A0A077ZJU0_TRITR Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A077ZJU0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 124 aa.

						>A0A077ZJU0_TRITR|A0A077ZJU0
MSVDSRKEDEETVFLAELNGIMELNSLEVALQNGKYEFKVADDGRIALKIGAQIFLCYWEEVLGTDLIIDXEQQKAIGVSVKRLIGERTIFERKSDPLECSATLSSTPAYVVDCACDITITEPR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.5	Very low	69.1	Low	238 Å²	238	167.2 Å²	167.2	100%	1.172	85%	0.848	S	S	*	*				0	106.7	0	-65.7	-171.5	-173.3	0	0	106.6
2	S	66.2	Low	70.6	Confident	130 Å²	130	161.1 Å²	161.1	91%	0.909	83%	0.826	S	S	*	*			trans	-92.4	110.3	178.8	-55.8	0	0	0	0	107.8	D4	S2-D4 PolarHBondContact O-N 3.23Å
3	V	67.4	Low	72.3	Confident	138 Å²	138	152.1 Å²	152.1	84%	0.836	78%	0.783	S	S	*	*			trans	-83.3	108.2	174	-113.8	0	0	0	0	107.3	S5	V3-S5 PolarHBondContact O-N 3.34Å
4	D	59.9	Low	73.8	Confident	121 Å²	121	146.3 Å²	146.3	65%	0.647	75%	0.749	S	S	*	*			trans	-74.9	94.4	171.8	-175.8	26.8	0	0	0	108.2	S2 R6	S2-D4 PolarHBondContact O-N 3.23Å; D4-R6 VanDerWaalsContact C-N 3.31Å; D4-R6 PolarHBondContact O-N 2.92Å; D4-R6 IonicContact OD2-CZ 3.82Å; D4-R6 IonicContact OD2-NE 3.1Å; D4-R6 PolarHBondContact OD2-NE 3.29Å; D4-R6 VanDerWaalsContact OD2-NE 3.1Å; D4-R6 IonicContact OD2-NH2 3.61Å
5	S	65	Low	75.3	Confident	105 Å²	105	141.6 Å²	141.6	73%	0.734	73%	0.726	S	S	*	*			trans	-79	80.8	174.9	37.5	0	0	0	0	109.9	V3 K7	V3-S5 PolarHBondContact O-N 3.34Å; S5-K7 PolarHBondContact O-N 3.19Å; S5-K7 VanDerWaalsContact O-N 3.1Å
6	R	67.2	Low	76.5	Confident	207 Å²	207	135.6 Å²	135.6	78%	0.781	70%	0.704	S	S	*	*			trans	-63.1	108.6	165	-62.4	-179.9	-167.5	176.2	2.1	107.7	D4 E8	D4-R6 VanDerWaalsContact C-N 3.31Å; D4-R6 PolarHBondContact O-N 2.92Å; D4-R6 IonicContact OD2-CZ 3.82Å; D4-R6 IonicContact OD2-NE 3.1Å; D4-R6 PolarHBondContact OD2-NE 3.29Å; D4-R6 VanDerWaalsContact OD2-NE 3.1Å; D4-R6 IonicContact OD2-NH2 3.61Å; R6-E8 PolarHBondContact O-N 3.46Å
7	K	69.3	Low	77.7	Confident	193 Å²	193	132.4 Å²	132.4	84%	0.839	69%	0.685	S	S	*	*			trans	-66.4	115	169.3	-70.5	-178.4	178.8	179.9	0	107	S5	S5-K7 PolarHBondContact O-N 3.19Å; S5-K7 VanDerWaalsContact O-N 3.1Å
8	E	74.7	Confident	78.7	Confident	187 Å²	187	127.6 Å²	127.6	87%	0.874	66%	0.66	S	S	*	*			trans	-68.6	127	166.3	-65.2	173.5	170.6	0	0	106.8	R6 E10	R6-E8 PolarHBondContact O-N 3.46Å; E8-E10 PolarHBondContact O-N 2.64Å
9	D	78.8	Confident	79.6	Confident	161 Å²	161	123.3 Å²	123.3	86%	0.861	64%	0.638	S	S	*	*			trans	-63.8	127.7	175.8	-65.9	-44.3	0	0	0	108.7	E11	D9-E11 PolarHBondContact O-N 2.77Å
10	E	78.7	Confident	80.2	Confident	182 Å²	182	119.7 Å²	119.7	85%	0.85	63%	0.633	S	S	*	*			trans	-77.1	107.7	179.5	-173.1	174.5	-173.2	0	0	109.4	E8	E8-E10 PolarHBondContact O-N 2.64Å
11	E	83.5	Confident	80.7	Confident	177 Å²	177	121 Å²	121	83%	0.827	64%	0.639	S	S	*	*			trans	-76.3	125.4	172.7	-173.5	175.6	-170.3	0	0	109.9	D9	D9-E11 PolarHBondContact O-N 2.77Å
12	T	86.5	Confident	82.6	Confident	94 Å²	94	112 Å²	112	58%	0.577	60%	0.595	S	S	*	*			trans	-111.9	126.4	177.3	-58.9	0	0	0	0	110.3
13	V	93	Very high	83.8	Confident	44 Å²	44	111.4 Å²	111.4	27%	0.267	58%	0.577	S	S	.	*			trans	-102.7	126.2	174	-171.4	0	0	0	0	108.8	I68 I77	V13-I68 HydrophobicContact CB-CD1 4.36Å; V13-I68 HydrophobicContact CG1-CB 4.39Å; V13-I68 HydrophobicContact CG1-CD1 3.71Å; V13-I68 HydrophobicContact CG1-CG2 4.05Å; V13-I77 HydrophobicContact CG1-CD1 4.44Å
14	F	94.1	Very high	85.1	Confident	71 Å²	71	109.7 Å²	109.7	31%	0.311	56%	0.563	S	S	.	*			trans	-138	163.3	-176.4	62.5	-89.7	0	0	0	111.3	A16 W59 L84	F14-A16 HydrophobicContact CE2-CB 4.32Å; F14-W59 HydrophobicContact CB-CH2 4.13Å; F14-W59 HydrophobicContact CB-CZ3 4Å; F14-W59 AromaticContact CD1-CH2 3.68Å; F14-W59 HydrophobicContact CD1-CH2 3.68Å; F14-W59 HydrophobicContact CD1-CZ3 4.4Å; F14-W59 AromaticContact CD2-CH2 3.51Å; F14-W59 HydrophobicContact CD2-CH2 3.51Å; F14-W59 AromaticContact CD2-CZ3 3.72Å; F14-W59 HydrophobicContact CD2-CZ3 3.72Å; F14-W59 AromaticContact CE1-CH2 3.87Å; F14-W59 HydrophobicContact CE1-CH2 3.87Å; F14-W59 AromaticContact CE2-CH2 3.72Å; F14-W59 HydrophobicContact CE2-CH2 3.72Å; F14-W59 HydrophobicContact CE2-CZ3 4.29Å; F14-W59 AromaticContact CG-CH2 3.49Å; F14-W59 HydrophobicContact CG-CH2 3.49Å; F14-W59 VanDerWaalsContact CG-CH2 3.49Å; F14-W59 AromaticContact CG-CZ3 3.79Å; F14-W59 HydrophobicContact CG-CZ3 3.79Å; F14-W59 AromaticContact CZ-CH2 3.89Å; F14-W59 HydrophobicContact CZ-CH2 3.89Å; F14-W59 HydrophobicContact CZ-CZ2 4.49Å; F14-L84 HydrophobicContact CD2-CB 3.96Å; F14-L84 HydrophobicContact CE2-CB 3.76Å; F14-L84 HydrophobicContact CE2-CD2 3.85Å; F14-L84 HydrophobicContact CE2-CG 4.44Å; F14-L84 HydrophobicContact CZ-CD2 4.39Å
15	L	95.5	Very high	86.8	Confident	76 Å²	76	109 Å²	109	40%	0.398	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.6	133.2	172.5	-170.8	72.2	0	0	0	109.9	R83 L84	L15-R83 HydrophobicContact CB-CG 4.21Å; L15-R83 WeakPolarHBondContact O-CA 3.34Å; L15-L84 PolarHBondContact O-N 2.88Å
16	A	95.5	Very high	88.1	Confident	46 Å²	46	106.9 Å²	106.9	38%	0.38	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.3	170.7	0	0	0	0	0	110.1	F14 L84	F14-A16 HydrophobicContact CE2-CB 4.32Å; A16-L84 CarbonylContact C-O 3.45Å; A16-L84 VanDerWaalsContact CA-O 3.25Å; A16-L84 WeakPolarHBondContact CA-O 3.22Å; A16-L84 HydrophobicContact CB-CB 4.18Å; A16-L84 HydrophobicContact CB-CD2 4.45Å
17	E	95.9	Very high	89.4	Confident	81 Å²	81	97.6 Å²	97.6	38%	0.379	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116	176.2	-173	168.9	163.6	0	0	108.5	R83 L84 I85 G86	E17-R83 IonicContact OE2-NH1 3.49Å; E17-L84 PolarHBondContact N-O 3.21Å; E17-I85 HydrophobicContact CB-CD1 3.84Å; E17-I85 CarbonylContact O-C 3.6Å; E17-G86 PolarHBondContact O-N 3.34Å
18	L	95.5	Very high	90.7	Very high	46 Å²	46	92.5 Å²	92.5	24%	0.241	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	111.3	-176.2	-58.4	-178.1	0	0	0	110.3	M22 L27 L48 I50 F55	L18-M22 HydrophobicContact CB-CE 4.12Å; L18-M22 WeakPolarHBondContact O-CE 3.45Å; L18-L27 HydrophobicContact CD1-CD2 4.31Å; L18-L48 HydrophobicContact CD2-CD2 3.93Å; L18-I50 HydrophobicContact CD1-CD1 3.65Å; L18-F55 HydrophobicContact CB-CD1 4.18Å; L18-F55 HydrophobicContact CB-CE1 3.81Å; L18-F55 HydrophobicContact CB-CZ 4.16Å; L18-F55 HydrophobicContact CD1-CD2 4.46Å; L18-F55 HydrophobicContact CD1-CE1 4.49Å; L18-F55 HydrophobicContact CD1-CE2 4.1Å; L18-F55 HydrophobicContact CD1-CZ 4.12Å; L18-F55 HydrophobicContact CD2-CB 4.43Å; L18-F55 HydrophobicContact CD2-CD1 4.04Å; L18-F55 HydrophobicContact CD2-CD2 4.33Å; L18-F55 HydrophobicContact CD2-CE1 4.41Å; L18-F55 HydrophobicContact CD2-CG 4Å; L18-F55 HydrophobicContact CG-CE1 4.46Å
19	N	95.6	Very high	91.7	Very high	45 Å²	45	87.3 Å²	87.3	24%	0.241	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	143.7	-174.6	-65.9	-34.5	0	0	0	111.8	G86 E87 R88	N19-G86 PolarHBondContact N-O 2.84Å; N19-E87 WeakPolarHBondContact CB-OE1 3.25Å; N19-E87 WeakPolarHBondContact CB-OE2 3.37Å; N19-E87 PolarHBondContact ND2-OE1 3.46Å; N19-R88 VanDerWaalsContact O-CB 3.31Å; N19-R88 WeakPolarHBondContact O-CB 3.44Å; N19-R88 PolarHBondContact O-N 3.3Å
20	G	91.9	Very high	92.6	Very high	52 Å²	52	79.9 Å²	79.9	54%	0.536	43%	0.431	S	S	.	.	S	Bend	trans	119.6	170.9	176	0	0	0	0	0	114.3	M22	G20-M22 WeakPolarHBondContact O-CE 3.44Å; G20-M22 PolarHBondContact O-N 3.37Å
21	I	90.7	Very high	93.4	Very high	148 Å²	148	75 Å²	75	76%	0.759	41%	0.411	S	S	*	.			trans	-74.5	122.4	179.2	-58.8	172.9	0	0	0	108.7	R88	I21-R88 WeakPolarHBondContact O-CD 3.5Å; I21-R88 PolarHBondContact O-NE 2.71Å; I21-R88 PolarHBondContact O-NH1 2.75Å
22	M	89.4	Confident	94	Very high	49 Å²	49	74 Å²	74	24%	0.241	41%	0.406	C	S	.	.			trans	-147.7	156.8	177.5	64.8	-169.8	82.4	0	0	111.5	L18 G20 L24 L27 F55	L18-M22 HydrophobicContact CB-CE 4.12Å; L18-M22 WeakPolarHBondContact O-CE 3.45Å; G20-M22 WeakPolarHBondContact O-CE 3.44Å; G20-M22 PolarHBondContact O-N 3.37Å; M22-L24 PolarHBondContact O-N 3.23Å; M22-L27 HydrophobicContact SD-CD2 3.79Å; M22-F55 HydrophobicContact CE-CE1 3.47Å; M22-F55 VanDerWaalsContact CE-CE1 3.47Å; M22-F55 HydrophobicContact CE-CZ 3.59Å; M22-F55 HydrophobicContact SD-CE1 4.32Å; M22-F55 HydrophobicContact SD-CZ 3.81Å
23	E	92.3	Very high	94.5	Very high	117 Å²	117	74.4 Å²	74.4	55%	0.547	40%	0.404	S	S	.	.			trans	-85.1	104.6	171.7	-175.2	-179.7	-155.3	0	0	109.3	N25 S26 L27	E23-N25 VanDerWaalsContact C-N 3.34Å; E23-N25 PolarHBondContact O-N 2.75Å; E23-S26 VanDerWaalsContact CD-OG 3.23Å; E23-S26 PolarHBondContact O-N 2.82Å; E23-S26 WeakPolarHBondContact OE2-CB 3.28Å; E23-S26 PolarHBondContact OE2-OG 3Å; E23-L27 PolarHBondContact O-N 3.21Å; E23-L27 VanDerWaalsContact O-N 3.13Å
24	L	93.2	Very high	94.6	Very high	102 Å²	102	74.5 Å²	74.5	53%	0.534	41%	0.414	S	S	.	.	H	α-helix	trans	-58.7	-43.1	-174.3	-175.3	60.9	0	0	0	112.5	M22 S26 L27 E28	M22-L24 PolarHBondContact O-N 3.23Å; L24-S26 VanDerWaalsContact C-N 3.32Å; L24-S26 PolarHBondContact O-N 3.3Å; L24-L27 WeakPolarHBondContact O-CB 3.46Å; L24-L27 PolarHBondContact O-N 3.28Å; L24-L27 VanDerWaalsContact O-N 3.08Å; L24-E28 HydrophobicContact CD1-CG 4.32Å; L24-E28 HydrophobicContact CG-CG 4.32Å; L24-E28 WeakPolarHBondContact O-CG 3.32Å; L24-E28 PolarHBondContact O-N 3.34Å
25	N	95.8	Very high	94.7	Very high	107 Å²	107	77.3 Å²	77.3	57%	0.572	43%	0.427	S	S	*	.	H	α-helix	trans	-58.7	-42.9	178.6	-64.3	-23.6	0	0	0	112.3	E23 L27 E28 V29	E23-N25 VanDerWaalsContact C-N 3.34Å; E23-N25 PolarHBondContact O-N 2.75Å; N25-L27 VanDerWaalsContact C-N 3.32Å; N25-E28 PolarHBondContact O-N 3.21Å; N25-V29 WeakPolarHBondContact O-CB 3.45Å; N25-V29 VanDerWaalsContact O-CG2 3.25Å; N25-V29 WeakPolarHBondContact O-CG2 3.39Å; N25-V29 PolarHBondContact O-N 2.92Å
26	S	93.7	Very high	94.7	Very high	59 Å²	59	79.9 Å²	79.9	41%	0.413	43%	0.432	S	S	.	.	H	α-helix	trans	-67	-35.2	177.7	-74.6	0	0	0	0	111.8	E23 L24 A30	E23-S26 VanDerWaalsContact CD-OG 3.23Å; E23-S26 PolarHBondContact O-N 2.82Å; E23-S26 WeakPolarHBondContact OE2-CB 3.28Å; E23-S26 PolarHBondContact OE2-OG 3Å; L24-S26 VanDerWaalsContact C-N 3.32Å; L24-S26 PolarHBondContact O-N 3.3Å; S26-A30 WeakPolarHBondContact O-CB 3.36Å; S26-A30 PolarHBondContact O-N 2.81Å
27	L	93.9	Very high	94.7	Very high	13 Å²	13	82 Å²	82	7%	0.068	43%	0.434	C	S	.	.	H	α-helix	trans	-67.4	-47.8	174.7	-165.7	80.7	0	0	0	111.5	L18 M22 E23 L24 N25 A30 L31 I50 Q53 F55	L18-L27 HydrophobicContact CD1-CD2 4.31Å; M22-L27 HydrophobicContact SD-CD2 3.79Å; E23-L27 PolarHBondContact O-N 3.21Å; E23-L27 VanDerWaalsContact O-N 3.13Å; L24-L27 WeakPolarHBondContact O-CB 3.46Å; L24-L27 PolarHBondContact O-N 3.28Å; L24-L27 VanDerWaalsContact O-N 3.08Å; N25-L27 VanDerWaalsContact C-N 3.32Å; L27-A30 WeakPolarHBondContact O-CB 3.4Å; L27-A30 PolarHBondContact O-N 3.11Å; L27-L31 HydrophobicContact CG-CD1 4.24Å; L27-L31 WeakPolarHBondContact O-CG 3.3Å; L27-L31 PolarHBondContact O-N 3.22Å; L27-I50 HydrophobicContact CD1-CB 3.64Å; L27-I50 HydrophobicContact CD1-CD1 3.99Å; L27-I50 HydrophobicContact CD1-CG1 4.43Å; L27-I50 HydrophobicContact CD1-CG2 3.42Å; L27-I50 VanDerWaalsContact CD1-CG2 3.42Å; L27-I50 HydrophobicContact CG-CG2 4.03Å; L27-Q53 HydrophobicContact CD1-CB 4.41Å; L27-Q53 HydrophobicContact CD1-CG 4.38Å; L27-F55 HydrophobicContact CD1-CE2 4.26Å
28	E	95.6	Very high	94.6	Very high	85 Å²	85	82.9 Å²	82.9	40%	0.397	44%	0.437	S	S	.	.	H	α-helix	trans	-59.6	-47.6	177.9	-73.3	176.8	-179.1	0	0	111.6	L24 N25 A30 L31 Q32	L24-E28 HydrophobicContact CD1-CG 4.32Å; L24-E28 HydrophobicContact CG-CG 4.32Å; L24-E28 WeakPolarHBondContact O-CG 3.32Å; L24-E28 PolarHBondContact O-N 3.34Å; N25-E28 PolarHBondContact O-N 3.21Å; E28-A30 VanDerWaalsContact C-N 3.29Å; E28-A30 PolarHBondContact O-N 3.06Å; E28-L31 PolarHBondContact O-N 2.9Å; E28-Q32 WeakPolarHBondContact O-CB 3.32Å; E28-Q32 VanDerWaalsContact O-CG 3.32Å; E28-Q32 WeakPolarHBondContact O-CG 3.46Å; E28-Q32 PolarHBondContact O-N 3.15Å
29	V	97.3	Very high	94.5	Very high	78 Å²	78	86.6 Å²	86.6	47%	0.473	45%	0.451	S	S	.	.	H	α-helix	trans	-62.4	-37.7	176.3	171.6	0	0	0	0	111	N25 N33	N25-V29 WeakPolarHBondContact O-CB 3.45Å; N25-V29 VanDerWaalsContact O-CG2 3.25Å; N25-V29 WeakPolarHBondContact O-CG2 3.39Å; N25-V29 PolarHBondContact O-N 2.92Å; V29-N33 VanDerWaalsContact CG1-ND2 3.34Å; V29-N33 WeakPolarHBondContact CG1-ND2 3.48Å; V29-N33 VanDerWaalsContact O-CB 3.3Å; V29-N33 WeakPolarHBondContact O-CB 3.43Å; V29-N33 VanDerWaalsContact O-CG 3.27Å; V29-N33 PolarHBondContact O-N 3.39Å; V29-N33 VanDerWaalsContact O-N 3.15Å; V29-N33 PolarHBondContact O-ND2 2.88Å
30	A	96.8	Very high	94.4	Very high	6 Å²	6	89.8 Å²	89.8	5%	0.05	47%	0.472	C	S	.	.	H	α-helix	trans	-65.3	-44.3	175.4	0	0	0	0	0	111.7	S26 L27 E28 N33 G34 K35 I50	S26-A30 WeakPolarHBondContact O-CB 3.36Å; S26-A30 PolarHBondContact O-N 2.81Å; L27-A30 WeakPolarHBondContact O-CB 3.4Å; L27-A30 PolarHBondContact O-N 3.11Å; E28-A30 VanDerWaalsContact C-N 3.29Å; E28-A30 PolarHBondContact O-N 3.06Å; A30-N33 CarbonylContact O-C 3.6Å; A30-N33 PolarHBondContact O-N 3.17Å; A30-G34 PolarHBondContact O-N 3.17Å; A30-K35 HydrophobicContact CB-CB 4.16Å; A30-K35 WeakPolarHBondContact O-CB 3.1Å; A30-K35 PolarHBondContact O-N 3.08Å; A30-I50 HydrophobicContact CB-CG2 3.87Å
31	L	95.5	Very high	94.2	Very high	79 Å²	79	88.8 Å²	88.8	41%	0.414	46%	0.458	S	S	.	.	H	α-helix	trans	-64	-47.4	178.2	-72.5	166.7	0	0	0	112.2	L27 E28 N33 G34 Y36 I50	L27-L31 HydrophobicContact CG-CD1 4.24Å; L27-L31 WeakPolarHBondContact O-CG 3.3Å; L27-L31 PolarHBondContact O-N 3.22Å; E28-L31 PolarHBondContact O-N 2.9Å; L31-N33 PolarHBondContact O-N 2.99Å; L31-G34 PolarHBondContact O-N 3.13Å; L31-Y36 HydrophobicContact CD2-CD1 4.13Å; L31-I50 HydrophobicContact CD2-CD1 4.22Å; L31-I50 HydrophobicContact CD2-CG1 4.48Å; L31-I50 HydrophobicContact CD2-CG2 3.95Å; L31-I50 HydrophobicContact CG-CG2 3.85Å
32	Q	96.1	Very high	93.9	Very high	157 Å²	157	90.4 Å²	90.4	73%	0.734	47%	0.468	S	S	*	.	H	α-helix	trans	-60.7	-32.1	177.1	-71.9	173.6	0.7	0	0	112.6	E28 G34	E28-Q32 WeakPolarHBondContact O-CB 3.32Å; E28-Q32 VanDerWaalsContact O-CG 3.32Å; E28-Q32 WeakPolarHBondContact O-CG 3.46Å; E28-Q32 PolarHBondContact O-N 3.15Å; Q32-G34 VanDerWaalsContact C-N 3.33Å
33	N	97.4	Very high	93.9	Very high	101 Å²	101	92.3 Å²	92.3	54%	0.54	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	6.6	176.6	-69.7	-50.1	0	0	0	113.7	V29 A30 L31 K35	V29-N33 VanDerWaalsContact CG1-ND2 3.34Å; V29-N33 WeakPolarHBondContact CG1-ND2 3.48Å; V29-N33 VanDerWaalsContact O-CB 3.3Å; V29-N33 WeakPolarHBondContact O-CB 3.43Å; V29-N33 VanDerWaalsContact O-CG 3.27Å; V29-N33 PolarHBondContact O-N 3.39Å; V29-N33 VanDerWaalsContact O-N 3.15Å; V29-N33 PolarHBondContact O-ND2 2.88Å; A30-N33 CarbonylContact O-C 3.6Å; A30-N33 PolarHBondContact O-N 3.17Å; L31-N33 PolarHBondContact O-N 2.99Å; N33-K35 VanDerWaalsContact C-N 3.26Å; N33-K35 HydrophobicContact CB-CD 4.41Å; N33-K35 HydrophobicContact CB-CG 4.18Å; N33-K35 PolarHBondContact O-N 2.85Å
34	G	95.8	Very high	93.7	Very high	46 Å²	46	89.1 Å²	89.1	47%	0.474	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	21.5	-179.8	0	0	0	0	0	114.7	A30 L31 Q32 Y36	A30-G34 PolarHBondContact O-N 3.17Å; L31-G34 PolarHBondContact O-N 3.13Å; Q32-G34 VanDerWaalsContact C-N 3.33Å; G34-Y36 VanDerWaalsContact C-N 3.25Å; G34-Y36 PolarHBondContact O-N 3.41Å; G34-Y36 VanDerWaalsContact O-N 3.07Å
35	K	96.4	Very high	93.7	Very high	131 Å²	131	87.1 Å²	87.1	57%	0.57	46%	0.464	S	S	*	.			trans	-86.1	61	-178.9	-64.1	-177.7	179.4	176.2	0	111.3	A30 N33 G51	A30-K35 HydrophobicContact CB-CB 4.16Å; A30-K35 WeakPolarHBondContact O-CB 3.1Å; A30-K35 PolarHBondContact O-N 3.08Å; N33-K35 VanDerWaalsContact C-N 3.26Å; N33-K35 HydrophobicContact CB-CD 4.41Å; N33-K35 HydrophobicContact CB-CG 4.18Å; N33-K35 PolarHBondContact O-N 2.85Å; K35-G51 PolarHBondContact O-N 2.68Å
36	Y	95.5	Very high	93.7	Very high	129 Å²	129	83 Å²	83	51%	0.506	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	151.8	174.1	60.5	-92.5	0	0	0	111.8	L31 G34 F38 K49	L31-Y36 HydrophobicContact CD2-CD1 4.13Å; G34-Y36 VanDerWaalsContact C-N 3.25Å; G34-Y36 PolarHBondContact O-N 3.41Å; G34-Y36 VanDerWaalsContact O-N 3.07Å; Y36-F38 HydrophobicContact CD2-CD2 4.4Å; Y36-F38 AromaticContact CD2-CE2 3.94Å; Y36-F38 HydrophobicContact CD2-CE2 3.94Å; Y36-F38 HydrophobicContact CE2-CE2 4.26Å; Y36-K49 CarbonylContact C-O 3.57Å; Y36-K49 WeakPolarHBondContact CA-O 3.4Å; Y36-K49 WeakPolarHBondContact CB-O 3.32Å
37	E	95.3	Very high	93.7	Very high	90 Å²	90	81.1 Å²	81.1	42%	0.421	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	136.7	-179.9	-175.6	-177.7	-169.2	0	0	109.5	K39 L48 K49	E37-K39 HydrophobicContact CG-CG 4.39Å; E37-K39 WeakPolarHBondContact OE1-CE 3.31Å; E37-K39 IonicContact OE1-NZ 3.54Å; E37-L48 WeakPolarHBondContact O-CA 3.45Å; E37-K49 HydrophobicContact CB-CB 4.5Å; E37-K49 PolarHBondContact N-O 2.89Å; E37-K49 PolarHBondContact O-N 2.87Å
38	F	93.7	Very high	93.8	Very high	101 Å²	101	80.8 Å²	80.8	44%	0.443	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	135.3	171.4	-65.2	-91.2	0	0	0	109.3	Y36 I46 A47 L48 L84	Y36-F38 HydrophobicContact CD2-CD2 4.4Å; Y36-F38 AromaticContact CD2-CE2 3.94Å; Y36-F38 HydrophobicContact CD2-CE2 3.94Å; Y36-F38 HydrophobicContact CE2-CE2 4.26Å; F38-I46 HydrophobicContact CB-CG2 4.29Å; F38-I46 HydrophobicContact CD1-CG2 3.72Å; F38-A47 CarbonylContact C-O 3.47Å; F38-A47 WeakPolarHBondContact CA-O 3.47Å; F38-L48 HydrophobicContact CD1-CB 4.25Å; F38-L48 HydrophobicContact CD1-CD1 3.86Å; F38-L48 HydrophobicContact CD1-CG 4.47Å; F38-L48 HydrophobicContact CD2-CD1 4.37Å; F38-L48 HydrophobicContact CE1-CB 4.3Å; F38-L48 HydrophobicContact CE1-CD1 3.59Å; F38-L48 HydrophobicContact CE1-CD2 3.93Å; F38-L48 HydrophobicContact CE1-CG 4.14Å; F38-L48 HydrophobicContact CE2-CD1 4.11Å; F38-L48 HydrophobicContact CG-CD1 4.26Å; F38-L48 HydrophobicContact CZ-CD1 3.72Å; F38-L48 HydrophobicContact CZ-CD2 4.35Å; F38-L84 HydrophobicContact CE1-CD2 4.01Å
39	K	93.7	Very high	93.7	Very high	123 Å²	123	81.5 Å²	81.5	54%	0.535	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	134.1	168.7	-64.9	-169.9	-178.9	-173.2	0	109.7	E37 I46 A47	E37-K39 HydrophobicContact CG-CG 4.39Å; E37-K39 WeakPolarHBondContact OE1-CE 3.31Å; E37-K39 IonicContact OE1-NZ 3.54Å; K39-I46 CarbonylContact O-C 3.59Å; K39-I46 WeakPolarHBondContact O-CA 3Å; K39-A47 HydrophobicContact CB-CB 4.38Å; K39-A47 PolarHBondContact N-O 3.44Å; K39-A47 PolarHBondContact O-N 3.12Å
40	V	92.7	Very high	93.6	Very high	113 Å²	113	78 Å²	78	69%	0.685	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	125.3	171.6	-176.4	0	0	0	0	107.7
41	A	86.7	Confident	93.5	Very high	30 Å²	30	79 Å²	79	25%	0.248	42%	0.419	C	S	.	.			trans	-81.2	162.1	171.9	0	0	0	0	0	110.4	D43 G44 R45	A41-D43 WeakPolarHBondContact CB-OD1 3.47Å; A41-D43 PolarHBondContact O-N 3.15Å; A41-D43 VanDerWaalsContact O-N 3.12Å; A41-G44 PolarHBondContact O-N 2.76Å; A41-R45 WeakPolarHBondContact CB-O 3.41Å; A41-R45 PolarHBondContact N-O 3.4Å
42	D	85.3	Confident	93.3	Very high	182 Å²	182	79.5 Å²	79.5	97%	0.973	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.7	-176.9	-65.3	-29.1	0	0	0	113.6	G44	D42-G44 VanDerWaalsContact C-N 3.28Å
43	D	88.6	Confident	93.1	Very high	89 Å²	89	73.5 Å²	73.5	48%	0.476	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	1	177.2	63.4	8.7	0	0	0	113.9	A41 R45	A41-D43 WeakPolarHBondContact CB-OD1 3.47Å; A41-D43 PolarHBondContact O-N 3.15Å; A41-D43 VanDerWaalsContact O-N 3.12Å; D43-R45 VanDerWaalsContact C-N 3.32Å; D43-R45 VanDerWaalsContact OD1-CB 3.26Å; D43-R45 WeakPolarHBondContact OD1-CB 3.49Å; D43-R45 PolarHBondContact OD1-N 3.1Å; D43-R45 IonicContact OD1-NE 3.68Å; D43-R45 IonicContact OD2-CZ 3.1Å; D43-R45 IonicContact OD2-NE 2.73Å; D43-R45 PolarHBondContact OD2-NE 3.15Å; D43-R45 IonicContact OD2-NH2 2.7Å; D43-R45 PolarHBondContact OD2-NH2 3.32Å
44	G	89.7	Confident	92.9	Very high	51 Å²	51	70.2 Å²	70.2	53%	0.526	39%	0.389	S	S	.	.	S	Bend	trans	84.5	-3.1	-178.2	0	0	0	0	0	114.8	A41 D42	A41-G44 PolarHBondContact O-N 2.76Å; D42-G44 VanDerWaalsContact C-N 3.28Å
45	R	92.8	Very high	92.9	Very high	60 Å²	60	68 Å²	68	23%	0.226	37%	0.366	C	S	.	.			trans	-70.3	157.5	169.1	-65	-173.2	-71.6	-164.8	-7	110.1	A41 D43 L56 C57 E122	A41-R45 WeakPolarHBondContact CB-O 3.41Å; A41-R45 PolarHBondContact N-O 3.4Å; D43-R45 VanDerWaalsContact C-N 3.32Å; D43-R45 VanDerWaalsContact OD1-CB 3.26Å; D43-R45 WeakPolarHBondContact OD1-CB 3.49Å; D43-R45 PolarHBondContact OD1-N 3.1Å; D43-R45 IonicContact OD1-NE 3.68Å; D43-R45 IonicContact OD2-CZ 3.1Å; D43-R45 IonicContact OD2-NE 2.73Å; D43-R45 PolarHBondContact OD2-NE 3.15Å; D43-R45 IonicContact OD2-NH2 2.7Å; D43-R45 PolarHBondContact OD2-NH2 3.32Å; R45-L56 HydrophobicContact CB-CD1 3.64Å; R45-L56 HydrophobicContact CB-CG 4.17Å; R45-C57 CarbonylContact C-O 3.58Å; R45-C57 WeakPolarHBondContact CA-O 3.38Å; R45-C57 WeakPolarHBondContact CB-O 2.77Å; R45-E122 IonicContact CZ-OE1 3.68Å; R45-E122 IonicContact NH1-OE1 2.75Å; R45-E122 PolarHBondContact NH1-OE1 3.49Å; R45-E122 IonicContact NH2-OE1 3.65Å
46	I	94.8	Very high	92.8	Very high	21 Å²	21	62.6 Å²	62.6	11%	0.108	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	113.3	-177.5	-60.1	169	0	0	0	108.5	F38 K39 L48 C57 W59 L84	F38-I46 HydrophobicContact CB-CG2 4.29Å; F38-I46 HydrophobicContact CD1-CG2 3.72Å; K39-I46 CarbonylContact O-C 3.59Å; K39-I46 WeakPolarHBondContact O-CA 3Å; I46-L48 PolarHBondContact O-N 3.33Å; I46-C57 HydrophobicContact CB-CB 4.21Å; I46-C57 PolarHBondContact N-O 2.92Å; I46-C57 WeakPolarHBondContact O-CA 3.48Å; I46-C57 WeakPolarHBondContact O-CB 3.44Å; I46-C57 PolarHBondContact O-N 2.84Å; I46-W59 HydrophobicContact CD1-CZ2 4.5Å; I46-L84 HydrophobicContact CD1-CD1 3.87Å
47	A	94.4	Very high	92.9	Very high	19 Å²	19	56.4 Å²	56.4	16%	0.157	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	113.7	167	0	0	0	0	0	109.1	F38 K39 F55	F38-A47 CarbonylContact C-O 3.47Å; F38-A47 WeakPolarHBondContact CA-O 3.47Å; K39-A47 HydrophobicContact CB-CB 4.38Å; K39-A47 PolarHBondContact N-O 3.44Å; K39-A47 PolarHBondContact O-N 3.12Å; A47-F55 CarbonylContact C-O 3.56Å; A47-F55 WeakPolarHBondContact CA-O 3.34Å
48	L	95.1	Very high	93	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	113.7	175.6	169.1	55.7	0	0	0	109.2	L18 E37 F38 I46 I50 I54 F55	L18-L48 HydrophobicContact CD2-CD2 3.93Å; E37-L48 WeakPolarHBondContact O-CA 3.45Å; F38-L48 HydrophobicContact CD1-CB 4.25Å; F38-L48 HydrophobicContact CD1-CD1 3.86Å; F38-L48 HydrophobicContact CD1-CG 4.47Å; F38-L48 HydrophobicContact CD2-CD1 4.37Å; F38-L48 HydrophobicContact CE1-CB 4.3Å; F38-L48 HydrophobicContact CE1-CD1 3.59Å; F38-L48 HydrophobicContact CE1-CD2 3.93Å; F38-L48 HydrophobicContact CE1-CG 4.14Å; F38-L48 HydrophobicContact CE2-CD1 4.11Å; F38-L48 HydrophobicContact CG-CD1 4.26Å; F38-L48 HydrophobicContact CZ-CD1 3.72Å; F38-L48 HydrophobicContact CZ-CD2 4.35Å; I46-L48 PolarHBondContact O-N 3.33Å; L48-I50 HydrophobicContact CD1-CD1 4.2Å; L48-I50 HydrophobicContact CD1-CG1 3.78Å; L48-I50 HydrophobicContact CD2-CD1 4Å; L48-I50 HydrophobicContact CD2-CG1 4.45Å; L48-I50 HydrophobicContact CG-CD1 4.04Å; L48-I50 HydrophobicContact CG-CG1 3.95Å; L48-I54 CarbonylContact O-C 3.47Å; L48-I54 WeakPolarHBondContact O-CA 3.29Å; L48-F55 HydrophobicContact CB-CB 4.27Å; L48-F55 PolarHBondContact N-O 2.88Å; L48-F55 PolarHBondContact O-N 2.88Å
49	K	94.7	Very high	93.1	Very high	99 Å²	99	57.3 Å²	57.3	43%	0.43	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.7	172.1	-179	176.6	178.6	-174.7	0	109.2	Y36 E37 G51 Q53 I54	Y36-K49 CarbonylContact C-O 3.57Å; Y36-K49 WeakPolarHBondContact CA-O 3.4Å; Y36-K49 WeakPolarHBondContact CB-O 3.32Å; E37-K49 HydrophobicContact CB-CB 4.5Å; E37-K49 PolarHBondContact N-O 2.89Å; E37-K49 PolarHBondContact O-N 2.87Å; K49-G51 VanDerWaalsContact CE-O 3.28Å; K49-G51 WeakPolarHBondContact CE-O 3.35Å; K49-Q53 CarbonylContact C-O 3.5Å; K49-Q53 WeakPolarHBondContact CA-O 3.41Å; K49-I54 HydrophobicContact CB-CG2 4.41Å; K49-I54 HydrophobicContact CG-CG1 4.33Å
50	I	95.4	Very high	93.2	Very high	6 Å²	6	55.8 Å²	55.8	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	106.9	172.4	-55.6	169.5	0	0	0	108	L18 L27 A30 L31 L48 A52 Q53 F55	L18-I50 HydrophobicContact CD1-CD1 3.65Å; L27-I50 HydrophobicContact CD1-CB 3.64Å; L27-I50 HydrophobicContact CD1-CD1 3.99Å; L27-I50 HydrophobicContact CD1-CG1 4.43Å; L27-I50 HydrophobicContact CD1-CG2 3.42Å; L27-I50 VanDerWaalsContact CD1-CG2 3.42Å; L27-I50 HydrophobicContact CG-CG2 4.03Å; A30-I50 HydrophobicContact CB-CG2 3.87Å; L31-I50 HydrophobicContact CD2-CD1 4.22Å; L31-I50 HydrophobicContact CD2-CG1 4.48Å; L31-I50 HydrophobicContact CD2-CG2 3.95Å; L31-I50 HydrophobicContact CG-CG2 3.85Å; L48-I50 HydrophobicContact CD1-CD1 4.2Å; L48-I50 HydrophobicContact CD1-CG1 3.78Å; L48-I50 HydrophobicContact CD2-CD1 4Å; L48-I50 HydrophobicContact CD2-CG1 4.45Å; L48-I50 HydrophobicContact CG-CD1 4.04Å; L48-I50 HydrophobicContact CG-CG1 3.95Å; I50-A52 PolarHBondContact O-N 3.07Å; I50-A52 VanDerWaalsContact O-N 3.11Å; I50-Q53 PolarHBondContact N-O 3.24Å; I50-Q53 PolarHBondContact O-N 2.86Å; I50-F55 HydrophobicContact CD1-CE2 4.3Å
51	G	94	Very high	93.4	Very high	26 Å²	26	57.4 Å²	57.4	27%	0.268	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	-114.2	-171.8	0	0	0	0	0	111.6	K35 K49	K35-G51 PolarHBondContact O-N 2.68Å; K49-G51 VanDerWaalsContact CE-O 3.28Å; K49-G51 WeakPolarHBondContact CE-O 3.35Å
52	A	91.3	Very high	93.6	Very high	90 Å²	90	57.2 Å²	57.2	74%	0.744	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-7.6	176.4	0	0	0	0	0	113.6	I50	I50-A52 PolarHBondContact O-N 3.07Å; I50-A52 VanDerWaalsContact O-N 3.11Å
53	Q	92.4	Very high	94.1	Very high	31 Å²	31	57.8 Å²	57.8	15%	0.145	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	144.2	179.8	-54.8	-56	-31.3	0	0	109.9	L27 K49 I50 F55	L27-Q53 HydrophobicContact CD1-CB 4.41Å; L27-Q53 HydrophobicContact CD1-CG 4.38Å; K49-Q53 CarbonylContact C-O 3.5Å; K49-Q53 WeakPolarHBondContact CA-O 3.41Å; I50-Q53 PolarHBondContact N-O 3.24Å; I50-Q53 PolarHBondContact O-N 2.86Å; Q53-F55 HydrophobicContact CB-CE2 3.72Å; Q53-F55 HydrophobicContact CB-CZ 4.14Å
54	I	93.3	Very high	94.4	Very high	32 Å²	32	55.8 Å²	55.8	16%	0.164	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135.4	177.9	-38.8	176.9	0	0	0	109.1	L48 K49 T89 F91	L48-I54 CarbonylContact O-C 3.47Å; L48-I54 WeakPolarHBondContact O-CA 3.29Å; K49-I54 HydrophobicContact CB-CG2 4.41Å; K49-I54 HydrophobicContact CG-CG1 4.33Å; I54-T89 PolarHBondContact O-N 3.49Å; I54-F91 HydrophobicContact CB-CD2 4.04Å; I54-F91 HydrophobicContact CB-CE2 4.01Å; I54-F91 HydrophobicContact CD1-CD2 3.58Å; I54-F91 HydrophobicContact CD1-CE2 4.29Å; I54-F91 HydrophobicContact CG1-CD2 4.38Å; I54-F91 HydrophobicContact CG2-CD2 3.64Å; I54-F91 HydrophobicContact CG2-CE2 3.19Å; I54-F91 HydrophobicContact CG2-CZ 4.17Å
55	F	94.6	Very high	94.6	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.2	-177.3	-59.8	-90.7	0	0	0	108.5	L18 M22 L27 A47 L48 I50 Q53 E87 R88	L18-F55 HydrophobicContact CB-CD1 4.18Å; L18-F55 HydrophobicContact CB-CE1 3.81Å; L18-F55 HydrophobicContact CB-CZ 4.16Å; L18-F55 HydrophobicContact CD1-CD2 4.46Å; L18-F55 HydrophobicContact CD1-CE1 4.49Å; L18-F55 HydrophobicContact CD1-CE2 4.1Å; L18-F55 HydrophobicContact CD1-CZ 4.12Å; L18-F55 HydrophobicContact CD2-CB 4.43Å; L18-F55 HydrophobicContact CD2-CD1 4.04Å; L18-F55 HydrophobicContact CD2-CD2 4.33Å; L18-F55 HydrophobicContact CD2-CE1 4.41Å; L18-F55 HydrophobicContact CD2-CG 4Å; L18-F55 HydrophobicContact CG-CE1 4.46Å; M22-F55 HydrophobicContact CE-CE1 3.47Å; M22-F55 VanDerWaalsContact CE-CE1 3.47Å; M22-F55 HydrophobicContact CE-CZ 3.59Å; M22-F55 HydrophobicContact SD-CE1 4.32Å; M22-F55 HydrophobicContact SD-CZ 3.81Å; L27-F55 HydrophobicContact CD1-CE2 4.26Å; A47-F55 CarbonylContact C-O 3.56Å; A47-F55 WeakPolarHBondContact CA-O 3.34Å; L48-F55 HydrophobicContact CB-CB 4.27Å; L48-F55 PolarHBondContact N-O 2.88Å; L48-F55 PolarHBondContact O-N 2.88Å; I50-F55 HydrophobicContact CD1-CE2 4.3Å; Q53-F55 HydrophobicContact CB-CE2 3.72Å; Q53-F55 HydrophobicContact CB-CZ 4.14Å; F55-E87 WeakPolarHBondContact CA-O 3.37Å; F55-R88 HydrophobicContact CD1-CB 4.07Å; F55-R88 HydrophobicContact CE1-CB 3.86Å; F55-R88 HydrophobicContact CE1-CG 4.37Å
56	L	95.4	Very high	94.7	Very high	16 Å²	16	55.9 Å²	55.9	8%	0.084	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.9	166.6	-172.9	58.9	0	0	0	108	R45 E87 T89 I120	R45-L56 HydrophobicContact CB-CD1 3.64Å; R45-L56 HydrophobicContact CB-CG 4.17Å; L56-E87 PolarHBondContact N-O 3.43Å; L56-E87 PolarHBondContact O-N 2.87Å; L56-T89 HydrophobicContact CB-CG2 4.14Å; L56-I120 HydrophobicContact CD1-CD1 3.38Å; L56-I120 HydrophobicContact CD2-CD1 3.69Å; L56-I120 HydrophobicContact CD2-CG2 4.02Å; L56-I120 HydrophobicContact CG-CD1 4.07Å
57	C	97	Very high	94.7	Very high	0 Å²	0	60 Å²	60	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	151	-169.9	-49	0	0	0	0	112.7	R45 I46 L84 I85 G86	R45-C57 CarbonylContact C-O 3.58Å; R45-C57 WeakPolarHBondContact CA-O 3.38Å; R45-C57 WeakPolarHBondContact CB-O 2.77Å; I46-C57 HydrophobicContact CB-CB 4.21Å; I46-C57 PolarHBondContact N-O 2.92Å; I46-C57 WeakPolarHBondContact O-CA 3.48Å; I46-C57 WeakPolarHBondContact O-CB 3.44Å; I46-C57 PolarHBondContact O-N 2.84Å; C57-L84 HydrophobicContact CB-CD1 3.59Å; C57-L84 HydrophobicContact CB-CD2 4.18Å; C57-L84 HydrophobicContact CB-CG 3.75Å; C57-I85 CarbonylContact C-O 3.52Å; C57-I85 WeakPolarHBondContact CA-O 3.32Å; C57-I85 WeakPolarHBondContact CB-O 3.48Å; C57-G86 WeakPolarHBondContact SG-CA 3.26Å
58	Y	96.3	Very high	94.7	Very high	95 Å²	95	60.8 Å²	60.8	37%	0.373	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	157	170.8	59.3	-88.3	0	0	0	109.8	E60 I85	Y58-E60 HydrophobicContact CE2-CB 4.23Å; Y58-I85 HydrophobicContact CD2-CB 4.45Å; Y58-I85 HydrophobicContact CE1-CB 4.18Å; Y58-I85 HydrophobicContact CE1-CG2 4.19Å; Y58-I85 HydrophobicContact CE2-CB 3.97Å; Y58-I85 HydrophobicContact CE2-CG1 4.19Å; Y58-I85 HydrophobicContact CE2-CG2 4.45Å; Y58-I85 PolarHBondContact N-O 3.23Å; Y58-I85 PolarHBondContact O-N 2.95Å
59	W	96	Very high	94.8	Very high	115 Å²	115	65.1 Å²	65.1	44%	0.436	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	130.7	174.9	-69.7	104.6	0	0	0	110.3	F14 I46 K82 R83 L84	F14-W59 HydrophobicContact CB-CH2 4.13Å; F14-W59 HydrophobicContact CB-CZ3 4Å; F14-W59 AromaticContact CD1-CH2 3.68Å; F14-W59 HydrophobicContact CD1-CH2 3.68Å; F14-W59 HydrophobicContact CD1-CZ3 4.4Å; F14-W59 AromaticContact CD2-CH2 3.51Å; F14-W59 HydrophobicContact CD2-CH2 3.51Å; F14-W59 AromaticContact CD2-CZ3 3.72Å; F14-W59 HydrophobicContact CD2-CZ3 3.72Å; F14-W59 AromaticContact CE1-CH2 3.87Å; F14-W59 HydrophobicContact CE1-CH2 3.87Å; F14-W59 AromaticContact CE2-CH2 3.72Å; F14-W59 HydrophobicContact CE2-CH2 3.72Å; F14-W59 HydrophobicContact CE2-CZ3 4.29Å; F14-W59 AromaticContact CG-CH2 3.49Å; F14-W59 HydrophobicContact CG-CH2 3.49Å; F14-W59 VanDerWaalsContact CG-CH2 3.49Å; F14-W59 AromaticContact CG-CZ3 3.79Å; F14-W59 HydrophobicContact CG-CZ3 3.79Å; F14-W59 AromaticContact CZ-CH2 3.89Å; F14-W59 HydrophobicContact CZ-CH2 3.89Å; F14-W59 HydrophobicContact CZ-CZ2 4.49Å; I46-W59 HydrophobicContact CD1-CZ2 4.5Å; W59-K82 HydrophobicContact CE3-CB 4.14Å; W59-R83 WeakPolarHBondContact CA-O 3.43Å; W59-L84 HydrophobicContact CD2-CD1 4.09Å; W59-L84 HydrophobicContact CE3-CB 4.15Å; W59-L84 HydrophobicContact CE3-CD1 4.41Å; W59-L84 HydrophobicContact CH2-CB 4.14Å; W59-L84 HydrophobicContact CZ2-CD1 4.21Å; W59-L84 HydrophobicContact CZ3-CB 3.88Å
60	E	96.5	Very high	94.8	Very high	91 Å²	91	62.3 Å²	62.3	43%	0.425	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.5	173.6	-172.2	171.1	-112.7	0	0	109.9	Y58 K82 R83 I85	Y58-E60 HydrophobicContact CE2-CB 4.23Å; E60-K82 CarbonylContact O-C 3.58Å; E60-K82 VanDerWaalsContact O-CA 3.22Å; E60-K82 WeakPolarHBondContact O-CA 3.39Å; E60-R83 PolarHBondContact N-O 2.81Å; E60-R83 PolarHBondContact O-N 2.84Å; E60-I85 HydrophobicContact CB-CD1 4.46Å; E60-I85 HydrophobicContact CB-CG1 3.66Å
61	E	96.3	Very high	94.7	Very high	147 Å²	147	66.1 Å²	66.1	69%	0.687	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	126.6	171.6	-174.3	171.8	-175.1	0	0	109.3	V81	E61-V81 WeakPolarHBondContact CA-O 3.37Å
62	V	92.2	Very high	94.8	Very high	26 Å²	26	73.8 Å²	73.8	16%	0.158	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	146.3	-176.4	-67.7	0	0	0	0	111.9	G64 V81 R83	V62-G64 PolarHBondContact O-N 2.8Å; V62-V81 WeakPolarHBondContact CG2-O 3.34Å; V62-V81 PolarHBondContact N-O 2.73Å; V62-R83 HydrophobicContact CG1-CB 4.13Å; V62-R83 HydrophobicContact CG1-CG 3.57Å
63	L	94.8	Very high	95	Very high	193 Å²	193	75.8 Å²	75.8	100%	1.01	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	91.5	168.2	-65.4	-178.6	0	0	0	109.5
64	G	94.7	Very high	95	Very high	47 Å²	47	82.8 Å²	82.8	49%	0.485	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	136.3	-152.5	178.7	0	0	0	0	0	111.9	V62	V62-G64 PolarHBondContact O-N 2.8Å
65	T	94.7	Very high	95.2	Very high	89 Å²	89	87.3 Å²	87.3	55%	0.546	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	125.4	178.1	-56.7	0	0	0	0	108.4	V79 V81	T65-V79 HydrophobicContact CG2-CG1 3.32Å; T65-V81 HydrophobicContact CG2-CG1 4.41Å
66	D	94.4	Very high	95.2	Very high	25 Å²	25	90 Å²	90	13%	0.134	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	119.3	172.5	-65.9	-38.3	0	0	0	109	V79 S80 R83	D66-V79 CarbonylContact O-C 3.58Å; D66-V79 WeakPolarHBondContact O-CA 3.49Å; D66-S80 PolarHBondContact N-O 2.8Å; D66-S80 PolarHBondContact O-N 2.81Å; D66-R83 IonicContact OD1-CZ 3.67Å; D66-R83 IonicContact OD1-NE 2.71Å; D66-R83 PolarHBondContact OD1-NE 2.74Å; D66-R83 IonicContact OD1-NH2 3.52Å; D66-R83 PolarHBondContact OD1-NH2 2.89Å; D66-R83 WeakPolarHBondContact OD2-CG 3.46Å; D66-R83 IonicContact OD2-CZ 2.84Å; D66-R83 IonicContact OD2-NE 3.55Å; D66-R83 PolarHBondContact OD2-NE 2.84Å; D66-R83 IonicContact OD2-NH2 3.59Å
67	L	95.1	Very high	95.1	Very high	107 Å²	107	93.2 Å²	93.2	56%	0.56	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	112.8	168.2	-178	65.1	0	0	0	108.4	I69 A76 V79	L67-I69 HydrophobicContact CD2-CD1 4.06Å; L67-I69 HydrophobicContact CD2-CG1 4.37Å; L67-I69 HydrophobicContact CG-CD1 4.27Å; L67-I69 HydrophobicContact CG-CG1 4.06Å; L67-A76 HydrophobicContact CD1-CB 3.85Å; L67-V79 HydrophobicContact CD1-CG2 3.97Å
68	I	95.1	Very high	94.9	Very high	35 Å²	35	93.8 Å²	93.8	18%	0.179	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	119.8	-175.6	-53.3	171.8	0	0	0	107.9	V13 A76 I77 G78	V13-I68 HydrophobicContact CB-CD1 4.36Å; V13-I68 HydrophobicContact CG1-CB 4.39Å; V13-I68 HydrophobicContact CG1-CD1 3.71Å; V13-I68 HydrophobicContact CG1-CG2 4.05Å; I68-A76 WeakPolarHBondContact O-CA 3.39Å; I68-I77 HydrophobicContact CB-CG1 4.29Å; I68-I77 HydrophobicContact CG2-CD1 3.95Å; I68-I77 HydrophobicContact CG2-CG1 3.83Å; I68-I77 WeakPolarHBondContact O-CG1 3.35Å; I68-I77 PolarHBondContact O-N 3.16Å; I68-G78 PolarHBondContact N-O 3.35Å; I68-G78 PolarHBondContact O-N 2.93Å
69	I	96	Very high	94.8	Very high	97 Å²	97	94.2 Å²	94.2	50%	0.497	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.6	-173	-57.8	176.1	0	0	0	108.9	L67 X71 K75	L67-I69 HydrophobicContact CD2-CD1 4.06Å; L67-I69 HydrophobicContact CD2-CG1 4.37Å; L67-I69 HydrophobicContact CG-CD1 4.27Å; L67-I69 HydrophobicContact CG-CG1 4.06Å; I69-A71 PolarHBondContact O-N 3.01Å; I69-K75 WeakPolarHBondContact CA-O 3.34Å
70	D	94.8	Very high	94.8	Very high	41 Å²	41	89.3 Å²	89.3	22%	0.219	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	112.9	164.3	-179.9	-19.3	0	0	0	108.1	E72 Q73 Q74 K75 I77	D70-E72 VanDerWaalsContact C-N 3.3Å; D70-E72 PolarHBondContact O-N 3.31Å; D70-E72 WeakPolarHBondContact OD1-CB 3.25Å; D70-E72 PolarHBondContact OD1-N 2.85Å; D70-Q73 HydrophobicContact CB-CB 4.27Å; D70-Q73 PolarHBondContact O-N 2.78Å; D70-Q73 PolarHBondContact OD1-N 3.27Å; D70-Q73 VanDerWaalsContact OD2-CD 3.3Å; D70-Q73 WeakPolarHBondContact OD2-CG 3.04Å; D70-Q73 PolarHBondContact OD2-NE2 2.93Å; D70-Q73 VanDerWaalsContact OD2-NE2 3.16Å; D70-Q74 VanDerWaalsContact O-CA 3.29Å; D70-Q74 WeakPolarHBondContact O-CA 3.45Å; D70-Q74 PolarHBondContact O-N 2.83Å; D70-K75 PolarHBondContact N-O 2.77Å; D70-K75 PolarHBondContact O-N 3.34Å; D70-I77 HydrophobicContact CB-CD1 4.4Å; D70-I77 HydrophobicContact CB-CG2 3.78Å
71	X	94.1	Very high	94.7	Very high	86 Å²	86	88.3 Å²	88.3	71%	0.711	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-28.3	-176.7	0	0	0	0	0	113.1	I69	I69-A71 PolarHBondContact O-N 3.01Å
72	E	95.8	Very high	94.7	Very high	187 Å²	187	86.4 Å²	86.4	87%	0.874	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-41.8	179.3	-60.8	-171.8	173	0	0	110.8	D70	D70-E72 VanDerWaalsContact C-N 3.3Å; D70-E72 PolarHBondContact O-N 3.31Å; D70-E72 WeakPolarHBondContact OD1-CB 3.25Å; D70-E72 PolarHBondContact OD1-N 2.85Å
73	Q	95.4	Very high	94.9	Very high	131 Å²	131	88.3 Å²	88.3	61%	0.612	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-9.1	179.8	-60.3	-177	28.8	0	0	113.6	D70 K75	D70-Q73 HydrophobicContact CB-CB 4.27Å; D70-Q73 PolarHBondContact O-N 2.78Å; D70-Q73 PolarHBondContact OD1-N 3.27Å; D70-Q73 VanDerWaalsContact OD2-CD 3.3Å; D70-Q73 WeakPolarHBondContact OD2-CG 3.04Å; D70-Q73 PolarHBondContact OD2-NE2 2.93Å; D70-Q73 VanDerWaalsContact OD2-NE2 3.16Å; Q73-K75 HydrophobicContact CB-CB 4.13Å; Q73-K75 PolarHBondContact O-N 3.49Å
74	Q	93.5	Very high	95	Very high	178 Å²	178	79.1 Å²	79.1	83%	0.832	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	36.1	-171.8	-59.4	-172.5	-20.7	0	0	112.9	D70	D70-Q74 VanDerWaalsContact O-CA 3.29Å; D70-Q74 WeakPolarHBondContact O-CA 3.45Å; D70-Q74 PolarHBondContact O-N 2.83Å
75	K	96.1	Very high	95.1	Very high	128 Å²	128	77.1 Å²	77.1	56%	0.557	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.3	-173	-170.4	-173.5	171.9	-170.5	0	110.3	I69 D70 Q73 I77	I69-K75 WeakPolarHBondContact CA-O 3.34Å; D70-K75 PolarHBondContact N-O 2.77Å; D70-K75 PolarHBondContact O-N 3.34Å; Q73-K75 HydrophobicContact CB-CB 4.13Å; Q73-K75 PolarHBondContact O-N 3.49Å; K75-I77 PolarHBondContact O-N 3.19Å
76	A	94.1	Very high	95.2	Very high	55 Å²	55	72.9 Å²	72.9	46%	0.455	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	121.6	167.2	0	0	0	0	0	109.5	L67 I68	L67-A76 HydrophobicContact CD1-CB 3.85Å; I68-A76 WeakPolarHBondContact O-CA 3.39Å
77	I	94.7	Very high	95.2	Very high	85 Å²	85	75.8 Å²	75.8	44%	0.436	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-16.5	179.9	58.9	167.9	0	0	0	112.3	V13 I68 D70 K75	V13-I77 HydrophobicContact CG1-CD1 4.44Å; I68-I77 HydrophobicContact CB-CG1 4.29Å; I68-I77 HydrophobicContact CG2-CD1 3.95Å; I68-I77 HydrophobicContact CG2-CG1 3.83Å; I68-I77 WeakPolarHBondContact O-CG1 3.35Å; I68-I77 PolarHBondContact O-N 3.16Å; D70-I77 HydrophobicContact CB-CD1 4.4Å; D70-I77 HydrophobicContact CB-CG2 3.78Å; K75-I77 PolarHBondContact O-N 3.19Å
78	G	93.2	Very high	95.2	Very high	12 Å²	12	75.6 Å²	75.6	12%	0.124	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	152.1	-177.2	0	0	0	0	0	113	I68	I68-G78 PolarHBondContact N-O 3.35Å; I68-G78 PolarHBondContact O-N 2.93Å
79	V	94.1	Very high	94.9	Very high	104 Å²	104	75.7 Å²	75.7	63%	0.63	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.8	125.1	168.8	-179.1	0	0	0	0	106.3	T65 D66 L67	T65-V79 HydrophobicContact CG2-CG1 3.32Å; D66-V79 CarbonylContact O-C 3.58Å; D66-V79 WeakPolarHBondContact O-CA 3.49Å; L67-V79 HydrophobicContact CD1-CG2 3.97Å
80	S	94.2	Very high	94.3	Very high	12 Å²	12	77.7 Å²	77.7	8%	0.084	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	140.6	179.2	-167.7	0	0	0	0	112	D66 K82	D66-S80 PolarHBondContact N-O 2.8Å; D66-S80 PolarHBondContact O-N 2.81Å; S80-K82 PolarHBondContact OG-N 2.7Å; S80-K82 VanDerWaalsContact OG-N 3.09Å; S80-K82 PolarHBondContact OG-O 2.73Å
81	V	95.6	Very high	93.3	Very high	70 Å²	70	77.3 Å²	77.3	42%	0.424	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	3.1	167.3	-62.4	0	0	0	0	111.6	E61 V62 T65	E61-V81 WeakPolarHBondContact CA-O 3.37Å; V62-V81 WeakPolarHBondContact CG2-O 3.34Å; V62-V81 PolarHBondContact N-O 2.73Å; T65-V81 HydrophobicContact CG2-CG1 4.41Å
82	K	95.4	Very high	92.2	Very high	107 Å²	107	80.4 Å²	80.4	47%	0.465	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	145.4	177.8	-66.1	-177.6	178.9	179.9	0	111.3	W59 E60 S80	W59-K82 HydrophobicContact CE3-CB 4.14Å; E60-K82 CarbonylContact O-C 3.58Å; E60-K82 VanDerWaalsContact O-CA 3.22Å; E60-K82 WeakPolarHBondContact O-CA 3.39Å; S80-K82 PolarHBondContact OG-N 2.7Å; S80-K82 VanDerWaalsContact OG-N 3.09Å; S80-K82 PolarHBondContact OG-O 2.73Å
83	R	96.4	Very high	90.7	Very high	65 Å²	65	81.9 Å²	81.9	25%	0.245	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	150.2	171.5	-66.9	-172.7	-174.7	173	2.7	110.5	L15 E17 W59 E60 V62 D66 I85	L15-R83 HydrophobicContact CB-CG 4.21Å; L15-R83 WeakPolarHBondContact O-CA 3.34Å; E17-R83 IonicContact OE2-NH1 3.49Å; W59-R83 WeakPolarHBondContact CA-O 3.43Å; E60-R83 PolarHBondContact N-O 2.81Å; E60-R83 PolarHBondContact O-N 2.84Å; V62-R83 HydrophobicContact CG1-CB 4.13Å; V62-R83 HydrophobicContact CG1-CG 3.57Å; D66-R83 IonicContact OD1-CZ 3.67Å; D66-R83 IonicContact OD1-NE 2.71Å; D66-R83 PolarHBondContact OD1-NE 2.74Å; D66-R83 IonicContact OD1-NH2 3.52Å; D66-R83 PolarHBondContact OD1-NH2 2.89Å; D66-R83 WeakPolarHBondContact OD2-CG 3.46Å; D66-R83 IonicContact OD2-CZ 2.84Å; D66-R83 IonicContact OD2-NE 3.55Å; D66-R83 PolarHBondContact OD2-NE 2.84Å; D66-R83 IonicContact OD2-NH2 3.59Å; R83-I85 HydrophobicContact CB-CD1 3.83Å
84	L	96.8	Very high	89.1	Confident	1 Å²	1	82 Å²	82	1%	0.005	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	107.1	169.5	-174.9	69.3	0	0	0	108	F14 L15 A16 E17 F38 I46 C57 W59	F14-L84 HydrophobicContact CD2-CB 3.96Å; F14-L84 HydrophobicContact CE2-CB 3.76Å; F14-L84 HydrophobicContact CE2-CD2 3.85Å; F14-L84 HydrophobicContact CE2-CG 4.44Å; F14-L84 HydrophobicContact CZ-CD2 4.39Å; L15-L84 PolarHBondContact O-N 2.88Å; A16-L84 CarbonylContact C-O 3.45Å; A16-L84 VanDerWaalsContact CA-O 3.25Å; A16-L84 WeakPolarHBondContact CA-O 3.22Å; A16-L84 HydrophobicContact CB-CB 4.18Å; A16-L84 HydrophobicContact CB-CD2 4.45Å; E17-L84 PolarHBondContact N-O 3.21Å; F38-L84 HydrophobicContact CE1-CD2 4.01Å; I46-L84 HydrophobicContact CD1-CD1 3.87Å; C57-L84 HydrophobicContact CB-CD1 3.59Å; C57-L84 HydrophobicContact CB-CD2 4.18Å; C57-L84 HydrophobicContact CB-CG 3.75Å; W59-L84 HydrophobicContact CD2-CD1 4.09Å; W59-L84 HydrophobicContact CE3-CB 4.15Å; W59-L84 HydrophobicContact CE3-CD1 4.41Å; W59-L84 HydrophobicContact CH2-CB 4.14Å; W59-L84 HydrophobicContact CZ2-CD1 4.21Å; W59-L84 HydrophobicContact CZ3-CB 3.88Å
85	I	97.3	Very high	87.2	Confident	5 Å²	5	78.3 Å²	78.3	3%	0.026	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	123.6	179.2	-49.3	-55.8	0	0	0	108	E17 C57 Y58 E60 R83	E17-I85 HydrophobicContact CB-CD1 3.84Å; E17-I85 CarbonylContact O-C 3.6Å; C57-I85 CarbonylContact C-O 3.52Å; C57-I85 WeakPolarHBondContact CA-O 3.32Å; C57-I85 WeakPolarHBondContact CB-O 3.48Å; Y58-I85 HydrophobicContact CD2-CB 4.45Å; Y58-I85 HydrophobicContact CE1-CB 4.18Å; Y58-I85 HydrophobicContact CE1-CG2 4.19Å; Y58-I85 HydrophobicContact CE2-CB 3.97Å; Y58-I85 HydrophobicContact CE2-CG1 4.19Å; Y58-I85 HydrophobicContact CE2-CG2 4.45Å; Y58-I85 PolarHBondContact N-O 3.23Å; Y58-I85 PolarHBondContact O-N 2.95Å; E60-I85 HydrophobicContact CB-CD1 4.46Å; E60-I85 HydrophobicContact CB-CG1 3.66Å; R83-I85 HydrophobicContact CB-CD1 3.83Å
86	G	96.4	Very high	85.2	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118.5	-176.6	0	0	0	0	0	112.3	E17 N19 C57	E17-G86 PolarHBondContact O-N 3.34Å; N19-G86 PolarHBondContact N-O 2.84Å; C57-G86 WeakPolarHBondContact SG-CA 3.26Å
87	E	95.5	Very high	83.1	Confident	86 Å²	86	81 Å²	81	40%	0.402	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	125.9	174.5	-65.2	-58.4	142.6	0	0	110	N19 F55 L56 T89	N19-E87 WeakPolarHBondContact CB-OE1 3.25Å; N19-E87 WeakPolarHBondContact CB-OE2 3.37Å; N19-E87 PolarHBondContact ND2-OE1 3.46Å; F55-E87 WeakPolarHBondContact CA-O 3.37Å; L56-E87 PolarHBondContact N-O 3.43Å; L56-E87 PolarHBondContact O-N 2.87Å; E87-T89 PolarHBondContact O-N 3.26Å
88	R	94.2	Very high	81	Confident	103 Å²	103	83.7 Å²	83.7	39%	0.389	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	126.1	177.1	-174.6	-178.6	-177	-133.6	-6.7	109.7	N19 I21 F55	N19-R88 VanDerWaalsContact O-CB 3.31Å; N19-R88 WeakPolarHBondContact O-CB 3.44Å; N19-R88 PolarHBondContact O-N 3.3Å; I21-R88 WeakPolarHBondContact O-CD 3.5Å; I21-R88 PolarHBondContact O-NE 2.71Å; I21-R88 PolarHBondContact O-NH1 2.75Å; F55-R88 HydrophobicContact CD1-CB 4.07Å; F55-R88 HydrophobicContact CE1-CB 3.86Å; F55-R88 HydrophobicContact CE1-CG 4.37Å
89	T	89.1	Confident	78.6	Confident	36 Å²	36	92.1 Å²	92.1	22%	0.221	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	154.9	-179.7	-171.4	0	0	0	0	111.3	I54 L56 E87 F91	I54-T89 PolarHBondContact O-N 3.49Å; L56-T89 HydrophobicContact CB-CG2 4.14Å; E87-T89 PolarHBondContact O-N 3.26Å; T89-F91 HydrophobicContact CG2-CD1 4.21Å; T89-F91 HydrophobicContact CG2-CD2 4.46Å; T89-F91 HydrophobicContact CG2-CE1 3.5Å; T89-F91 HydrophobicContact CG2-CE2 3.96Å; T89-F91 HydrophobicContact CG2-CZ 3.41Å; T89-F91 VanDerWaalsContact CG2-CZ 3.41Å
90	I	83.4	Confident	75.9	Confident	140 Å²	140	91.8 Å²	91.8	72%	0.718	46%	0.459	S	S	*	.			trans	-110.3	124.7	171.6	-59.9	174.7	0	0	0	106.3
91	F	74.1	Confident	73.7	Confident	33 Å²	33	97 Å²	97	15%	0.145	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-93.2	127.8	175.9	-68.9	-45.6	0	0	0	111.2	I54 T89 I118 I120	I54-F91 HydrophobicContact CB-CD2 4.04Å; I54-F91 HydrophobicContact CB-CE2 4.01Å; I54-F91 HydrophobicContact CD1-CD2 3.58Å; I54-F91 HydrophobicContact CD1-CE2 4.29Å; I54-F91 HydrophobicContact CG1-CD2 4.38Å; I54-F91 HydrophobicContact CG2-CD2 3.64Å; I54-F91 HydrophobicContact CG2-CE2 3.19Å; I54-F91 HydrophobicContact CG2-CZ 4.17Å; T89-F91 HydrophobicContact CG2-CD1 4.21Å; T89-F91 HydrophobicContact CG2-CD2 4.46Å; T89-F91 HydrophobicContact CG2-CE1 3.5Å; T89-F91 HydrophobicContact CG2-CE2 3.96Å; T89-F91 HydrophobicContact CG2-CZ 3.41Å; T89-F91 VanDerWaalsContact CG2-CZ 3.41Å; F91-I118 HydrophobicContact CB-CD1 4.3Å; F91-I118 HydrophobicContact CB-CG1 4.38Å; F91-I118 HydrophobicContact CB-CG2 3.57Å; F91-I118 HydrophobicContact CD1-CG2 3.38Å; F91-I118 HydrophobicContact CD2-CB 4.49Å; F91-I118 HydrophobicContact CD2-CD1 3.91Å; F91-I118 HydrophobicContact CD2-CG2 3.39Å; F91-I118 HydrophobicContact CE1-CG2 3.9Å; F91-I118 HydrophobicContact CE2-CG2 3.76Å; F91-I118 HydrophobicContact CG-CB 4.44Å; F91-I118 HydrophobicContact CG-CD1 4.38Å; F91-I118 HydrophobicContact CG-CG2 3.15Å; F91-I118 HydrophobicContact CZ-CG2 4.04Å; F91-I120 HydrophobicContact CD1-CB 4.47Å; F91-I120 HydrophobicContact CD1-CD1 4.44Å; F91-I120 HydrophobicContact CD1-CG1 3.94Å; F91-I120 HydrophobicContact CD1-CG2 4.43Å; F91-I120 HydrophobicContact CE1-CB 3.9Å; F91-I120 HydrophobicContact CE1-CD1 3.28Å; F91-I120 HydrophobicContact CE1-CG1 3.19Å; F91-I120 HydrophobicContact CE1-CG2 3.77Å; F91-I120 HydrophobicContact CZ-CD1 3.38Å; F91-I120 HydrophobicContact CZ-CG1 3.77Å
92	E	70.3	Confident	71.3	Confident	150 Å²	150	97.6 Å²	97.6	70%	0.701	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-84	135.6	167.4	-61.6	-169.8	163.1	0	0	108.7	K94	E92-K94 PolarHBondContact O-N 2.94Å
93	R	64.8	Low	68.8	Low	219 Å²	219	99 Å²	99	83%	0.826	53%	0.525	S	S	*	.	B	Isolated β-bridge	trans	-68.7	125.5	168.4	-74.9	-172.7	-168.7	149.4	-0	107.7	S95	R93-S95 PolarHBondContact O-N 3.12Å; R93-S95 VanDerWaalsContact O-N 3.12Å
94	K	62.7	Low	66.3	Low	132 Å²	132	104.8 Å²	104.8	57%	0.574	56%	0.56	S	S	*	*			trans	-66	112.4	163.8	-165.5	174.3	-179.1	-178.3	0	107.4	E92 D96	E92-K94 PolarHBondContact O-N 2.94Å; K94-D96 PolarHBondContact O-N 2.91Å
95	S	52.4	Low	63.9	Low	102 Å²	102	109.7 Å²	109.7	71%	0.713	59%	0.594	S	S	*	*			trans	-70.1	116.7	165.5	55.4	0	0	0	0	107.2	R93	R93-S95 PolarHBondContact O-N 3.12Å; R93-S95 VanDerWaalsContact O-N 3.12Å
96	D	55.8	Low	61.3	Low	117 Å²	117	115 Å²	115	63%	0.626	63%	0.632	S	S	*	*			trans	-58.3	132.8	159.4	-70.1	-37.9	0	0	0	107.5	K94 L98	K94-D96 PolarHBondContact O-N 2.91Å; D96-L98 PolarHBondContact O-N 2.9Å
97	P	49.4	Very low	58.8	Low	122 Å²	122	120.7 Å²	120.7	79%	0.792	67%	0.667	S	S	*	*			trans	-68.4	82.6	168.3	27.6	-30.2	0	0	0	107.9	E99	P97-E99 PolarHBondContact O-N 2.85Å; P97-E99 VanDerWaalsContact O-N 3.15Å
98	L	50.9	Low	56	Low	142 Å²	142	123 Å²	123	74%	0.743	69%	0.689	S	S	*	*			trans	-69.5	104.4	158.2	-80.9	165.9	0	0	0	106.2	D96 C100	D96-L98 PolarHBondContact O-N 2.9Å; L98-C100 PolarHBondContact O-N 2.62Å
99	E	42.5	Very low	53.3	Low	189 Å²	189	122.7 Å²	122.7	88%	0.883	71%	0.709	S	S	*	*			trans	-59	71.9	154.9	-74.1	-172.8	145	0	0	109.1	P97 S101	P97-E99 PolarHBondContact O-N 2.85Å; P97-E99 VanDerWaalsContact O-N 3.15Å; E99-S101 VanDerWaalsContact C-N 3.34Å; E99-S101 PolarHBondContact O-N 3.09Å
100	C	37.5	Very low	50.8	Low	97 Å²	97	131.9 Å²	131.9	66%	0.655	74%	0.741	S	S	*	*			trans	-87.5	82	167.3	-85.8	0	0	0	0	107.9	L98 A102	L98-C100 PolarHBondContact O-N 2.62Å; C100-A102 PolarHBondContact O-N 2.91Å
101	S	47	Very low	48.3	Very low	122 Å²	122	131.9 Å²	131.9	85%	0.853	75%	0.747	S	S	*	*			trans	-71.5	67.4	158.5	51.7	0	0	0	0	109.3	E99	E99-S101 VanDerWaalsContact C-N 3.34Å; E99-S101 PolarHBondContact O-N 3.09Å
102	A	45.2	Very low	46.5	Very low	81 Å²	81	135.9 Å²	135.9	67%	0.669	77%	0.774	S	S	*	*			trans	-103	97.7	173.3	0	0	0	0	0	108.8	C100 L104	C100-A102 PolarHBondContact O-N 2.91Å; A102-L104 PolarHBondContact O-N 3.1Å
103	T	43.3	Very low	44.7	Very low	137 Å²	137	136 Å²	136	84%	0.84	78%	0.78	S	S	*	*			trans	-46.3	126.5	162.6	37.7	0	0	0	0	110.7	S105	T103-S105 PolarHBondContact O-N 2.79Å
104	L	43	Very low	43.6	Very low	186 Å²	186	129.9 Å²	129.9	97%	0.974	77%	0.77	S	S	*	*			trans	-48	113.9	179	-68.3	151.6	0	0	0	111.9	A102	A102-L104 PolarHBondContact O-N 3.1Å
105	S	46.8	Very low	42.5	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	78%	0.784	S	S	*	*			trans	-141.5	119	162.1	167.5	0	0	0	0	107.6	T103 T107	T103-S105 PolarHBondContact O-N 2.79Å; S105-T107 PolarHBondContact O-N 3.23Å
106	S	43.6	Very low	42.1	Very low	117 Å²	117	127.1 Å²	127.1	82%	0.818	77%	0.772	S	S	*	*			trans	-65.6	108.8	-171.3	55.7	0	0	0	0	113.1
107	T	42.9	Very low	41.5	Very low	120 Å²	120	128.4 Å²	128.4	74%	0.736	78%	0.779	S	S	*	*			trans	-163.3	131.7	154.2	-12.9	0	0	0	0	108.2	S105 A109	S105-T107 PolarHBondContact O-N 3.23Å; T107-A109 PolarHBondContact O-N 3.38Å
108	P	37.6	Very low	41.4	Very low	133 Å²	133	127 Å²	127	86%	0.864	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-71.9	119.2	-174.9	27.7	-31.8	0	0	0	110.3
109	A	37.6	Very low	41	Very low	98 Å²	98	123.9 Å²	123.9	81%	0.81	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-102.2	137.4	174.2	0	0	0	0	0	110.7	T107	T107-A109 PolarHBondContact O-N 3.38Å
110	Y	36.2	Very low	41	Very low	229 Å²	229	117.2 Å²	117.2	90%	0.898	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-54.2	141.7	-178.5	-94.8	-109.3	0	0	0	113.6	V112	Y110-V112 PolarHBondContact O-N 2.99Å
111	V	30.8	Very low	41.4	Very low	139 Å²	139	118 Å²	118	84%	0.842	72%	0.723	S	S	*	*			trans	-77.5	115.2	167.6	-179.5	0	0	0	0	108.3
112	V	35.4	Very low	41	Very low	118 Å²	118	118.9 Å²	118.9	72%	0.715	71%	0.714	S	S	*	*			trans	-87.7	117	163.5	179.3	0	0	0	0	107	Y110 C114	Y110-V112 PolarHBondContact O-N 2.99Å; V112-C114 PolarHBondContact O-N 2.97Å
113	D	33.1	Very low	40.9	Very low	153 Å²	153	121.1 Å²	121.1	82%	0.818	72%	0.721	S	S	*	*			trans	-74	98.1	172.6	-168	14.2	0	0	0	108.2
114	C	42.3	Very low	40.8	Very low	90 Å²	90	129.6 Å²	129.6	61%	0.608	74%	0.738	S	S	*	*			trans	-103.6	117.5	168.4	-74.3	0	0	0	0	108.2	V112 C116	V112-C114 PolarHBondContact O-N 2.97Å; C114-C116 PolarHBondContact O-N 3.1Å; C114-C116 VanDerWaalsContact O-N 3.1Å; C114-C116 PolarHBondContact O-SG 3.07Å
115	A	39.7	Very low	40.7	Very low	105 Å²	105	126.8 Å²	126.8	87%	0.868	73%	0.726	S	S	*	*			trans	-44.1	113.3	172.5	0	0	0	0	0	110.8
116	C	43.7	Very low	40.4	Very low	70 Å²	70	128 Å²	128	47%	0.473	73%	0.726	S	S	.	*			trans	-109.8	128.2	174.1	4.3	0	0	0	0	109.1	C114 I118	C114-C116 PolarHBondContact O-N 3.1Å; C114-C116 VanDerWaalsContact O-N 3.1Å; C114-C116 PolarHBondContact O-SG 3.07Å; C116-I118 PolarHBondContact O-N 3.2Å
117	D	43	Very low	40.2	Very low	145 Å²	145	128.6 Å²	128.6	78%	0.775	72%	0.721	S	S	*	*			trans	-53.4	128	175.2	-61.8	-54.8	0	0	0	111.1
118	I	46.8	Very low	40.1	Very low	93 Å²	93	129.1 Å²	129.1	48%	0.477	72%	0.72	S	S	.	*	B	Isolated β-bridge	trans	-81.8	119.6	174.5	-73.5	171.4	0	0	0	107.2	F91 C116	F91-I118 HydrophobicContact CB-CD1 4.3Å; F91-I118 HydrophobicContact CB-CG1 4.38Å; F91-I118 HydrophobicContact CB-CG2 3.57Å; F91-I118 HydrophobicContact CD1-CG2 3.38Å; F91-I118 HydrophobicContact CD2-CB 4.49Å; F91-I118 HydrophobicContact CD2-CD1 3.91Å; F91-I118 HydrophobicContact CD2-CG2 3.39Å; F91-I118 HydrophobicContact CE1-CG2 3.9Å; F91-I118 HydrophobicContact CE2-CG2 3.76Å; F91-I118 HydrophobicContact CG-CB 4.44Å; F91-I118 HydrophobicContact CG-CD1 4.38Å; F91-I118 HydrophobicContact CG-CG2 3.15Å; F91-I118 HydrophobicContact CZ-CG2 4.04Å; C116-I118 PolarHBondContact O-N 3.2Å
119	T	43.3	Very low	40.2	Very low	76 Å²	76	128.9 Å²	128.9	47%	0.466	71%	0.711	S	S	.	*			trans	-107	132.5	169.5	21.7	0	0	0	0	108.7
120	I	41.7	Very low	40.4	Very low	49 Å²	49	130.9 Å²	130.9	25%	0.251	70%	0.704	S	S	.	*			trans	-97.1	123.8	-175.1	-41.3	-171.7	0	0	0	108.6	L56 F91	L56-I120 HydrophobicContact CD1-CD1 3.38Å; L56-I120 HydrophobicContact CD2-CD1 3.69Å; L56-I120 HydrophobicContact CD2-CG2 4.02Å; L56-I120 HydrophobicContact CG-CD1 4.07Å; F91-I120 HydrophobicContact CD1-CB 4.47Å; F91-I120 HydrophobicContact CD1-CD1 4.44Å; F91-I120 HydrophobicContact CD1-CG1 3.94Å; F91-I120 HydrophobicContact CD1-CG2 4.43Å; F91-I120 HydrophobicContact CE1-CB 3.9Å; F91-I120 HydrophobicContact CE1-CD1 3.28Å; F91-I120 HydrophobicContact CE1-CG1 3.19Å; F91-I120 HydrophobicContact CE1-CG2 3.77Å; F91-I120 HydrophobicContact CZ-CD1 3.38Å; F91-I120 HydrophobicContact CZ-CG1 3.77Å
121	T	45.5	Very low	40.7	Very low	113 Å²	113	123.9 Å²	123.9	69%	0.693	69%	0.69	S	S	*	*			trans	-109.6	127.2	169.8	48	0	0	0	0	109.9
122	E	40.3	Very low	41.5	Very low	141 Å²	141	122.8 Å²	122.8	66%	0.659	68%	0.679	S	S	*	*			trans	-73.6	140.9	174.5	-70.4	179.2	172.6	0	0	111.2	R45	R45-E122 IonicContact CZ-OE1 3.68Å; R45-E122 IonicContact NH1-OE1 2.75Å; R45-E122 PolarHBondContact NH1-OE1 3.49Å; R45-E122 IonicContact NH2-OE1 3.65Å
123	P	42.4	Very low	42	Very low	127 Å²	127	123.2 Å²	123.2	83%	0.825	68%	0.676	S	S	*	*			trans	-72.2	141.9	169	29.6	-30.7	0	0	0	110.5
124	R	42.1	Very low	42.8	Very low	316 Å²	316	120.5 Å²	120.5	100%	1.192	66%	0.663	S	S	*	*			trans	-65	0	-177	-170.4	-178.8	-175.2	177.1	3.1	114.2

Retrieved 124 of 124 residues in 102.7 ms (Link to these results)

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