A0A077Z7I0_TRITR Loading...

DNA directed RNA polymerase III subunit RPC8

AlphaFold DB , UniProt , Accession A0A077Z7I0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 205 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	87.6	Confident	94.5	Very high	67 Å²	67	72.2 Å²	72.2	33%	0.33	37%	0.371	S	S	.	.				0	-65.8	0	-159	176.4	174.2	0	0	113.3	F77 R78 E83 L85 F103	M1-F77 HydrophobicContact CE-CD2 3.96Å; M1-F77 HydrophobicContact CE-CE2 3.56Å; M1-F77 HydrophobicContact CG-CD2 3.82Å; M1-F77 HydrophobicContact CG-CE2 3.58Å; M1-F77 HydrophobicContact SD-CE2 4.44Å; M1-R78 CarbonylContact O-C 3.55Å; M1-R78 PolarHBondContact O-N 3.3Å; M1-R78 VanDerWaalsContact O-O 3.05Å; M1-E83 VanDerWaalsContact CA-OE1 3.25Å; M1-E83 WeakPolarHBondContact CA-OE1 3.25Å; M1-E83 VanDerWaalsContact CA-OE2 3.27Å; M1-E83 WeakPolarHBondContact CA-OE2 3.45Å; M1-E83 WeakPolarHBondContact CB-OE1 3.3Å; M1-E83 PolarHBondContact N-OE1 3.14Å; M1-E83 PolarHBondContact N-OE2 3.38Å; M1-L85 HydrophobicContact CE-CD2 4.46Å; M1-L85 HydrophobicContact CG-CD2 4.15Å; M1-L85 HydrophobicContact SD-CD2 4.11Å; M1-F103 HydrophobicContact CE-CE1 3.94Å; M1-F103 HydrophobicContact CE-CZ 3.53Å
2	F	93.1	Very high	94.4	Very high	94 Å²	94	73.4 Å²	73.4	41%	0.412	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	142.2	-176.6	-60.9	-77.8	0	0	0	111.8	V46 L75 I76 F77 F103	F2-V46 HydrophobicContact CD1-CG2 4.18Å; F2-V46 HydrophobicContact CE1-CG2 3.84Å; F2-L75 HydrophobicContact CB-CD1 3.95Å; F2-L75 HydrophobicContact CG-CD1 4.49Å; F2-I76 CarbonylContact C-O 3.58Å; F2-I76 VanDerWaalsContact CA-O 3.32Å; F2-I76 WeakPolarHBondContact CA-O 3.49Å; F2-F77 HydrophobicContact CD1-CB 4.11Å; F2-F77 HydrophobicContact CD1-CD2 4.28Å; F2-F77 HydrophobicContact CE1-CB 3.93Å; F2-F77 AromaticContact CE1-CD2 3.85Å; F2-F77 HydrophobicContact CE1-CD2 3.85Å; F2-F77 HydrophobicContact CE1-CG 4.37Å; F2-F77 HydrophobicContact CZ-CD2 4.27Å; F2-F103 HydrophobicContact CE1-CZ 4.24Å; F2-F103 HydrophobicContact CZ-CE1 4.09Å; F2-F103 HydrophobicContact CZ-CZ 4.04Å
3	K	94.1	Very high	94.3	Very high	127 Å²	127	67.8 Å²	67.8	55%	0.552	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.9	151.4	174.1	-70.6	-171.3	176.1	-178.5	0	110	I76 R78	K3-I76 PolarHBondContact N-O 2.85Å; K3-I76 PolarHBondContact O-N 2.68Å; K3-R78 HydrophobicContact CD-CB 4.33Å; K3-R78 HydrophobicContact CD-CG 4.28Å; K3-R78 HydrophobicContact CG-CB 4.42Å
4	V	95.8	Very high	94.2	Very high	69 Å²	69	66.6 Å²	66.6	42%	0.418	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.4	172	-176.4	0	0	0	0	107.9	Y49 R73 L74	V4-Y49 HydrophobicContact CG1-CD1 4.27Å; V4-R73 HydrophobicContact CG1-CB 3.56Å; V4-R73 HydrophobicContact CG1-CG 3.97Å; V4-L74 WeakPolarHBondContact CA-O 3.34Å
5	Y	96.1	Very high	93.9	Very high	103 Å²	103	65.8 Å²	65.8	40%	0.404	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.6	-178.2	-170.2	-104	0	0	0	110.6	I7 V42 R73 L74 I76	Y5-I7 HydrophobicContact CD1-CD1 3.85Å; Y5-I7 HydrophobicContact CD1-CG1 3.49Å; Y5-I7 VanDerWaalsContact CD1-CG1 3.49Å; Y5-I7 HydrophobicContact CE1-CD1 3.95Å; Y5-I7 HydrophobicContact CE1-CG1 3.6Å; Y5-V42 HydrophobicContact CD1-CG1 3.99Å; Y5-V42 HydrophobicContact CD2-CG1 3.71Å; Y5-V42 HydrophobicContact CE1-CG1 4.28Å; Y5-V42 HydrophobicContact CE1-CG2 4.17Å; Y5-V42 HydrophobicContact CE2-CG1 4.02Å; Y5-V42 HydrophobicContact CE2-CG2 3.98Å; Y5-V42 HydrophobicContact CG-CG1 3.71Å; Y5-R73 CarbonylContact O-C 3.53Å; Y5-R73 VanDerWaalsContact O-CA 3.3Å; Y5-R73 WeakPolarHBondContact O-CA 3.37Å; Y5-L74 PolarHBondContact N-O 2.83Å; Y5-L74 PolarHBondContact O-N 2.88Å; Y5-I76 VanDerWaalsContact CB-CD1 3.4Å; Y5-I76 HydrophobicContact CD1-CD1 4.09Å; Y5-I76 HydrophobicContact CG-CD1 3.94Å
6	T	96.6	Very high	93.7	Very high	67 Å²	67	69.6 Å²	69.6	41%	0.411	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	130	179.4	-64.2	0	0	0	0	110.3	Q52 V71 F72 R73	T6-Q52 PolarHBondContact OG1-OE1 3.15Å; T6-V71 HydrophobicContact CG2-CG1 3.66Å; T6-F72 WeakPolarHBondContact CA-O 3.31Å; T6-R73 WeakPolarHBondContact OG1-CG 3.35Å
7	I	94.6	Very high	93.3	Very high	27 Å²	27	66.8 Å²	66.8	14%	0.138	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.1	173.8	-58.3	-172.2	0	0	0	108.8	Y5 Q9 F34 V71 F72 L74	Y5-I7 HydrophobicContact CD1-CD1 3.85Å; Y5-I7 HydrophobicContact CD1-CG1 3.49Å; Y5-I7 VanDerWaalsContact CD1-CG1 3.49Å; Y5-I7 HydrophobicContact CE1-CD1 3.95Å; Y5-I7 HydrophobicContact CE1-CG1 3.6Å; I7-Q9 HydrophobicContact CG2-CB 4.24Å; I7-F34 HydrophobicContact CD1-CD1 4.3Å; I7-F34 HydrophobicContact CD1-CE1 3.91Å; I7-F34 HydrophobicContact CG2-CZ 4.48Å; I7-V71 WeakPolarHBondContact O-CA 3.46Å; I7-F72 HydrophobicContact CB-CE2 4.23Å; I7-F72 HydrophobicContact CB-CZ 4.29Å; I7-F72 HydrophobicContact CG2-CZ 4.31Å; I7-F72 PolarHBondContact N-O 3.19Å; I7-F72 PolarHBondContact O-N 3.14Å; I7-L74 HydrophobicContact CD1-CD1 3.54Å; I7-L74 HydrophobicContact CD1-CG 4.44Å; I7-L74 HydrophobicContact CG1-CD1 4.37Å
8	S	95.9	Very high	92.7	Very high	87 Å²	87	67.2 Å²	67.2	61%	0.608	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	121.6	166.2	-177.9	0	0	0	0	108.2
9	Q	94.7	Very high	92.3	Very high	85 Å²	85	74.1 Å²	74.1	40%	0.397	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	148	-177.8	-174	68.7	-29.5	0	0	111.4	I7 I11 F34 V70 F72	I7-Q9 HydrophobicContact CG2-CB 4.24Å; Q9-I11 HydrophobicContact CB-CD1 4.35Å; Q9-I11 HydrophobicContact CG-CD1 3.98Å; Q9-F34 HydrophobicContact CG-CZ 4.32Å; Q9-V70 PolarHBondContact N-O 3.44Å; Q9-V70 PolarHBondContact O-N 3.14Å; Q9-F72 HydrophobicContact CB-CE1 3.94Å; Q9-F72 HydrophobicContact CB-CZ 4.23Å
10	V	95.6	Very high	92.2	Very high	68 Å²	68	74.7 Å²	74.7	41%	0.412	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	116.6	172.2	-170.2	0	0	0	0	109.5	Y67 T68 D69	V10-Y67 HydrophobicContact CG1-CD1 4.11Å; V10-T68 WeakPolarHBondContact CA-O 3.38Å; V10-D69 VanDerWaalsContact CG2-OD1 3.29Å; V10-D69 WeakPolarHBondContact CG2-OD1 3.48Å
11	I	95.1	Very high	92.2	Very high	0 Å²	0	75.6 Å²	75.6	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.7	-179	-54.8	-58.8	0	0	0	109.8	Q9 L26 E29 I30 T68 V70 F72	Q9-I11 HydrophobicContact CB-CD1 4.35Å; Q9-I11 HydrophobicContact CG-CD1 3.98Å; I11-L26 HydrophobicContact CB-CD2 3.99Å; I11-L26 HydrophobicContact CG2-CD2 3.86Å; I11-E29 HydrophobicContact CG2-CB 3.67Å; I11-E29 HydrophobicContact CG2-CG 4.44Å; I11-I30 HydrophobicContact CD1-CD1 4.48Å; I11-I30 HydrophobicContact CD1-CG1 3.66Å; I11-I30 HydrophobicContact CG1-CD1 4.23Å; I11-I30 HydrophobicContact CG1-CG1 3.84Å; I11-T68 PolarHBondContact N-O 3.22Å; I11-T68 PolarHBondContact O-N 3.48Å; I11-V70 HydrophobicContact CG1-CG2 4.31Å; I11-F72 HydrophobicContact CD1-CE1 4.34Å
12	R	93.7	Very high	92.3	Very high	87 Å²	87	75.5 Å²	75.5	33%	0.328	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	125	172.5	-179.1	-179.1	177.3	-98.5	7.2	109.9	E14 E63 C65 T66 Y67	R12-E14 IonicContact NH1-OE1 3.63Å; R12-E14 PolarHBondContact NH1-OE1 2.83Å; R12-E63 IonicContact CZ-OE2 3.84Å; R12-E63 IonicContact NE-OE2 2.96Å; R12-E63 IonicContact NH2-OE2 2.72Å; R12-E63 PolarHBondContact NH2-OE2 2.84Å; R12-C65 HydrophobicContact CG-CB 4.38Å; R12-C65 PolarHBondContact NH2-SG 2.65Å; R12-T66 CarbonylContact C-O 3.56Å; R12-T66 WeakPolarHBondContact CA-O 3.43Å; R12-Y67 HydrophobicContact CB-CD1 4.15Å; R12-Y67 HydrophobicContact CB-CE1 3.87Å; R12-Y67 HydrophobicContact CG-CD1 4.49Å; R12-Y67 HydrophobicContact CG-CE1 3.94Å
13	T	92.9	Very high	92.2	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.4	172.1	-54.8	0	0	0	0	110.3	K17 L18 C25 T66	T13-K17 HydrophobicContact CG2-CB 3.98Å; T13-L18 HydrophobicContact CG2-CD2 4.03Å; T13-C25 HydrophobicContact CG2-CB 4.06Å; T13-T66 WeakPolarHBondContact CB-OG1 3.03Å; T13-T66 PolarHBondContact N-O 2.87Å; T13-T66 PolarHBondContact O-N 2.87Å
14	E	92.7	Very high	92.2	Very high	51 Å²	51	72.9 Å²	72.9	24%	0.238	37%	0.368	C	S	.	.			trans	-79.6	149.4	-177	-66.4	167.4	149.3	0	0	112	R12 H16 K17	R12-E14 IonicContact NH1-OE1 3.63Å; R12-E14 PolarHBondContact NH1-OE1 2.83Å; E14-H16 VanDerWaalsContact C-N 3.27Å; E14-H16 VanDerWaalsContact CB-CE1 3.41Å; E14-H16 WeakPolarHBondContact CB-CE1 3.45Å; E14-H16 PolarHBondContact O-N 3.39Å; E14-H16 VanDerWaalsContact O-N 3.16Å; E14-H16 IonicContact OE2-CE1 2.7Å; E14-H16 PolarHBondContact OE2-CE1 3.13Å; E14-H16 IonicContact OE2-NE2 3.67Å; E14-H16 PolarHBondContact OE2-NE2 3.14Å; E14-K17 HydrophobicContact CB-CD 4.28Å; E14-K17 WeakPolarHBondContact O-CB 3.38Å; E14-K17 PolarHBondContact O-N 3.48Å; E14-K17 VanDerWaalsContact OE2-CE 3.29Å; E14-K17 WeakPolarHBondContact OE2-CE 3.32Å; E14-K17 IonicContact OE2-NZ 3.47Å; E14-K17 PolarHBondContact OE2-NZ 3.17Å
15	P	90.4	Very high	92	Very high	55 Å²	55	69.7 Å²	69.7	36%	0.357	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-57.4	-36.9	-173.5	-23.2	29.6	0	0	0	114.1	K17 L18 E63	P15-K17 PolarHBondContact O-N 3.1Å; P15-L18 WeakPolarHBondContact O-CB 3.49Å; P15-L18 PolarHBondContact O-N 3.39Å; P15-E63 WeakPolarHBondContact CG-O 3.28Å
16	H	89.9	Confident	91.9	Very high	127 Å²	127	64.8 Å²	64.8	59%	0.588	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-68.8	-20.6	-179.2	64.7	-89.8	0	0	0	112.9	E14	E14-H16 VanDerWaalsContact C-N 3.27Å; E14-H16 VanDerWaalsContact CB-CE1 3.41Å; E14-H16 WeakPolarHBondContact CB-CE1 3.45Å; E14-H16 PolarHBondContact O-N 3.39Å; E14-H16 VanDerWaalsContact O-N 3.16Å; E14-H16 IonicContact OE2-CE1 2.7Å; E14-H16 PolarHBondContact OE2-CE1 3.13Å; E14-H16 IonicContact OE2-NE2 3.67Å; E14-H16 PolarHBondContact OE2-NE2 3.14Å
17	K	87.7	Confident	91.8	Very high	22 Å²	22	66.4 Å²	66.4	10%	0.096	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-84.9	-18.5	176.8	-63.6	173.1	175.2	159.7	0	112.2	T13 E14 P15 K19 L20 C25 E29	T13-K17 HydrophobicContact CG2-CB 3.98Å; E14-K17 HydrophobicContact CB-CD 4.28Å; E14-K17 WeakPolarHBondContact O-CB 3.38Å; E14-K17 PolarHBondContact O-N 3.48Å; E14-K17 VanDerWaalsContact OE2-CE 3.29Å; E14-K17 WeakPolarHBondContact OE2-CE 3.32Å; E14-K17 IonicContact OE2-NZ 3.47Å; E14-K17 PolarHBondContact OE2-NZ 3.17Å; P15-K17 PolarHBondContact O-N 3.1Å; K17-K19 PolarHBondContact O-N 3.34Å; K17-L20 WeakPolarHBondContact O-CB 3.21Å; K17-L20 PolarHBondContact O-N 3.4Å; K17-C25 PolarHBondContact O-SG 3.2Å; K17-E29 IonicContact NZ-OE1 2.99Å; K17-E29 PolarHBondContact NZ-OE1 2.96Å
18	L	82.7	Confident	91.8	Very high	74 Å²	74	70.4 Å²	70.4	39%	0.387	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-11.9	-179.3	-60.1	176.2	0	0	0	114.5	T13 P15 L20 T66	T13-L18 HydrophobicContact CG2-CD2 4.03Å; P15-L18 WeakPolarHBondContact O-CB 3.49Å; P15-L18 PolarHBondContact O-N 3.39Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L18-T66 HydrophobicContact CD1-CG2 3.95Å; L18-T66 HydrophobicContact CD2-CG2 3.81Å
19	K	85.4	Confident	91.7	Very high	198 Å²	198	66.8 Å²	66.8	86%	0.861	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-19.5	172.9	-65.5	-176.1	179.1	-179.6	0	113.2	K17	K17-K19 PolarHBondContact O-N 3.34Å
20	L	88.7	Confident	91.7	Very high	85 Å²	85	62.8 Å²	62.8	45%	0.445	30%	0.299	S	S	.	.	S	Bend	trans	-85.7	173	177.6	-60.2	163.8	0	0	0	109.5	K17 L18 F22	K17-L20 WeakPolarHBondContact O-CB 3.21Å; K17-L20 PolarHBondContact O-N 3.4Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L20-F22 PolarHBondContact O-N 3.4Å
21	D	92	Very high	91.7	Very high	95 Å²	95	62.4 Å²	62.4	51%	0.508	29%	0.294	S	S	.	.			trans	-57.3	129.7	171.7	177.3	41.6	0	0	0	110.4	V23 E24 C25	D21-V23 VanDerWaalsContact C-N 3.32Å; D21-V23 PolarHBondContact O-N 3.3Å; D21-E24 HydrophobicContact CB-CB 3.92Å; D21-E24 PolarHBondContact O-N 3.37Å; D21-E24 PolarHBondContact OD2-N 2.92Å; D21-E24 VanDerWaalsContact OD2-N 3.16Å; D21-C25 PolarHBondContact O-N 2.84Å; D21-C25 PolarHBondContact O-SG 3.39Å
22	F	90.1	Very high	91.7	Very high	65 Å²	65	70.4 Å²	70.4	29%	0.285	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-41.4	-174.2	179.4	-104.7	0	0	0	111	L20 C25 L26 I54 S57 T68	L20-F22 PolarHBondContact O-N 3.4Å; F22-C25 WeakPolarHBondContact O-CB 3.3Å; F22-C25 PolarHBondContact O-N 2.89Å; F22-L26 HydrophobicContact CD1-CD1 4.08Å; F22-L26 HydrophobicContact CE1-CD1 3.51Å; F22-L26 HydrophobicContact CE1-CG 4.18Å; F22-L26 HydrophobicContact CZ-CD1 3.88Å; F22-L26 HydrophobicContact CZ-CD2 4.32Å; F22-L26 HydrophobicContact CZ-CG 4.19Å; F22-L26 WeakPolarHBondContact O-CG 3.29Å; F22-L26 PolarHBondContact O-N 2.75Å; F22-L26 VanDerWaalsContact O-N 3.09Å; F22-I54 HydrophobicContact CE1-CG2 4.14Å; F22-S57 WeakPolarHBondContact CZ-OG 3.43Å; F22-T68 HydrophobicContact CE1-CG2 4.38Å; F22-T68 HydrophobicContact CZ-CG2 3.93Å; F22-T68 WeakPolarHBondContact CZ-OG1 3.25Å
23	V	92.2	Very high	91.6	Very high	49 Å²	49	69.2 Å²	69.2	30%	0.297	32%	0.323	S	S	.	.	H	α-helix	trans	-67	-43.1	178.6	-179.6	0	0	0	0	110.3	D21 C25 L26 K27 F51 I54	D21-V23 VanDerWaalsContact C-N 3.32Å; D21-V23 PolarHBondContact O-N 3.3Å; V23-C25 VanDerWaalsContact C-N 3.3Å; V23-C25 PolarHBondContact O-N 3.36Å; V23-L26 PolarHBondContact O-N 2.86Å; V23-K27 WeakPolarHBondContact O-CG 3.26Å; V23-K27 PolarHBondContact O-N 2.88Å; V23-F51 HydrophobicContact CG1-CD2 4.31Å; V23-F51 HydrophobicContact CG1-CE2 3.83Å; V23-I54 HydrophobicContact CG2-CD1 4.41Å
24	E	92.8	Very high	91.6	Very high	117 Å²	117	70.7 Å²	70.7	55%	0.547	33%	0.329	S	S	.	.	H	α-helix	trans	-58.9	-40.2	174	-167.9	-177.5	174.2	0	0	112.7	D21 K27 R28	D21-E24 HydrophobicContact CB-CB 3.92Å; D21-E24 PolarHBondContact O-N 3.37Å; D21-E24 PolarHBondContact OD2-N 2.92Å; D21-E24 VanDerWaalsContact OD2-N 3.16Å; E24-K27 PolarHBondContact O-N 3.31Å; E24-R28 PolarHBondContact O-N 2.94Å
25	C	92.9	Very high	91.6	Very high	2 Å²	2	70 Å²	70	1%	0.014	33%	0.329	C	S	.	.	H	α-helix	trans	-61.6	-46.4	175.6	-71.5	0	0	0	0	112.2	T13 K17 D21 F22 V23 K27 R28 E29	T13-C25 HydrophobicContact CG2-CB 4.06Å; K17-C25 PolarHBondContact O-SG 3.2Å; D21-C25 PolarHBondContact O-N 2.84Å; D21-C25 PolarHBondContact O-SG 3.39Å; F22-C25 WeakPolarHBondContact O-CB 3.3Å; F22-C25 PolarHBondContact O-N 2.89Å; V23-C25 VanDerWaalsContact C-N 3.3Å; V23-C25 PolarHBondContact O-N 3.36Å; C25-K27 PolarHBondContact O-N 2.57Å; C25-R28 PolarHBondContact O-N 3.25Å; C25-E29 PolarHBondContact O-N 2.94Å
26	L	93.7	Very high	91.7	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-60.4	-45	176	-68.7	178.1	0	0	0	111.5	I11 F22 V23 R28 E29 I30 F51 I54 T68 V70	I11-L26 HydrophobicContact CB-CD2 3.99Å; I11-L26 HydrophobicContact CG2-CD2 3.86Å; F22-L26 HydrophobicContact CD1-CD1 4.08Å; F22-L26 HydrophobicContact CE1-CD1 3.51Å; F22-L26 HydrophobicContact CE1-CG 4.18Å; F22-L26 HydrophobicContact CZ-CD1 3.88Å; F22-L26 HydrophobicContact CZ-CD2 4.32Å; F22-L26 HydrophobicContact CZ-CG 4.19Å; F22-L26 WeakPolarHBondContact O-CG 3.29Å; F22-L26 PolarHBondContact O-N 2.75Å; F22-L26 VanDerWaalsContact O-N 3.09Å; V23-L26 PolarHBondContact O-N 2.86Å; L26-R28 VanDerWaalsContact C-N 3.29Å; L26-R28 PolarHBondContact O-N 2.96Å; L26-E29 PolarHBondContact O-N 3.44Å; L26-I30 WeakPolarHBondContact O-CB 3.15Å; L26-I30 VanDerWaalsContact O-CG1 3.29Å; L26-I30 WeakPolarHBondContact O-CG1 3.36Å; L26-I30 PolarHBondContact O-N 3.44Å; L26-F51 HydrophobicContact CB-CE1 4.19Å; L26-F51 HydrophobicContact CB-CZ 3.86Å; L26-I54 HydrophobicContact CD1-CD1 4.43Å; L26-I54 HydrophobicContact CD1-CG2 4.06Å; L26-T68 HydrophobicContact CD1-CG2 4.46Å; L26-V70 HydrophobicContact CD1-CG2 4.15Å; L26-V70 HydrophobicContact CD2-CG2 4.32Å
27	K	94.8	Very high	91.8	Very high	100 Å²	100	72.6 Å²	72.6	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-56.5	-45.6	176.4	-69.6	-178.2	176.3	175.7	0	111.4	V23 E24 C25 N31 L48 F51	V23-K27 WeakPolarHBondContact O-CG 3.26Å; V23-K27 PolarHBondContact O-N 2.88Å; E24-K27 PolarHBondContact O-N 3.31Å; C25-K27 PolarHBondContact O-N 2.57Å; K27-N31 WeakPolarHBondContact O-CB 3.47Å; K27-N31 VanDerWaalsContact O-CG 3.32Å; K27-N31 PolarHBondContact O-N 2.85Å; K27-N31 PolarHBondContact O-ND2 3.39Å; K27-L48 HydrophobicContact CB-CD2 4.08Å; K27-L48 HydrophobicContact CG-CD2 3.68Å; K27-F51 HydrophobicContact CD-CE2 4.29Å; K27-F51 HydrophobicContact CG-CE2 3.49Å; K27-F51 VanDerWaalsContact CG-CE2 3.49Å; K27-F51 HydrophobicContact CG-CZ 3.72Å
28	R	93.9	Very high	91.9	Very high	111 Å²	111	74.1 Å²	74.1	42%	0.419	35%	0.35	S	S	.	.	H	α-helix	trans	-65.9	-45	-179.3	-174.8	175.1	62.5	-165.9	-8.6	112.1	E24 C25 L26 N31 R32	E24-R28 PolarHBondContact O-N 2.94Å; C25-R28 PolarHBondContact O-N 3.25Å; L26-R28 VanDerWaalsContact C-N 3.29Å; L26-R28 PolarHBondContact O-N 2.96Å; R28-N31 PolarHBondContact O-N 3.25Å; R28-R32 VanDerWaalsContact O-CB 3.29Å; R28-R32 WeakPolarHBondContact O-CB 3.49Å; R28-R32 PolarHBondContact O-N 3.43Å
29	E	93.5	Very high	92.3	Very high	12 Å²	12	72.2 Å²	72.2	6%	0.056	34%	0.342	C	S	.	.	H	α-helix	trans	-67	-40.3	178.8	-68.2	-55.9	147.3	0	0	111.8	I11 K17 C25 L26 R32 Q33	I11-E29 HydrophobicContact CG2-CB 3.67Å; I11-E29 HydrophobicContact CG2-CG 4.44Å; K17-E29 IonicContact NZ-OE1 2.99Å; K17-E29 PolarHBondContact NZ-OE1 2.96Å; C25-E29 PolarHBondContact O-N 2.94Å; L26-E29 PolarHBondContact O-N 3.44Å; E29-R32 PolarHBondContact O-N 3.28Å; E29-R32 IonicContact OE2-NH1 2.76Å; E29-Q33 WeakPolarHBondContact O-CB 3.43Å; E29-Q33 VanDerWaalsContact O-CG 3.27Å; E29-Q33 WeakPolarHBondContact O-CG 3.41Å; E29-Q33 PolarHBondContact O-N 3.48Å
30	I	95.5	Very high	92.5	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-48.5	175	-68.2	164.3	0	0	0	110.8	I11 L26 R32 Q33 F34 L48 F51 F72 L74	I11-I30 HydrophobicContact CD1-CD1 4.48Å; I11-I30 HydrophobicContact CD1-CG1 3.66Å; I11-I30 HydrophobicContact CG1-CD1 4.23Å; I11-I30 HydrophobicContact CG1-CG1 3.84Å; L26-I30 WeakPolarHBondContact O-CB 3.15Å; L26-I30 VanDerWaalsContact O-CG1 3.29Å; L26-I30 WeakPolarHBondContact O-CG1 3.36Å; L26-I30 PolarHBondContact O-N 3.44Å; I30-R32 VanDerWaalsContact C-N 3.29Å; I30-R32 PolarHBondContact O-N 2.96Å; I30-Q33 PolarHBondContact O-N 2.96Å; I30-Q33 VanDerWaalsContact O-N 3.08Å; I30-F34 HydrophobicContact CG2-CD2 3.96Å; I30-F34 WeakPolarHBondContact O-CD2 3.46Å; I30-F34 PolarHBondContact O-N 3.17Å; I30-L48 HydrophobicContact CG2-CB 4.37Å; I30-L48 HydrophobicContact CG2-CD1 4.14Å; I30-F51 HydrophobicContact CD1-CD1 4.42Å; I30-F51 HydrophobicContact CD1-CE1 3.41Å; I30-F51 VanDerWaalsContact CD1-CE1 3.41Å; I30-F51 HydrophobicContact CD1-CZ 3.99Å; I30-F72 HydrophobicContact CD1-CD1 3.69Å; I30-F72 HydrophobicContact CD1-CD2 4.39Å; I30-F72 HydrophobicContact CD1-CE1 3.85Å; I30-F72 HydrophobicContact CD1-CG 3.97Å; I30-F72 HydrophobicContact CD1-CZ 4.3Å; I30-F72 HydrophobicContact CG1-CD1 4.38Å; I30-F72 HydrophobicContact CG1-CE1 4.04Å; I30-F72 HydrophobicContact CG1-CZ 4.15Å; I30-F72 HydrophobicContact CG2-CD2 3.9Å; I30-F72 HydrophobicContact CG2-CE1 4.47Å; I30-F72 HydrophobicContact CG2-CE2 3.52Å; I30-F72 HydrophobicContact CG2-CZ 3.85Å; I30-L74 HydrophobicContact CG2-CD2 4.13Å
31	N	95	Very high	92.6	Very high	60 Å²	60	68.6 Å²	68.6	32%	0.321	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-40.2	177.6	-77.2	-30.4	0	0	0	111.4	K27 R28 Q33 C35 L48	K27-N31 WeakPolarHBondContact O-CB 3.47Å; K27-N31 VanDerWaalsContact O-CG 3.32Å; K27-N31 PolarHBondContact O-N 2.85Å; K27-N31 PolarHBondContact O-ND2 3.39Å; R28-N31 PolarHBondContact O-N 3.25Å; N31-Q33 VanDerWaalsContact C-N 3.29Å; N31-Q33 PolarHBondContact O-N 2.79Å; N31-C35 HydrophobicContact CB-CB 4.43Å; N31-C35 WeakPolarHBondContact O-CA 3.47Å; N31-C35 WeakPolarHBondContact O-CB 3.21Å; N31-C35 PolarHBondContact O-N 3.13Å; N31-L48 WeakPolarHBondContact OD1-CB 3.4Å; N31-L48 PolarHBondContact OD1-N 2.79Å
32	R	94.2	Very high	92.6	Very high	169 Å²	169	65.2 Å²	65.2	64%	0.638	32%	0.315	S	S	*	.	H	α-helix	trans	-62.4	-36.8	174.6	-177.4	-176.4	177.9	-165	0.8	112.6	R28 E29 I30	R28-R32 VanDerWaalsContact O-CB 3.29Å; R28-R32 WeakPolarHBondContact O-CB 3.49Å; R28-R32 PolarHBondContact O-N 3.43Å; E29-R32 PolarHBondContact O-N 3.28Å; E29-R32 IonicContact OE2-NH1 2.76Å; I30-R32 VanDerWaalsContact C-N 3.29Å; I30-R32 PolarHBondContact O-N 2.96Å
33	Q	92.4	Very high	92.7	Very high	62 Å²	62	62.1 Å²	62.1	29%	0.29	30%	0.301	S	S	.	.	H	α-helix	trans	-78.8	-37.1	-177.7	-74.8	178.9	18.4	0	0	113.2	E29 I30 N31 K37	E29-Q33 WeakPolarHBondContact O-CB 3.43Å; E29-Q33 VanDerWaalsContact O-CG 3.27Å; E29-Q33 WeakPolarHBondContact O-CG 3.41Å; E29-Q33 PolarHBondContact O-N 3.48Å; I30-Q33 PolarHBondContact O-N 2.96Å; I30-Q33 VanDerWaalsContact O-N 3.08Å; N31-Q33 VanDerWaalsContact C-N 3.29Å; N31-Q33 PolarHBondContact O-N 2.79Å; Q33-K37 WeakPolarHBondContact O-CD 3.46Å; Q33-K37 WeakPolarHBondContact O-CE 3.41Å; Q33-K37 PolarHBondContact O-NZ 3.32Å
34	F	93.3	Very high	92.8	Very high	31 Å²	31	60.3 Å²	60.3	14%	0.136	29%	0.29	C	S	.	.	H	α-helix	trans	-113.9	-33.1	-170.1	-67.4	-86	0	0	0	114.6	I7 Q9 I30 K37 C45 F72 L74	I7-F34 HydrophobicContact CD1-CD1 4.3Å; I7-F34 HydrophobicContact CD1-CE1 3.91Å; I7-F34 HydrophobicContact CG2-CZ 4.48Å; Q9-F34 HydrophobicContact CG-CZ 4.32Å; I30-F34 HydrophobicContact CG2-CD2 3.96Å; I30-F34 WeakPolarHBondContact O-CD2 3.46Å; I30-F34 PolarHBondContact O-N 3.17Å; F34-K37 WeakPolarHBondContact O-CB 3.22Å; F34-K37 PolarHBondContact O-N 2.82Å; F34-C45 WeakPolarHBondContact O-CB 3.26Å; F34-F72 HydrophobicContact CD2-CE2 4.27Å; F34-F72 HydrophobicContact CD2-CZ 4.1Å; F34-F72 HydrophobicContact CE2-CE2 4.2Å; F34-F72 AromaticContact CE2-CZ 3.61Å; F34-F72 HydrophobicContact CE2-CZ 3.61Å; F34-F72 HydrophobicContact CZ-CZ 4.08Å; F34-L74 HydrophobicContact CB-CD1 3.87Å; F34-L74 HydrophobicContact CB-CD2 4.26Å; F34-L74 HydrophobicContact CD1-CD1 3.72Å; F34-L74 HydrophobicContact CE1-CD1 4.43Å; F34-L74 HydrophobicContact CG-CD1 3.82Å
35	C	92.7	Very high	92.9	Very high	35 Å²	35	54.8 Å²	54.8	24%	0.236	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	141.5	-174	-170.7	0	0	0	0	111.9	N31 K37 V46	N31-C35 HydrophobicContact CB-CB 4.43Å; N31-C35 WeakPolarHBondContact O-CA 3.47Å; N31-C35 WeakPolarHBondContact O-CB 3.21Å; N31-C35 PolarHBondContact O-N 3.13Å; C35-K37 PolarHBondContact O-N 2.83Å; C35-K37 VanDerWaalsContact O-N 3.16Å; C35-V46 PolarHBondContact SG-O 2.79Å
36	N	91.7	Very high	92.9	Very high	129 Å²	129	57.1 Å²	57.1	69%	0.69	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	17.5	-176.7	-57.9	-29.3	0	0	0	114.4	C45	N36-C45 PolarHBondContact N-O 3.13Å
37	K	91.6	Very high	92.9	Very high	109 Å²	109	57.6 Å²	57.6	47%	0.474	28%	0.284	S	S	.	.			trans	-107.9	147.5	174.3	-56.8	-169.2	-167.5	168.3	0	111	Q33 F34 C35 C45	Q33-K37 WeakPolarHBondContact O-CD 3.46Å; Q33-K37 WeakPolarHBondContact O-CE 3.41Å; Q33-K37 PolarHBondContact O-NZ 3.32Å; F34-K37 WeakPolarHBondContact O-CB 3.22Å; F34-K37 PolarHBondContact O-N 2.82Å; C35-K37 PolarHBondContact O-N 2.83Å; C35-K37 VanDerWaalsContact O-N 3.16Å; K37-C45 PolarHBondContact O-N 2.87Å
38	V	91.2	Very high	92.9	Very high	53 Å²	53	54.4 Å²	54.4	32%	0.321	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	125.3	171	179.4	0	0	0	0	108.1	V44 F157 F185	V38-V44 HydrophobicContact CG2-CG2 4.21Å; V38-F157 HydrophobicContact CG1-CD1 4.11Å; V38-F157 HydrophobicContact CG1-CE1 4.28Å; V38-F185 HydrophobicContact CG1-CB 3.76Å; V38-F185 HydrophobicContact CG2-CB 3.87Å
39	V	90.7	Very high	93	Very high	35 Å²	35	55.5 Å²	55.5	21%	0.212	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	119.5	164.9	-178.6	0	0	0	0	106.6	D41 V42 G43	V39-D41 PolarHBondContact O-N 3.06Å; V39-V42 HydrophobicContact CB-CB 3.99Å; V39-V42 HydrophobicContact CG1-CB 3.79Å; V39-V42 HydrophobicContact CG1-CG2 3.77Å; V39-V42 PolarHBondContact O-N 2.83Å; V39-G43 PolarHBondContact N-O 3.1Å; V39-G43 PolarHBondContact O-N 3.04Å
40	L	89.9	Confident	93.1	Very high	77 Å²	77	57.4 Å²	57.4	40%	0.403	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	136.3	-178	-66.9	173.4	0	0	0	111.2	V42 D159	L40-V42 WeakPolarHBondContact O-CG2 3.41Å; L40-V42 PolarHBondContact O-N 2.93Å; L40-D159 HydrophobicContact CD1-CB 4.26Å; L40-D159 HydrophobicContact CD2-CB 4.38Å
41	D	89.7	Confident	93.2	Very high	129 Å²	129	59.3 Å²	59.3	69%	0.69	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	-3.5	-175.9	-61.3	-36.8	0	0	0	116.7	V39	V39-D41 PolarHBondContact O-N 3.06Å
42	V	92.2	Very high	93.2	Very high	24 Å²	24	61.4 Å²	61.4	15%	0.145	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-45.6	-176.3	-174.3	0	0	0	0	111.9	Y5 V39 L40 I76 R78	Y5-V42 HydrophobicContact CD1-CG1 3.99Å; Y5-V42 HydrophobicContact CD2-CG1 3.71Å; Y5-V42 HydrophobicContact CE1-CG1 4.28Å; Y5-V42 HydrophobicContact CE1-CG2 4.17Å; Y5-V42 HydrophobicContact CE2-CG1 4.02Å; Y5-V42 HydrophobicContact CE2-CG2 3.98Å; Y5-V42 HydrophobicContact CG-CG1 3.71Å; V39-V42 HydrophobicContact CB-CB 3.99Å; V39-V42 HydrophobicContact CG1-CB 3.79Å; V39-V42 HydrophobicContact CG1-CG2 3.77Å; V39-V42 PolarHBondContact O-N 2.83Å; L40-V42 WeakPolarHBondContact O-CG2 3.41Å; L40-V42 PolarHBondContact O-N 2.93Å; V42-I76 HydrophobicContact CB-CD1 4.44Å; V42-I76 HydrophobicContact CG1-CD1 3.31Å; V42-I76 HydrophobicContact CG1-CG2 4.26Å; V42-R78 WeakPolarHBondContact O-CB 3.15Å; V42-R78 WeakPolarHBondContact O-CD 3.11Å; V42-R78 WeakPolarHBondContact O-CG 3.47Å
43	G	93.1	Very high	93.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	132.5	-165.6	179.1	0	0	0	0	0	114.2	V39	V39-G43 PolarHBondContact N-O 3.1Å; V39-G43 PolarHBondContact O-N 3.04Å
44	V	93.5	Very high	93.5	Very high	11 Å²	11	59.5 Å²	59.5	7%	0.067	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	123.1	179.6	-177	0	0	0	0	110	V38 V46 I76 F77 F104 F185	V38-V44 HydrophobicContact CG2-CG2 4.21Å; V44-V46 PolarHBondContact O-N 2.77Å; V44-I76 CarbonylContact O-C 3.59Å; V44-I76 WeakPolarHBondContact O-CA 3.37Å; V44-I76 WeakPolarHBondContact O-CG2 3.36Å; V44-F77 HydrophobicContact CB-CB 4.32Å; V44-F77 PolarHBondContact N-O 3.21Å; V44-F77 VanDerWaalsContact N-O 3.11Å; V44-F77 PolarHBondContact O-N 3.33Å; V44-F104 HydrophobicContact CG2-CD2 3.83Å; V44-F104 HydrophobicContact CG2-CE2 4.1Å; V44-F185 HydrophobicContact CG2-CD1 3.61Å; V44-F185 HydrophobicContact CG2-CE1 4.04Å
45	C	94.3	Very high	93.5	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.007	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	122	175.7	178.4	0	0	0	0	111	F34 N36 K37	F34-C45 WeakPolarHBondContact O-CB 3.26Å; N36-C45 PolarHBondContact N-O 3.13Å; K37-C45 PolarHBondContact O-N 2.87Å
46	V	93.6	Very high	93.4	Very high	52 Å²	52	63.1 Å²	63.1	32%	0.315	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-31.2	176.1	-176.4	0	0	0	0	110.9	F2 C35 V44 L75 F77	F2-V46 HydrophobicContact CD1-CG2 4.18Å; F2-V46 HydrophobicContact CE1-CG2 3.84Å; C35-V46 PolarHBondContact SG-O 2.79Å; V44-V46 PolarHBondContact O-N 2.77Å; V46-L75 HydrophobicContact CB-CD2 4.33Å; V46-L75 HydrophobicContact CB-CG 4.36Å; V46-L75 HydrophobicContact CG1-CD2 4.35Å; V46-L75 PolarHBondContact N-O 2.67Å; V46-F77 HydrophobicContact CG2-CB 4.12Å
47	G	93.4	Very high	93.5	Very high	10 Å²	10	59 Å²	59	10%	0.103	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162	178.6	177	0	0	0	0	0	113.5	Y49 L75	G47-Y49 PolarHBondContact O-N 2.91Å; G47-L75 PolarHBondContact O-N 3.25Å
48	L	95.9	Very high	93.6	Very high	33 Å²	33	61.5 Å²	61.5	17%	0.173	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	126.7	172.7	177	68.5	0	0	0	110.9	K27 I30 N31 F51 F72 L74	K27-L48 HydrophobicContact CB-CD2 4.08Å; K27-L48 HydrophobicContact CG-CD2 3.68Å; I30-L48 HydrophobicContact CG2-CB 4.37Å; I30-L48 HydrophobicContact CG2-CD1 4.14Å; N31-L48 WeakPolarHBondContact OD1-CB 3.4Å; N31-L48 PolarHBondContact OD1-N 2.79Å; L48-F51 HydrophobicContact CD2-CE1 4.27Å; L48-F51 HydrophobicContact CD2-CE2 3.92Å; L48-F51 HydrophobicContact CD2-CZ 3.73Å; L48-F72 HydrophobicContact CD1-CB 3.77Å; L48-F72 HydrophobicContact CD1-CD2 3.77Å; L48-F72 HydrophobicContact CD1-CG 4.04Å; L48-L74 HydrophobicContact CD1-CD2 4.5Å
49	Y	96	Very high	93.6	Very high	133 Å²	133	64.7 Å²	64.7	52%	0.522	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-62.4	173.2	-176.6	-102.5	0	0	0	110.3	V4 G47 R73	V4-Y49 HydrophobicContact CG1-CD1 4.27Å; G47-Y49 PolarHBondContact O-N 2.91Å; Y49-R73 WeakPolarHBondContact CA-O 3.45Å; Y49-R73 VanDerWaalsContact CB-O 3.3Å; Y49-R73 WeakPolarHBondContact CB-O 3.25Å; Y49-R73 HydrophobicContact CD1-CB 4.31Å; Y49-R73 PolarHBondContact N-O 3Å
50	D	96	Very high	93.7	Very high	52 Å²	52	64.1 Å²	64.1	28%	0.278	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	173.6	175.4	73.2	-16.4	0	0	0	113.2	F72 R73	D50-F72 WeakPolarHBondContact O-CA 3.49Å; D50-F72 WeakPolarHBondContact O-CB 3.41Å; D50-R73 VanDerWaalsContact CG-NH2 3.27Å; D50-R73 PolarHBondContact N-O 3.48Å; D50-R73 PolarHBondContact O-N 3.09Å; D50-R73 WeakPolarHBondContact OD1-CB 3.34Å; D50-R73 IonicContact OD1-CZ 2.68Å; D50-R73 IonicContact OD1-NE 3.21Å; D50-R73 PolarHBondContact OD1-NE 2.89Å; D50-R73 IonicContact OD1-NH2 3.33Å; D50-R73 PolarHBondContact OD1-NH2 2.81Å; D50-R73 IonicContact OD2-CZ 2.67Å; D50-R73 IonicContact OD2-NE 2.63Å; D50-R73 IonicContact OD2-NH2 3.54Å; D50-R73 PolarHBondContact OD2-NH2 2.97Å
51	F	96.6	Very high	93.7	Very high	41 Å²	41	69.9 Å²	69.9	18%	0.18	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.2	171.3	-64	-76.4	0	0	0	109.9	V23 L26 K27 I30 L48 I54 V70 F72	V23-F51 HydrophobicContact CG1-CD2 4.31Å; V23-F51 HydrophobicContact CG1-CE2 3.83Å; L26-F51 HydrophobicContact CB-CE1 4.19Å; L26-F51 HydrophobicContact CB-CZ 3.86Å; K27-F51 HydrophobicContact CD-CE2 4.29Å; K27-F51 HydrophobicContact CG-CE2 3.49Å; K27-F51 VanDerWaalsContact CG-CE2 3.49Å; K27-F51 HydrophobicContact CG-CZ 3.72Å; I30-F51 HydrophobicContact CD1-CD1 4.42Å; I30-F51 HydrophobicContact CD1-CE1 3.41Å; I30-F51 VanDerWaalsContact CD1-CE1 3.41Å; I30-F51 HydrophobicContact CD1-CZ 3.99Å; L48-F51 HydrophobicContact CD2-CE1 4.27Å; L48-F51 HydrophobicContact CD2-CE2 3.92Å; L48-F51 HydrophobicContact CD2-CZ 3.73Å; F51-I54 HydrophobicContact CB-CD1 4.29Å; F51-I54 HydrophobicContact CB-CG1 4.16Å; F51-I54 HydrophobicContact CD1-CD1 4.37Å; F51-I54 HydrophobicContact CD1-CG1 4.17Å; F51-I54 HydrophobicContact CD2-CD1 4.3Å; F51-I54 HydrophobicContact CG-CD1 4.09Å; F51-I54 HydrophobicContact CG-CG1 4.18Å; F51-V70 HydrophobicContact CD1-CG1 3.44Å; F51-V70 VanDerWaalsContact CD1-CG1 3.44Å; F51-V70 HydrophobicContact CE1-CG1 3.71Å; F51-F72 HydrophobicContact CD1-CB 3.95Å; F51-F72 HydrophobicContact CE1-CB 4.45Å
52	Q	96	Very high	93.7	Very high	103 Å²	103	70.5 Å²	70.5	48%	0.481	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-43.5	169.5	-65	-168.9	-62.9	0	0	110.9	T6 V71 R73	T6-Q52 PolarHBondContact OG1-OE1 3.15Å; Q52-V71 HydrophobicContact CB-CB 4.48Å; Q52-V71 HydrophobicContact CB-CG1 4.23Å; Q52-V71 PolarHBondContact N-O 2.8Å; Q52-R73 HydrophobicContact CG-CG 3.88Å
53	E	95.8	Very high	93.5	Very high	122 Å²	122	74.6 Å²	74.6	57%	0.57	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146	133.3	-179.6	-169.6	178.4	168.3	0	0	110.3	V70 V71	E53-V70 WeakPolarHBondContact O-CG1 3.44Å; E53-V71 HydrophobicContact CB-CB 4.08Å; E53-V71 HydrophobicContact CB-CG2 4.31Å; E53-V71 PolarHBondContact N-O 2.9Å; E53-V71 PolarHBondContact O-N 2.78Å
54	I	95.2	Very high	93.4	Very high	69 Å²	69	76 Å²	76	35%	0.354	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	108.8	170.7	-59.9	174.8	0	0	0	106.6	F22 V23 L26 F51 T68 V70	F22-I54 HydrophobicContact CE1-CG2 4.14Å; V23-I54 HydrophobicContact CG2-CD1 4.41Å; L26-I54 HydrophobicContact CD1-CD1 4.43Å; L26-I54 HydrophobicContact CD1-CG2 4.06Å; F51-I54 HydrophobicContact CB-CD1 4.29Å; F51-I54 HydrophobicContact CB-CG1 4.16Å; F51-I54 HydrophobicContact CD1-CD1 4.37Å; F51-I54 HydrophobicContact CD1-CG1 4.17Å; F51-I54 HydrophobicContact CD2-CD1 4.3Å; F51-I54 HydrophobicContact CG-CD1 4.09Å; F51-I54 HydrophobicContact CG-CG1 4.18Å; I54-T68 HydrophobicContact CG2-CG2 4.2Å; I54-V70 HydrophobicContact CG1-CG1 4.38Å
55	G	93.6	Very high	93.3	Very high	24 Å²	24	75.6 Å²	75.6	25%	0.247	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-173.6	-179.5	0	0	0	0	0	113.4	D69	G55-D69 VanDerWaalsContact CA-O 3.31Å; G55-D69 WeakPolarHBondContact CA-O 3.25Å; G55-D69 PolarHBondContact N-O 2.73Å
56	T	92.1	Very high	93.2	Very high	118 Å²	118	76 Å²	76	72%	0.724	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	136	178.1	-58.2	0	0	0	0	110.8
57	S	92	Very high	93.3	Very high	42 Å²	42	77.8 Å²	77.8	29%	0.294	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	131.3	176.9	-59.5	0	0	0	0	111.3	F22 Y67 T68	F22-S57 WeakPolarHBondContact CZ-OG 3.43Å; S57-Y67 WeakPolarHBondContact CA-O 3.38Å; S57-T68 WeakPolarHBondContact CB-OG1 3.43Å; S57-T68 WeakPolarHBondContact OG-CG2 3.48Å; S57-T68 PolarHBondContact OG-OG1 3.01Å
58	R	93.9	Very high	93.4	Very high	163 Å²	163	77.3 Å²	77.3	62%	0.615	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.8	176.2	-58.1	176.4	-166.2	156.6	14.4	109.4	T66 Y67 D69	R58-T66 CarbonylContact O-C 3.55Å; R58-T66 WeakPolarHBondContact O-CA 3.48Å; R58-Y67 PolarHBondContact N-O 3.19Å; R58-Y67 PolarHBondContact O-N 2.88Å; R58-D69 IonicContact CZ-OD2 3.46Å; R58-D69 IonicContact NH2-OD2 2.84Å; R58-D69 PolarHBondContact NH2-OD2 2.82Å
59	I	92.9	Very high	93.4	Very high	119 Å²	119	78.3 Å²	78.3	61%	0.61	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	127.9	179.1	-54.7	175.4	0	0	0	108.9	C65 T66	I59-C65 WeakPolarHBondContact CA-O 3.31Å; I59-T66 HydrophobicContact CG1-CG2 4.22Å
60	A	91.9	Very high	93.4	Very high	24 Å²	24	72 Å²	72	20%	0.198	38%	0.375	C	S	.	.			trans	-75.3	128.4	172.6	0	0	0	0	0	111.1	T62 G64 C65 Y67	A60-T62 VanDerWaalsContact C-N 3.34Å; A60-T62 PolarHBondContact O-N 3.15Å; A60-G64 WeakPolarHBondContact O-CA 3.32Å; A60-G64 PolarHBondContact O-N 2.81Å; A60-C65 PolarHBondContact N-O 3.41Å; A60-Y67 HydrophobicContact CB-CD2 4.22Å; A60-Y67 HydrophobicContact CB-CE2 3.77Å
61	H	89.3	Confident	93.5	Very high	197 Å²	197	71.2 Å²	71.2	91%	0.912	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-38.3	-174.4	-62.3	83.7	0	0	0	113.7
62	T	90.4	Very high	93.5	Very high	143 Å²	143	69.3 Å²	69.3	88%	0.877	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-42.2	-173.3	-47.5	0	0	0	0	113.2	A60	A60-T62 VanDerWaalsContact C-N 3.34Å; A60-T62 PolarHBondContact O-N 3.15Å
63	E	88.6	Confident	93.6	Very high	109 Å²	109	67.7 Å²	67.7	51%	0.509	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-17.1	-172.3	-60.9	-179.1	-175.9	0	0	113.5	R12 P15 C65	R12-E63 IonicContact CZ-OE2 3.84Å; R12-E63 IonicContact NE-OE2 2.96Å; R12-E63 IonicContact NH2-OE2 2.72Å; R12-E63 PolarHBondContact NH2-OE2 2.84Å; P15-E63 WeakPolarHBondContact CG-O 3.28Å; E63-C65 HydrophobicContact CB-CB 4.34Å; E63-C65 PolarHBondContact O-N 2.88Å; E63-C65 PolarHBondContact OE2-SG 2.91Å
64	G	90	Very high	93.6	Very high	30 Å²	30	61.9 Å²	61.9	31%	0.309	33%	0.326	S	S	.	.			trans	69.7	3.2	-170.8	0	0	0	0	0	114.6	A60	A60-G64 WeakPolarHBondContact O-CA 3.32Å; A60-G64 PolarHBondContact O-N 2.81Å
65	C	92.2	Very high	93.6	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.02	32%	0.323	C	S	.	.			trans	-65.7	151.5	175.6	-60.3	0	0	0	0	111.2	R12 I59 A60 E63 Y67	R12-C65 HydrophobicContact CG-CB 4.38Å; R12-C65 PolarHBondContact NH2-SG 2.65Å; I59-C65 WeakPolarHBondContact CA-O 3.31Å; A60-C65 PolarHBondContact N-O 3.41Å; E63-C65 HydrophobicContact CB-CB 4.34Å; E63-C65 PolarHBondContact O-N 2.88Å; E63-C65 PolarHBondContact OE2-SG 2.91Å; C65-Y67 HydrophobicContact CB-CE2 4.46Å
66	T	92.9	Very high	93.7	Very high	9 Å²	9	60.1 Å²	60.1	6%	0.055	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.7	172.9	65.3	0	0	0	0	110.8	R12 T13 L18 R58 I59	R12-T66 CarbonylContact C-O 3.56Å; R12-T66 WeakPolarHBondContact CA-O 3.43Å; T13-T66 WeakPolarHBondContact CB-OG1 3.03Å; T13-T66 PolarHBondContact N-O 2.87Å; T13-T66 PolarHBondContact O-N 2.87Å; L18-T66 HydrophobicContact CD1-CG2 3.95Å; L18-T66 HydrophobicContact CD2-CG2 3.81Å; R58-T66 CarbonylContact O-C 3.55Å; R58-T66 WeakPolarHBondContact O-CA 3.48Å; I59-T66 HydrophobicContact CG1-CG2 4.22Å
67	Y	94.9	Very high	93.9	Very high	90 Å²	90	54.5 Å²	54.5	35%	0.353	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.2	169.7	-68.7	-88.5	0	0	0	108	V10 R12 S57 R58 A60 C65	V10-Y67 HydrophobicContact CG1-CD1 4.11Å; R12-Y67 HydrophobicContact CB-CD1 4.15Å; R12-Y67 HydrophobicContact CB-CE1 3.87Å; R12-Y67 HydrophobicContact CG-CD1 4.49Å; R12-Y67 HydrophobicContact CG-CE1 3.94Å; S57-Y67 WeakPolarHBondContact CA-O 3.38Å; R58-Y67 PolarHBondContact N-O 3.19Å; R58-Y67 PolarHBondContact O-N 2.88Å; A60-Y67 HydrophobicContact CB-CD2 4.22Å; A60-Y67 HydrophobicContact CB-CE2 3.77Å; C65-Y67 HydrophobicContact CB-CE2 4.46Å
68	T	95.2	Very high	94	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.3	-176.2	-49.4	0	0	0	0	109.2	V10 I11 F22 L26 I54 S57 V70	V10-T68 WeakPolarHBondContact CA-O 3.38Å; I11-T68 PolarHBondContact N-O 3.22Å; I11-T68 PolarHBondContact O-N 3.48Å; F22-T68 HydrophobicContact CE1-CG2 4.38Å; F22-T68 HydrophobicContact CZ-CG2 3.93Å; F22-T68 WeakPolarHBondContact CZ-OG1 3.25Å; L26-T68 HydrophobicContact CD1-CG2 4.46Å; I54-T68 HydrophobicContact CG2-CG2 4.2Å; S57-T68 WeakPolarHBondContact CB-OG1 3.43Å; S57-T68 WeakPolarHBondContact OG-CG2 3.48Å; S57-T68 PolarHBondContact OG-OG1 3.01Å; T68-V70 HydrophobicContact CG2-CG2 3.78Å; T68-V70 PolarHBondContact O-N 3.28Å
69	D	96	Very high	94	Very high	54 Å²	54	47.6 Å²	47.6	29%	0.289	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	120.5	172.6	-58.6	-36.9	0	0	0	108.2	V10 G55 R58	V10-D69 VanDerWaalsContact CG2-OD1 3.29Å; V10-D69 WeakPolarHBondContact CG2-OD1 3.48Å; G55-D69 VanDerWaalsContact CA-O 3.31Å; G55-D69 WeakPolarHBondContact CA-O 3.25Å; G55-D69 PolarHBondContact N-O 2.73Å; R58-D69 IonicContact CZ-OD2 3.46Å; R58-D69 IonicContact NH2-OD2 2.84Å; R58-D69 PolarHBondContact NH2-OD2 2.82Å
70	V	96.5	Very high	94	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133	-177.3	-171.1	0	0	0	0	110.3	Q9 I11 L26 F51 E53 I54 T68 F72	Q9-V70 PolarHBondContact N-O 3.44Å; Q9-V70 PolarHBondContact O-N 3.14Å; I11-V70 HydrophobicContact CG1-CG2 4.31Å; L26-V70 HydrophobicContact CD1-CG2 4.15Å; L26-V70 HydrophobicContact CD2-CG2 4.32Å; F51-V70 HydrophobicContact CD1-CG1 3.44Å; F51-V70 VanDerWaalsContact CD1-CG1 3.44Å; F51-V70 HydrophobicContact CE1-CG1 3.71Å; E53-V70 WeakPolarHBondContact O-CG1 3.44Å; I54-V70 HydrophobicContact CG1-CG1 4.38Å; T68-V70 HydrophobicContact CG2-CG2 3.78Å; T68-V70 PolarHBondContact O-N 3.28Å; V70-F72 HydrophobicContact CB-CD1 4.16Å; V70-F72 HydrophobicContact CG1-CB 4.36Å; V70-F72 HydrophobicContact CG1-CD1 3.85Å
71	V	97.4	Very high	94.2	Very high	35 Å²	35	50.5 Å²	50.5	21%	0.212	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.6	167.6	-173.3	0	0	0	0	108	T6 I7 Q52 E53	T6-V71 HydrophobicContact CG2-CG1 3.66Å; I7-V71 WeakPolarHBondContact O-CA 3.46Å; Q52-V71 HydrophobicContact CB-CB 4.48Å; Q52-V71 HydrophobicContact CB-CG1 4.23Å; Q52-V71 PolarHBondContact N-O 2.8Å; E53-V71 HydrophobicContact CB-CB 4.08Å; E53-V71 HydrophobicContact CB-CG2 4.31Å; E53-V71 PolarHBondContact N-O 2.9Å; E53-V71 PolarHBondContact O-N 2.78Å
72	F	96.6	Very high	94.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	161	-175.6	59	-91.6	0	0	0	111.6	T6 I7 Q9 I11 I30 F34 L48 D50 F51 V70 L74	T6-F72 WeakPolarHBondContact CA-O 3.31Å; I7-F72 HydrophobicContact CB-CE2 4.23Å; I7-F72 HydrophobicContact CB-CZ 4.29Å; I7-F72 HydrophobicContact CG2-CZ 4.31Å; I7-F72 PolarHBondContact N-O 3.19Å; I7-F72 PolarHBondContact O-N 3.14Å; Q9-F72 HydrophobicContact CB-CE1 3.94Å; Q9-F72 HydrophobicContact CB-CZ 4.23Å; I11-F72 HydrophobicContact CD1-CE1 4.34Å; I30-F72 HydrophobicContact CD1-CD1 3.69Å; I30-F72 HydrophobicContact CD1-CD2 4.39Å; I30-F72 HydrophobicContact CD1-CE1 3.85Å; I30-F72 HydrophobicContact CD1-CG 3.97Å; I30-F72 HydrophobicContact CD1-CZ 4.3Å; I30-F72 HydrophobicContact CG1-CD1 4.38Å; I30-F72 HydrophobicContact CG1-CE1 4.04Å; I30-F72 HydrophobicContact CG1-CZ 4.15Å; I30-F72 HydrophobicContact CG2-CD2 3.9Å; I30-F72 HydrophobicContact CG2-CE1 4.47Å; I30-F72 HydrophobicContact CG2-CE2 3.52Å; I30-F72 HydrophobicContact CG2-CZ 3.85Å; F34-F72 HydrophobicContact CD2-CE2 4.27Å; F34-F72 HydrophobicContact CD2-CZ 4.1Å; F34-F72 HydrophobicContact CE2-CE2 4.2Å; F34-F72 AromaticContact CE2-CZ 3.61Å; F34-F72 HydrophobicContact CE2-CZ 3.61Å; F34-F72 HydrophobicContact CZ-CZ 4.08Å; L48-F72 HydrophobicContact CD1-CB 3.77Å; L48-F72 HydrophobicContact CD1-CD2 3.77Å; L48-F72 HydrophobicContact CD1-CG 4.04Å; D50-F72 WeakPolarHBondContact O-CA 3.49Å; D50-F72 WeakPolarHBondContact O-CB 3.41Å; F51-F72 HydrophobicContact CD1-CB 3.95Å; F51-F72 HydrophobicContact CE1-CB 4.45Å; V70-F72 HydrophobicContact CB-CD1 4.16Å; V70-F72 HydrophobicContact CG1-CB 4.36Å; V70-F72 HydrophobicContact CG1-CD1 3.85Å; F72-L74 HydrophobicContact CD2-CD2 3.83Å; F72-L74 HydrophobicContact CD2-CG 4.04Å; F72-L74 HydrophobicContact CE2-CD1 4.18Å; F72-L74 HydrophobicContact CE2-CD2 3.65Å; F72-L74 HydrophobicContact CE2-CG 3.8Å
73	R	97.2	Very high	94.7	Very high	70 Å²	70	37.1 Å²	37.1	26%	0.264	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	132.1	177.6	-66.5	-173.7	-64.6	177.6	-3.5	110.4	V4 Y5 T6 Y49 D50 Q52	V4-R73 HydrophobicContact CG1-CB 3.56Å; V4-R73 HydrophobicContact CG1-CG 3.97Å; Y5-R73 CarbonylContact O-C 3.53Å; Y5-R73 VanDerWaalsContact O-CA 3.3Å; Y5-R73 WeakPolarHBondContact O-CA 3.37Å; T6-R73 WeakPolarHBondContact OG1-CG 3.35Å; Y49-R73 WeakPolarHBondContact CA-O 3.45Å; Y49-R73 VanDerWaalsContact CB-O 3.3Å; Y49-R73 WeakPolarHBondContact CB-O 3.25Å; Y49-R73 HydrophobicContact CD1-CB 4.31Å; Y49-R73 PolarHBondContact N-O 3Å; D50-R73 VanDerWaalsContact CG-NH2 3.27Å; D50-R73 PolarHBondContact N-O 3.48Å; D50-R73 PolarHBondContact O-N 3.09Å; D50-R73 WeakPolarHBondContact OD1-CB 3.34Å; D50-R73 IonicContact OD1-CZ 2.68Å; D50-R73 IonicContact OD1-NE 3.21Å; D50-R73 PolarHBondContact OD1-NE 2.89Å; D50-R73 IonicContact OD1-NH2 3.33Å; D50-R73 PolarHBondContact OD1-NH2 2.81Å; D50-R73 IonicContact OD2-CZ 2.67Å; D50-R73 IonicContact OD2-NE 2.63Å; D50-R73 IonicContact OD2-NH2 3.54Å; D50-R73 PolarHBondContact OD2-NH2 2.97Å; Q52-R73 HydrophobicContact CG-CG 3.88Å
74	L	96.4	Very high	95	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	142.6	173	-64.7	180	0	0	0	110.2	V4 Y5 I7 I30 F34 L48 F72 I76	V4-L74 WeakPolarHBondContact CA-O 3.34Å; Y5-L74 PolarHBondContact N-O 2.83Å; Y5-L74 PolarHBondContact O-N 2.88Å; I7-L74 HydrophobicContact CD1-CD1 3.54Å; I7-L74 HydrophobicContact CD1-CG 4.44Å; I7-L74 HydrophobicContact CG1-CD1 4.37Å; I30-L74 HydrophobicContact CG2-CD2 4.13Å; F34-L74 HydrophobicContact CB-CD1 3.87Å; F34-L74 HydrophobicContact CB-CD2 4.26Å; F34-L74 HydrophobicContact CD1-CD1 3.72Å; F34-L74 HydrophobicContact CE1-CD1 4.43Å; F34-L74 HydrophobicContact CG-CD1 3.82Å; L48-L74 HydrophobicContact CD1-CD2 4.5Å; F72-L74 HydrophobicContact CD2-CD2 3.83Å; F72-L74 HydrophobicContact CD2-CG 4.04Å; F72-L74 HydrophobicContact CE2-CD1 4.18Å; F72-L74 HydrophobicContact CE2-CD2 3.65Å; F72-L74 HydrophobicContact CE2-CG 3.8Å; L74-I76 HydrophobicContact CB-CD1 4.24Å; L74-I76 HydrophobicContact CB-CG1 3.97Å
75	L	96.4	Very high	95.2	Very high	53 Å²	53	34.6 Å²	34.6	28%	0.277	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	117.7	164.9	-175.9	66.1	0	0	0	108.1	F2 V46 G47	F2-L75 HydrophobicContact CB-CD1 3.95Å; F2-L75 HydrophobicContact CG-CD1 4.49Å; V46-L75 HydrophobicContact CB-CD2 4.33Å; V46-L75 HydrophobicContact CB-CG 4.36Å; V46-L75 HydrophobicContact CG1-CD2 4.35Å; V46-L75 PolarHBondContact N-O 2.67Å; G47-L75 PolarHBondContact O-N 3.25Å
76	I	95.7	Very high	95.3	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.7	-174.6	-57.8	-172.4	0	0	0	109.5	F2 K3 Y5 V42 V44 L74 R78	F2-I76 CarbonylContact C-O 3.58Å; F2-I76 VanDerWaalsContact CA-O 3.32Å; F2-I76 WeakPolarHBondContact CA-O 3.49Å; K3-I76 PolarHBondContact N-O 2.85Å; K3-I76 PolarHBondContact O-N 2.68Å; Y5-I76 VanDerWaalsContact CB-CD1 3.4Å; Y5-I76 HydrophobicContact CD1-CD1 4.09Å; Y5-I76 HydrophobicContact CG-CD1 3.94Å; V42-I76 HydrophobicContact CB-CD1 4.44Å; V42-I76 HydrophobicContact CG1-CD1 3.31Å; V42-I76 HydrophobicContact CG1-CG2 4.26Å; V44-I76 CarbonylContact O-C 3.59Å; V44-I76 WeakPolarHBondContact O-CA 3.37Å; V44-I76 WeakPolarHBondContact O-CG2 3.36Å; L74-I76 HydrophobicContact CB-CD1 4.24Å; L74-I76 HydrophobicContact CB-CG1 3.97Å; I76-R78 HydrophobicContact CG2-CB 4.49Å; I76-R78 PolarHBondContact O-N 2.73Å
77	F	95.2	Very high	95.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	110	166.3	175.7	-109	0	0	0	109.3	M1 F2 V44 V46 P79 L85 F103 F104 F185	M1-F77 HydrophobicContact CE-CD2 3.96Å; M1-F77 HydrophobicContact CE-CE2 3.56Å; M1-F77 HydrophobicContact CG-CD2 3.82Å; M1-F77 HydrophobicContact CG-CE2 3.58Å; M1-F77 HydrophobicContact SD-CE2 4.44Å; F2-F77 HydrophobicContact CD1-CB 4.11Å; F2-F77 HydrophobicContact CD1-CD2 4.28Å; F2-F77 HydrophobicContact CE1-CB 3.93Å; F2-F77 AromaticContact CE1-CD2 3.85Å; F2-F77 HydrophobicContact CE1-CD2 3.85Å; F2-F77 HydrophobicContact CE1-CG 4.37Å; F2-F77 HydrophobicContact CZ-CD2 4.27Å; V44-F77 HydrophobicContact CB-CB 4.32Å; V44-F77 PolarHBondContact N-O 3.21Å; V44-F77 VanDerWaalsContact N-O 3.11Å; V44-F77 PolarHBondContact O-N 3.33Å; V46-F77 HydrophobicContact CG2-CB 4.12Å; F77-P79 HydrophobicContact CE1-CG 4.05Å; F77-P79 HydrophobicContact CE2-CG 4.29Å; F77-P79 HydrophobicContact CZ-CB 4.37Å; F77-P79 HydrophobicContact CZ-CG 3.78Å; F77-L85 HydrophobicContact CZ-CD1 4.15Å; F77-F103 HydrophobicContact CB-CD2 4.47Å; F77-F103 HydrophobicContact CB-CE2 3.86Å; F77-F103 AromaticContact CD1-CE2 3.66Å; F77-F103 HydrophobicContact CD1-CE2 3.66Å; F77-F103 AromaticContact CD2-CE2 3.44Å; F77-F103 HydrophobicContact CD2-CE2 3.44Å; F77-F103 VanDerWaalsContact CD2-CE2 3.44Å; F77-F103 AromaticContact CD2-CZ 3.52Å; F77-F103 HydrophobicContact CD2-CZ 3.52Å; F77-F103 AromaticContact CE1-CE2 3.96Å; F77-F103 HydrophobicContact CE1-CE2 3.96Å; F77-F103 AromaticContact CE2-CE2 3.78Å; F77-F103 HydrophobicContact CE2-CE2 3.78Å; F77-F103 AromaticContact CE2-CZ 3.67Å; F77-F103 HydrophobicContact CE2-CZ 3.67Å; F77-F103 HydrophobicContact CG-CD2 4.33Å; F77-F103 AromaticContact CG-CE2 3.36Å; F77-F103 HydrophobicContact CG-CE2 3.36Å; F77-F103 AromaticContact CG-CZ 3.97Å; F77-F103 HydrophobicContact CG-CZ 3.97Å; F77-F103 HydrophobicContact CZ-CE2 4.02Å; F77-F103 HydrophobicContact CZ-CZ 4.22Å; F77-F104 HydrophobicContact CD1-CG 4.49Å; F77-F104 HydrophobicContact CE1-CB 4.28Å; F77-F104 AromaticContact CE1-CD1 3.91Å; F77-F104 HydrophobicContact CE1-CD1 3.91Å; F77-F104 HydrophobicContact CE1-CE1 4.5Å; F77-F104 HydrophobicContact CE1-CG 4.1Å; F77-F185 HydrophobicContact CD1-CE1 4.45Å; F77-F185 HydrophobicContact CE1-CE1 4.49Å
78	R	93.9	Very high	95.6	Very high	59 Å²	59	41.7 Å²	41.7	22%	0.223	21%	0.206	C	C	.	.			trans	-143.8	84.7	178.3	-174.7	59.6	170.9	94.8	-13.8	108.6	M1 K3 V42 I76 M155	M1-R78 CarbonylContact O-C 3.55Å; M1-R78 PolarHBondContact O-N 3.3Å; M1-R78 VanDerWaalsContact O-O 3.05Å; K3-R78 HydrophobicContact CD-CB 4.33Å; K3-R78 HydrophobicContact CD-CG 4.28Å; K3-R78 HydrophobicContact CG-CB 4.42Å; V42-R78 WeakPolarHBondContact O-CB 3.15Å; V42-R78 WeakPolarHBondContact O-CD 3.11Å; V42-R78 WeakPolarHBondContact O-CG 3.47Å; I76-R78 HydrophobicContact CG2-CB 4.49Å; I76-R78 PolarHBondContact O-N 2.73Å; R78-M155 PolarHBondContact NH1-SD 2.72Å; R78-M155 PolarHBondContact NH2-SD 3.29Å
79	P	93.8	Very high	95.6	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-64.6	159.7	176.6	27.9	-34.4	0	0	0	111.3	F77 E83 L85 V152 M155 L187	F77-P79 HydrophobicContact CE1-CG 4.05Å; F77-P79 HydrophobicContact CE2-CG 4.29Å; F77-P79 HydrophobicContact CZ-CB 4.37Å; F77-P79 HydrophobicContact CZ-CG 3.78Å; P79-E83 WeakPolarHBondContact CA-OE2 3.25Å; P79-E83 WeakPolarHBondContact CB-OE2 3.29Å; P79-L85 HydrophobicContact CB-CD1 3.98Å; P79-L85 HydrophobicContact CG-CD1 4.38Å; P79-V152 HydrophobicContact CB-CG2 4.28Å; P79-M155 VanDerWaalsContact O-CE 3.31Å; P79-M155 WeakPolarHBondContact O-CE 3.48Å; P79-L187 HydrophobicContact CB-CD1 4.43Å; P79-L187 HydrophobicContact CG-CD1 3.34Å
80	F	93.6	Very high	95.5	Very high	115 Å²	115	41 Å²	41	50%	0.504	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-102.5	152.6	176.6	60	-91.1	0	0	0	111.3	G82 E83	F80-G82 PolarHBondContact O-N 2.82Å; F80-E83 HydrophobicContact CD1-CB 3.85Å; F80-E83 VanDerWaalsContact CD1-CD 3.41Å; F80-E83 HydrophobicContact CD1-CG 4.01Å; F80-E83 WeakPolarHBondContact CD1-OE2 3.48Å; F80-E83 HydrophobicContact CD2-CB 3.69Å; F80-E83 HydrophobicContact CE1-CB 3.69Å; F80-E83 HydrophobicContact CE1-CG 3.5Å; F80-E83 VanDerWaalsContact CE1-CG 3.5Å; F80-E83 VanDerWaalsContact CE1-OE1 3.3Å; F80-E83 WeakPolarHBondContact CE1-OE1 3.3Å; F80-E83 VanDerWaalsContact CE1-OE2 3.28Å; F80-E83 WeakPolarHBondContact CE1-OE2 3.33Å; F80-E83 VanDerWaalsContact CE2-CA 3.47Å; F80-E83 HydrophobicContact CE2-CB 3.51Å; F80-E83 HydrophobicContact CE2-CG 4.1Å; F80-E83 HydrophobicContact CG-CB 3.84Å; F80-E83 HydrophobicContact CZ-CB 3.5Å; F80-E83 HydrophobicContact CZ-CG 3.53Å; F80-E83 PolarHBondContact N-OE2 2.81Å; F80-E83 WeakPolarHBondContact O-CB 3.19Å; F80-E83 PolarHBondContact O-N 3.25Å
81	V	95.2	Very high	95.3	Very high	89 Å²	89	45.8 Å²	45.8	54%	0.539	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	129.9	172.9	174	0	0	0	0	109.3	I153 M155	V81-I153 WeakPolarHBondContact CG1-O 3.44Å; V81-I153 WeakPolarHBondContact CG2-O 3.44Å; V81-M155 HydrophobicContact CG2-CE 4.3Å; V81-M155 HydrophobicContact CG2-SD 4.49Å
82	G	95.2	Very high	95.1	Very high	35 Å²	35	44.5 Å²	44.5	36%	0.361	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	-6.4	-173.1	0	0	0	0	0	114.6	F80 V152	F80-G82 PolarHBondContact O-N 2.82Å; G82-V152 PolarHBondContact N-O 2.99Å
83	E	95	Very high	94.9	Very high	25 Å²	25	46.3 Å²	46.3	12%	0.117	23%	0.23	C	C	.	.			trans	-67.2	140.7	174.5	-168.5	160.9	-158.6	0	0	110.8	M1 P79 F80 L85 R151 V152	M1-E83 VanDerWaalsContact CA-OE1 3.25Å; M1-E83 WeakPolarHBondContact CA-OE1 3.25Å; M1-E83 VanDerWaalsContact CA-OE2 3.27Å; M1-E83 WeakPolarHBondContact CA-OE2 3.45Å; M1-E83 WeakPolarHBondContact CB-OE1 3.3Å; M1-E83 PolarHBondContact N-OE1 3.14Å; M1-E83 PolarHBondContact N-OE2 3.38Å; P79-E83 WeakPolarHBondContact CA-OE2 3.25Å; P79-E83 WeakPolarHBondContact CB-OE2 3.29Å; F80-E83 HydrophobicContact CD1-CB 3.85Å; F80-E83 VanDerWaalsContact CD1-CD 3.41Å; F80-E83 HydrophobicContact CD1-CG 4.01Å; F80-E83 WeakPolarHBondContact CD1-OE2 3.48Å; F80-E83 HydrophobicContact CD2-CB 3.69Å; F80-E83 HydrophobicContact CE1-CB 3.69Å; F80-E83 HydrophobicContact CE1-CG 3.5Å; F80-E83 VanDerWaalsContact CE1-CG 3.5Å; F80-E83 VanDerWaalsContact CE1-OE1 3.3Å; F80-E83 WeakPolarHBondContact CE1-OE1 3.3Å; F80-E83 VanDerWaalsContact CE1-OE2 3.28Å; F80-E83 WeakPolarHBondContact CE1-OE2 3.33Å; F80-E83 VanDerWaalsContact CE2-CA 3.47Å; F80-E83 HydrophobicContact CE2-CB 3.51Å; F80-E83 HydrophobicContact CE2-CG 4.1Å; F80-E83 HydrophobicContact CG-CB 3.84Å; F80-E83 HydrophobicContact CZ-CB 3.5Å; F80-E83 HydrophobicContact CZ-CG 3.53Å; F80-E83 PolarHBondContact N-OE2 2.81Å; F80-E83 WeakPolarHBondContact O-CB 3.19Å; F80-E83 PolarHBondContact O-N 3.25Å; E83-L85 HydrophobicContact CG-CD2 4.02Å; E83-L85 HydrophobicContact CG-CG 4.35Å; E83-R151 CarbonylContact O-C 3.52Å; E83-R151 WeakPolarHBondContact O-CA 3.49Å; E83-V152 HydrophobicContact CB-CG2 4.33Å; E83-V152 WeakPolarHBondContact O-CG2 3.29Å; E83-V152 PolarHBondContact O-N 3.47Å
84	I	95.2	Very high	94.7	Very high	74 Å²	74	48.3 Å²	48.3	38%	0.379	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.3	174.8	-63.6	174.5	0	0	0	108.6	R149 F150 R151 L196	I84-R149 HydrophobicContact CG2-CG 3.26Å; I84-F150 CarbonylContact C-O 3.56Å; I84-F150 WeakPolarHBondContact CA-O 3.48Å; I84-R151 HydrophobicContact CG1-CB 4.31Å; I84-R151 HydrophobicContact CG1-CG 4.5Å; I84-L196 HydrophobicContact CD1-CD2 4.42Å; I84-L196 HydrophobicContact CG2-CD2 4.23Å
85	L	95.1	Very high	94.5	Very high	11 Å²	11	52 Å²	52	6%	0.058	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	159	-179.3	-63	178.7	0	0	0	111	M1 F77 P79 E83 R149 F150 V152 L187	M1-L85 HydrophobicContact CE-CD2 4.46Å; M1-L85 HydrophobicContact CG-CD2 4.15Å; M1-L85 HydrophobicContact SD-CD2 4.11Å; F77-L85 HydrophobicContact CZ-CD1 4.15Å; P79-L85 HydrophobicContact CB-CD1 3.98Å; P79-L85 HydrophobicContact CG-CD1 4.38Å; E83-L85 HydrophobicContact CG-CD2 4.02Å; E83-L85 HydrophobicContact CG-CG 4.35Å; L85-R149 WeakPolarHBondContact O-CA 3.42Å; L85-F150 HydrophobicContact CB-CE1 3.94Å; L85-F150 HydrophobicContact CB-CE2 3.9Å; L85-F150 HydrophobicContact CB-CZ 3.5Å; L85-F150 HydrophobicContact CD1-CE2 4.19Å; L85-F150 HydrophobicContact CD1-CZ 4.07Å; L85-F150 HydrophobicContact CG-CZ 4.39Å; L85-F150 PolarHBondContact N-O 2.9Å; L85-F150 PolarHBondContact O-N 2.81Å; L85-V152 HydrophobicContact CD1-CG2 3.84Å; L85-V152 HydrophobicContact CG-CG2 4.23Å; L85-L187 HydrophobicContact CD1-CD2 4.26Å
86	Y	94.9	Very high	94.4	Very high	127 Å²	127	49.5 Å²	49.5	50%	0.498	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.5	173.2	-64	-91.9	0	0	0	109.3	T101 V148 R149 T199	Y86-T101 WeakPolarHBondContact O-CG2 3.42Å; Y86-V148 WeakPolarHBondContact CA-O 3.41Å; Y86-R149 HydrophobicContact CD1-CB 4.26Å; Y86-R149 HydrophobicContact CE1-CB 4.12Å; Y86-R149 HydrophobicContact CE1-CG 4.15Å; Y86-R149 PolarHBondContact OH-NE 2.71Å; Y86-R149 PolarHBondContact OH-NH2 2.82Å; Y86-T199 HydrophobicContact CD1-CG2 4.12Å; Y86-T199 HydrophobicContact CE1-CG2 4.04Å
87	G	95.9	Very high	94.4	Very high	8 Å²	8	49.4 Å²	49.4	8%	0.082	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	173	173.1	0	0	0	0	0	111.3	S100 I147 V148	G87-S100 CarbonylContact C-O 3.51Å; G87-S100 VanDerWaalsContact CA-O 3.25Å; G87-S100 WeakPolarHBondContact CA-O 3.28Å; G87-I147 CarbonylContact O-C 3.58Å; G87-I147 WeakPolarHBondContact O-CA 3.3Å; G87-V148 PolarHBondContact N-O 2.7Å; G87-V148 WeakPolarHBondContact O-CG2 3.29Å; G87-V148 PolarHBondContact O-N 3.21Å
88	K	96.4	Very high	94.5	Very high	116 Å²	116	52.5 Å²	52.5	50%	0.504	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130.5	176	-177.7	173.5	-179.2	174.7	0	108.2	S90 S100 G145 S146	K88-S90 PolarHBondContact O-N 2.96Å; K88-S90 VanDerWaalsContact O-N 3.15Å; K88-S100 PolarHBondContact N-O 2.7Å; K88-S100 PolarHBondContact O-N 2.82Å; K88-S100 PolarHBondContact O-OG 3.42Å; K88-G145 VanDerWaalsContact CE-O 3.22Å; K88-G145 WeakPolarHBondContact CE-O 3.3Å; K88-G145 WeakPolarHBondContact CG-O 3.43Å; K88-S146 WeakPolarHBondContact CA-O 3.41Å
89	I	96	Very high	94.6	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	120	174.5	-63.9	179.9	0	0	0	108.9	C92 V97 W98 M142 E143 G145 S146 V148	I89-C92 WeakPolarHBondContact CG2-SG 3.37Å; I89-V97 HydrophobicContact CB-CG1 4.34Å; I89-V97 HydrophobicContact CD1-CG1 3.98Å; I89-V97 HydrophobicContact CG1-CG1 3.81Å; I89-V97 HydrophobicContact CG2-CG1 3.79Å; I89-W98 WeakPolarHBondContact CA-O 3.15Å; I89-M142 HydrophobicContact CD1-CB 3.89Å; I89-E143 WeakPolarHBondContact CB-O 3.42Å; I89-E143 WeakPolarHBondContact CD1-O 3.19Å; I89-G145 WeakPolarHBondContact O-CA 3.31Å; I89-G145 PolarHBondContact O-N 2.83Å; I89-S146 PolarHBondContact N-O 2.63Å; I89-V148 HydrophobicContact CD1-CG1 3.67Å; I89-V148 HydrophobicContact CG1-CG1 3.73Å; I89-V148 HydrophobicContact CG1-CG2 4.07Å
90	S	94.4	Very high	94.6	Very high	38 Å²	38	50.9 Å²	50.9	27%	0.266	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-42.7	176.7	52.1	0	0	0	0	111.4	K88 W98 K144	K88-S90 PolarHBondContact O-N 2.96Å; K88-S90 VanDerWaalsContact O-N 3.15Å; S90-W98 PolarHBondContact N-O 2.83Å; S90-W98 WeakPolarHBondContact OG-CB 3.34Å; S90-W98 PolarHBondContact OG-O 2.92Å; S90-W98 VanDerWaalsContact OG-O 3.09Å; S90-K144 WeakPolarHBondContact O-CD 3.42Å; S90-K144 WeakPolarHBondContact O-CE 3.45Å; S90-K144 WeakPolarHBondContact O-CG 3.34Å
91	Q	92.4	Very high	94.6	Very high	101 Å²	101	46.9 Å²	46.9	47%	0.472	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	147.1	-177.7	177.9	171.3	-19.1	0	0	109.9	D93 W98	Q91-D93 PolarHBondContact NE2-OD1 2.85Å; Q91-D93 PolarHBondContact NE2-OD2 3.29Å; Q91-W98 HydrophobicContact CB-CB 4.19Å; Q91-W98 PolarHBondContact N-O 2.85Å; Q91-W98 PolarHBondContact O-N 3.16Å
92	C	92.6	Very high	94.3	Very high	8 Å²	8	51.1 Å²	51.1	5%	0.054	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.3	171.8	-66.2	0	0	0	0	107.5	I89 S125 M142	I89-C92 WeakPolarHBondContact CG2-SG 3.37Å; C92-S125 VanDerWaalsContact CB-O 3.29Å; C92-S125 WeakPolarHBondContact CB-O 3.35Å; C92-M142 PolarHBondContact SG-O 3.16Å; C92-M142 VanDerWaalsContact SG-O 3.39Å
93	D	92.4	Very high	93.9	Very high	39 Å²	39	52.8 Å²	52.8	21%	0.209	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	168.3	176.4	-60.1	-49.8	0	0	0	109.2	Q91 T95 G96 W98 W127	Q91-D93 PolarHBondContact NE2-OD1 2.85Å; Q91-D93 PolarHBondContact NE2-OD2 3.29Å; D93-T95 PolarHBondContact O-N 3.04Å; D93-G96 CarbonylContact C-O 3.6Å; D93-G96 PolarHBondContact N-O 3.41Å; D93-G96 PolarHBondContact O-N 2.72Å; D93-G96 VanDerWaalsContact O-N 3.13Å; D93-W98 VanDerWaalsContact OD2-CD1 3.31Å; D93-W98 PolarHBondContact OD2-NE1 2.78Å; D93-W127 PolarHBondContact O-NE1 2.82Å
94	D	92.5	Very high	93.7	Very high	111 Å²	111	52.4 Å²	52.4	59%	0.594	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22	174.3	67.3	-24.7	0	0	0	113.4	Y120 W127	D94-Y120 HydrophobicContact CB-CD1 3.78Å; D94-Y120 HydrophobicContact CB-CE1 3.93Å; D94-Y120 HydrophobicContact CB-CG 4.33Å; D94-W127 VanDerWaalsContact O-CZ2 3.26Å; D94-W127 WeakPolarHBondContact O-CZ2 3.47Å
95	T	93.6	Very high	93.6	Very high	79 Å²	79	51.1 Å²	51.1	49%	0.485	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-22.4	175	62.5	0	0	0	0	113.5	D93 A111	D93-T95 PolarHBondContact O-N 3.04Å; T95-A111 PolarHBondContact O-N 3.39Å
96	G	94.1	Very high	93.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.8	-157.6	-175.1	0	0	0	0	0	114.5	D93 V109 W127	D93-G96 CarbonylContact C-O 3.6Å; D93-G96 PolarHBondContact N-O 3.41Å; D93-G96 PolarHBondContact O-N 2.72Å; D93-G96 VanDerWaalsContact O-N 3.13Å; G96-V109 CarbonylContact C-O 3.54Å; G96-V109 VanDerWaalsContact CA-O 3.25Å; G96-V109 WeakPolarHBondContact CA-O 2.93Å; G96-W127 PolarHBondContact O-NE1 3.08Å
97	V	95.4	Very high	93.5	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	126.3	-173.6	-178.1	0	0	0	0	110	I89 V99 V109 L114 W127	I89-V97 HydrophobicContact CB-CG1 4.34Å; I89-V97 HydrophobicContact CD1-CG1 3.98Å; I89-V97 HydrophobicContact CG1-CG1 3.81Å; I89-V97 HydrophobicContact CG2-CG1 3.79Å; V97-V99 HydrophobicContact CG1-CG2 4.09Å; V97-V109 PolarHBondContact N-O 2.79Å; V97-V109 PolarHBondContact O-N 2.93Å; V97-L114 HydrophobicContact CG2-CD1 4.28Å; V97-L114 HydrophobicContact CG2-CD2 4.1Å; V97-W127 HydrophobicContact CG2-CG 4.07Å
98	W	96.1	Very high	93.6	Very high	65 Å²	65	49 Å²	49	25%	0.246	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.3	169	-68.7	95.3	0	0	0	110.3	I89 S90 Q91 D93 I107 F108	I89-W98 WeakPolarHBondContact CA-O 3.15Å; S90-W98 PolarHBondContact N-O 2.83Å; S90-W98 WeakPolarHBondContact OG-CB 3.34Å; S90-W98 PolarHBondContact OG-O 2.92Å; S90-W98 VanDerWaalsContact OG-O 3.09Å; Q91-W98 HydrophobicContact CB-CB 4.19Å; Q91-W98 PolarHBondContact N-O 2.85Å; Q91-W98 PolarHBondContact O-N 3.16Å; D93-W98 VanDerWaalsContact OD2-CD1 3.31Å; D93-W98 PolarHBondContact OD2-NE1 2.78Å; W98-I107 CarbonylContact C-O 3.6Å; W98-I107 WeakPolarHBondContact CA-O 3.12Å; W98-F108 HydrophobicContact CD2-CB 4.45Å; W98-F108 AromaticContact CD2-CD2 3.79Å; W98-F108 HydrophobicContact CD2-CD2 3.79Å; W98-F108 AromaticContact CE2-CD2 3.52Å; W98-F108 HydrophobicContact CE3-CB 4.04Å; W98-F108 HydrophobicContact CE3-CD2 4.25Å; W98-F108 HydrophobicContact CG-CD2 4.25Å; W98-F108 HydrophobicContact CH2-CB 4.04Å; W98-F108 HydrophobicContact CH2-CD2 4.24Å; W98-F108 HydrophobicContact CH2-CG 4.31Å; W98-F108 HydrophobicContact CZ2-CB 4.43Å; W98-F108 AromaticContact CZ2-CD2 3.77Å; W98-F108 HydrophobicContact CZ2-CD2 3.77Å; W98-F108 HydrophobicContact CZ2-CE2 4.34Å; W98-F108 HydrophobicContact CZ2-CG 4.25Å; W98-F108 HydrophobicContact CZ3-CB 3.84Å; W98-F108 HydrophobicContact CZ3-CD2 4.46Å; W98-F108 HydrophobicContact CZ3-CG 4.5Å; W98-F108 AromaticContact NE1-CD2 3.82Å; W98-F108 AromaticContact NE1-CE2 3.95Å
99	V	96.5	Very high	93.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.2	-177.2	-178.1	0	0	0	0	108.8	V97 A105 I107 V148 F150 M191	V97-V99 HydrophobicContact CG1-CG2 4.09Å; V99-A105 CarbonylContact O-C 3.54Å; V99-I107 HydrophobicContact CB-CB 4.03Å; V99-I107 HydrophobicContact CB-CG2 4.09Å; V99-I107 HydrophobicContact CG1-CD1 4.42Å; V99-I107 PolarHBondContact N-O 3.05Å; V99-I107 VanDerWaalsContact O-CB 3.25Å; V99-I107 WeakPolarHBondContact O-CB 3.42Å; V99-I107 PolarHBondContact O-N 3.13Å; V99-V148 HydrophobicContact CG1-CG2 3.79Å; V99-V148 HydrophobicContact CG2-CG2 3.86Å; V99-F150 HydrophobicContact CG1-CD1 4.18Å; V99-F150 HydrophobicContact CG1-CE1 3.84Å; V99-M191 HydrophobicContact CG2-CE 3.79Å
100	S	94.9	Very high	93.5	Very high	26 Å²	26	44.8 Å²	44.8	18%	0.182	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	148.3	178.3	62.5	0	0	0	0	110.9	G87 K88	G87-S100 CarbonylContact C-O 3.51Å; G87-S100 VanDerWaalsContact CA-O 3.25Å; G87-S100 WeakPolarHBondContact CA-O 3.28Å; K88-S100 PolarHBondContact N-O 2.7Å; K88-S100 PolarHBondContact O-N 2.82Å; K88-S100 PolarHBondContact O-OG 3.42Å
101	T	92.3	Very high	93.5	Very high	30 Å²	30	44.6 Å²	44.6	18%	0.184	24%	0.242	C	C	.	.			trans	-114.8	-178.8	170.5	66.7	0	0	0	0	108.7	Y86 F103 F104 I107	Y86-T101 WeakPolarHBondContact O-CG2 3.42Å; T101-F103 PolarHBondContact O-N 3.1Å; T101-F104 PolarHBondContact N-O 2.79Å; T101-F104 PolarHBondContact OG1-N 2.61Å; T101-F104 VanDerWaalsContact OG1-N 3.16Å; T101-F104 PolarHBondContact OG1-O 2.98Å; T101-I107 HydrophobicContact CG2-CD1 3.65Å
102	L	88.6	Confident	93.6	Very high	178 Å²	178	48.5 Å²	48.5	93%	0.932	26%	0.26	S	S	*	.	S	Bend	trans	-61.7	-30.3	-178.5	-172.2	64.6	0	0	0	113.9
103	F	87.3	Confident	93.7	Very high	71 Å²	71	50.4 Å²	50.4	31%	0.311	27%	0.27	S	S	.	.	S	Bend	trans	-125.9	-2	-172.8	58.1	-98.5	0	0	0	113.4	M1 F2 F77 T101	M1-F103 HydrophobicContact CE-CE1 3.94Å; M1-F103 HydrophobicContact CE-CZ 3.53Å; F2-F103 HydrophobicContact CE1-CZ 4.24Å; F2-F103 HydrophobicContact CZ-CE1 4.09Å; F2-F103 HydrophobicContact CZ-CZ 4.04Å; F77-F103 HydrophobicContact CB-CD2 4.47Å; F77-F103 HydrophobicContact CB-CE2 3.86Å; F77-F103 AromaticContact CD1-CE2 3.66Å; F77-F103 HydrophobicContact CD1-CE2 3.66Å; F77-F103 AromaticContact CD2-CE2 3.44Å; F77-F103 HydrophobicContact CD2-CE2 3.44Å; F77-F103 VanDerWaalsContact CD2-CE2 3.44Å; F77-F103 AromaticContact CD2-CZ 3.52Å; F77-F103 HydrophobicContact CD2-CZ 3.52Å; F77-F103 AromaticContact CE1-CE2 3.96Å; F77-F103 HydrophobicContact CE1-CE2 3.96Å; F77-F103 AromaticContact CE2-CE2 3.78Å; F77-F103 HydrophobicContact CE2-CE2 3.78Å; F77-F103 AromaticContact CE2-CZ 3.67Å; F77-F103 HydrophobicContact CE2-CZ 3.67Å; F77-F103 HydrophobicContact CG-CD2 4.33Å; F77-F103 AromaticContact CG-CE2 3.36Å; F77-F103 HydrophobicContact CG-CE2 3.36Å; F77-F103 AromaticContact CG-CZ 3.97Å; F77-F103 HydrophobicContact CG-CZ 3.97Å; F77-F103 HydrophobicContact CZ-CE2 4.02Å; F77-F103 HydrophobicContact CZ-CZ 4.22Å; T101-F103 PolarHBondContact O-N 3.1Å
104	F	91.7	Very high	93.8	Very high	16 Å²	16	48.8 Å²	48.8	7%	0.07	26%	0.261	C	S	.	.			trans	-149.1	127.1	-176.9	-179	-110.1	0	0	0	111	V44 F77 T101 E106 I107 F185 L187	V44-F104 HydrophobicContact CG2-CD2 3.83Å; V44-F104 HydrophobicContact CG2-CE2 4.1Å; F77-F104 HydrophobicContact CD1-CG 4.49Å; F77-F104 HydrophobicContact CE1-CB 4.28Å; F77-F104 AromaticContact CE1-CD1 3.91Å; F77-F104 HydrophobicContact CE1-CD1 3.91Å; F77-F104 HydrophobicContact CE1-CE1 4.5Å; F77-F104 HydrophobicContact CE1-CG 4.1Å; T101-F104 PolarHBondContact N-O 2.79Å; T101-F104 PolarHBondContact OG1-N 2.61Å; T101-F104 VanDerWaalsContact OG1-N 3.16Å; T101-F104 PolarHBondContact OG1-O 2.98Å; F104-E106 HydrophobicContact CE1-CB 4.34Å; F104-E106 VanDerWaalsContact CE1-O 3.29Å; F104-E106 WeakPolarHBondContact CE1-O 3.05Å; F104-E106 HydrophobicContact CE2-CB 3.88Å; F104-E106 HydrophobicContact CE2-CG 4.35Å; F104-E106 HydrophobicContact CZ-CB 3.64Å; F104-E106 VanDerWaalsContact CZ-O 3.25Å; F104-E106 WeakPolarHBondContact CZ-O 3.27Å; F104-I107 HydrophobicContact CD1-CD1 3.97Å; F104-I107 HydrophobicContact CD1-CG1 3.62Å; F104-I107 HydrophobicContact CE1-CD1 4.35Å; F104-I107 HydrophobicContact CE1-CG1 3.5Å; F104-F185 HydrophobicContact CD2-CD1 4.25Å; F104-F185 HydrophobicContact CE1-CD1 4.46Å; F104-F185 HydrophobicContact CE1-CE1 4.31Å; F104-F185 AromaticContact CE2-CD1 3.37Å; F104-F185 HydrophobicContact CE2-CD1 3.37Å; F104-F185 AromaticContact CE2-CE1 3.92Å; F104-F185 HydrophobicContact CE2-CE1 3.92Å; F104-F185 HydrophobicContact CE2-CG 4.28Å; F104-F185 AromaticContact CZ-CD1 3.49Å; F104-F185 HydrophobicContact CZ-CD1 3.49Å; F104-F185 VanDerWaalsContact CZ-CD1 3.49Å; F104-F185 AromaticContact CZ-CE1 3.74Å; F104-F185 HydrophobicContact CZ-CE1 3.74Å; F104-F185 HydrophobicContact CZ-CG 4.29Å; F104-F185 WeakPolarHBondContact CZ-O 3.19Å; F104-L187 HydrophobicContact CE1-CB 3.89Å; F104-L187 HydrophobicContact CZ-CB 4.45Å
105	A	92.2	Very high	93.8	Very high	47 Å²	47	43.8 Å²	43.8	39%	0.388	24%	0.235	S	C	.	.			trans	-112.8	-12.1	-171.7	0	0	0	0	0	115	V99 I107	V99-A105 CarbonylContact O-C 3.54Å; A105-I107 VanDerWaalsContact C-N 3.33Å; A105-I107 PolarHBondContact O-N 3.19Å; A105-I107 VanDerWaalsContact O-N 3.14Å
106	E	93	Very high	93.6	Very high	73 Å²	73	50.2 Å²	50.2	34%	0.341	25%	0.252	S	S	.	.			trans	-92.8	59.2	-171.6	-53.7	-56.8	139.6	0	0	111.4	F104 P183 F185 V186 L187	F104-E106 HydrophobicContact CE1-CB 4.34Å; F104-E106 VanDerWaalsContact CE1-O 3.29Å; F104-E106 WeakPolarHBondContact CE1-O 3.05Å; F104-E106 HydrophobicContact CE2-CB 3.88Å; F104-E106 HydrophobicContact CE2-CG 4.35Å; F104-E106 HydrophobicContact CZ-CB 3.64Å; F104-E106 VanDerWaalsContact CZ-O 3.25Å; F104-E106 WeakPolarHBondContact CZ-O 3.27Å; E106-P183 HydrophobicContact CB-CB 4.31Å; E106-P183 HydrophobicContact CG-CB 3.78Å; E106-F185 VanDerWaalsContact CB-O 3.3Å; E106-F185 WeakPolarHBondContact CB-O 3.38Å; E106-V186 WeakPolarHBondContact O-CA 3.16Å; E106-L187 PolarHBondContact O-N 3.32Å
107	I	95.9	Very high	93.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123.7	174.9	-54	155.7	0	0	0	108.6	W98 V99 T101 F104 A105 F150 L187	W98-I107 CarbonylContact C-O 3.6Å; W98-I107 WeakPolarHBondContact CA-O 3.12Å; V99-I107 HydrophobicContact CB-CB 4.03Å; V99-I107 HydrophobicContact CB-CG2 4.09Å; V99-I107 HydrophobicContact CG1-CD1 4.42Å; V99-I107 PolarHBondContact N-O 3.05Å; V99-I107 VanDerWaalsContact O-CB 3.25Å; V99-I107 WeakPolarHBondContact O-CB 3.42Å; V99-I107 PolarHBondContact O-N 3.13Å; T101-I107 HydrophobicContact CG2-CD1 3.65Å; F104-I107 HydrophobicContact CD1-CD1 3.97Å; F104-I107 HydrophobicContact CD1-CG1 3.62Å; F104-I107 HydrophobicContact CE1-CD1 4.35Å; F104-I107 HydrophobicContact CE1-CG1 3.5Å; A105-I107 VanDerWaalsContact C-N 3.33Å; A105-I107 PolarHBondContact O-N 3.19Å; A105-I107 VanDerWaalsContact O-N 3.14Å; I107-F150 HydrophobicContact CD1-CE1 4.27Å; I107-F150 HydrophobicContact CD1-CZ 3.74Å; I107-F150 HydrophobicContact CG1-CZ 4.4Å; I107-F150 HydrophobicContact CG2-CD2 4.32Å; I107-F150 HydrophobicContact CG2-CE1 4.35Å; I107-F150 HydrophobicContact CG2-CE2 3.75Å; I107-F150 HydrophobicContact CG2-CZ 3.76Å; I107-L187 CarbonylContact C-O 3.6Å; I107-L187 WeakPolarHBondContact CA-O 3.33Å; I107-L187 HydrophobicContact CB-CB 4.41Å; I107-L187 HydrophobicContact CB-CD2 4.47Å; I107-L187 HydrophobicContact CG1-CB 4.03Å; I107-L187 HydrophobicContact CG1-CD2 3.93Å; I107-L187 HydrophobicContact CG2-CB 4.33Å; I107-L187 HydrophobicContact CG2-CD2 3.87Å
108	F	96.6	Very high	93.3	Very high	30 Å²	30	52.9 Å²	52.9	13%	0.132	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.6	-179.8	-174.9	-115.3	0	0	0	111.3	W98 V186 L187 Y188 G189	W98-F108 HydrophobicContact CD2-CB 4.45Å; W98-F108 AromaticContact CD2-CD2 3.79Å; W98-F108 HydrophobicContact CD2-CD2 3.79Å; W98-F108 AromaticContact CE2-CD2 3.52Å; W98-F108 HydrophobicContact CE3-CB 4.04Å; W98-F108 HydrophobicContact CE3-CD2 4.25Å; W98-F108 HydrophobicContact CG-CD2 4.25Å; W98-F108 HydrophobicContact CH2-CB 4.04Å; W98-F108 HydrophobicContact CH2-CD2 4.24Å; W98-F108 HydrophobicContact CH2-CG 4.31Å; W98-F108 HydrophobicContact CZ2-CB 4.43Å; W98-F108 AromaticContact CZ2-CD2 3.77Å; W98-F108 HydrophobicContact CZ2-CD2 3.77Å; W98-F108 HydrophobicContact CZ2-CE2 4.34Å; W98-F108 HydrophobicContact CZ2-CG 4.25Å; W98-F108 HydrophobicContact CZ3-CB 3.84Å; W98-F108 HydrophobicContact CZ3-CD2 4.46Å; W98-F108 HydrophobicContact CZ3-CG 4.5Å; W98-F108 AromaticContact NE1-CD2 3.82Å; W98-F108 AromaticContact NE1-CE2 3.95Å; F108-V186 HydrophobicContact CB-CG1 4.45Å; F108-L187 PolarHBondContact N-O 2.88Å; F108-Y188 HydrophobicContact CB-CD1 4.25Å; F108-Y188 HydrophobicContact CB-CE1 4.35Å; F108-Y188 AromaticContact CD1-CD1 4Å; F108-Y188 HydrophobicContact CD1-CD1 4Å; F108-Y188 AromaticContact CD1-CE1 3.94Å; F108-Y188 HydrophobicContact CD1-CE1 3.94Å; F108-Y188 WeakPolarHBondContact O-CA 3.37Å; F108-G189 PolarHBondContact O-N 3.16Å
109	V	96.6	Very high	93.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	111.1	170.1	178.8	0	0	0	0	107.3	G96 V97 N113 L114 M191	G96-V109 CarbonylContact C-O 3.54Å; G96-V109 VanDerWaalsContact CA-O 3.25Å; G96-V109 WeakPolarHBondContact CA-O 2.93Å; V97-V109 PolarHBondContact N-O 2.79Å; V97-V109 PolarHBondContact O-N 2.93Å; V109-N113 HydrophobicContact CG1-CB 4.18Å; V109-L114 HydrophobicContact CG1-CD2 3.81Å; V109-L114 HydrophobicContact CG1-CG 4.45Å; V109-M191 HydrophobicContact CB-CE 4.42Å; V109-M191 HydrophobicContact CG1-CG 4.26Å; V109-M191 HydrophobicContact CG2-CE 3.91Å
110	S	95.5	Very high	92.9	Very high	29 Å²	29	57.3 Å²	57.3	20%	0.203	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	155.6	179.8	61.4	0	0	0	0	111.7	E112 N113 L114	S110-E112 PolarHBondContact O-N 2.95Å; S110-N113 WeakPolarHBondContact O-CA 3.47Å; S110-N113 PolarHBondContact O-N 3.14Å; S110-N113 PolarHBondContact OG-ND2 2.95Å; S110-L114 PolarHBondContact O-N 2.83Å
111	A	93.8	Very high	92.8	Very high	34 Å²	34	57.3 Å²	57.3	28%	0.281	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-51.5	-39	176.1	0	0	0	0	0	113.3	T95 N113 L114 W127	T95-A111 PolarHBondContact O-N 3.39Å; A111-N113 PolarHBondContact O-N 2.77Å; A111-L114 WeakPolarHBondContact O-CB 3.43Å; A111-L114 PolarHBondContact O-N 3.4Å; A111-W127 HydrophobicContact CB-CH2 3.37Å; A111-W127 HydrophobicContact CB-CZ2 3.66Å; A111-W127 HydrophobicContact CB-CZ3 4.26Å
112	E	93.5	Very high	92.6	Very high	182 Å²	182	63.4 Å²	63.4	85%	0.85	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-65.2	-24	177.9	-60.2	-178.5	169.2	0	0	113.5	S110	S110-E112 PolarHBondContact O-N 2.95Å
113	N	95.2	Very high	92.6	Very high	48 Å²	48	62.6 Å²	62.6	26%	0.257	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-98	6.7	-179.5	-74.4	-51.1	0	0	0	112.9	V109 S110 A111 I153 T190 M191 S192	V109-N113 HydrophobicContact CG1-CB 4.18Å; S110-N113 WeakPolarHBondContact O-CA 3.47Å; S110-N113 PolarHBondContact O-N 3.14Å; S110-N113 PolarHBondContact OG-ND2 2.95Å; A111-N113 PolarHBondContact O-N 2.77Å; N113-I153 WeakPolarHBondContact OD1-CD1 3.35Å; N113-T190 PolarHBondContact O-OG1 3.11Å; N113-T190 VanDerWaalsContact O-OG1 3.14Å; N113-M191 PolarHBondContact O-N 3.35Å; N113-S192 PolarHBondContact O-N 2.92Å
114	L	94.5	Very high	92.5	Very high	5 Å²	5	63.9 Å²	63.9	3%	0.026	32%	0.323	C	S	.	.	S	Bend	trans	-80.6	160.5	169.7	-65.6	176.9	0	0	0	110.7	V97 V109 S110 A111 Y116 W127 M142 M191	V97-L114 HydrophobicContact CG2-CD1 4.28Å; V97-L114 HydrophobicContact CG2-CD2 4.1Å; V109-L114 HydrophobicContact CG1-CD2 3.81Å; V109-L114 HydrophobicContact CG1-CG 4.45Å; S110-L114 PolarHBondContact O-N 2.83Å; A111-L114 WeakPolarHBondContact O-CB 3.43Å; A111-L114 PolarHBondContact O-N 3.4Å; L114-Y116 PolarHBondContact O-N 3Å; L114-W127 HydrophobicContact CD1-CB 4.17Å; L114-W127 HydrophobicContact CD1-CD2 3.27Å; L114-W127 HydrophobicContact CD1-CE3 3.46Å; L114-W127 VanDerWaalsContact CD1-CE3 3.46Å; L114-W127 HydrophobicContact CD1-CG 3.61Å; L114-W127 HydrophobicContact CD1-CH2 4.32Å; L114-W127 HydrophobicContact CD1-CZ2 4.16Å; L114-W127 HydrophobicContact CD1-CZ3 3.99Å; L114-M142 HydrophobicContact CD2-CE 4.14Å; L114-M142 HydrophobicContact CD2-SD 3.95Å; L114-M191 HydrophobicContact CD2-SD 4.43Å
115	P	92	Very high	92.4	Very high	7 Å²	7	66.2 Å²	66.2	5%	0.045	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-51.2	138.9	170.5	-24.7	32.8	0	0	0	112	S118 W129 M142 M191 W201	P115-S118 WeakPolarHBondContact O-CB 3.17Å; P115-S118 PolarHBondContact O-N 2.84Å; P115-S118 PolarHBondContact O-OG 3.5Å; P115-W129 HydrophobicContact CB-CB 4.47Å; P115-W129 HydrophobicContact CB-CD2 3.59Å; P115-W129 VanDerWaalsContact CB-CE2 3.49Å; P115-W129 HydrophobicContact CB-CE3 4.29Å; P115-W129 HydrophobicContact CB-CG 3.66Å; P115-W129 HydrophobicContact CB-CZ2 4.1Å; P115-W129 HydrophobicContact CG-CD2 4.12Å; P115-W129 HydrophobicContact CG-CE3 4.37Å; P115-W129 HydrophobicContact CG-CG 4.3Å; P115-M142 HydrophobicContact CG-CE 4Å; P115-M191 WeakPolarHBondContact CG-O 3.32Å; P115-W201 HydrophobicContact CG-CZ3 4.28Å
116	Y	90.1	Very high	92.3	Very high	214 Å²	214	64 Å²	64	84%	0.839	32%	0.323	S	S	*	.	S	Bend	trans	-98.3	137.8	174.8	-179.3	-91.5	0	0	0	110.4	L114	L114-Y116 PolarHBondContact O-N 3Å
117	P	91.6	Very high	92.4	Very high	34 Å²	34	61.2 Å²	61.2	22%	0.221	31%	0.309	C	S	.	.	S	Bend	cis	-85	128.7	-9.2	27.6	-24.3	0	0	0	112.6	E130	P117-E130 WeakPolarHBondContact CD-O 3.21Å; P117-E130 HydrophobicContact CG-CB 4.13Å; P117-E130 PolarHBondContact O-N 3.25Å
118	S	91.3	Very high	92.3	Very high	22 Å²	22	62.2 Å²	62.2	15%	0.154	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.6	172.1	-68.4	0	0	0	0	111.6	P115 I128	P115-S118 WeakPolarHBondContact O-CB 3.17Å; P115-S118 PolarHBondContact O-N 2.84Å; P115-S118 PolarHBondContact O-OG 3.5Å; S118-I128 CarbonylContact C-O 3.52Å; S118-I128 WeakPolarHBondContact CA-O 3.17Å
119	N	92	Very high	92.1	Very high	85 Å²	85	62.1 Å²	62.1	46%	0.455	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	139.8	178.7	-71.2	-60.7	0	0	0	110.5	I128 E130	N119-I128 PolarHBondContact N-O 2.94Å; N119-I128 PolarHBondContact O-N 2.85Å; N119-E130 PolarHBondContact ND2-OE1 2.83Å
120	Y	92.9	Very high	91.8	Very high	73 Å²	73	65.4 Å²	65.4	29%	0.286	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	130.4	174	178.1	-109.4	0	0	0	110.8	D94 E122 W127	D94-Y120 HydrophobicContact CB-CD1 3.78Å; D94-Y120 HydrophobicContact CB-CE1 3.93Å; D94-Y120 HydrophobicContact CB-CG 4.33Å; Y120-E122 HydrophobicContact CE1-CB 4.08Å; Y120-W127 AromaticContact CD2-CD1 3.95Å; Y120-W127 HydrophobicContact CD2-CD2 4.28Å; Y120-W127 AromaticContact CD2-CE2 3.91Å; Y120-W127 HydrophobicContact CD2-CG 4.34Å; Y120-W127 HydrophobicContact CD2-CZ2 4.41Å; Y120-W127 AromaticContact CD2-NE1 3.67Å; Y120-W127 HydrophobicContact CG-CZ2 4.43Å
121	S	91.5	Very high	91.4	Very high	25 Å²	25	69.2 Å²	69.2	18%	0.175	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	107.8	174.7	180	0	0	0	0	109.8	N123 E124 S125 A126	S121-N123 VanDerWaalsContact C-N 3.28Å; S121-N123 PolarHBondContact O-N 2.85Å; S121-E124 PolarHBondContact O-N 3.13Å; S121-S125 WeakPolarHBondContact O-CA 3.35Å; S121-S125 PolarHBondContact O-N 2.91Å; S121-A126 PolarHBondContact N-O 3.4Å; S121-A126 PolarHBondContact O-N 3.5Å
122	E	88.8	Confident	91	Very high	159 Å²	159	75.2 Å²	75.2	74%	0.743	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-35.6	178.7	-170.8	177	-175.1	0	0	112	Y120 E124 S125	Y120-E122 HydrophobicContact CE1-CB 4.08Å; E122-E124 VanDerWaalsContact C-N 3.3Å; E122-E124 PolarHBondContact O-N 2.97Å; E122-S125 PolarHBondContact O-N 3.33Å
123	N	88.5	Confident	90.3	Very high	161 Å²	161	69.3 Å²	69.3	86%	0.861	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-37.7	-179.2	-70.4	-15	0	0	0	112.9	S121	S121-N123 VanDerWaalsContact C-N 3.28Å; S121-N123 PolarHBondContact O-N 2.85Å
124	E	84.9	Confident	89.7	Confident	97 Å²	97	75.6 Å²	75.6	45%	0.453	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-8.6	-178.2	-68.1	174	176	0	0	112.3	S121 E122 A126 Y141	S121-E124 PolarHBondContact O-N 3.13Å; E122-E124 VanDerWaalsContact C-N 3.3Å; E122-E124 PolarHBondContact O-N 2.97Å; E124-A126 HydrophobicContact CB-CB 4.06Å; E124-A126 PolarHBondContact O-N 2.79Å; E124-Y141 VanDerWaalsContact OE2-CD1 3.32Å; E124-Y141 WeakPolarHBondContact OE2-CD1 3.47Å; E124-Y141 WeakPolarHBondContact OE2-CE1 3.48Å
125	S	90	Very high	88.9	Confident	65 Å²	65	84.7 Å²	84.7	46%	0.455	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	49	-170.9	-57	0	0	0	0	110.7	C92 S121 E122	C92-S125 VanDerWaalsContact CB-O 3.29Å; C92-S125 WeakPolarHBondContact CB-O 3.35Å; S121-S125 WeakPolarHBondContact O-CA 3.35Å; S121-S125 PolarHBondContact O-N 2.91Å; E122-S125 PolarHBondContact O-N 3.33Å
126	A	91.4	Very high	88.4	Confident	0 Å²	0	86.1 Å²	86.1	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	151	-172.9	0	0	0	0	0	111	S121 E124 E143	S121-A126 PolarHBondContact N-O 3.4Å; S121-A126 PolarHBondContact O-N 3.5Å; E124-A126 HydrophobicContact CB-CB 4.06Å; E124-A126 PolarHBondContact O-N 2.79Å; A126-E143 HydrophobicContact CB-CG 4.03Å
127	W	94.3	Very high	87.9	Confident	16 Å²	16	79.6 Å²	79.6	6%	0.061	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	132.3	169.9	-78.8	87.2	0	0	0	109.8	D93 D94 G96 V97 A111 L114 Y120 M142	D93-W127 PolarHBondContact O-NE1 2.82Å; D94-W127 VanDerWaalsContact O-CZ2 3.26Å; D94-W127 WeakPolarHBondContact O-CZ2 3.47Å; G96-W127 PolarHBondContact O-NE1 3.08Å; V97-W127 HydrophobicContact CG2-CG 4.07Å; A111-W127 HydrophobicContact CB-CH2 3.37Å; A111-W127 HydrophobicContact CB-CZ2 3.66Å; A111-W127 HydrophobicContact CB-CZ3 4.26Å; L114-W127 HydrophobicContact CD1-CB 4.17Å; L114-W127 HydrophobicContact CD1-CD2 3.27Å; L114-W127 HydrophobicContact CD1-CE3 3.46Å; L114-W127 VanDerWaalsContact CD1-CE3 3.46Å; L114-W127 HydrophobicContact CD1-CG 3.61Å; L114-W127 HydrophobicContact CD1-CH2 4.32Å; L114-W127 HydrophobicContact CD1-CZ2 4.16Å; L114-W127 HydrophobicContact CD1-CZ3 3.99Å; Y120-W127 AromaticContact CD2-CD1 3.95Å; Y120-W127 HydrophobicContact CD2-CD2 4.28Å; Y120-W127 AromaticContact CD2-CE2 3.91Å; Y120-W127 HydrophobicContact CD2-CG 4.34Å; Y120-W127 HydrophobicContact CD2-CZ2 4.41Å; Y120-W127 AromaticContact CD2-NE1 3.67Å; Y120-W127 HydrophobicContact CG-CZ2 4.43Å; W127-M142 HydrophobicContact CB-CB 4.07Å; W127-M142 HydrophobicContact CB-CG 4.49Å; W127-M142 HydrophobicContact CB-SD 4.28Å; W127-M142 PolarHBondContact N-O 2.86Å; W127-M142 WeakPolarHBondContact O-CB 3.32Å; W127-M142 PolarHBondContact O-N 3.26Å
128	I	93	Very high	87.6	Confident	20 Å²	20	79.6 Å²	79.6	10%	0.103	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	116.4	-178.8	-53.2	175	0	0	0	107.6	S118 N119 Q139 Y141	S118-I128 CarbonylContact C-O 3.52Å; S118-I128 WeakPolarHBondContact CA-O 3.17Å; N119-I128 PolarHBondContact N-O 2.94Å; N119-I128 PolarHBondContact O-N 2.85Å; I128-Q139 HydrophobicContact CG2-CB 3.84Å; I128-Q139 HydrophobicContact CG2-CG 4.11Å; I128-Y141 HydrophobicContact CD1-CD1 4.09Å; I128-Y141 HydrophobicContact CD1-CE1 3.63Å; I128-Y141 HydrophobicContact CG1-CD1 3.74Å; I128-Y141 HydrophobicContact CG1-CE1 3.81Å; I128-Y141 HydrophobicContact CG2-CE1 4.5Å
129	W	92.8	Very high	87.5	Confident	29 Å²	29	83.7 Å²	83.7	11%	0.11	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	122.3	170.3	177.8	31.8	0	0	0	109.6	P115 Y131 L140 M142 W201 W202	P115-W129 HydrophobicContact CB-CB 4.47Å; P115-W129 HydrophobicContact CB-CD2 3.59Å; P115-W129 VanDerWaalsContact CB-CE2 3.49Å; P115-W129 HydrophobicContact CB-CE3 4.29Å; P115-W129 HydrophobicContact CB-CG 3.66Å; P115-W129 HydrophobicContact CB-CZ2 4.1Å; P115-W129 HydrophobicContact CG-CD2 4.12Å; P115-W129 HydrophobicContact CG-CE3 4.37Å; P115-W129 HydrophobicContact CG-CG 4.3Å; W129-Y131 AromaticContact CH2-CD2 3.58Å; W129-Y131 HydrophobicContact CH2-CD2 3.58Å; W129-Y131 HydrophobicContact CH2-CE2 4.04Å; W129-Y131 HydrophobicContact CH2-CG 4.39Å; W129-Y131 AromaticContact CZ2-CD2 3.46Å; W129-Y131 HydrophobicContact CZ2-CD2 3.46Å; W129-Y131 VanDerWaalsContact CZ2-CD2 3.46Å; W129-Y131 HydrophobicContact CZ2-CE2 4.12Å; W129-Y131 HydrophobicContact CZ2-CG 4.39Å; W129-Y131 HydrophobicContact CZ3-CD2 4.32Å; W129-Y131 PolarHBondContact O-N 3.36Å; W129-L140 HydrophobicContact CB-CB 4.35Å; W129-L140 HydrophobicContact CD2-CD1 4.45Å; W129-L140 HydrophobicContact CE3-CB 4.34Å; W129-L140 HydrophobicContact CE3-CD1 3.61Å; W129-L140 HydrophobicContact CZ3-CD1 3.8Å; W129-L140 PolarHBondContact N-O 3.36Å; W129-L140 PolarHBondContact O-N 3.36Å; W129-M142 HydrophobicContact CB-CE 4.15Å; W129-W201 HydrophobicContact CD2-CZ3 4.49Å; W129-W201 HydrophobicContact CE3-CD2 4.19Å; W129-W201 AromaticContact CE3-CE3 3.63Å; W129-W201 HydrophobicContact CE3-CE3 3.63Å; W129-W201 AromaticContact CE3-CH2 3.96Å; W129-W201 HydrophobicContact CE3-CH2 3.96Å; W129-W201 HydrophobicContact CE3-CZ2 4.47Å; W129-W201 AromaticContact CE3-CZ3 3.47Å; W129-W201 HydrophobicContact CE3-CZ3 3.47Å; W129-W201 VanDerWaalsContact CE3-CZ3 3.47Å; W129-W201 HydrophobicContact CZ3-CD2 4.31Å; W129-W201 AromaticContact CZ3-CE3 3.6Å; W129-W201 HydrophobicContact CZ3-CE3 3.6Å; W129-W201 AromaticContact CZ3-CZ3 3.81Å; W129-W201 HydrophobicContact CZ3-CZ3 3.81Å; W129-W202 HydrophobicContact CH2-CH2 4.3Å; W129-W202 HydrophobicContact CH2-CZ2 4.47Å; W129-W202 HydrophobicContact CZ3-CZ2 4.37Å
130	E	90.2	Very high	87.5	Confident	69 Å²	69	81.6 Å²	81.6	32%	0.322	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	98.1	173.9	-70.4	172.8	-159.6	0	0	109	P117 N119	P117-E130 WeakPolarHBondContact CD-O 3.21Å; P117-E130 HydrophobicContact CG-CB 4.13Å; P117-E130 PolarHBondContact O-N 3.25Å; N119-E130 PolarHBondContact ND2-OE1 2.83Å
131	Y	87.6	Confident	87.5	Confident	108 Å²	108	82 Å²	82	42%	0.424	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	119	178.8	-175.4	-113.9	0	0	0	110.4	W129 T133 A138 L140	W129-Y131 AromaticContact CH2-CD2 3.58Å; W129-Y131 HydrophobicContact CH2-CD2 3.58Å; W129-Y131 HydrophobicContact CH2-CE2 4.04Å; W129-Y131 HydrophobicContact CH2-CG 4.39Å; W129-Y131 AromaticContact CZ2-CD2 3.46Å; W129-Y131 HydrophobicContact CZ2-CD2 3.46Å; W129-Y131 VanDerWaalsContact CZ2-CD2 3.46Å; W129-Y131 HydrophobicContact CZ2-CE2 4.12Å; W129-Y131 HydrophobicContact CZ2-CG 4.39Å; W129-Y131 HydrophobicContact CZ3-CD2 4.32Å; W129-Y131 PolarHBondContact O-N 3.36Å; Y131-T133 HydrophobicContact CD1-CG2 3.5Å; Y131-T133 HydrophobicContact CE1-CG2 3.74Å; Y131-T133 PolarHBondContact O-N 2.9Å; Y131-A138 PolarHBondContact N-O 3.33Å; Y131-A138 PolarHBondContact O-N 3.46Å; Y131-L140 HydrophobicContact CG-CD1 4.34Å
132	E	84.2	Confident	87.5	Confident	161 Å²	161	80.8 Å²	80.8	75%	0.752	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	120.5	175.1	-66.9	-176.6	176	0	0	110.3
133	T	80.7	Confident	87.7	Confident	57 Å²	57	77.8 Å²	77.8	35%	0.35	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	163.2	173	71.3	0	0	0	0	110.4	Y131 E135 G136 A138	Y131-T133 HydrophobicContact CD1-CG2 3.5Å; Y131-T133 HydrophobicContact CE1-CG2 3.74Å; Y131-T133 PolarHBondContact O-N 2.9Å; T133-E135 PolarHBondContact O-N 2.92Å; T133-E135 VanDerWaalsContact O-N 3.14Å; T133-E135 PolarHBondContact OG1-N 2.88Å; T133-G136 WeakPolarHBondContact CA-O 3.43Å; T133-G136 WeakPolarHBondContact CB-O 3.29Å; T133-G136 PolarHBondContact N-O 3.04Å; T133-G136 PolarHBondContact O-N 2.87Å; T133-G136 VanDerWaalsContact O-N 3.15Å; T133-G136 VanDerWaalsContact O-O 3.14Å; T133-G136 PolarHBondContact OG1-N 3Å; T133-G136 PolarHBondContact OG1-O 2.88Å; T133-A138 HydrophobicContact CG2-CB 4.08Å
134	D	80.8	Confident	87.9	Confident	180 Å²	180	77.8 Å²	77.8	96%	0.963	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.1	175.4	-65.8	-31.5	0	0	0	112.9
135	E	77.6	Confident	88.3	Confident	196 Å²	196	74.4 Å²	74.4	92%	0.916	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-8.2	-178.3	-60.5	-173.9	169.4	0	0	113.6	T133	T133-E135 PolarHBondContact O-N 2.92Å; T133-E135 VanDerWaalsContact O-N 3.14Å; T133-E135 PolarHBondContact OG1-N 2.88Å
136	G	81.6	Confident	88.5	Confident	38 Å²	38	72.7 Å²	72.7	39%	0.392	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	141.4	-169.4	-177.3	0	0	0	0	0	113.8	T133	T133-G136 WeakPolarHBondContact CA-O 3.43Å; T133-G136 WeakPolarHBondContact CB-O 3.29Å; T133-G136 PolarHBondContact N-O 3.04Å; T133-G136 PolarHBondContact O-N 2.87Å; T133-G136 VanDerWaalsContact O-N 3.15Å; T133-G136 VanDerWaalsContact O-O 3.14Å; T133-G136 PolarHBondContact OG1-N 3Å; T133-G136 PolarHBondContact OG1-O 2.88Å
137	A	80	Confident	88.7	Confident	77 Å²	77	77.1 Å²	77.1	64%	0.636	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	116.8	174.3	0	0	0	0	0	110.5
138	A	86.6	Confident	88.7	Confident	34 Å²	34	76.3 Å²	76.3	28%	0.281	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.4	172.4	0	0	0	0	0	109.9	Y131 T133	Y131-A138 PolarHBondContact N-O 3.33Å; Y131-A138 PolarHBondContact O-N 3.46Å; T133-A138 HydrophobicContact CG2-CB 4.08Å
139	Q	89.2	Confident	88.9	Confident	107 Å²	107	78.6 Å²	78.6	50%	0.5	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	115.8	177	-69.1	-179.3	-25	0	0	109.6	I128 Y141	I128-Q139 HydrophobicContact CG2-CB 3.84Å; I128-Q139 HydrophobicContact CG2-CG 4.11Å; Q139-Y141 HydrophobicContact CB-CE2 4.14Å; Q139-Y141 PolarHBondContact OE1-OH 2.98Å
140	L	91.5	Very high	89	Confident	42 Å²	42	77.2 Å²	77.2	22%	0.22	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	113.8	-178.8	-65.4	179.6	0	0	0	110	W129 Y131 W201	W129-L140 HydrophobicContact CB-CB 4.35Å; W129-L140 HydrophobicContact CD2-CD1 4.45Å; W129-L140 HydrophobicContact CE3-CB 4.34Å; W129-L140 HydrophobicContact CE3-CD1 3.61Å; W129-L140 HydrophobicContact CZ3-CD1 3.8Å; W129-L140 PolarHBondContact N-O 3.36Å; W129-L140 PolarHBondContact O-N 3.36Å; Y131-L140 HydrophobicContact CG-CD1 4.34Å; L140-W201 HydrophobicContact CB-CD2 4.44Å; L140-W201 HydrophobicContact CB-CZ2 4.18Å; L140-W201 HydrophobicContact CD1-CB 4.44Å; L140-W201 HydrophobicContact CD1-CD2 4.23Å; L140-W201 HydrophobicContact CD1-CG 4.06Å
141	Y	91.9	Very high	89.3	Confident	80 Å²	80	77.4 Å²	77.4	31%	0.314	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.8	-172.4	-60.8	-96.6	0	0	0	112.6	E124 I128 Q139	E124-Y141 VanDerWaalsContact OE2-CD1 3.32Å; E124-Y141 WeakPolarHBondContact OE2-CD1 3.47Å; E124-Y141 WeakPolarHBondContact OE2-CE1 3.48Å; I128-Y141 HydrophobicContact CD1-CD1 4.09Å; I128-Y141 HydrophobicContact CD1-CE1 3.63Å; I128-Y141 HydrophobicContact CG1-CD1 3.74Å; I128-Y141 HydrophobicContact CG1-CE1 3.81Å; I128-Y141 HydrophobicContact CG2-CE1 4.5Å; Q139-Y141 HydrophobicContact CB-CE2 4.14Å; Q139-Y141 PolarHBondContact OE1-OH 2.98Å
142	M	93.1	Very high	89.7	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	82.6	169	-60.3	-173.9	-135.4	0	0	109.2	I89 C92 L114 P115 W127 W129 M191 W201	I89-M142 HydrophobicContact CD1-CB 3.89Å; C92-M142 PolarHBondContact SG-O 3.16Å; C92-M142 VanDerWaalsContact SG-O 3.39Å; L114-M142 HydrophobicContact CD2-CE 4.14Å; L114-M142 HydrophobicContact CD2-SD 3.95Å; P115-M142 HydrophobicContact CG-CE 4Å; W127-M142 HydrophobicContact CB-CB 4.07Å; W127-M142 HydrophobicContact CB-CG 4.49Å; W127-M142 HydrophobicContact CB-SD 4.28Å; W127-M142 PolarHBondContact N-O 2.86Å; W127-M142 WeakPolarHBondContact O-CB 3.32Å; W127-M142 PolarHBondContact O-N 3.26Å; W129-M142 HydrophobicContact CB-CE 4.15Å; M142-M191 HydrophobicContact SD-SD 4.42Å; M142-W201 HydrophobicContact CE-CH2 3.48Å; M142-W201 VanDerWaalsContact CE-CH2 3.48Å; M142-W201 HydrophobicContact CE-CZ2 4.23Å; M142-W201 HydrophobicContact CE-CZ3 4.43Å; M142-W201 HydrophobicContact CG-CH2 3.52Å; M142-W201 HydrophobicContact CG-CZ2 3.43Å; M142-W201 VanDerWaalsContact CG-CZ2 3.43Å; M142-W201 HydrophobicContact SD-CH2 3.84Å; M142-W201 HydrophobicContact SD-CZ2 4.37Å
143	E	91.9	Very high	90.3	Very high	97 Å²	97	67.9 Å²	67.9	45%	0.453	36%	0.36	S	S	.	.			trans	-91.2	161.2	-178.4	-61.8	177.6	-176	0	0	112.5	I89 A126 G145 S146	I89-E143 WeakPolarHBondContact CB-O 3.42Å; I89-E143 WeakPolarHBondContact CD1-O 3.19Å; A126-E143 HydrophobicContact CB-CG 4.03Å; E143-G145 PolarHBondContact O-N 2.95Å; E143-S146 WeakPolarHBondContact O-CB 3.37Å; E143-S146 PolarHBondContact O-N 3.4Å; E143-S146 VanDerWaalsContact O-N 3.13Å; E143-S146 PolarHBondContact O-OG 2.8Å
144	K	93.5	Very high	91	Very high	160 Å²	160	69 Å²	69	70%	0.696	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	124.6	169.4	-179.8	172	179.9	166.5	0	110.7	S90	S90-K144 WeakPolarHBondContact O-CD 3.42Å; S90-K144 WeakPolarHBondContact O-CE 3.45Å; S90-K144 WeakPolarHBondContact O-CG 3.34Å
145	G	93	Very high	91.6	Very high	26 Å²	26	61.4 Å²	61.4	27%	0.268	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-5	176.1	0	0	0	0	0	115.6	K88 I89 E143	K88-G145 VanDerWaalsContact CE-O 3.22Å; K88-G145 WeakPolarHBondContact CE-O 3.3Å; K88-G145 WeakPolarHBondContact CG-O 3.43Å; I89-G145 WeakPolarHBondContact O-CA 3.31Å; I89-G145 PolarHBondContact O-N 2.83Å; E143-G145 PolarHBondContact O-N 2.95Å
146	S	93.4	Very high	92.3	Very high	29 Å²	29	54.7 Å²	54.7	20%	0.203	30%	0.295	C	S	.	.			trans	-64.6	143.2	168.8	-65.6	0	0	0	0	111	K88 I89 E143	K88-S146 WeakPolarHBondContact CA-O 3.41Å; I89-S146 PolarHBondContact N-O 2.63Å; E143-S146 WeakPolarHBondContact O-CB 3.37Å; E143-S146 PolarHBondContact O-N 3.4Å; E143-S146 VanDerWaalsContact O-N 3.13Å; E143-S146 PolarHBondContact O-OG 2.8Å
147	I	95.4	Very high	92.9	Very high	93 Å²	93	54.5 Å²	54.5	48%	0.477	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	125.3	175.2	-58.7	174.8	0	0	0	107.8	G87 C198 T199	G87-I147 CarbonylContact O-C 3.58Å; G87-I147 WeakPolarHBondContact O-CA 3.3Å; I147-C198 CarbonylContact O-C 3.51Å; I147-C198 VanDerWaalsContact O-CA 3.3Å; I147-C198 WeakPolarHBondContact O-CA 3.47Å; I147-T199 HydrophobicContact CG2-CG2 4.01Å; I147-T199 PolarHBondContact O-N 2.9Å
148	V	95.4	Very high	93.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	146.4	-176.7	-69	0	0	0	0	111.4	Y86 G87 I89 V99 M191 G197 C198	Y86-V148 WeakPolarHBondContact CA-O 3.41Å; G87-V148 PolarHBondContact N-O 2.7Å; G87-V148 WeakPolarHBondContact O-CG2 3.29Å; G87-V148 PolarHBondContact O-N 3.21Å; I89-V148 HydrophobicContact CD1-CG1 3.67Å; I89-V148 HydrophobicContact CG1-CG1 3.73Å; I89-V148 HydrophobicContact CG1-CG2 4.07Å; V99-V148 HydrophobicContact CG1-CG2 3.79Å; V99-V148 HydrophobicContact CG2-CG2 3.86Å; V148-M191 HydrophobicContact CB-CE 3.67Å; V148-M191 HydrophobicContact CB-SD 4.12Å; V148-M191 HydrophobicContact CG1-CE 4.03Å; V148-M191 HydrophobicContact CG1-SD 4.18Å; V148-M191 HydrophobicContact CG2-CE 3.54Å; V148-G197 CarbonylContact C-O 3.46Å; V148-G197 VanDerWaalsContact CA-O 3.26Å; V148-G197 WeakPolarHBondContact CA-O 3.37Å; V148-C198 HydrophobicContact CG1-CB 4.49Å
149	R	95.9	Very high	93.4	Very high	68 Å²	68	57 Å²	57	26%	0.257	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.5	168.4	-173.7	-172.2	-67.4	154.5	-2.1	108.3	I84 L85 Y86 G195 L196 G197	I84-R149 HydrophobicContact CG2-CG 3.26Å; L85-R149 WeakPolarHBondContact O-CA 3.42Å; Y86-R149 HydrophobicContact CD1-CB 4.26Å; Y86-R149 HydrophobicContact CE1-CB 4.12Å; Y86-R149 HydrophobicContact CE1-CG 4.15Å; Y86-R149 PolarHBondContact OH-NE 2.71Å; Y86-R149 PolarHBondContact OH-NH2 2.82Å; R149-G195 VanDerWaalsContact CD-O 3.31Å; R149-G195 WeakPolarHBondContact CD-O 3.35Å; R149-G195 PolarHBondContact NH1-O 2.74Å; R149-L196 HydrophobicContact CG-CD2 3.85Å; R149-L196 CarbonylContact O-C 3.6Å; R149-L196 WeakPolarHBondContact O-CA 3.27Å; R149-L196 WeakPolarHBondContact O-CB 3.41Å; R149-G197 PolarHBondContact N-O 3.02Å; R149-G197 PolarHBondContact O-N 3.46Å
150	F	95.7	Very high	93	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	153.2	179.1	64.8	-87	0	0	0	110.1	I84 L85 V99 I107 V152 L187 T190 M191	I84-F150 CarbonylContact C-O 3.56Å; I84-F150 WeakPolarHBondContact CA-O 3.48Å; L85-F150 HydrophobicContact CB-CE1 3.94Å; L85-F150 HydrophobicContact CB-CE2 3.9Å; L85-F150 HydrophobicContact CB-CZ 3.5Å; L85-F150 HydrophobicContact CD1-CE2 4.19Å; L85-F150 HydrophobicContact CD1-CZ 4.07Å; L85-F150 HydrophobicContact CG-CZ 4.39Å; L85-F150 PolarHBondContact N-O 2.9Å; L85-F150 PolarHBondContact O-N 2.81Å; V99-F150 HydrophobicContact CG1-CD1 4.18Å; V99-F150 HydrophobicContact CG1-CE1 3.84Å; I107-F150 HydrophobicContact CD1-CE1 4.27Å; I107-F150 HydrophobicContact CD1-CZ 3.74Å; I107-F150 HydrophobicContact CG1-CZ 4.4Å; I107-F150 HydrophobicContact CG2-CD2 4.32Å; I107-F150 HydrophobicContact CG2-CE1 4.35Å; I107-F150 HydrophobicContact CG2-CE2 3.75Å; I107-F150 HydrophobicContact CG2-CZ 3.76Å; F150-V152 HydrophobicContact CE2-CG2 4.24Å; F150-L187 HydrophobicContact CE2-CD2 3.6Å; F150-L187 HydrophobicContact CZ-CD2 4.12Å; F150-T190 CarbonylContact C-O 3.43Å; F150-T190 VanDerWaalsContact CA-O 3.31Å; F150-T190 WeakPolarHBondContact CA-O 3.45Å; F150-T190 WeakPolarHBondContact CB-O 3.38Å; F150-M191 HydrophobicContact CB-CE 4.15Å; F150-M191 HydrophobicContact CB-CG 3.88Å
151	R	96.7	Very high	92.3	Very high	72 Å²	72	56.3 Å²	56.3	27%	0.272	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	133.3	172.5	-179.9	174.7	-69	158.4	16.7	109.7	E83 I84 I153 G189 T190 E193 L196	E83-R151 CarbonylContact O-C 3.52Å; E83-R151 WeakPolarHBondContact O-CA 3.49Å; I84-R151 HydrophobicContact CG1-CB 4.31Å; I84-R151 HydrophobicContact CG1-CG 4.5Å; R151-I153 PolarHBondContact O-N 2.76Å; R151-G189 CarbonylContact O-C 3.02Å; R151-G189 WeakPolarHBondContact O-CA 3.41Å; R151-T190 HydrophobicContact CB-CG2 3.94Å; R151-T190 PolarHBondContact N-O 3.46Å; R151-T190 PolarHBondContact O-N 3.2Å; R151-E193 IonicContact CZ-OE1 3.45Å; R151-E193 IonicContact CZ-OE2 3Å; R151-E193 IonicContact NH1-OE1 3.64Å; R151-E193 PolarHBondContact NH1-OE1 3.2Å; R151-E193 IonicContact NH1-OE2 3.68Å; R151-E193 PolarHBondContact NH1-OE2 2.96Å; R151-E193 IonicContact NH2-OE2 2.83Å; R151-E193 PolarHBondContact NH2-OE2 2.92Å; R151-L196 HydrophobicContact CB-CD1 4.06Å
152	V	96.6	Very high	91.3	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	123.7	175.4	-176.7	0	0	0	0	109.7	P79 G82 E83 L85 F150 M155 L187	P79-V152 HydrophobicContact CB-CG2 4.28Å; G82-V152 PolarHBondContact N-O 2.99Å; E83-V152 HydrophobicContact CB-CG2 4.33Å; E83-V152 WeakPolarHBondContact O-CG2 3.29Å; E83-V152 PolarHBondContact O-N 3.47Å; L85-V152 HydrophobicContact CD1-CG2 3.84Å; L85-V152 HydrophobicContact CG-CG2 4.23Å; F150-V152 HydrophobicContact CE2-CG2 4.24Å; V152-M155 HydrophobicContact CG1-CE 3.87Å; V152-L187 HydrophobicContact CG1-CD1 3.8Å; V152-L187 HydrophobicContact CG1-CD2 4.37Å; V152-L187 HydrophobicContact CG1-CG 4.06Å; V152-L187 HydrophobicContact CG2-CD1 4.35Å; V152-L187 HydrophobicContact CG2-CD2 3.82Å; V152-L187 HydrophobicContact CG2-CG 4.41Å
153	I	95.9	Very high	90	Very high	68 Å²	68	63.6 Å²	63.6	35%	0.349	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-47.4	172.7	-63.4	170.1	0	0	0	110.1	V81 N113 R151 Y188 T190	V81-I153 WeakPolarHBondContact CG1-O 3.44Å; V81-I153 WeakPolarHBondContact CG2-O 3.44Å; N113-I153 WeakPolarHBondContact OD1-CD1 3.35Å; R151-I153 PolarHBondContact O-N 2.76Å; I153-Y188 PolarHBondContact N-O 3.01Å; I153-T190 VanDerWaalsContact CD1-CB 3.41Å; I153-T190 HydrophobicContact CD1-CG2 3.7Å; I153-T190 HydrophobicContact CG1-CG2 3.69Å
154	D	94.7	Very high	88	Confident	82 Å²	82	67.1 Å²	67.1	44%	0.439	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	169	-173.5	-158.5	7.4	0	0	0	111.3	Y188	D154-Y188 HydrophobicContact CB-CD2 4.39Å; D154-Y188 PolarHBondContact N-O 2.85Å; D154-Y188 PolarHBondContact O-N 2.97Å
155	M	93.5	Very high	85.8	Confident	20 Å²	20	64 Å²	64	10%	0.099	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	142.3	168.9	70.6	-79.5	-57	0	0	112	R78 P79 V81 V152 F157 F185 V186 L187	R78-M155 PolarHBondContact NH1-SD 2.72Å; R78-M155 PolarHBondContact NH2-SD 3.29Å; P79-M155 VanDerWaalsContact O-CE 3.31Å; P79-M155 WeakPolarHBondContact O-CE 3.48Å; V81-M155 HydrophobicContact CG2-CE 4.3Å; V81-M155 HydrophobicContact CG2-SD 4.49Å; V152-M155 HydrophobicContact CG1-CE 3.87Å; M155-F157 HydrophobicContact CG-CE2 4.21Å; M155-F185 HydrophobicContact CB-CE2 3.74Å; M155-F185 HydrophobicContact CB-CZ 4.27Å; M155-F185 HydrophobicContact CG-CE2 3.86Å; M155-F185 HydrophobicContact CG-CZ 4.43Å; M155-V186 WeakPolarHBondContact CA-O 3.43Å; M155-L187 HydrophobicContact CB-CD1 4.09Å; M155-L187 HydrophobicContact CE-CD1 4.26Å
156	T	93.7	Very high	83.4	Confident	55 Å²	55	71.2 Å²	71.2	34%	0.337	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.4	-178.7	-56.2	0	0	0	0	110.2	F185 V186 Y188	T156-F185 WeakPolarHBondContact O-CA 3.43Å; T156-V186 PolarHBondContact N-O 3.09Å; T156-V186 PolarHBondContact O-N 3.27Å; T156-Y188 WeakPolarHBondContact OG1-CE2 3.31Å
157	F	92.8	Very high	80.7	Confident	34 Å²	34	75.2 Å²	75.2	15%	0.149	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.4	169.8	-65.2	-89.5	0	0	0	108.5	V38 M155 S184 F185	V38-F157 HydrophobicContact CG1-CD1 4.11Å; V38-F157 HydrophobicContact CG1-CE1 4.28Å; M155-F157 HydrophobicContact CG-CE2 4.21Å; F157-S184 WeakPolarHBondContact CA-O 3.48Å; F157-F185 HydrophobicContact CD1-CB 4.18Å; F157-F185 AromaticContact CD1-CD2 3.55Å; F157-F185 HydrophobicContact CD1-CD2 3.55Å; F157-F185 HydrophobicContact CD1-CE2 4.27Å; F157-F185 HydrophobicContact CD1-CG 4.14Å; F157-F185 HydrophobicContact CD2-CD2 4.29Å; F157-F185 HydrophobicContact CD2-CE2 4.45Å; F157-F185 HydrophobicContact CE1-CB 4.27Å; F157-F185 AromaticContact CE1-CD2 3.24Å; F157-F185 HydrophobicContact CE1-CD2 3.24Å; F157-F185 AromaticContact CE1-CE2 3.6Å; F157-F185 HydrophobicContact CE1-CE2 3.6Å; F157-F185 AromaticContact CE1-CG 3.82Å; F157-F185 HydrophobicContact CE1-CG 3.82Å; F157-F185 HydrophobicContact CE1-CZ 4.46Å; F157-F185 HydrophobicContact CE2-CD2 4.02Å; F157-F185 AromaticContact CE2-CE2 3.8Å; F157-F185 HydrophobicContact CE2-CE2 3.8Å; F157-F185 HydrophobicContact CG-CD2 4.08Å; F157-F185 AromaticContact CZ-CD2 3.5Å; F157-F185 HydrophobicContact CZ-CD2 3.5Å; F157-F185 VanDerWaalsContact CZ-CD2 3.5Å; F157-F185 AromaticContact CZ-CE2 3.33Å; F157-F185 HydrophobicContact CZ-CE2 3.33Å; F157-F185 HydrophobicContact CZ-CG 4.41Å; F157-F185 HydrophobicContact CZ-CZ 4.17Å
158	T	90.8	Very high	77.8	Confident	41 Å²	41	78.8 Å²	78.8	25%	0.252	43%	0.43	S	S	.	.			trans	-113.8	123.6	176.3	-55.8	0	0	0	0	108.2	V160 S184	T158-V160 HydrophobicContact CG2-CG2 4.3Å; T158-V160 PolarHBondContact O-N 3.33Å; T158-V160 VanDerWaalsContact O-N 3.13Å; T158-S184 PolarHBondContact N-O 2.96Å; T158-S184 WeakPolarHBondContact O-CA 3.42Å; T158-S184 WeakPolarHBondContact O-CB 3.35Å
159	D	85.7	Confident	74.7	Confident	122 Å²	122	82.6 Å²	82.6	65%	0.652	47%	0.469	S	S	*	.			trans	-77	98.8	173.1	-169.5	8.7	0	0	0	108.9	L40	L40-D159 HydrophobicContact CD1-CB 4.26Å; L40-D159 HydrophobicContact CD2-CB 4.38Å
160	V	81.7	Confident	71.6	Confident	40 Å²	40	87.3 Å²	87.3	24%	0.242	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-88.7	118	178.2	-173.9	0	0	0	0	107	T158 E182 S184	T158-V160 HydrophobicContact CG2-CG2 4.3Å; T158-V160 PolarHBondContact O-N 3.33Å; T158-V160 VanDerWaalsContact O-N 3.13Å; V160-E182 WeakPolarHBondContact CG2-O 3.38Å; V160-S184 WeakPolarHBondContact CG2-OG 3.47Å
161	P	77.2	Confident	68.5	Low	95 Å²	95	90.2 Å²	90.2	62%	0.617	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-58.8	146.1	174.6	25.5	-33	0	0	0	109	T163	P161-T163 PolarHBondContact O-N 2.97Å
162	P	70.8	Confident	65.4	Low	119 Å²	119	93.2 Å²	93.2	77%	0.773	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-54.1	116.4	174.1	22	-30.4	0	0	0	107.6	E164	P162-E164 PolarHBondContact O-N 2.92Å
163	T	64.7	Low	62.2	Low	113 Å²	113	96.5 Å²	96.5	69%	0.693	60%	0.595	S	S	*	*			trans	-60.6	108	170.7	-49.1	0	0	0	0	105.2	P161 S165	P161-T163 PolarHBondContact O-N 2.97Å; T163-S165 PolarHBondContact O-N 3.26Å
164	E	50.9	Low	59.5	Low	171 Å²	171	99 Å²	99	80%	0.799	62%	0.616	S	S	*	*			trans	-56.6	101.5	164.5	-67.6	179.9	-177.8	0	0	104.5	P162 E166	P162-E164 PolarHBondContact O-N 2.92Å; E164-E166 PolarHBondContact O-N 3.01Å
165	S	48	Very low	56.5	Low	96 Å²	96	100 Å²	100	67%	0.671	63%	0.629	S	S	*	*			trans	-61	98.4	162.8	52.4	0	0	0	0	104.1	T163 T167	T163-S165 PolarHBondContact O-N 3.26Å; S165-T167 PolarHBondContact O-N 3.06Å
166	E	41.2	Very low	54	Low	177 Å²	177	104.3 Å²	104.3	83%	0.827	66%	0.661	S	S	*	*			trans	-54.8	90.7	169.3	-71.4	179.3	169.1	0	0	106.8	E164	E164-E166 PolarHBondContact O-N 3.01Å
167	T	37.2	Very low	51.2	Low	113 Å²	113	110 Å²	110	69%	0.693	68%	0.684	S	S	*	*			trans	-134	58.2	166.7	-46.3	0	0	0	0	105.5	S165	S165-T167 PolarHBondContact O-N 3.06Å
168	D	35.2	Very low	48.9	Very low	167 Å²	167	116 Å²	116	89%	0.893	72%	0.717	S	S	*	*	S	Bend	trans	-164.5	103.7	157.7	-86.6	-32.9	0	0	0	108.8
169	G	29.5	Very low	46.7	Very low	80 Å²	80	123.4 Å²	123.4	83%	0.825	75%	0.746	S	S	*	*			trans	93.7	106.1	150.6	0	0	0	0	0	118.9
170	D	32.1	Very low	45	Very low	168 Å²	168	126.2 Å²	126.2	90%	0.898	76%	0.755	S	S	*	*			trans	91.2	105.7	141.2	-131.5	9.7	0	0	0	119.6
171	G	29.1	Very low	44.3	Very low	60 Å²	60	127.7 Å²	127.7	62%	0.619	77%	0.772	S	S	*	*				59.3	107.3	126.7	0	0	0	0	0	120.1
172	S	32.7	Very low	44.3	Very low	135 Å²	135	129.7 Å²	129.7	94%	0.944	77%	0.773	S	S	*	*			trans	68.6	98.9	146.6	50.9	0	0	0	0	119.5
173	G	28.2	Very low	44.9	Very low	70 Å²	70	126 Å²	126	72%	0.722	75%	0.749	S	S	*	*			trans	171.5	139.2	159.3	0	0	0	0	0	111.2
174	P	39.2	Very low	46	Very low	121 Å²	121	122.7 Å²	122.7	79%	0.786	73%	0.731	S	S	*	*			trans	-83.5	144.5	-146	33.4	-34.1	0	0	0	113.5	S176	P174-S176 PolarHBondContact O-N 3.18Å
175	S	32.8	Very low	48	Very low	103 Å²	103	114.7 Å²	114.7	72%	0.72	69%	0.694	S	S	*	*			trans	26.1	90.9	157.8	55.5	0	0	0	0	114	E177	S175-E177 PolarHBondContact O-N 3.3Å
176	S	40.2	Very low	50.2	Low	111 Å²	111	110.7 Å²	110.7	78%	0.776	67%	0.665	S	S	*	*			trans	-50.4	93.7	162	-48.6	0	0	0	0	107.7	P174 N178	P174-S176 PolarHBondContact O-N 3.18Å; S176-N178 PolarHBondContact O-N 3.3Å; S176-N178 VanDerWaalsContact O-N 3.1Å
177	E	36.1	Very low	52.8	Low	173 Å²	173	102.2 Å²	102.2	81%	0.808	63%	0.625	S	S	*	*			trans	-47	122.6	159.5	-70.8	174.6	158.8	0	0	104.1	S175 K179	S175-E177 PolarHBondContact O-N 3.3Å; E177-K179 PolarHBondContact O-N 2.96Å
178	N	42.8	Very low	55.6	Low	160 Å²	160	101 Å²	101	86%	0.856	61%	0.609	S	S	*	*			trans	-49.6	88.8	168.9	-94.3	-12.9	0	0	0	106.6	S176 Q180	S176-N178 PolarHBondContact O-N 3.3Å; S176-N178 VanDerWaalsContact O-N 3.1Å; N178-Q180 PolarHBondContact O-N 3.41Å
179	K	45.6	Very low	58.6	Low	198 Å²	198	93.1 Å²	93.1	86%	0.861	57%	0.567	S	S	*	*			trans	-60	97.4	158.1	-75.3	-178.1	-180	176.9	0	101.7	E177 A181	E177-K179 PolarHBondContact O-N 2.96Å; K179-A181 VanDerWaalsContact C-N 3.28Å; K179-A181 PolarHBondContact O-N 3.44Å
180	Q	50.3	Low	61.7	Low	180 Å²	180	89.6 Å²	89.6	84%	0.841	53%	0.529	S	S	*	.			trans	-49.9	107	171.7	-83.6	172.8	-35.3	0	0	104.3	N178 E182	N178-Q180 PolarHBondContact O-N 3.41Å; Q180-E182 PolarHBondContact O-N 3.32Å
181	A	65.7	Low	64.7	Low	72 Å²	72	81.7 Å²	81.7	60%	0.595	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-57.6	116.7	-179.9	0	0	0	0	0	105.2	K179	K179-A181 VanDerWaalsContact C-N 3.28Å; K179-A181 PolarHBondContact O-N 3.44Å
182	E	77.5	Confident	67.7	Low	136 Å²	136	81.9 Å²	81.9	64%	0.636	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-53.5	129.8	179.7	-68.6	-179.1	172.6	0	0	107.8	V160 Q180 S184	V160-E182 WeakPolarHBondContact CG2-O 3.38Å; Q180-E182 PolarHBondContact O-N 3.32Å; E182-S184 PolarHBondContact O-N 3.49Å
183	P	83.9	Confident	70.5	Confident	42 Å²	42	79.1 Å²	79.1	27%	0.273	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-60.8	131.4	-177.9	21.8	-33	0	0	0	110.5	E106 F185 V186	E106-P183 HydrophobicContact CB-CB 4.31Å; E106-P183 HydrophobicContact CG-CB 3.78Å; P183-F185 PolarHBondContact O-N 2.96Å; P183-F185 VanDerWaalsContact O-N 3.13Å; P183-V186 HydrophobicContact CB-CG2 3.93Å; P183-V186 HydrophobicContact CG-CG2 3.34Å
184	S	87.5	Confident	73.3	Confident	44 Å²	44	81.7 Å²	81.7	31%	0.308	46%	0.457	S	S	.	.	S	Bend	trans	-67.6	-13.2	-178.9	-47.3	0	0	0	0	113.7	F157 T158 V160 E182	F157-S184 WeakPolarHBondContact CA-O 3.48Å; T158-S184 PolarHBondContact N-O 2.96Å; T158-S184 WeakPolarHBondContact O-CA 3.42Å; T158-S184 WeakPolarHBondContact O-CB 3.35Å; V160-S184 WeakPolarHBondContact CG2-OG 3.47Å; E182-S184 PolarHBondContact O-N 3.49Å
185	F	93.3	Very high	75.6	Confident	3 Å²	3	76.9 Å²	76.9	1%	0.013	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	119.2	176.5	178.6	-128.9	0	0	0	110.6	V38 V44 F77 F104 E106 M155 T156 F157 P183 L187	V38-F185 HydrophobicContact CG1-CB 3.76Å; V38-F185 HydrophobicContact CG2-CB 3.87Å; V44-F185 HydrophobicContact CG2-CD1 3.61Å; V44-F185 HydrophobicContact CG2-CE1 4.04Å; F77-F185 HydrophobicContact CD1-CE1 4.45Å; F77-F185 HydrophobicContact CE1-CE1 4.49Å; F104-F185 HydrophobicContact CD2-CD1 4.25Å; F104-F185 HydrophobicContact CE1-CD1 4.46Å; F104-F185 HydrophobicContact CE1-CE1 4.31Å; F104-F185 AromaticContact CE2-CD1 3.37Å; F104-F185 HydrophobicContact CE2-CD1 3.37Å; F104-F185 AromaticContact CE2-CE1 3.92Å; F104-F185 HydrophobicContact CE2-CE1 3.92Å; F104-F185 HydrophobicContact CE2-CG 4.28Å; F104-F185 AromaticContact CZ-CD1 3.49Å; F104-F185 HydrophobicContact CZ-CD1 3.49Å; F104-F185 VanDerWaalsContact CZ-CD1 3.49Å; F104-F185 AromaticContact CZ-CE1 3.74Å; F104-F185 HydrophobicContact CZ-CE1 3.74Å; F104-F185 HydrophobicContact CZ-CG 4.29Å; F104-F185 WeakPolarHBondContact CZ-O 3.19Å; E106-F185 VanDerWaalsContact CB-O 3.3Å; E106-F185 WeakPolarHBondContact CB-O 3.38Å; M155-F185 HydrophobicContact CB-CE2 3.74Å; M155-F185 HydrophobicContact CB-CZ 4.27Å; M155-F185 HydrophobicContact CG-CE2 3.86Å; M155-F185 HydrophobicContact CG-CZ 4.43Å; T156-F185 WeakPolarHBondContact O-CA 3.43Å; F157-F185 HydrophobicContact CD1-CB 4.18Å; F157-F185 AromaticContact CD1-CD2 3.55Å; F157-F185 HydrophobicContact CD1-CD2 3.55Å; F157-F185 HydrophobicContact CD1-CE2 4.27Å; F157-F185 HydrophobicContact CD1-CG 4.14Å; F157-F185 HydrophobicContact CD2-CD2 4.29Å; F157-F185 HydrophobicContact CD2-CE2 4.45Å; F157-F185 HydrophobicContact CE1-CB 4.27Å; F157-F185 AromaticContact CE1-CD2 3.24Å; F157-F185 HydrophobicContact CE1-CD2 3.24Å; F157-F185 AromaticContact CE1-CE2 3.6Å; F157-F185 HydrophobicContact CE1-CE2 3.6Å; F157-F185 AromaticContact CE1-CG 3.82Å; F157-F185 HydrophobicContact CE1-CG 3.82Å; F157-F185 HydrophobicContact CE1-CZ 4.46Å; F157-F185 HydrophobicContact CE2-CD2 4.02Å; F157-F185 AromaticContact CE2-CE2 3.8Å; F157-F185 HydrophobicContact CE2-CE2 3.8Å; F157-F185 HydrophobicContact CG-CD2 4.08Å; F157-F185 AromaticContact CZ-CD2 3.5Å; F157-F185 HydrophobicContact CZ-CD2 3.5Å; F157-F185 VanDerWaalsContact CZ-CD2 3.5Å; F157-F185 AromaticContact CZ-CE2 3.33Å; F157-F185 HydrophobicContact CZ-CE2 3.33Å; F157-F185 HydrophobicContact CZ-CG 4.41Å; F157-F185 HydrophobicContact CZ-CZ 4.17Å; P183-F185 PolarHBondContact O-N 2.96Å; P183-F185 VanDerWaalsContact O-N 3.13Å; F185-L187 HydrophobicContact CZ-CD1 4.44Å
186	V	94.8	Very high	78.5	Confident	11 Å²	11	72.2 Å²	72.2	7%	0.067	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	136.9	177.1	-176.8	0	0	0	0	109.7	E106 F108 M155 T156 P183 Y188	E106-V186 WeakPolarHBondContact O-CA 3.16Å; F108-V186 HydrophobicContact CB-CG1 4.45Å; M155-V186 WeakPolarHBondContact CA-O 3.43Å; T156-V186 PolarHBondContact N-O 3.09Å; T156-V186 PolarHBondContact O-N 3.27Å; P183-V186 HydrophobicContact CB-CG2 3.93Å; P183-V186 HydrophobicContact CG-CG2 3.34Å; V186-Y188 HydrophobicContact CB-CE2 4.38Å; V186-Y188 HydrophobicContact CG1-CE1 4.04Å; V186-Y188 HydrophobicContact CG1-CE2 4.1Å
187	L	95.6	Very high	81	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.9	173.7	-165.9	96.4	0	0	0	110.1	P79 L85 F104 E106 I107 F108 F150 V152 M155 F185	P79-L187 HydrophobicContact CB-CD1 4.43Å; P79-L187 HydrophobicContact CG-CD1 3.34Å; L85-L187 HydrophobicContact CD1-CD2 4.26Å; F104-L187 HydrophobicContact CE1-CB 3.89Å; F104-L187 HydrophobicContact CZ-CB 4.45Å; E106-L187 PolarHBondContact O-N 3.32Å; I107-L187 CarbonylContact C-O 3.6Å; I107-L187 WeakPolarHBondContact CA-O 3.33Å; I107-L187 HydrophobicContact CB-CB 4.41Å; I107-L187 HydrophobicContact CB-CD2 4.47Å; I107-L187 HydrophobicContact CG1-CB 4.03Å; I107-L187 HydrophobicContact CG1-CD2 3.93Å; I107-L187 HydrophobicContact CG2-CB 4.33Å; I107-L187 HydrophobicContact CG2-CD2 3.87Å; F108-L187 PolarHBondContact N-O 2.88Å; F150-L187 HydrophobicContact CE2-CD2 3.6Å; F150-L187 HydrophobicContact CZ-CD2 4.12Å; V152-L187 HydrophobicContact CG1-CD1 3.8Å; V152-L187 HydrophobicContact CG1-CD2 4.37Å; V152-L187 HydrophobicContact CG1-CG 4.06Å; V152-L187 HydrophobicContact CG2-CD1 4.35Å; V152-L187 HydrophobicContact CG2-CD2 3.82Å; V152-L187 HydrophobicContact CG2-CG 4.41Å; M155-L187 HydrophobicContact CB-CD1 4.09Å; M155-L187 HydrophobicContact CE-CD1 4.26Å; F185-L187 HydrophobicContact CZ-CD1 4.44Å
188	Y	96.6	Very high	83.7	Confident	87 Å²	87	58.7 Å²	58.7	34%	0.341	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.3	174.3	-61.2	-78.6	0	0	0	110.7	F108 I153 D154 T156 V186	F108-Y188 HydrophobicContact CB-CD1 4.25Å; F108-Y188 HydrophobicContact CB-CE1 4.35Å; F108-Y188 AromaticContact CD1-CD1 4Å; F108-Y188 HydrophobicContact CD1-CD1 4Å; F108-Y188 AromaticContact CD1-CE1 3.94Å; F108-Y188 HydrophobicContact CD1-CE1 3.94Å; F108-Y188 WeakPolarHBondContact O-CA 3.37Å; I153-Y188 PolarHBondContact N-O 3.01Å; D154-Y188 HydrophobicContact CB-CD2 4.39Å; D154-Y188 PolarHBondContact N-O 2.85Å; D154-Y188 PolarHBondContact O-N 2.97Å; T156-Y188 WeakPolarHBondContact OG1-CE2 3.31Å; V186-Y188 HydrophobicContact CB-CE2 4.38Å; V186-Y188 HydrophobicContact CG1-CE1 4.04Å; V186-Y188 HydrophobicContact CG1-CE2 4.1Å
189	G	96.4	Very high	86	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	168.2	-179.7	0	0	0	0	0	114.1	F108 R151	F108-G189 PolarHBondContact O-N 3.16Å; R151-G189 CarbonylContact O-C 3.02Å; R151-G189 WeakPolarHBondContact O-CA 3.41Å
190	T	96.4	Very high	88.1	Confident	7 Å²	7	46.5 Å²	46.5	4%	0.043	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	148.6	167.8	177.2	0	0	0	0	111.9	N113 F150 R151 I153 S192	N113-T190 PolarHBondContact O-OG1 3.11Å; N113-T190 VanDerWaalsContact O-OG1 3.14Å; F150-T190 CarbonylContact C-O 3.43Å; F150-T190 VanDerWaalsContact CA-O 3.31Å; F150-T190 WeakPolarHBondContact CA-O 3.45Å; F150-T190 WeakPolarHBondContact CB-O 3.38Å; R151-T190 HydrophobicContact CB-CG2 3.94Å; R151-T190 PolarHBondContact N-O 3.46Å; R151-T190 PolarHBondContact O-N 3.2Å; I153-T190 VanDerWaalsContact CD1-CB 3.41Å; I153-T190 HydrophobicContact CD1-CG2 3.7Å; I153-T190 HydrophobicContact CG1-CG2 3.69Å; T190-S192 PolarHBondContact OG1-N 2.84Å; T190-S192 PolarHBondContact OG1-OG 3.16Å
191	M	95.2	Very high	89.8	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	24%	0.237	C	C	.	.			trans	-121.9	10	170.5	-62.1	-175.2	-163.9	0	0	112.3	V99 V109 N113 L114 P115 M142 V148 F150 E193 L196	V99-M191 HydrophobicContact CG2-CE 3.79Å; V109-M191 HydrophobicContact CB-CE 4.42Å; V109-M191 HydrophobicContact CG1-CG 4.26Å; V109-M191 HydrophobicContact CG2-CE 3.91Å; N113-M191 PolarHBondContact O-N 3.35Å; L114-M191 HydrophobicContact CD2-SD 4.43Å; P115-M191 WeakPolarHBondContact CG-O 3.32Å; M142-M191 HydrophobicContact SD-SD 4.42Å; V148-M191 HydrophobicContact CB-CE 3.67Å; V148-M191 HydrophobicContact CB-SD 4.12Å; V148-M191 HydrophobicContact CG1-CE 4.03Å; V148-M191 HydrophobicContact CG1-SD 4.18Å; V148-M191 HydrophobicContact CG2-CE 3.54Å; F150-M191 HydrophobicContact CB-CE 4.15Å; F150-M191 HydrophobicContact CB-CG 3.88Å; M191-E193 VanDerWaalsContact C-N 3.3Å; M191-E193 PolarHBondContact O-N 3.32Å; M191-L196 HydrophobicContact CB-CB 4.43Å
192	S	92	Very high	90.8	Very high	64 Å²	64	39.4 Å²	39.4	45%	0.448	22%	0.221	S	C	.	.			trans	-73.4	-16.2	-171.2	63.3	0	0	0	0	115.2	N113 T190	N113-S192 PolarHBondContact O-N 2.92Å; T190-S192 PolarHBondContact OG1-N 2.84Å; T190-S192 PolarHBondContact OG1-OG 3.16Å
193	E	90.5	Very high	90.9	Very high	78 Å²	78	39 Å²	39	36%	0.364	22%	0.223	S	C	.	.	S	Bend	trans	-87.6	153.6	-178.1	-58.3	178.1	-154.8	0	0	113.2	R151 M191 G195 L196	R151-E193 IonicContact CZ-OE1 3.45Å; R151-E193 IonicContact CZ-OE2 3Å; R151-E193 IonicContact NH1-OE1 3.64Å; R151-E193 PolarHBondContact NH1-OE1 3.2Å; R151-E193 IonicContact NH1-OE2 3.68Å; R151-E193 PolarHBondContact NH1-OE2 2.96Å; R151-E193 IonicContact NH2-OE2 2.83Å; R151-E193 PolarHBondContact NH2-OE2 2.92Å; M191-E193 VanDerWaalsContact C-N 3.3Å; M191-E193 PolarHBondContact O-N 3.32Å; E193-G195 PolarHBondContact O-N 2.84Å; E193-L196 HydrophobicContact CB-CD1 3.75Å; E193-L196 HydrophobicContact CB-CG 4.17Å; E193-L196 HydrophobicContact CG-CD1 4.29Å; E193-L196 VanDerWaalsContact O-CB 3.32Å; E193-L196 WeakPolarHBondContact O-CB 3.37Å; E193-L196 PolarHBondContact O-N 2.98Å; E193-L196 VanDerWaalsContact O-N 3.1Å
194	C	86.3	Confident	89.9	Confident	124 Å²	124	42.3 Å²	42.3	84%	0.838	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	136	174.8	-60.3	0	0	0	0	111.7	L196	C194-L196 VanDerWaalsContact C-N 3.3Å
195	G	88.3	Confident	88.2	Confident	19 Å²	19	47.2 Å²	47.2	20%	0.196	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	-0.5	-176.6	0	0	0	0	0	114.5	R149 E193 W202	R149-G195 VanDerWaalsContact CD-O 3.31Å; R149-G195 WeakPolarHBondContact CD-O 3.35Å; R149-G195 PolarHBondContact NH1-O 2.74Å; E193-G195 PolarHBondContact O-N 2.84Å; G195-W202 VanDerWaalsContact CA-CE2 3.49Å
196	L	93	Very high	87.9	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.026	31%	0.305	C	S	.	.			trans	-96.9	178.3	168.8	-56.7	-177.6	0	0	0	111.2	I84 R149 R151 M191 E193 C194 W202	I84-L196 HydrophobicContact CD1-CD2 4.42Å; I84-L196 HydrophobicContact CG2-CD2 4.23Å; R149-L196 HydrophobicContact CG-CD2 3.85Å; R149-L196 CarbonylContact O-C 3.6Å; R149-L196 WeakPolarHBondContact O-CA 3.27Å; R149-L196 WeakPolarHBondContact O-CB 3.41Å; R151-L196 HydrophobicContact CB-CD1 4.06Å; M191-L196 HydrophobicContact CB-CB 4.43Å; E193-L196 HydrophobicContact CB-CD1 3.75Å; E193-L196 HydrophobicContact CB-CG 4.17Å; E193-L196 HydrophobicContact CG-CD1 4.29Å; E193-L196 VanDerWaalsContact O-CB 3.32Å; E193-L196 WeakPolarHBondContact O-CB 3.37Å; E193-L196 PolarHBondContact O-N 2.98Å; E193-L196 VanDerWaalsContact O-N 3.1Å; C194-L196 VanDerWaalsContact C-N 3.3Å; L196-W202 VanDerWaalsContact O-CE2 3.32Å; L196-W202 VanDerWaalsContact O-CZ2 3.28Å; L196-W202 WeakPolarHBondContact O-CZ2 3.48Å; L196-W202 PolarHBondContact O-NE1 2.87Å
197	G	92.8	Very high	87.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	85.3	-154.2	-175.1	0	0	0	0	0	112.6	V148 R149 T199 W201	V148-G197 CarbonylContact C-O 3.46Å; V148-G197 VanDerWaalsContact CA-O 3.26Å; V148-G197 WeakPolarHBondContact CA-O 3.37Å; R149-G197 PolarHBondContact N-O 3.02Å; R149-G197 PolarHBondContact O-N 3.46Å; G197-T199 PolarHBondContact O-N 2.81Å; G197-W201 VanDerWaalsContact CA-CZ3 3.49Å
198	C	92.8	Very high	87.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	133.8	-175.6	-58.4	0	0	0	0	111.3	I147 V148 S200 W201 W202	I147-C198 CarbonylContact O-C 3.51Å; I147-C198 VanDerWaalsContact O-CA 3.3Å; I147-C198 WeakPolarHBondContact O-CA 3.47Å; V148-C198 HydrophobicContact CG1-CB 4.49Å; C198-S200 PolarHBondContact O-N 2.96Å; C198-W201 HydrophobicContact CB-CD2 3.73Å; C198-W201 VanDerWaalsContact CB-CE2 3.43Å; C198-W201 HydrophobicContact CB-CE3 4.36Å; C198-W201 HydrophobicContact CB-CG 4.03Å; C198-W201 HydrophobicContact CB-CH2 4.43Å; C198-W201 HydrophobicContact CB-CZ2 3.83Å; C198-W201 WeakPolarHBondContact O-CB 3.29Å; C198-W201 PolarHBondContact O-N 3.27Å; C198-W201 VanDerWaalsContact O-N 3.13Å; C198-W201 VanDerWaalsContact SG-CZ2 3.5Å; C198-W202 PolarHBondContact O-NE1 2.98Å
199	T	91.3	Very high	86.5	Confident	28 Å²	28	52.4 Å²	52.4	17%	0.172	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-61.7	-32.4	179.7	56.4	0	0	0	0	111.9	Y86 I147 G197 W201 W202 D203	Y86-T199 HydrophobicContact CD1-CG2 4.12Å; Y86-T199 HydrophobicContact CE1-CG2 4.04Å; I147-T199 HydrophobicContact CG2-CG2 4.01Å; I147-T199 PolarHBondContact O-N 2.9Å; G197-T199 PolarHBondContact O-N 2.81Å; T199-W201 PolarHBondContact O-N 2.84Å; T199-W201 VanDerWaalsContact O-N 3.14Å; T199-W202 PolarHBondContact O-N 2.81Å; T199-D203 PolarHBondContact O-N 3.34Å
200	S	89.4	Confident	85.9	Confident	74 Å²	74	55.6 Å²	55.6	52%	0.517	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-60.5	-21.2	177.5	54.6	0	0	0	0	114.3	C198 W202	C198-S200 PolarHBondContact O-N 2.96Å; S200-W202 PolarHBondContact O-N 3.22Å
201	W	87.5	Confident	85.2	Confident	33 Å²	33	58.9 Å²	58.9	13%	0.125	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-72.8	-21.1	175.2	-54.3	-22	0	0	0	112.6	P115 W129 L140 M142 G197 C198 T199	P115-W201 HydrophobicContact CG-CZ3 4.28Å; W129-W201 HydrophobicContact CD2-CZ3 4.49Å; W129-W201 HydrophobicContact CE3-CD2 4.19Å; W129-W201 AromaticContact CE3-CE3 3.63Å; W129-W201 HydrophobicContact CE3-CE3 3.63Å; W129-W201 AromaticContact CE3-CH2 3.96Å; W129-W201 HydrophobicContact CE3-CH2 3.96Å; W129-W201 HydrophobicContact CE3-CZ2 4.47Å; W129-W201 AromaticContact CE3-CZ3 3.47Å; W129-W201 HydrophobicContact CE3-CZ3 3.47Å; W129-W201 VanDerWaalsContact CE3-CZ3 3.47Å; W129-W201 HydrophobicContact CZ3-CD2 4.31Å; W129-W201 AromaticContact CZ3-CE3 3.6Å; W129-W201 HydrophobicContact CZ3-CE3 3.6Å; W129-W201 AromaticContact CZ3-CZ3 3.81Å; W129-W201 HydrophobicContact CZ3-CZ3 3.81Å; L140-W201 HydrophobicContact CB-CD2 4.44Å; L140-W201 HydrophobicContact CB-CZ2 4.18Å; L140-W201 HydrophobicContact CD1-CB 4.44Å; L140-W201 HydrophobicContact CD1-CD2 4.23Å; L140-W201 HydrophobicContact CD1-CG 4.06Å; M142-W201 HydrophobicContact CE-CH2 3.48Å; M142-W201 VanDerWaalsContact CE-CH2 3.48Å; M142-W201 HydrophobicContact CE-CZ2 4.23Å; M142-W201 HydrophobicContact CE-CZ3 4.43Å; M142-W201 HydrophobicContact CG-CH2 3.52Å; M142-W201 HydrophobicContact CG-CZ2 3.43Å; M142-W201 VanDerWaalsContact CG-CZ2 3.43Å; M142-W201 HydrophobicContact SD-CH2 3.84Å; M142-W201 HydrophobicContact SD-CZ2 4.37Å; G197-W201 VanDerWaalsContact CA-CZ3 3.49Å; C198-W201 HydrophobicContact CB-CD2 3.73Å; C198-W201 VanDerWaalsContact CB-CE2 3.43Å; C198-W201 HydrophobicContact CB-CE3 4.36Å; C198-W201 HydrophobicContact CB-CG 4.03Å; C198-W201 HydrophobicContact CB-CH2 4.43Å; C198-W201 HydrophobicContact CB-CZ2 3.83Å; C198-W201 WeakPolarHBondContact O-CB 3.29Å; C198-W201 PolarHBondContact O-N 3.27Å; C198-W201 VanDerWaalsContact O-N 3.13Å; C198-W201 VanDerWaalsContact SG-CZ2 3.5Å; T199-W201 PolarHBondContact O-N 2.84Å; T199-W201 VanDerWaalsContact O-N 3.14Å
202	W	85.2	Confident	84.5	Confident	71 Å²	71	63 Å²	63	27%	0.269	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-13	-171.1	-47.6	103.3	0	0	0	113	W129 G195 L196 C198 T199 S200 S204 A205	W129-W202 HydrophobicContact CH2-CH2 4.3Å; W129-W202 HydrophobicContact CH2-CZ2 4.47Å; W129-W202 HydrophobicContact CZ3-CZ2 4.37Å; G195-W202 VanDerWaalsContact CA-CE2 3.49Å; L196-W202 VanDerWaalsContact O-CE2 3.32Å; L196-W202 VanDerWaalsContact O-CZ2 3.28Å; L196-W202 WeakPolarHBondContact O-CZ2 3.48Å; L196-W202 PolarHBondContact O-NE1 2.87Å; C198-W202 PolarHBondContact O-NE1 2.98Å; T199-W202 PolarHBondContact O-N 2.81Å; S200-W202 PolarHBondContact O-N 3.22Å; W202-S204 PolarHBondContact O-N 2.96Å; W202-S204 VanDerWaalsContact O-N 3.1Å; W202-A205 PolarHBondContact O-N 2.82Å
203	D	79.5	Confident	83.9	Confident	126 Å²	126	62.9 Å²	62.9	67%	0.674	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.2	-177.9	-70.4	-28.5	0	0	0	113.2	T199	T199-D203 PolarHBondContact O-N 3.34Å
204	S	64	Low	83.4	Confident	112 Å²	112	61.7 Å²	61.7	78%	0.783	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	6.3	177.3	57.6	0	0	0	0	115.3	W202	W202-S204 PolarHBondContact O-N 2.96Å; W202-S204 VanDerWaalsContact O-N 3.1Å
205	A	50.6	Low	83.1	Confident	148 Å²	148	56 Å²	56	100%	1.223	36%	0.362	S	S	*	.			trans	-91.2	0	175.1	0	0	0	0	0	111.9	W202	W202-A205 PolarHBondContact O-N 2.82Å

Retrieved 205 of 205 residues in 189.9 ms (Link to these results)

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