerWaalsContact OE1-NH2 3.08Å; E572-R577 IonicContact OE2-CZ 2.74Å; E572-R577 IonicContact OE2-NE 2.85Å; E572-R577 PolarHBondContact OE2-NE 2.96Å; E572-R577 IonicContact OE2-NH2 3.07Å; E572-R577 PolarHBondContact OE2-NH2 2.88Å; E572-R577 VanDerWaalsContact OE2-NH2 3.07Å
573	E	90.5	Very high	91	Very high	17 Å²	17	50 Å²	50	8%	0.079	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	121.6	176.6	-170.6	-178.7	159.6	0	0	109.1	R22 L456 S529 A532 G575 Y576	R22-E573 IonicContact CZ-OE1 2.98Å; R22-E573 IonicContact CZ-OE2 3.54Å; R22-E573 IonicContact NE-OE1 2.74Å; R22-E573 PolarHBondContact NE-OE1 3.3Å; R22-E573 IonicContact NE-OE2 3.57Å; R22-E573 PolarHBondContact NE-OE2 3.18Å; R22-E573 IonicContact NH2-OE1 2.63Å; R22-E573 IonicContact NH2-OE2 2.98Å; R22-E573 PolarHBondContact NH2-OE2 3.41Å; L456-E573 HydrophobicContact CD1-CB 4.37Å; S529-E573 WeakPolarHBondContact CB-OE2 3.38Å; S529-E573 VanDerWaalsContact OG-CD 3.32Å; S529-E573 PolarHBondContact OG-OE2 3.16Å; A532-E573 HydrophobicContact CB-CB 3.9Å; A532-E573 HydrophobicContact CB-CG 4.45Å; E573-G575 PolarHBondContact O-N 2.75Å; E573-Y576 PolarHBondContact N-O 3.32Å; E573-Y576 WeakPolarHBondContact O-CB 3.42Å; E573-Y576 PolarHBondContact O-N 3.39Å
574	M	84.7	Confident	91.2	Very high	128 Å²	128	49.2 Å²	49.2	63%	0.631	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	32.6	179.7	-64	-66.4	-61.2	0	0	114.1	L456 H484 Y576	L456-M574 HydrophobicContact CD2-CB 4.05Å; L456-M574 HydrophobicContact CD2-CG 4.3Å; H484-M574 PolarHBondContact CE1-O 3.5Å; M574-Y576 VanDerWaalsContact C-N 3.34Å
575	G	84.7	Confident	91.3	Very high	51 Å²	51	45.4 Å²	45.4	53%	0.526	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	87	-9.9	-178.5	0	0	0	0	0	115.3	E573	E573-G575 PolarHBondContact O-N 2.75Å
576	Y	87.6	Confident	91.3	Very high	54 Å²	54	51.5 Å²	51.5	21%	0.212	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	122.7	172.7	177.1	-115.4	0	0	0	110.5	P452 L456 E572 E573 M574 K578	P452-Y576 HydrophobicContact CB-CD1 3.75Å; P452-Y576 HydrophobicContact CB-CD2 3.8Å; P452-Y576 HydrophobicContact CB-CE1 3.54Å; P452-Y576 HydrophobicContact CB-CE2 3.62Å; P452-Y576 HydrophobicContact CB-CG 3.87Å; P452-Y576 VanDerWaalsContact CB-CZ 3.48Å; P452-Y576 HydrophobicContact CG-CD2 4.01Å; P452-Y576 HydrophobicContact CG-CE1 4.31Å; P452-Y576 HydrophobicContact CG-CE2 3.55Å; L456-Y576 HydrophobicContact CD1-CD1 3.87Å; L456-Y576 HydrophobicContact CD1-CG 4.38Å; E572-Y576 VanDerWaalsContact CA-O 3.32Å; E572-Y576 WeakPolarHBondContact CA-O 3.46Å; E573-Y576 PolarHBondContact N-O 3.32Å; E573-Y576 WeakPolarHBondContact O-CB 3.42Å; E573-Y576 PolarHBondContact O-N 3.39Å; M574-Y576 VanDerWaalsContact C-N 3.34Å; Y576-K578 HydrophobicContact CE1-CB 4.03Å; Y576-K578 HydrophobicContact CE1-CD 4.31Å
577	R	89.8	Confident	90.9	Very high	168 Å²	168	46.1 Å²	46.1	63%	0.634	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	135.5	178.7	-70.5	-176.1	-177	153.1	14.2	111.9	S571 E572	S571-R577 CarbonylContact O-C 3.59Å; S571-R577 VanDerWaalsContact O-CA 3.3Å; S571-R577 WeakPolarHBondContact O-CA 3.38Å; E572-R577 HydrophobicContact CB-CG 4.02Å; E572-R577 HydrophobicContact CG-CG 3.84Å; E572-R577 IonicContact OE1-CZ 3.26Å; E572-R577 IonicContact OE1-NE 3.2Å; E572-R577 PolarHBondContact OE1-NE 3.29Å; E572-R577 IonicContact OE1-NH2 3.08Å; E572-R577 PolarHBondContact OE1-NH2 3.4Å; E572-R577 VanDerWaalsContact OE1-NH2 3.08Å; E572-R577 IonicContact OE2-CZ 2.74Å; E572-R577 IonicContact OE2-NE 2.85Å; E572-R577 PolarHBondContact OE2-NE 2.96Å; E572-R577 IonicContact OE2-NH2 3.07Å; E572-R577 PolarHBondContact OE2-NH2 2.88Å; E572-R577 VanDerWaalsContact OE2-NH2 3.07Å
578	K	88.1	Confident	90.2	Very high	35 Å²	35	49.1 Å²	49.1	15%	0.152	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	132.4	-179.4	-176.4	178.5	178.5	-175.8	0	111.1	D453 E570 S571 Y576 L580	D453-K578 IonicContact OD1-NZ 3.5Å; D453-K578 PolarHBondContact OD1-NZ 3.2Å; D453-K578 IonicContact OD2-NZ 3.69Å; D453-K578 PolarHBondContact OD2-NZ 3.33Å; E570-K578 CarbonylContact C-O 3.53Å; E570-K578 VanDerWaalsContact CA-O 3.3Å; E570-K578 WeakPolarHBondContact CA-O 3.31Å; S571-K578 PolarHBondContact N-O 3.19Å; S571-K578 PolarHBondContact O-N 2.76Å; S571-K578 PolarHBondContact OG-O 3.45Å; Y576-K578 HydrophobicContact CE1-CB 4.03Å; Y576-K578 HydrophobicContact CE1-CD 4.31Å; K578-L580 HydrophobicContact CD-CD2 3.92Å; K578-L580 HydrophobicContact CG-CD2 4.04Å
579	V	90.8	Very high	88.7	Confident	44 Å²	44	51.1 Å²	51.1	27%	0.267	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	126.5	169.3	-176.6	0	0	0	0	108.1	E570	E570-V579 HydrophobicContact CG-CG2 4.12Å
580	L	90.1	Very high	86.9	Confident	9 Å²	9	56 Å²	56	5%	0.047	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-31.3	-174.3	-63.8	176.4	0	0	0	113.3	P526 Y534 C569 K578	P526-L580 HydrophobicContact CG-CB 4.41Å; Y534-L580 HydrophobicContact CD1-CD1 3.74Å; Y534-L580 HydrophobicContact CE1-CD1 3.33Å; C569-L580 PolarHBondContact O-N 2.9Å; K578-L580 HydrophobicContact CD-CD2 3.92Å; K578-L580 HydrophobicContact CG-CD2 4.04Å
581	A	90.9	Very high	84.9	Confident	8 Å²	8	56.8 Å²	56.8	7%	0.066	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	145	177.6	0	0	0	0	0	110.4	K568 C569 Y583	K568-A581 WeakPolarHBondContact CA-O 3.14Å; C569-A581 HydrophobicContact CB-CB 4.34Å; C569-A581 PolarHBondContact N-O 3.32Å; A581-Y583 HydrophobicContact CB-CD2 4.47Å; A581-Y583 HydrophobicContact CB-CE2 3.56Å
582	Q	94.3	Very high	82.4	Confident	24 Å²	24	64.9 Å²	64.9	11%	0.112	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.6	178.8	-170.6	166.4	3.3	0	0	111	V510 K511 R566 Y567 K568	V510-Q582 HydrophobicContact CB-CG 4.44Å; V510-Q582 HydrophobicContact CG1-CG 4.33Å; V510-Q582 HydrophobicContact CG2-CB 4.5Å; V510-Q582 HydrophobicContact CG2-CG 3.85Å; K511-Q582 PolarHBondContact N-O 3.23Å; R566-Q582 HydrophobicContact CG-CG 4.42Å; Y567-Q582 WeakPolarHBondContact O-CA 3.41Å; K568-Q582 HydrophobicContact CG-CG 4.01Å
583	Y	94.1	Very high	79.8	Confident	25 Å²	25	68.1 Å²	68.1	10%	0.098	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	147	-175.7	-57.5	-86.8	0	0	0	110.8	K511 I513 L523 R524 W536 R566 Y567 A581	K511-Y583 HydrophobicContact CB-CD1 3.9Å; K511-Y583 HydrophobicContact CB-CE1 4.2Å; K511-Y583 HydrophobicContact CD-CE1 4.16Å; K511-Y583 CarbonylContact O-C 3.6Å; K511-Y583 VanDerWaalsContact O-CA 3.32Å; K511-Y583 WeakPolarHBondContact O-CA 3.4Å; I513-Y583 HydrophobicContact CD1-CD1 3.55Å; I513-Y583 HydrophobicContact CD1-CE1 4Å; I513-Y583 HydrophobicContact CG1-CD1 4.44Å; L523-Y583 HydrophobicContact CB-CD2 4.36Å; L523-Y583 HydrophobicContact CB-CE2 4.35Å; L523-Y583 HydrophobicContact CD1-CD2 4.01Å; L523-Y583 HydrophobicContact CD1-CG 4.15Å; L523-Y583 HydrophobicContact CD2-CD1 3.95Å; L523-Y583 HydrophobicContact CD2-CD2 4.17Å; L523-Y583 HydrophobicContact CD2-CE1 4.36Å; L523-Y583 HydrophobicContact CD2-CG 3.83Å; L523-Y583 HydrophobicContact CG-CD2 4.43Å; R524-Y583 WeakPolarHBondContact O-CE2 3.36Å; R524-Y583 PolarHBondContact O-OH 3.49Å; W536-Y583 HydrophobicContact CH2-CD2 4.03Å; W536-Y583 AromaticContact CH2-CE2 3.73Å; W536-Y583 HydrophobicContact CH2-CE2 3.73Å; W536-Y583 AromaticContact CZ3-CD2 3.98Å; W536-Y583 HydrophobicContact CZ3-CD2 3.98Å; W536-Y583 HydrophobicContact CZ3-CE2 4.13Å; R566-Y583 WeakPolarHBondContact CA-O 3.46Å; Y567-Y583 PolarHBondContact N-O 3.36Å; Y567-Y583 PolarHBondContact O-N 2.89Å; A581-Y583 HydrophobicContact CB-CD2 4.47Å; A581-Y583 HydrophobicContact CB-CE2 3.56Å
584	E	94.1	Very high	77.3	Confident	53 Å²	53	77.2 Å²	77.2	25%	0.248	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	109.2	170.3	-164.7	72	-144.6	0	0	108.3	V510 K511 S512 I513 R566	V510-E584 HydrophobicContact CG1-CB 3.7Å; K511-E584 PolarHBondContact O-N 3.27Å; S512-E584 CarbonylContact C-O 3.59Å; S512-E584 WeakPolarHBondContact CA-O 3.5Å; I513-E584 PolarHBondContact N-O 3.27Å; R566-E584 WeakPolarHBondContact CB-OE2 3.5Å; R566-E584 IonicContact NE-OE2 3.38Å; R566-E584 PolarHBondContact NE-OE2 3.3Å
585	L	93.4	Very high	75	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.01	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	130.9	-177.5	-67.8	-170	0	0	0	111.9	I513 V515 L523 I556 M559 G565 Y567	I513-L585 HydrophobicContact CB-CD2 3.82Å; I513-L585 HydrophobicContact CG2-CD2 4.3Å; I513-L585 WeakPolarHBondContact O-CA 3Å; V515-L585 HydrophobicContact CG2-CD2 4.19Å; L523-L585 HydrophobicContact CD1-CD1 4.29Å; L523-L585 HydrophobicContact CD2-CD2 4.17Å; I556-L585 HydrophobicContact CD1-CD1 3.2Å; M559-L585 HydrophobicContact CE-CB 4.03Å; G565-L585 PolarHBondContact N-O 2.84Å; G565-L585 VanDerWaalsContact N-O 3.08Å; G565-L585 PolarHBondContact O-N 3.39Å; Y567-L585 HydrophobicContact CD2-CB 4.36Å; Y567-L585 HydrophobicContact CD2-CD1 3.9Å; Y567-L585 HydrophobicContact CD2-CG 3.89Å; Y567-L585 HydrophobicContact CE2-CB 4.12Å; Y567-L585 HydrophobicContact CE2-CD1 3.58Å; Y567-L585 HydrophobicContact CE2-CG 3.92Å
586	R	92	Very high	72.8	Confident	147 Å²	147	77.3 Å²	77.3	56%	0.555	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.7	175.5	-61.5	-177.3	-179.6	178.4	-0.1	109.7	I513 T514 V515	I513-R586 PolarHBondContact O-N 3.23Å; T514-R586 WeakPolarHBondContact CA-O 3.2Å; V515-R586 PolarHBondContact N-O 3.02Å
587	C	85.1	Confident	70.4	Confident	9 Å²	9	80.8 Å²	80.8	6%	0.061	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-102.5	121.4	168.8	-175.6	0	0	0	0	107.5	S517 M559 Q564 S589	S517-C587 VanDerWaalsContact CA-SG 3.59Å; M559-C587 HydrophobicContact CE-CB 3.65Å; M559-C587 HydrophobicContact CG-CB 3.86Å; Q564-C587 HydrophobicContact CG-CB 3.95Å; Q564-C587 VanDerWaalsContact NE2-N 3.16Å; Q564-C587 PolarHBondContact NE2-O 2.77Å; C587-S589 PolarHBondContact O-N 2.9Å
588	P	79.3	Confident	68	Low	64 Å²	64	77.9 Å²	77.9	42%	0.416	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-63.3	132	173.7	25.5	-27.1	0	0	0	108.6	T514 V515 A590	T514-P588 HydrophobicContact CG2-CG 4.2Å; V515-P588 WeakPolarHBondContact O-CD 3.3Å; P588-A590 PolarHBondContact O-N 3.42Å
589	S	63.6	Low	65.4	Low	109 Å²	109	86.5 Å²	86.5	76%	0.762	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-51.8	131.9	176.4	-31.7	0	0	0	0	109.4	C587 G591	C587-S589 PolarHBondContact O-N 2.9Å; S589-G591 PolarHBondContact O-N 3.44Å
590	A	55.9	Low	62.8	Low	102 Å²	102	90.6 Å²	90.6	84%	0.843	51%	0.512	S	S	*	.	S	Bend	trans	-61.2	88.8	166.1	0	0	0	0	0	108.3	P588	P588-A590 PolarHBondContact O-N 3.42Å
591	G	50.7	Low	60.3	Low	64 Å²	64	97.8 Å²	97.8	66%	0.66	54%	0.543	S	S	*	.			trans	167.3	34.4	-166.1	0	0	0	0	0	115.3	S589	S589-G591 PolarHBondContact O-N 3.44Å
592	Q	40.3	Very low	57.6	Low	183 Å²	183	104.5 Å²	104.5	86%	0.855	58%	0.576	S	S	*	*			trans	-129.5	88.7	146.6	-83.6	-172.1	-8.1	0	0	106.8	F594	Q592-F594 PolarHBondContact O-N 3.03Å
593	T	36	Very low	54.8	Low	135 Å²	135	107.9 Å²	107.9	83%	0.828	61%	0.609	S	S	*	*			trans	-43	121.6	151.9	31.2	0	0	0	0	107.8	G595	T593-G595 PolarHBondContact O-N 2.95Å
594	F	37.6	Very low	51.9	Low	207 Å²	207	110.8 Å²	110.8	91%	0.908	64%	0.638	S	S	*	*			trans	-49.3	120.2	153.8	-85.9	-94.1	0	0	0	106.1	Q592	Q592-F594 PolarHBondContact O-N 3.03Å
595	G	36.1	Very low	49.2	Very low	50 Å²	50	114.3 Å²	114.3	52%	0.515	66%	0.662	S	S	.	*			trans	-52.3	151.3	175	0	0	0	0	0	110.1	T593 T597	T593-G595 PolarHBondContact O-N 2.95Å; G595-T597 PolarHBondContact O-N 3.37Å
596	P	38.7	Very low	46.4	Very low	131 Å²	131	124 Å²	124	85%	0.851	71%	0.705	S	S	*	*			trans	-70.1	93.4	-165.4	31	-34.3	0	0	0	110.1	V598	P596-V598 PolarHBondContact O-N 2.97Å; P596-V598 VanDerWaalsContact O-N 3.08Å
597	T	38	Very low	43.4	Very low	128 Å²	128	123.2 Å²	123.2	79%	0.785	71%	0.712	S	S	*	*			trans	-80.7	84.2	159.9	47.2	0	0	0	0	107.8	G595	G595-T597 PolarHBondContact O-N 3.37Å
598	V	38.2	Very low	40.9	Very low	107 Å²	107	128 Å²	128	65%	0.648	75%	0.745	S	S	*	*			trans	33.7	96.1	140.3	-176.6	0	0	0	0	114.7	P596 I600	P596-V598 PolarHBondContact O-N 2.97Å; P596-V598 VanDerWaalsContact O-N 3.08Å; V598-I600 HydrophobicContact CG1-CB 4.5Å; V598-I600 HydrophobicContact CG1-CD1 3.6Å; V598-I600 HydrophobicContact CG1-CG1 3.58Å; V598-I600 PolarHBondContact O-N 3.38Å; V598-I600 VanDerWaalsContact O-N 3.13Å
599	W	33.6	Very low	38.8	Very low	215 Å²	215	130.5 Å²	130.5	81%	0.814	76%	0.759	S	S	*	*			trans	-64.6	101.8	153.4	-84.9	81.6	0	0	0	108.5	F601	W599-F601 HydrophobicContact CD2-CE2 4.11Å; W599-F601 AromaticContact CE3-CD2 3.74Å; W599-F601 HydrophobicContact CE3-CD2 3.74Å; W599-F601 HydrophobicContact CE3-CE1 4.14Å; W599-F601 AromaticContact CE3-CE2 3.21Å; W599-F601 HydrophobicContact CE3-CE2 3.21Å; W599-F601 HydrophobicContact CE3-CG 4.39Å; W599-F601 AromaticContact CE3-CZ 3.45Å; W599-F601 HydrophobicContact CE3-CZ 3.45Å; W599-F601 VanDerWaalsContact CE3-CZ 3.45Å; W599-F601 HydrophobicContact CH2-CZ 4.26Å; W599-F601 HydrophobicContact CZ3-CD2 4.36Å; W599-F601 AromaticContact CZ3-CE1 3.77Å; W599-F601 HydrophobicContact CZ3-CE1 3.77Å; W599-F601 AromaticContact CZ3-CE2 3.59Å; W599-F601 HydrophobicContact CZ3-CE2 3.59Å; W599-F601 AromaticContact CZ3-CZ 3.25Å; W599-F601 HydrophobicContact CZ3-CZ 3.25Å
600	I	37.9	Very low	37.5	Very low	130 Å²	130	135.1 Å²	135.1	67%	0.667	76%	0.76	S	S	*	*			trans	-102	101.3	154.6	-74.5	160.1	0	0	0	106.5	V598 I602	V598-I600 HydrophobicContact CG1-CB 4.5Å; V598-I600 HydrophobicContact CG1-CD1 3.6Å; V598-I600 HydrophobicContact CG1-CG1 3.58Å; V598-I600 PolarHBondContact O-N 3.38Å; V598-I600 VanDerWaalsContact O-N 3.13Å; I600-I602 HydrophobicContact CG2-CG1 3.95Å; I600-I602 PolarHBondContact O-N 3.03Å
601	F	35.8	Very low	36.8	Very low	161 Å²	161	142 Å²	142	71%	0.706	77%	0.771	S	S	*	*			trans	-63.1	120.1	157.7	-79.4	-88.3	0	0	0	108.1	W599	W599-F601 HydrophobicContact CD2-CE2 4.11Å; W599-F601 AromaticContact CE3-CD2 3.74Å; W599-F601 HydrophobicContact CE3-CD2 3.74Å; W599-F601 HydrophobicContact CE3-CE1 4.14Å; W599-F601 AromaticContact CE3-CE2 3.21Å; W599-F601 HydrophobicContact CE3-CE2 3.21Å; W599-F601 HydrophobicContact CE3-CG 4.39Å; W599-F601 AromaticContact CE3-CZ 3.45Å; W599-F601 HydrophobicContact CE3-CZ 3.45Å; W599-F601 VanDerWaalsContact CE3-CZ 3.45Å; W599-F601 HydrophobicContact CH2-CZ 4.26Å; W599-F601 HydrophobicContact CZ3-CD2 4.36Å; W599-F601 AromaticContact CZ3-CE1 3.77Å; W599-F601 HydrophobicContact CZ3-CE1 3.77Å; W599-F601 AromaticContact CZ3-CE2 3.59Å; W599-F601 HydrophobicContact CZ3-CE2 3.59Å; W599-F601 AromaticContact CZ3-CZ 3.25Å; W599-F601 HydrophobicContact CZ3-CZ 3.25Å
602	I	35.6	Very low	36.1	Very low	148 Å²	148	145.9 Å²	145.9	76%	0.759	78%	0.777	S	S	*	*			trans	-107.7	93.9	150.9	-61.7	-178.1	0	0	0	106.4	I600 A604	I600-I602 HydrophobicContact CG2-CG1 3.95Å; I600-I602 PolarHBondContact O-N 3.03Å; I602-A604 HydrophobicContact CG2-CB 4.34Å
603	A	34.8	Very low	35.9	Very low	96 Å²	96	143.9 Å²	143.9	79%	0.793	77%	0.773	S	S	*	*			trans	-77.6	114.9	154.9	0	0	0	0	0	107.4
604	A	33.2	Very low	35.9	Very low	86 Å²	86	144.4 Å²	144.4	71%	0.711	77%	0.77	S	S	*	*			trans	-143.4	78.7	159.7	0	0	0	0	0	107.8	I602	I602-A604 HydrophobicContact CG2-CB 4.34Å
605	V	38.2	Very low	35.8	Very low	126 Å²	126	140.7 Å²	140.7	76%	0.764	76%	0.761	S	S	*	*			trans	-82.5	111.4	157.5	173.5	0	0	0	0	105.8
606	F	33.9	Very low	35.8	Very low	205 Å²	205	146.4 Å²	146.4	90%	0.899	78%	0.777	S	S	*	*			trans	-125.8	124.4	151.7	-104.5	-82.5	0	0	0	109.4
607	N	29.4	Very low	35.6	Very low	132 Å²	132	147.4 Å²	147.4	71%	0.706	77%	0.772	S	S	*	*			trans	-45.8	167	-179.1	-82.2	-53	0	0	0	117.7
608	S	32.4	Very low	35.4	Very low	108 Å²	108	148.8 Å²	148.8	76%	0.755	77%	0.771	S	S	*	*			trans	98.3	133.6	143	80.4	0	0	0	0	114.9
609	V	35.8	Very low	35.2	Very low	118 Å²	118	152 Å²	152	72%	0.715	78%	0.78	S	S	*	*			cis	-174.8	158.3	12.9	100.5	0	0	0	0	110.4
610	W	35.2	Very low	35.3	Very low	206 Å²	206	146.8 Å²	146.8	78%	0.78	78%	0.777	S	S	*	*			trans	80.9	130.3	160.2	-71.1	27.7	0	0	0	118.1
611	F	41.8	Very low	35.1	Very low	245 Å²	245	148.3 Å²	148.3	100%	1.075	79%	0.788	S	S	*	*			cis	-139.1	0	16.8	-125.5	-73.6	0	0	0	111.1

Retrieved 611 of 611 residues in 176.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).