A0A077ZDC4_TRITR Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A077ZDC4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 133 aa.

						>A0A077ZDC4_TRITR|A0A077ZDC4
MDCSFLNIGDLERKCESYKDTVQFKFTDTYHNLSLKAYSWFNWAAKYWPNAKYILKVDDDMYKEMRVQRREEDKWYVSYEEFNETVFPRFCSGSSYCLTTQAVQPLLDSVELTPFLWLDDVYITGLLSNIQPT
					

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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	53.4	Low	56.8	Low	150 Å²	150	87.6 Å²	87.6	74%	0.739	49%	0.486	S	S	*	.				0	130.9	0	-79.5	147.5	-171.8	0	0	106.9	K19	M1-K19 HydrophobicContact CE-CB 4.38Å; M1-K19 WeakPolarHBondContact CE-O 3.17Å; M1-K19 HydrophobicContact SD-CB 3.64Å; M1-K19 HydrophobicContact SD-CG 4.36Å
2	D	56.7	Low	57.2	Low	95 Å²	95	86.9 Å²	86.9	51%	0.508	48%	0.476	S	S	.	.			trans	-114.9	105.6	-176.7	-172.8	4.2	0	0	0	107.8	S4 F5	D2-S4 VanDerWaalsContact C-N 3.31Å; D2-S4 WeakPolarHBondContact OD1-CB 2.85Å; D2-S4 PolarHBondContact OD1-N 3.21Å; D2-S4 PolarHBondContact OD1-OG 3.34Å; D2-S4 PolarHBondContact OD2-OG 3.25Å; D2-F5 WeakPolarHBondContact OD2-CE2 3.43Å
3	C	56	Low	57.4	Low	37 Å²	37	92.5 Å²	92.5	25%	0.25	49%	0.486	C	S	.	.			trans	-91.6	9	174.4	-57.9	0	0	0	0	110.9	F5 L6 C15	C3-F5 PolarHBondContact O-N 3.3Å; C3-L6 HydrophobicContact CB-CD1 4.27Å; C3-C15 HydrophobicContact CB-CB 4.15Å; C3-C15 WeakPolarHBondContact CB-SG 3.38Å; C3-C15 WeakPolarHBondContact SG-CB 3.32Å; C3-C15 CovalentContact SG-SG 2.07Å; C3-C15 PolarHBondContact SG-SG 3.27Å
4	S	52.4	Low	57.8	Low	80 Å²	80	94.9 Å²	94.9	56%	0.559	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	14.6	-168.1	80.3	0	0	0	0	116.1	D2	D2-S4 VanDerWaalsContact C-N 3.31Å; D2-S4 WeakPolarHBondContact OD1-CB 2.85Å; D2-S4 PolarHBondContact OD1-N 3.21Å; D2-S4 PolarHBondContact OD1-OG 3.34Å; D2-S4 PolarHBondContact OD2-OG 3.25Å
5	F	51.8	Low	58.3	Low	102 Å²	102	88.9 Å²	88.9	45%	0.447	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	10.8	-174.2	-62.7	-71.9	0	0	0	114.3	D2 C3 Q23	D2-F5 WeakPolarHBondContact OD2-CE2 3.43Å; C3-F5 PolarHBondContact O-N 3.3Å; F5-Q23 PolarHBondContact O-NE2 3.1Å; F5-Q23 VanDerWaalsContact O-NE2 3.17Å; F5-Q23 PolarHBondContact O-OE1 2.63Å
6	L	54.5	Low	58.9	Low	10 Å²	10	91.8 Å²	91.8	5%	0.052	47%	0.471	C	S	.	.			trans	-95.7	97.1	-174.4	-69.6	168.3	0	0	0	112.2	C3 I8 L11 E12 C15 Q23	C3-L6 HydrophobicContact CB-CD1 4.27Å; L6-I8 PolarHBondContact O-N 3.15Å; L6-L11 HydrophobicContact CD1-CB 4.28Å; L6-L11 HydrophobicContact CD2-CB 3.8Å; L6-L11 HydrophobicContact CD2-CD1 4.2Å; L6-E12 HydrophobicContact CB-CG 3.34Å; L6-E12 HydrophobicContact CD1-CB 4.45Å; L6-E12 HydrophobicContact CD1-CG 3.92Å; L6-E12 HydrophobicContact CG-CG 4.25Å; L6-C15 HydrophobicContact CD1-CB 3.81Å; L6-Q23 HydrophobicContact CD2-CG 4.29Å
7	N	51.7	Low	59.7	Low	173 Å²	173	91.7 Å²	91.7	93%	0.925	48%	0.48	S	S	*	.			trans	-77.8	23.3	171.1	-85.7	-32.3	0	0	0	114.3
8	I	60.5	Low	60.8	Low	103 Å²	103	95.8 Å²	95.8	53%	0.528	49%	0.489	S	S	.	.	S	Bend	trans	-133.8	98.1	-177.7	-55.7	175.7	0	0	0	107.4	L6 D10 L11 E12	L6-I8 PolarHBondContact O-N 3.15Å; I8-D10 PolarHBondContact O-N 2.83Å; I8-L11 HydrophobicContact CB-CD1 4.18Å; I8-L11 HydrophobicContact CB-CG 4.5Å; I8-L11 HydrophobicContact CD1-CD1 4.2Å; I8-L11 HydrophobicContact CG2-CD1 4.37Å; I8-L11 HydrophobicContact CG2-CG 4.39Å; I8-L11 PolarHBondContact O-N 2.73Å; I8-E12 PolarHBondContact O-N 3.39Å
9	G	60.3	Low	61.8	Low	40 Å²	40	98.4 Å²	98.4	41%	0.412	50%	0.497	S	S	.	.	H	α-helix	trans	-57.8	-17.9	-169.3	0	0	0	0	0	116.1	R13	G9-R13 WeakPolarHBondContact O-CG 3.36Å; G9-R13 PolarHBondContact O-N 2.7Å
10	D	63.9	Low	62.9	Low	97 Å²	97	99.1 Å²	99.1	52%	0.519	50%	0.502	S	S	.	.	H	α-helix	trans	-74	-33.2	172	-73.6	-15.9	0	0	0	113.2	I8 R13 K14	I8-D10 PolarHBondContact O-N 2.83Å; D10-R13 IonicContact OD1-CZ 3.68Å; D10-R13 IonicContact OD1-NE 3.93Å; D10-R13 IonicContact OD1-NH2 2.66Å; D10-R13 PolarHBondContact OD1-NH2 3.43Å; D10-K14 WeakPolarHBondContact O-CG 3.35Å; D10-K14 PolarHBondContact O-N 3.42Å
11	L	63.3	Low	64	Low	77 Å²	77	96.8 Å²	96.8	40%	0.403	49%	0.493	S	S	.	.	H	α-helix	trans	-77	-35.4	177.1	-70.2	173.1	0	0	0	111.3	L6 I8 R13 K14 C15	L6-L11 HydrophobicContact CD1-CB 4.28Å; L6-L11 HydrophobicContact CD2-CB 3.8Å; L6-L11 HydrophobicContact CD2-CD1 4.2Å; I8-L11 HydrophobicContact CB-CD1 4.18Å; I8-L11 HydrophobicContact CB-CG 4.5Å; I8-L11 HydrophobicContact CD1-CD1 4.2Å; I8-L11 HydrophobicContact CG2-CD1 4.37Å; I8-L11 HydrophobicContact CG2-CG 4.39Å; I8-L11 PolarHBondContact O-N 2.73Å; L11-R13 PolarHBondContact O-N 3.46Å; L11-K14 PolarHBondContact O-N 3.08Å; L11-C15 VanDerWaalsContact O-CB 3.31Å; L11-C15 WeakPolarHBondContact O-CB 3.43Å; L11-C15 PolarHBondContact O-N 3.14Å
12	E	62	Low	65.6	Low	79 Å²	79	91.6 Å²	91.6	37%	0.369	47%	0.47	S	S	.	.	H	α-helix	trans	-57.7	-50.2	174.1	-72.5	-178.6	142.7	0	0	110.9	L6 I8 K14 C15 E16	L6-E12 HydrophobicContact CB-CG 3.34Å; L6-E12 HydrophobicContact CD1-CB 4.45Å; L6-E12 HydrophobicContact CD1-CG 3.92Å; L6-E12 HydrophobicContact CG-CG 4.25Å; I8-E12 PolarHBondContact O-N 3.39Å; E12-K14 VanDerWaalsContact C-N 3.31Å; E12-K14 PolarHBondContact O-N 2.94Å; E12-C15 WeakPolarHBondContact O-CB 3.18Å; E12-C15 PolarHBondContact O-N 3.31Å; E12-C15 VanDerWaalsContact O-N 3.17Å; E12-E16 WeakPolarHBondContact O-CG 3.46Å; E12-E16 PolarHBondContact O-N 3.19Å
13	R	59.9	Low	67.1	Low	159 Å²	159	90.7 Å²	90.7	60%	0.6	46%	0.462	S	S	*	.	H	α-helix	trans	-59.9	-39	178.2	-70.8	-171.4	-67.2	167.1	-2.4	113	G9 D10 L11 S17	G9-R13 WeakPolarHBondContact O-CG 3.36Å; G9-R13 PolarHBondContact O-N 2.7Å; D10-R13 IonicContact OD1-CZ 3.68Å; D10-R13 IonicContact OD1-NE 3.93Å; D10-R13 IonicContact OD1-NH2 2.66Å; D10-R13 PolarHBondContact OD1-NH2 3.43Å; L11-R13 PolarHBondContact O-N 3.46Å; R13-S17 WeakPolarHBondContact O-CB 3.48Å; R13-S17 PolarHBondContact O-N 3.21Å; R13-S17 PolarHBondContact O-OG 3.34Å
14	K	62.4	Low	68.6	Low	126 Å²	126	91.3 Å²	91.3	55%	0.548	46%	0.461	S	S	.	.	H	α-helix	trans	-69.4	-43.3	175.9	-73.7	179.4	179.6	-179.4	0	111.7	D10 L11 E12 E16 S17 Y18	D10-K14 WeakPolarHBondContact O-CG 3.35Å; D10-K14 PolarHBondContact O-N 3.42Å; L11-K14 PolarHBondContact O-N 3.08Å; E12-K14 VanDerWaalsContact C-N 3.31Å; E12-K14 PolarHBondContact O-N 2.94Å; K14-E16 VanDerWaalsContact C-N 3.32Å; K14-E16 PolarHBondContact O-N 2.91Å; K14-S17 PolarHBondContact O-N 2.87Å; K14-Y18 PolarHBondContact O-N 3.15Å; K14-Y18 VanDerWaalsContact O-N 3.11Å
15	C	66.6	Low	70.4	Confident	5 Å²	5	96.5 Å²	96.5	3%	0.034	47%	0.473	C	S	.	.	H	α-helix	trans	-55.6	-47.6	176.1	-168.4	0	0	0	0	110.8	C3 L6 L11 E12 S17 K19	C3-C15 HydrophobicContact CB-CB 4.15Å; C3-C15 WeakPolarHBondContact CB-SG 3.38Å; C3-C15 WeakPolarHBondContact SG-CB 3.32Å; C3-C15 CovalentContact SG-SG 2.07Å; C3-C15 PolarHBondContact SG-SG 3.27Å; L6-C15 HydrophobicContact CD1-CB 3.81Å; L11-C15 VanDerWaalsContact O-CB 3.31Å; L11-C15 WeakPolarHBondContact O-CB 3.43Å; L11-C15 PolarHBondContact O-N 3.14Å; E12-C15 WeakPolarHBondContact O-CB 3.18Å; E12-C15 PolarHBondContact O-N 3.31Å; E12-C15 VanDerWaalsContact O-N 3.17Å; C15-S17 VanDerWaalsContact C-N 3.34Å; C15-S17 PolarHBondContact O-N 2.9Å; C15-K19 WeakPolarHBondContact O-CA 3.24Å; C15-K19 PolarHBondContact O-N 3.09Å
16	E	67.2	Low	72.2	Confident	136 Å²	136	94.6 Å²	94.6	64%	0.636	47%	0.465	S	S	*	.	H	α-helix	trans	-64.6	-36.6	179.1	-72.1	178	169	0	0	113.1	E12 K14	E12-E16 WeakPolarHBondContact O-CG 3.46Å; E12-E16 PolarHBondContact O-N 3.19Å; K14-E16 VanDerWaalsContact C-N 3.32Å; K14-E16 PolarHBondContact O-N 2.91Å
17	S	73	Confident	74	Confident	90 Å²	90	99.1 Å²	99.1	63%	0.629	49%	0.493	S	S	*	.	H	α-helix	trans	-74.1	-45.1	-175.5	-61.4	0	0	0	0	112.7	R13 K14 C15	R13-S17 WeakPolarHBondContact O-CB 3.48Å; R13-S17 PolarHBondContact O-N 3.21Å; R13-S17 PolarHBondContact O-OG 3.34Å; K14-S17 PolarHBondContact O-N 2.87Å; C15-S17 VanDerWaalsContact C-N 3.34Å; C15-S17 PolarHBondContact O-N 2.9Å
18	Y	78.9	Confident	75.8	Confident	166 Å²	166	95.8 Å²	95.8	65%	0.651	48%	0.475	S	S	*	.	H	α-helix	trans	-103.2	-20.2	-171	-65.2	-72.3	0	0	0	114.3	K14 D20	K14-Y18 PolarHBondContact O-N 3.15Å; K14-Y18 VanDerWaalsContact O-N 3.11Å; Y18-D20 VanDerWaalsContact CB-CG 3.43Å; Y18-D20 WeakPolarHBondContact CB-OD1 3.2Å; Y18-D20 WeakPolarHBondContact CB-OD2 3.32Å; Y18-D20 PolarHBondContact O-N 2.78Å; Y18-D20 VanDerWaalsContact O-N 3.15Å
19	K	79.2	Confident	77.4	Confident	144 Å²	144	93.6 Å²	93.6	63%	0.626	47%	0.467	S	S	*	.	S	Bend	trans	52.4	33.6	-179.1	-63.9	-177.3	-177.4	177.3	0	112.7	M1 C15	M1-K19 HydrophobicContact CE-CB 4.38Å; M1-K19 WeakPolarHBondContact CE-O 3.17Å; M1-K19 HydrophobicContact SD-CB 3.64Å; M1-K19 HydrophobicContact SD-CG 4.36Å; C15-K19 WeakPolarHBondContact O-CA 3.24Å; C15-K19 PolarHBondContact O-N 3.09Å
20	D	84.9	Confident	78.9	Confident	112 Å²	112	100.3 Å²	100.3	60%	0.599	48%	0.481	S	S	*	.			trans	-118.4	0.7	-176.1	62.1	-3.5	0	0	0	112.5	Y18	Y18-D20 VanDerWaalsContact CB-CG 3.43Å; Y18-D20 WeakPolarHBondContact CB-OD1 3.2Å; Y18-D20 WeakPolarHBondContact CB-OD2 3.32Å; Y18-D20 PolarHBondContact O-N 2.78Å; Y18-D20 VanDerWaalsContact O-N 3.15Å
21	T	85.5	Confident	80.3	Confident	52 Å²	52	101.3 Å²	101.3	32%	0.319	48%	0.482	S	S	.	.			trans	-101.3	136.3	-173.8	-59.2	0	0	0	0	110.9
22	V	87.1	Confident	81.8	Confident	41 Å²	41	99.5 Å²	99.5	25%	0.248	47%	0.473	C	S	.	.			trans	-125.8	129.9	173	-174.6	0	0	0	0	108.1	F24 W43	V22-F24 HydrophobicContact CG1-CE1 4Å; V22-F24 HydrophobicContact CG1-CE2 3.86Å; V22-F24 HydrophobicContact CG1-CZ 3.53Å; V22-W43 HydrophobicContact CB-CD2 4.49Å; V22-W43 HydrophobicContact CB-CZ3 4.45Å; V22-W43 HydrophobicContact CG1-CD2 3.84Å; V22-W43 HydrophobicContact CG1-CE3 4.32Å; V22-W43 HydrophobicContact CG1-CG 3.98Å; V22-W43 HydrophobicContact CG1-CZ2 4.36Å; V22-W43 HydrophobicContact CG2-CD2 3.89Å; V22-W43 HydrophobicContact CG2-CE3 3.74Å; V22-W43 HydrophobicContact CG2-CH2 3.14Å; V22-W43 HydrophobicContact CG2-CZ2 3.38Å; V22-W43 HydrophobicContact CG2-CZ3 3.27Å
23	Q	87.4	Confident	83.3	Confident	75 Å²	75	97.6 Å²	97.6	35%	0.35	47%	0.465	S	S	.	.			trans	-120.7	139.9	178	-161.2	-168.6	4.2	0	0	110.4	F5 L6	F5-Q23 PolarHBondContact O-NE2 3.1Å; F5-Q23 VanDerWaalsContact O-NE2 3.17Å; F5-Q23 PolarHBondContact O-OE1 2.63Å; L6-Q23 HydrophobicContact CD2-CG 4.29Å
24	F	89.2	Confident	85	Confident	50 Å²	50	90.1 Å²	90.1	22%	0.219	44%	0.437	C	S	.	.			trans	-115.2	153.8	177.1	-59.5	-73.4	0	0	0	110.1	V22 F26 S39 W40 W43	V22-F24 HydrophobicContact CG1-CE1 4Å; V22-F24 HydrophobicContact CG1-CE2 3.86Å; V22-F24 HydrophobicContact CG1-CZ 3.53Å; F24-F26 VanDerWaalsContact C-N 3.34Å; F24-F26 HydrophobicContact CB-CD1 3.68Å; F24-F26 HydrophobicContact CB-CE1 3.25Å; F24-F26 HydrophobicContact CB-CZ 4.09Å; F24-F26 HydrophobicContact CD2-CE1 4.21Å; F24-F26 HydrophobicContact CG-CE1 4.01Å; F24-F26 PolarHBondContact O-N 3.21Å; F24-S39 WeakPolarHBondContact CE1-O 3.19Å; F24-S39 WeakPolarHBondContact CZ-O 3.33Å; F24-W40 HydrophobicContact CE2-CB 4.2Å; F24-W43 HydrophobicContact CE1-CB 3.91Å; F24-W43 HydrophobicContact CE1-CG 4.29Å; F24-W43 HydrophobicContact CZ-CB 3.68Å; F24-W43 HydrophobicContact CZ-CG 4.1Å
25	K	89.7	Confident	86.5	Confident	190 Å²	190	87.4 Å²	87.4	83%	0.826	43%	0.428	S	S	*	.	S	Bend	trans	-85.6	70.6	-175.3	-167.9	-178.8	177.3	179.6	0	111.8
26	F	89.7	Confident	87.8	Confident	61 Å²	61	90.3 Å²	90.3	27%	0.268	44%	0.441	S	S	.	.	S	Bend	trans	-151.4	160.8	168.7	60	-99.4	0	0	0	110.7	F24 D28 N32 K36	F24-F26 VanDerWaalsContact C-N 3.34Å; F24-F26 HydrophobicContact CB-CD1 3.68Å; F24-F26 HydrophobicContact CB-CE1 3.25Å; F24-F26 HydrophobicContact CB-CZ 4.09Å; F24-F26 HydrophobicContact CD2-CE1 4.21Å; F24-F26 HydrophobicContact CG-CE1 4.01Å; F24-F26 PolarHBondContact O-N 3.21Å; F26-D28 PolarHBondContact O-N 3.12Å; F26-N32 HydrophobicContact CD2-CB 4.28Å; F26-K36 HydrophobicContact CE2-CB 3.95Å; F26-K36 VanDerWaalsContact CZ-CA 3.45Å; F26-K36 HydrophobicContact CZ-CB 3.54Å; F26-K36 HydrophobicContact CZ-CG 3.98Å
27	T	91.7	Very high	89.1	Confident	106 Å²	106	84.1 Å²	84.1	65%	0.65	41%	0.413	S	S	*	.			trans	-75.5	124.2	176.2	-52.4	0	0	0	0	110.2	T29 N32	T27-T29 HydrophobicContact CG2-CG2 3.95Å; T27-T29 PolarHBondContact O-N 3.5Å; T27-N32 PolarHBondContact O-ND2 3.23Å
28	D	90.2	Very high	90.1	Very high	102 Å²	102	83.2 Å²	83.2	55%	0.545	40%	0.396	S	S	.	.			trans	-72.7	108.8	179.5	-163.4	-9.8	0	0	0	111.1	F26 K36	F26-D28 PolarHBondContact O-N 3.12Å; D28-K36 WeakPolarHBondContact OD1-CE 3.39Å; D28-K36 IonicContact OD1-NZ 2.77Å; D28-K36 PolarHBondContact OD1-NZ 3.31Å; D28-K36 WeakPolarHBondContact OD2-CE 3.13Å; D28-K36 IonicContact OD2-NZ 3.53Å; D28-K36 PolarHBondContact OD2-NZ 2.87Å
29	T	93	Very high	90.8	Very high	57 Å²	57	76.4 Å²	76.4	35%	0.35	37%	0.372	S	S	.	.			trans	-145	159.3	178.1	70.8	0	0	0	0	109.6	T27 H31 N32 L33	T27-T29 HydrophobicContact CG2-CG2 3.95Å; T27-T29 PolarHBondContact O-N 3.5Å; T29-H31 PolarHBondContact O-N 3.38Å; T29-H31 PolarHBondContact OG1-N 2.62Å; T29-N32 PolarHBondContact O-N 2.93Å; T29-N32 PolarHBondContact OG1-N 2.8Å; T29-N32 PolarHBondContact OG1-ND2 2.95Å; T29-L33 PolarHBondContact O-N 2.78Å
30	Y	91.8	Very high	91.5	Very high	182 Å²	182	73.3 Å²	73.3	71%	0.714	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-53.4	-37	173.6	-78.1	-76.2	0	0	0	112.9	N32 L33	Y30-N32 PolarHBondContact O-N 2.99Å; Y30-L33 HydrophobicContact CD1-CD1 3.86Å; Y30-L33 WeakPolarHBondContact O-CG 3.18Å; Y30-L33 PolarHBondContact O-N 3.34Å
31	H	93.9	Very high	91.9	Very high	117 Å²	117	68 Å²	68	54%	0.542	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-71.2	-12.9	179.2	-73	85.5	0	0	0	113.8	T29 W117	T29-H31 PolarHBondContact O-N 3.38Å; T29-H31 PolarHBondContact OG1-N 2.62Å; H31-W117 VanDerWaalsContact O-CB 3.24Å; H31-W117 WeakPolarHBondContact O-CB 3.44Å
32	N	94.7	Very high	92.3	Very high	39 Å²	39	68.8 Å²	68.8	21%	0.209	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-107.5	10.2	179.1	-70.3	-24.9	0	0	0	112.9	F26 T27 T29 Y30 S34 L35 K36	F26-N32 HydrophobicContact CD2-CB 4.28Å; T27-N32 PolarHBondContact O-ND2 3.23Å; T29-N32 PolarHBondContact O-N 2.93Å; T29-N32 PolarHBondContact OG1-N 2.8Å; T29-N32 PolarHBondContact OG1-ND2 2.95Å; Y30-N32 PolarHBondContact O-N 2.99Å; N32-S34 VanDerWaalsContact C-N 3.29Å; N32-S34 PolarHBondContact O-N 3.49Å; N32-L35 WeakPolarHBondContact O-CB 3.48Å; N32-L35 PolarHBondContact O-N 3.21Å; N32-L35 VanDerWaalsContact O-N 3.12Å; N32-K36 PolarHBondContact O-N 3.38Å
33	L	93.8	Very high	92.7	Very high	40 Å²	40	68.9 Å²	68.9	21%	0.209	33%	0.327	C	S	.	.	H	α-helix	trans	-59.4	-40	180	-72.1	176.1	0	0	0	112.4	T29 Y30 L35 K36 A37 D119	T29-L33 PolarHBondContact O-N 2.78Å; Y30-L33 HydrophobicContact CD1-CD1 3.86Å; Y30-L33 WeakPolarHBondContact O-CG 3.18Å; Y30-L33 PolarHBondContact O-N 3.34Å; L33-L35 VanDerWaalsContact C-N 3.33Å; L33-L35 PolarHBondContact O-N 3.17Å; L33-K36 HydrophobicContact CD2-CD 4.47Å; L33-K36 WeakPolarHBondContact O-CB 3.32Å; L33-K36 PolarHBondContact O-N 3.4Å; L33-K36 VanDerWaalsContact O-N 3.14Å; L33-A37 WeakPolarHBondContact O-CB 3.36Å; L33-A37 PolarHBondContact O-N 2.82Å; L33-D119 HydrophobicContact CB-CB 3.97Å
34	S	94.8	Very high	93	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.007	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-37.6	175.9	-69.9	0	0	0	0	113.1	N32 A37 Y38 L116 W117 D119	N32-S34 VanDerWaalsContact C-N 3.29Å; N32-S34 PolarHBondContact O-N 3.49Å; S34-A37 PolarHBondContact O-N 3.46Å; S34-Y38 WeakPolarHBondContact O-CB 3.33Å; S34-Y38 PolarHBondContact O-N 3.2Å; S34-L116 WeakPolarHBondContact CB-O 3.36Å; S34-L116 PolarHBondContact OG-O 3.32Å; S34-W117 PolarHBondContact N-O 3.5Å; S34-W117 VanDerWaalsContact OG-C 3.26Å; S34-W117 PolarHBondContact OG-O 3.33Å; S34-D119 WeakPolarHBondContact OG-CA 3.32Å; S34-D119 PolarHBondContact OG-N 3.24Å
35	L	94.6	Very high	93.1	Very high	70 Å²	70	64.1 Å²	64.1	37%	0.366	31%	0.31	S	S	.	.	H	α-helix	trans	-67.9	-38.2	173.3	-66.1	176.4	0	0	0	111.6	N32 L33 S39 F115	N32-L35 WeakPolarHBondContact O-CB 3.48Å; N32-L35 PolarHBondContact O-N 3.21Å; N32-L35 VanDerWaalsContact O-N 3.12Å; L33-L35 VanDerWaalsContact C-N 3.33Å; L33-L35 PolarHBondContact O-N 3.17Å; L35-S39 VanDerWaalsContact O-CB 3.26Å; L35-S39 WeakPolarHBondContact O-CB 3.4Å; L35-S39 PolarHBondContact O-N 3.46Å; L35-S39 PolarHBondContact O-OG 2.93Å; L35-F115 HydrophobicContact CD2-CE2 3.88Å; L35-F115 HydrophobicContact CG-CE2 3.82Å; L35-F115 HydrophobicContact CG-CZ 4.04Å
36	K	94.5	Very high	93.3	Very high	66 Å²	66	61.7 Å²	61.7	29%	0.287	30%	0.299	S	S	.	.	H	α-helix	trans	-62.2	-49.4	174.1	-178.6	-175.1	-76.3	-179.9	0	111.3	F26 D28 N32 L33 S39 W40	F26-K36 HydrophobicContact CE2-CB 3.95Å; F26-K36 VanDerWaalsContact CZ-CA 3.45Å; F26-K36 HydrophobicContact CZ-CB 3.54Å; F26-K36 HydrophobicContact CZ-CG 3.98Å; D28-K36 WeakPolarHBondContact OD1-CE 3.39Å; D28-K36 IonicContact OD1-NZ 2.77Å; D28-K36 PolarHBondContact OD1-NZ 3.31Å; D28-K36 WeakPolarHBondContact OD2-CE 3.13Å; D28-K36 IonicContact OD2-NZ 3.53Å; D28-K36 PolarHBondContact OD2-NZ 2.87Å; N32-K36 PolarHBondContact O-N 3.38Å; L33-K36 HydrophobicContact CD2-CD 4.47Å; L33-K36 WeakPolarHBondContact O-CB 3.32Å; L33-K36 PolarHBondContact O-N 3.4Å; L33-K36 VanDerWaalsContact O-N 3.14Å; K36-S39 PolarHBondContact O-N 3.14Å; K36-W40 VanDerWaalsContact O-CB 3.32Å; K36-W40 WeakPolarHBondContact O-CB 3.44Å; K36-W40 PolarHBondContact O-N 3.17Å
37	A	93.8	Very high	93.4	Very high	6 Å²	6	64.9 Å²	64.9	5%	0.05	31%	0.31	C	S	.	.	H	α-helix	trans	-60.7	-49.5	178.8	0	0	0	0	0	110.9	L33 S34 S39 W40 F41 D119 I123	L33-A37 WeakPolarHBondContact O-CB 3.36Å; L33-A37 PolarHBondContact O-N 2.82Å; S34-A37 PolarHBondContact O-N 3.46Å; A37-S39 PolarHBondContact O-N 3.41Å; A37-W40 PolarHBondContact O-N 3.35Å; A37-F41 HydrophobicContact CB-CD2 4.49Å; A37-F41 HydrophobicContact CB-CE2 4.33Å; A37-F41 WeakPolarHBondContact O-CD2 3.26Å; A37-F41 PolarHBondContact O-N 2.82Å; A37-D119 HydrophobicContact CB-CB 4.2Å; A37-I123 HydrophobicContact CB-CD1 4.11Å; A37-I123 HydrophobicContact CB-CG1 3.93Å
38	Y	93.8	Very high	93.5	Very high	70 Å²	70	66.1 Å²	66.1	28%	0.275	30%	0.303	S	S	.	.	H	α-helix	trans	-53.6	-51.7	174.4	172.6	-94.4	0	0	0	112.2	S34 W40 F41 N42 L107 V110	S34-Y38 WeakPolarHBondContact O-CB 3.33Å; S34-Y38 PolarHBondContact O-N 3.2Å; Y38-W40 VanDerWaalsContact C-N 3.29Å; Y38-W40 PolarHBondContact O-N 3.12Å; Y38-F41 PolarHBondContact O-N 2.69Å; Y38-N42 WeakPolarHBondContact O-CB 3.22Å; Y38-N42 PolarHBondContact O-N 3.33Å; Y38-L107 HydrophobicContact CD2-CD2 3.35Å; Y38-L107 HydrophobicContact CE2-CB 4.07Å; Y38-L107 HydrophobicContact CE2-CD2 3.25Å; Y38-L107 HydrophobicContact CE2-CG 4.19Å; Y38-L107 HydrophobicContact CG-CD2 4.25Å; Y38-V110 HydrophobicContact CD2-CG2 3.63Å; Y38-V110 HydrophobicContact CE2-CB 4.23Å; Y38-V110 HydrophobicContact CE2-CG1 4.4Å; Y38-V110 HydrophobicContact CE2-CG2 3.67Å
39	S	94.2	Very high	93.6	Very high	23 Å²	23	65.1 Å²	65.1	16%	0.161	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-41.6	-177.6	-59.7	0	0	0	0	111.4	F24 L35 K36 A37 W43	F24-S39 WeakPolarHBondContact CE1-O 3.19Å; F24-S39 WeakPolarHBondContact CZ-O 3.33Å; L35-S39 VanDerWaalsContact O-CB 3.26Å; L35-S39 WeakPolarHBondContact O-CB 3.4Å; L35-S39 PolarHBondContact O-N 3.46Å; L35-S39 PolarHBondContact O-OG 2.93Å; K36-S39 PolarHBondContact O-N 3.14Å; A37-S39 PolarHBondContact O-N 3.41Å; S39-W43 VanDerWaalsContact O-CB 3.25Å; S39-W43 WeakPolarHBondContact O-CB 3.48Å; S39-W43 PolarHBondContact O-N 2.91Å
40	W	93.7	Very high	93.7	Very high	80 Å²	80	70 Å²	70	30%	0.303	33%	0.326	S	S	.	.	H	α-helix	trans	-67.7	-44.3	178.5	-175.4	84.6	0	0	0	112.6	F24 K36 A37 Y38 W43 A44 I54 L55 K56	F24-W40 HydrophobicContact CE2-CB 4.2Å; K36-W40 VanDerWaalsContact O-CB 3.32Å; K36-W40 WeakPolarHBondContact O-CB 3.44Å; K36-W40 PolarHBondContact O-N 3.17Å; A37-W40 PolarHBondContact O-N 3.35Å; Y38-W40 VanDerWaalsContact C-N 3.29Å; Y38-W40 PolarHBondContact O-N 3.12Å; W40-W43 PolarHBondContact O-N 3.07Å; W40-A44 WeakPolarHBondContact O-CB 3.38Å; W40-A44 PolarHBondContact O-N 3.5Å; W40-I54 HydrophobicContact CE3-CG2 4.24Å; W40-I54 HydrophobicContact CH2-CG2 3.22Å; W40-I54 HydrophobicContact CZ2-CG2 4.28Å; W40-I54 HydrophobicContact CZ3-CG2 3.2Å; W40-L55 WeakPolarHBondContact CH2-O 3.44Å; W40-K56 HydrophobicContact CZ3-CB 4.32Å
41	F	94	Very high	93.9	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-45.7	175.6	-77.4	-59.7	0	0	0	112.3	A37 Y38 W43 A44 A45 I54 K56 Y96 L98 V103 I123	A37-F41 HydrophobicContact CB-CD2 4.49Å; A37-F41 HydrophobicContact CB-CE2 4.33Å; A37-F41 WeakPolarHBondContact O-CD2 3.26Å; A37-F41 PolarHBondContact O-N 2.82Å; Y38-F41 PolarHBondContact O-N 2.69Å; F41-W43 VanDerWaalsContact C-N 3.29Å; F41-W43 PolarHBondContact O-N 2.9Å; F41-A44 PolarHBondContact O-N 2.93Å; F41-A45 WeakPolarHBondContact O-CB 3.49Å; F41-A45 PolarHBondContact O-N 2.96Å; F41-I54 HydrophobicContact CD1-CG2 3.85Å; F41-I54 HydrophobicContact CE1-CB 4.38Å; F41-I54 HydrophobicContact CE1-CG2 3.66Å; F41-K56 HydrophobicContact CZ-CB 4.19Å; F41-Y96 AromaticContact CE2-CE2 3.8Å; F41-Y96 HydrophobicContact CE2-CE2 3.8Å; F41-Y96 HydrophobicContact CZ-CD2 4.34Å; F41-Y96 AromaticContact CZ-CE2 3.5Å; F41-Y96 HydrophobicContact CZ-CE2 3.5Å; F41-L98 HydrophobicContact CD1-CD1 4.2Å; F41-L98 HydrophobicContact CE1-CD1 3.68Å; F41-L98 HydrophobicContact CE1-CG 4.47Å; F41-L98 HydrophobicContact CE2-CD1 4.28Å; F41-L98 HydrophobicContact CZ-CD1 3.77Å; F41-V103 HydrophobicContact CB-CG1 4.03Å; F41-V103 HydrophobicContact CD1-CG2 4.27Å; F41-I123 HydrophobicContact CD2-CG2 4.45Å; F41-I123 HydrophobicContact CE2-CG2 3.91Å
42	N	93.3	Very high	94	Very high	68 Å²	68	64.9 Å²	64.9	36%	0.364	31%	0.313	S	S	.	.	H	α-helix	trans	-58.2	-43.9	175.5	-177.3	37.9	0	0	0	111.4	Y38 K46 L107	Y38-N42 WeakPolarHBondContact O-CB 3.22Å; Y38-N42 PolarHBondContact O-N 3.33Å; N42-K46 WeakPolarHBondContact O-CB 3.34Å; N42-K46 PolarHBondContact O-N 3.42Å; N42-L107 HydrophobicContact CB-CD1 3.89Å; N42-L107 HydrophobicContact CB-CD2 4.11Å
43	W	94.8	Very high	94.1	Very high	43 Å²	43	69.1 Å²	69.1	16%	0.163	33%	0.327	C	S	.	.	H	α-helix	trans	-65.1	-46.2	176.3	-174.7	91.2	0	0	0	112.3	V22 F24 S39 W40 F41 A45 K46 Y47 W48	V22-W43 HydrophobicContact CB-CD2 4.49Å; V22-W43 HydrophobicContact CB-CZ3 4.45Å; V22-W43 HydrophobicContact CG1-CD2 3.84Å; V22-W43 HydrophobicContact CG1-CE3 4.32Å; V22-W43 HydrophobicContact CG1-CG 3.98Å; V22-W43 HydrophobicContact CG1-CZ2 4.36Å; V22-W43 HydrophobicContact CG2-CD2 3.89Å; V22-W43 HydrophobicContact CG2-CE3 3.74Å; V22-W43 HydrophobicContact CG2-CH2 3.14Å; V22-W43 HydrophobicContact CG2-CZ2 3.38Å; V22-W43 HydrophobicContact CG2-CZ3 3.27Å; F24-W43 HydrophobicContact CE1-CB 3.91Å; F24-W43 HydrophobicContact CE1-CG 4.29Å; F24-W43 HydrophobicContact CZ-CB 3.68Å; F24-W43 HydrophobicContact CZ-CG 4.1Å; S39-W43 VanDerWaalsContact O-CB 3.25Å; S39-W43 WeakPolarHBondContact O-CB 3.48Å; S39-W43 PolarHBondContact O-N 2.91Å; W40-W43 PolarHBondContact O-N 3.07Å; F41-W43 VanDerWaalsContact C-N 3.29Å; F41-W43 PolarHBondContact O-N 2.9Å; W43-A45 PolarHBondContact O-N 3.27Å; W43-K46 PolarHBondContact O-N 2.93Å; W43-Y47 AromaticContact CD1-CD2 3.46Å; W43-Y47 VanDerWaalsContact CD1-CD2 3.46Å; W43-Y47 AromaticContact CD1-CE2 3.39Å; W43-Y47 AromaticContact CD2-CD2 3.93Å; W43-Y47 HydrophobicContact CD2-CD2 3.93Å; W43-Y47 AromaticContact CE2-CD2 3.56Å; W43-Y47 AromaticContact CG-CD2 3.83Å; W43-Y47 HydrophobicContact CG-CD2 3.83Å; W43-Y47 HydrophobicContact CG-CE2 4.17Å; W43-Y47 HydrophobicContact CZ2-CD2 4.24Å; W43-Y47 HydrophobicContact CZ2-CG 4.49Å; W43-Y47 AromaticContact NE1-CD2 3.25Å; W43-Y47 AromaticContact NE1-CE2 3.29Å; W43-Y47 VanDerWaalsContact NE1-CE2 3.29Å; W43-Y47 VanDerWaalsContact O-CD2 3.31Å; W43-Y47 WeakPolarHBondContact O-CD2 3.25Å; W43-Y47 PolarHBondContact O-N 3.31Å; W43-W48 HydrophobicContact CE3-CE3 4.33Å; W43-W48 HydrophobicContact CE3-CH2 4.05Å; W43-W48 AromaticContact CE3-CZ3 3.54Å; W43-W48 HydrophobicContact CE3-CZ3 3.54Å; W43-W48 HydrophobicContact CH2-CE3 4.35Å; W43-W48 AromaticContact CH2-CH2 2.95Å; W43-W48 HydrophobicContact CH2-CH2 2.95Å; W43-W48 AromaticContact CH2-CZ2 3.68Å; W43-W48 HydrophobicContact CH2-CZ2 3.68Å; W43-W48 AromaticContact CH2-CZ3 3.36Å; W43-W48 HydrophobicContact CH2-CZ3 3.36Å; W43-W48 HydrophobicContact CZ2-CH2 4.14Å; W43-W48 HydrophobicContact CZ2-CZ3 4.44Å; W43-W48 AromaticContact CZ3-CE3 3.92Å; W43-W48 HydrophobicContact CZ3-CE3 3.92Å; W43-W48 AromaticContact CZ3-CH2 2.93Å; W43-W48 HydrophobicContact CZ3-CH2 2.93Å; W43-W48 HydrophobicContact CZ3-CZ2 4.06Å; W43-W48 AromaticContact CZ3-CZ3 2.83Å; W43-W48 HydrophobicContact CZ3-CZ3 2.83Å
44	A	93.2	Very high	94.1	Very high	5 Å²	5	67.8 Å²	67.8	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	-62.2	-45.6	-179.3	0	0	0	0	0	112.1	W40 F41 K46 W48 I54	W40-A44 WeakPolarHBondContact O-CB 3.38Å; W40-A44 PolarHBondContact O-N 3.5Å; F41-A44 PolarHBondContact O-N 2.93Å; A44-K46 VanDerWaalsContact C-N 3.33Å; A44-K46 PolarHBondContact O-N 3.36Å; A44-W48 HydrophobicContact CB-CE3 4.29Å; A44-W48 HydrophobicContact CB-CZ3 4.47Å; A44-W48 CarbonylContact O-C 3.59Å; A44-W48 WeakPolarHBondContact O-CA 3.06Å; A44-W48 PolarHBondContact O-N 2.96Å; A44-I54 HydrophobicContact CB-CD1 3.99Å; A44-I54 HydrophobicContact CB-CG2 4.32Å
45	A	92	Very high	94	Very high	21 Å²	21	72.2 Å²	72.2	17%	0.174	34%	0.343	C	S	.	.	H	α-helix	trans	-65	-36.7	176.8	0	0	0	0	0	112.4	F41 W43 V103	F41-A45 WeakPolarHBondContact O-CB 3.49Å; F41-A45 PolarHBondContact O-N 2.96Å; W43-A45 PolarHBondContact O-N 3.27Å; A45-V103 HydrophobicContact CB-CB 4.04Å; A45-V103 HydrophobicContact CB-CG1 3.65Å; A45-V103 HydrophobicContact CB-CG2 4.49Å
46	K	93.1	Very high	93.8	Very high	139 Å²	139	70.3 Å²	70.3	60%	0.604	33%	0.332	S	S	*	.	H	α-helix	trans	-68	-43.3	178.1	-179.3	175.1	-179.8	177.7	0	113	N42 W43 A44	N42-K46 WeakPolarHBondContact O-CB 3.34Å; N42-K46 PolarHBondContact O-N 3.42Å; W43-K46 PolarHBondContact O-N 2.93Å; A44-K46 VanDerWaalsContact C-N 3.33Å; A44-K46 PolarHBondContact O-N 3.36Å
47	Y	93	Very high	93.6	Very high	128 Å²	128	70.6 Å²	70.6	50%	0.502	34%	0.339	S	S	.	.	H	α-helix	trans	-98.5	-18.1	-172.3	-69.9	-76.5	0	0	0	114.2	W43	W43-Y47 AromaticContact CD1-CD2 3.46Å; W43-Y47 VanDerWaalsContact CD1-CD2 3.46Å; W43-Y47 AromaticContact CD1-CE2 3.39Å; W43-Y47 AromaticContact CD2-CD2 3.93Å; W43-Y47 HydrophobicContact CD2-CD2 3.93Å; W43-Y47 AromaticContact CE2-CD2 3.56Å; W43-Y47 AromaticContact CG-CD2 3.83Å; W43-Y47 HydrophobicContact CG-CD2 3.83Å; W43-Y47 HydrophobicContact CG-CE2 4.17Å; W43-Y47 HydrophobicContact CZ2-CD2 4.24Å; W43-Y47 HydrophobicContact CZ2-CG 4.49Å; W43-Y47 AromaticContact NE1-CD2 3.25Å; W43-Y47 AromaticContact NE1-CE2 3.29Å; W43-Y47 VanDerWaalsContact NE1-CE2 3.29Å; W43-Y47 VanDerWaalsContact O-CD2 3.31Å; W43-Y47 WeakPolarHBondContact O-CD2 3.25Å; W43-Y47 PolarHBondContact O-N 3.31Å
48	W	92.6	Very high	93.3	Very high	131 Å²	131	73.5 Å²	73.5	50%	0.496	35%	0.354	S	S	.	.			trans	-132.6	64.7	172.6	-56.9	-76	0	0	0	112.8	W43 A44 N50 A51	W43-W48 HydrophobicContact CE3-CE3 4.33Å; W43-W48 HydrophobicContact CE3-CH2 4.05Å; W43-W48 AromaticContact CE3-CZ3 3.54Å; W43-W48 HydrophobicContact CE3-CZ3 3.54Å; W43-W48 HydrophobicContact CH2-CE3 4.35Å; W43-W48 AromaticContact CH2-CH2 2.95Å; W43-W48 HydrophobicContact CH2-CH2 2.95Å; W43-W48 AromaticContact CH2-CZ2 3.68Å; W43-W48 HydrophobicContact CH2-CZ2 3.68Å; W43-W48 AromaticContact CH2-CZ3 3.36Å; W43-W48 HydrophobicContact CH2-CZ3 3.36Å; W43-W48 HydrophobicContact CZ2-CH2 4.14Å; W43-W48 HydrophobicContact CZ2-CZ3 4.44Å; W43-W48 AromaticContact CZ3-CE3 3.92Å; W43-W48 HydrophobicContact CZ3-CE3 3.92Å; W43-W48 AromaticContact CZ3-CH2 2.93Å; W43-W48 HydrophobicContact CZ3-CH2 2.93Å; W43-W48 HydrophobicContact CZ3-CZ2 4.06Å; W43-W48 AromaticContact CZ3-CZ3 2.83Å; W43-W48 HydrophobicContact CZ3-CZ3 2.83Å; A44-W48 HydrophobicContact CB-CE3 4.29Å; A44-W48 HydrophobicContact CB-CZ3 4.47Å; A44-W48 CarbonylContact O-C 3.59Å; A44-W48 WeakPolarHBondContact O-CA 3.06Å; A44-W48 PolarHBondContact O-N 2.96Å; W48-N50 PolarHBondContact O-N 3.4Å; W48-A51 HydrophobicContact CB-CB 4.29Å; W48-A51 WeakPolarHBondContact O-CB 3.21Å; W48-A51 PolarHBondContact O-N 3.31Å; W48-A51 VanDerWaalsContact O-N 3.09Å
49	P	93.2	Very high	92.9	Very high	82 Å²	82	77.8 Å²	77.8	53%	0.532	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.6	-179.6	26.4	-36.2	0	0	0	113.6
50	N	95.6	Very high	92.3	Very high	159 Å²	159	79.8 Å²	79.8	85%	0.85	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-3.5	-179.2	-63.1	-36.6	0	0	0	113.9	W48 K52	W48-N50 PolarHBondContact O-N 3.4Å; N50-K52 PolarHBondContact O-N 3.07Å
51	A	95.4	Very high	91.7	Very high	39 Å²	39	76.3 Å²	76.3	32%	0.322	38%	0.378	S	S	.	.			trans	-61.2	136.3	172.6	0	0	0	0	0	109.1	W48 T100	W48-A51 HydrophobicContact CB-CB 4.29Å; W48-A51 WeakPolarHBondContact O-CB 3.21Å; W48-A51 PolarHBondContact O-N 3.31Å; W48-A51 VanDerWaalsContact O-N 3.09Å; A51-T100 WeakPolarHBondContact O-CB 3.21Å; A51-T100 PolarHBondContact O-OG1 2.88Å
52	K	95.9	Very high	90.7	Very high	152 Å²	152	83.5 Å²	83.5	66%	0.661	41%	0.406	S	S	*	.	S	Bend	trans	-75.1	-38.8	177.3	-171.7	175.1	179.7	-179.7	0	111.6	N50 T100	N50-K52 PolarHBondContact O-N 3.07Å; K52-T100 PolarHBondContact O-N 2.91Å
53	Y	96.1	Very high	89.9	Confident	129 Å²	129	84.9 Å²	84.9	51%	0.506	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.7	-176.2	-58.5	-68.3	0	0	0	110.1	L98 T99	Y53-L98 CarbonylContact C-O 3.57Å; Y53-L98 WeakPolarHBondContact CA-O 3.23Å; Y53-T99 HydrophobicContact CD1-CG2 4.07Å; Y53-T99 HydrophobicContact CE1-CG2 3.91Å
54	I	93.6	Very high	89.2	Confident	12 Å²	12	88.4 Å²	88.4	6%	0.062	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	119.9	172.3	-62.1	167.8	0	0	0	106.8	W40 F41 A44 C97 L98 T100 V103	W40-I54 HydrophobicContact CE3-CG2 4.24Å; W40-I54 HydrophobicContact CH2-CG2 3.22Å; W40-I54 HydrophobicContact CZ2-CG2 4.28Å; W40-I54 HydrophobicContact CZ3-CG2 3.2Å; F41-I54 HydrophobicContact CD1-CG2 3.85Å; F41-I54 HydrophobicContact CE1-CB 4.38Å; F41-I54 HydrophobicContact CE1-CG2 3.66Å; A44-I54 HydrophobicContact CB-CD1 3.99Å; A44-I54 HydrophobicContact CB-CG2 4.32Å; I54-C97 WeakPolarHBondContact O-CA 3.43Å; I54-L98 PolarHBondContact N-O 3.06Å; I54-L98 PolarHBondContact O-N 3.33Å; I54-T100 HydrophobicContact CD1-CG2 4.26Å; I54-V103 HydrophobicContact CD1-CG2 3.7Å
55	L	93	Very high	88.8	Confident	93 Å²	93	90.9 Å²	90.9	49%	0.487	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	121.9	-177.4	-179	72	0	0	0	109.8	W40 V57 C97	W40-L55 WeakPolarHBondContact CH2-O 3.44Å; L55-V57 HydrophobicContact CD1-CG2 4.37Å; L55-V57 HydrophobicContact CD2-CG2 3.49Å; L55-V57 VanDerWaalsContact CD2-CG2 3.49Å; L55-V57 HydrophobicContact CG-CG2 3.52Å; L55-C97 HydrophobicContact CD1-CB 3.9Å
56	K	91.9	Very high	88.8	Confident	30 Å²	30	98.6 Å²	98.6	13%	0.13	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.5	171.9	-171.9	-84.5	-157.2	-170.2	0	108.8	W40 F41 D58 S95 Y96 D119	W40-K56 HydrophobicContact CZ3-CB 4.32Å; F41-K56 HydrophobicContact CZ-CB 4.19Å; K56-D58 IonicContact NZ-OD1 3.52Å; K56-D58 PolarHBondContact NZ-OD1 3.47Å; K56-D58 IonicContact NZ-OD2 2.88Å; K56-S95 WeakPolarHBondContact O-CA 3.39Å; K56-S95 VanDerWaalsContact O-CB 3.24Å; K56-S95 WeakPolarHBondContact O-CB 3.46Å; K56-Y96 HydrophobicContact CB-CD2 4.31Å; K56-Y96 HydrophobicContact CB-CE1 4.14Å; K56-Y96 HydrophobicContact CB-CE2 3.95Å; K56-Y96 HydrophobicContact CD-CD1 4.33Å; K56-Y96 HydrophobicContact CD-CE1 3.59Å; K56-Y96 HydrophobicContact CG-CE1 4.04Å; K56-Y96 HydrophobicContact CG-CE2 4.38Å; K56-Y96 PolarHBondContact N-O 3.26Å; K56-Y96 PolarHBondContact O-N 2.92Å; K56-D119 WeakPolarHBondContact CE-OD2 3.44Å; K56-D119 IonicContact NZ-OD2 3.9Å; K56-D119 PolarHBondContact NZ-OD2 3.19Å
57	V	90.1	Very high	88.8	Confident	73 Å²	73	92.4 Å²	92.4	44%	0.442	44%	0.437	S	S	.	.			trans	-134.7	134.7	-179.5	-169.8	0	0	0	0	107.2	L55 M61	L55-V57 HydrophobicContact CD1-CG2 4.37Å; L55-V57 HydrophobicContact CD2-CG2 3.49Å; L55-V57 VanDerWaalsContact CD2-CG2 3.49Å; L55-V57 HydrophobicContact CG-CG2 3.52Å; V57-M61 HydrophobicContact CG1-CB 3.57Å; V57-M61 HydrophobicContact CG1-CG 3.47Å; V57-M61 VanDerWaalsContact CG1-CG 3.47Å
58	D	87.6	Confident	88.8	Confident	67 Å²	67	89.6 Å²	89.6	36%	0.358	43%	0.428	S	S	.	.			trans	-76.7	155.5	171.8	-62.1	-33.5	0	0	0	110.6	K56 D60 M61	K56-D58 IonicContact NZ-OD1 3.52Å; K56-D58 PolarHBondContact NZ-OD1 3.47Å; K56-D58 IonicContact NZ-OD2 2.88Å; D58-D60 WeakPolarHBondContact CB-OD1 3.32Å; D58-D60 PolarHBondContact O-N 2.85Å; D58-D60 VanDerWaalsContact O-N 3.16Å; D58-M61 HydrophobicContact CB-CG 3.87Å; D58-M61 HydrophobicContact CB-SD 4.45Å; D58-M61 WeakPolarHBondContact O-CB 3.22Å; D58-M61 WeakPolarHBondContact O-CG 3.32Å; D58-M61 PolarHBondContact O-N 2.98Å
59	D	85.5	Confident	88.9	Confident	159 Å²	159	86 Å²	86	85%	0.85	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-9.3	-176.9	66.9	-9.5	0	0	0	113.4
60	D	80.2	Confident	89	Confident	66 Å²	66	88.7 Å²	88.7	35%	0.353	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	8.1	-179.8	67.4	-8.5	0	0	0	115.6	D58 Y62 K63 S92	D58-D60 WeakPolarHBondContact CB-OD1 3.32Å; D58-D60 PolarHBondContact O-N 2.85Å; D58-D60 VanDerWaalsContact O-N 3.16Å; D60-Y62 VanDerWaalsContact C-N 3.3Å; D60-Y62 PolarHBondContact O-N 3.48Å; D60-K63 VanDerWaalsContact CA-CE 3.5Å; D60-K63 HydrophobicContact CB-CD 3.78Å; D60-S92 PolarHBondContact O-OG 2.84Å
61	M	80.9	Confident	89	Confident	7 Å²	7	88.7 Å²	88.7	3%	0.034	41%	0.409	C	S	.	.	S	Bend	trans	-67.3	-30.1	-179.6	-69.2	-69.7	-58.1	0	0	113.3	V57 D58 C91 S92 G93 S94	V57-M61 HydrophobicContact CG1-CB 3.57Å; V57-M61 HydrophobicContact CG1-CG 3.47Å; V57-M61 VanDerWaalsContact CG1-CG 3.47Å; D58-M61 HydrophobicContact CB-CG 3.87Å; D58-M61 HydrophobicContact CB-SD 4.45Å; D58-M61 WeakPolarHBondContact O-CB 3.22Å; D58-M61 WeakPolarHBondContact O-CG 3.32Å; D58-M61 PolarHBondContact O-N 2.98Å; M61-C91 VanDerWaalsContact CE-SG 3.55Å; M61-C91 CarbonylContact O-C 3.53Å; M61-C91 VanDerWaalsContact O-CA 3.31Å; M61-C91 WeakPolarHBondContact O-CA 3.44Å; M61-S92 WeakPolarHBondContact CA-OG 3.12Å; M61-S92 PolarHBondContact O-N 2.59Å; M61-S92 PolarHBondContact O-OG 3.26Å; M61-G93 WeakPolarHBondContact CE-O 3.19Å; M61-G93 WeakPolarHBondContact SD-CA 3.31Å; M61-S94 PolarHBondContact SD-N 2.86Å; M61-S94 VanDerWaalsContact SD-N 3.44Å; M61-S94 VanDerWaalsContact SD-O 3.34Å
62	Y	73.8	Confident	89	Confident	150 Å²	150	93.7 Å²	93.7	59%	0.588	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	94	179.4	-167	-103.6	0	0	0	109.9	D60 R89	D60-Y62 VanDerWaalsContact C-N 3.3Å; D60-Y62 PolarHBondContact O-N 3.48Å; Y62-R89 HydrophobicContact CE1-CB 4.27Å; Y62-R89 HydrophobicContact CE1-CG 4.31Å; Y62-R89 HydrophobicContact CE2-CB 3.98Å; Y62-R89 WeakPolarHBondContact OH-CB 3.33Å; Y62-R89 WeakPolarHBondContact OH-CD 3.44Å
63	K	75.3	Confident	88.9	Confident	97 Å²	97	88 Å²	88	42%	0.422	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.7	-178.2	-74.8	-177.8	169.1	169.6	0	111.6	D60 M65	D60-K63 VanDerWaalsContact CA-CE 3.5Å; D60-K63 HydrophobicContact CB-CD 3.78Å; K63-M65 HydrophobicContact CB-CG 4.08Å; K63-M65 PolarHBondContact O-N 3.06Å
64	E	80.4	Confident	88.7	Confident	117 Å²	117	90.1 Å²	90.1	55%	0.547	41%	0.414	S	S	.	.			trans	-79.4	109.5	157.6	-68	175.1	-169.1	0	0	106.5	V86 R89	E64-V86 HydrophobicContact CB-CG1 4.13Å; E64-R89 HydrophobicContact CG-CG 3.6Å; E64-R89 IonicContact OE1-CZ 3.49Å; E64-R89 IonicContact OE1-NE 2.65Å; E64-R89 PolarHBondContact OE1-NE 3.13Å; E64-R89 IonicContact OE1-NH2 3.28Å; E64-R89 PolarHBondContact OE1-NH2 3.09Å
65	M	85.3	Confident	88.5	Confident	57 Å²	57	97.6 Å²	97.6	28%	0.281	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-101.2	135.2	-180	-67	-178.2	55.2	0	0	110.2	K63 F87 F90	K63-M65 HydrophobicContact CB-CG 4.08Å; K63-M65 PolarHBondContact O-N 3.06Å; M65-F87 HydrophobicContact CB-CD2 4.33Å; M65-F87 PolarHBondContact O-N 3.44Å; M65-F90 HydrophobicContact CB-CE1 3.87Å; M65-F90 HydrophobicContact CB-CZ 4.22Å; M65-F90 HydrophobicContact CG-CE1 3.84Å; M65-F90 HydrophobicContact CG-CZ 4.05Å; M65-F90 HydrophobicContact SD-CE1 3.89Å; M65-F90 HydrophobicContact SD-CZ 3.46Å; M65-F90 WeakPolarHBondContact SD-CZ 3.39Å
66	R	92.1	Very high	88.6	Confident	183 Å²	183	97.1 Å²	97.1	69%	0.691	43%	0.434	S	S	*	.	B	Isolated β-bridge	trans	-65.3	138.2	166	-69.8	-175.9	178.8	-82	-1.2	108.9	Q68 V86	R66-Q68 PolarHBondContact O-N 3.49Å; R66-V86 HydrophobicContact CG-CG2 4.48Å
67	V	92.9	Very high	88.7	Confident	10 Å²	10	97 Å²	97	6%	0.061	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-68.4	127.3	177.8	-174.3	0	0	0	0	108.1	R69 V77 F82 T85 F87	V67-R69 PolarHBondContact O-N 3.19Å; V67-V77 HydrophobicContact CG1-CB 3.73Å; V67-V77 HydrophobicContact CG1-CG1 4.37Å; V67-V77 HydrophobicContact CG1-CG2 4.44Å; V67-F82 HydrophobicContact CG2-CD1 3.66Å; V67-F82 HydrophobicContact CG2-CE1 3.72Å; V67-T85 PolarHBondContact N-O 2.93Å; V67-F87 HydrophobicContact CB-CE2 4.28Å; V67-F87 HydrophobicContact CB-CZ 4.31Å; V67-F87 HydrophobicContact CG1-CE1 4.47Å; V67-F87 HydrophobicContact CG1-CE2 4.26Å; V67-F87 HydrophobicContact CG1-CZ 3.89Å; V67-F87 HydrophobicContact CG2-CD1 4.11Å; V67-F87 HydrophobicContact CG2-CD2 4.06Å; V67-F87 HydrophobicContact CG2-CE1 3.98Å; V67-F87 HydrophobicContact CG2-CE2 3.95Å; V67-F87 HydrophobicContact CG2-CG 4.15Å; V67-F87 HydrophobicContact CG2-CZ 3.9Å
68	Q	94	Very high	89	Confident	68 Å²	68	94.3 Å²	94.3	32%	0.318	42%	0.42	S	S	.	.	B	Isolated β-bridge	trans	-76.3	123.4	177.5	-54.9	-60.1	-21.9	0	0	108.6	R66 D73 W75 Y76 V77	R66-Q68 PolarHBondContact O-N 3.49Å; Q68-D73 HydrophobicContact CB-CB 3.78Å; Q68-D73 HydrophobicContact CG-CB 4.32Å; Q68-W75 HydrophobicContact CG-CB 4.39Å; Q68-Y76 WeakPolarHBondContact O-CA 3.35Å; Q68-V77 PolarHBondContact O-N 3.38Å
69	R	94.6	Very high	89.4	Confident	56 Å²	56	97.3 Å²	97.3	21%	0.211	43%	0.428	C	S	.	.			trans	-112.1	2.7	-172.7	-59.9	-56	-172.2	171.3	6.9	113.8	V67 Y76 V77 S78 Y79 F82 E84	V67-R69 PolarHBondContact O-N 3.19Å; R69-Y76 WeakPolarHBondContact O-CE2 3.34Å; R69-V77 VanDerWaalsContact CD-O 3.29Å; R69-V77 WeakPolarHBondContact CD-O 3.4Å; R69-V77 PolarHBondContact NH1-O 2.98Å; R69-S78 PolarHBondContact NH1-O 2.85Å; R69-Y79 HydrophobicContact CG-CE2 4.3Å; R69-F82 PolarHBondContact NH1-O 2.97Å; R69-F82 VanDerWaalsContact NH1-O 3.14Å; R69-F82 PolarHBondContact NH2-O 2.99Å; R69-E84 PolarHBondContact NH2-O 3.48Å
70	R	95.6	Very high	89.9	Confident	139 Å²	139	97.9 Å²	97.9	53%	0.525	43%	0.425	S	S	.	.	S	Bend	trans	-96.9	129.4	176.3	-47.9	179.2	-68.9	178.5	3.8	108.3	E72 D73 Y76	R70-E72 VanDerWaalsContact CB-CD 3.48Å; R70-E72 HydrophobicContact CB-CG 4.19Å; R70-E72 WeakPolarHBondContact CB-OE2 3.24Å; R70-E72 IonicContact NE-OE1 3.61Å; R70-E72 PolarHBondContact O-N 2.71Å; R70-E72 VanDerWaalsContact O-N 3.13Å; R70-D73 VanDerWaalsContact CB-OD2 3.32Å; R70-D73 WeakPolarHBondContact CB-OD2 3.31Å; R70-D73 IonicContact CZ-OD1 3.45Å; R70-D73 IonicContact CZ-OD2 2.71Å; R70-D73 IonicContact NE-OD1 3.52Å; R70-D73 IonicContact NE-OD2 3.07Å; R70-D73 PolarHBondContact NE-OD2 3.04Å; R70-D73 IonicContact NH2-OD1 2.79Å; R70-D73 PolarHBondContact NH2-OD1 3.49Å; R70-D73 IonicContact NH2-OD2 2.65Å; R70-D73 PolarHBondContact NH2-OD2 2.93Å; R70-D73 WeakPolarHBondContact O-CB 3.33Å; R70-D73 PolarHBondContact O-N 2.82Å; R70-Y76 VanDerWaalsContact C-CD2 3.46Å; R70-Y76 WeakPolarHBondContact O-CD2 3.44Å
71	E	94.2	Very high	90.7	Very high	158 Å²	158	101.3 Å²	101.3	74%	0.738	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.5	-175.9	-68.3	-179.1	-172.2	0	0	112.4	D73 Y76	E71-D73 VanDerWaalsContact C-N 3.33Å; E71-Y76 HydrophobicContact CG-CD2 4.29Å; E71-Y76 HydrophobicContact CG-CE1 4.2Å; E71-Y76 HydrophobicContact CG-CE2 3.84Å
72	E	95.7	Very high	91.3	Very high	145 Å²	145	103.8 Å²	103.8	68%	0.678	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-16.2	173.2	67.4	-96.5	-154.7	0	0	114.8	R70	R70-E72 VanDerWaalsContact CB-CD 3.48Å; R70-E72 HydrophobicContact CB-CG 4.19Å; R70-E72 WeakPolarHBondContact CB-OE2 3.24Å; R70-E72 IonicContact NE-OE1 3.61Å; R70-E72 PolarHBondContact O-N 2.71Å; R70-E72 VanDerWaalsContact O-N 3.13Å
73	D	93.7	Very high	92.4	Very high	32 Å²	32	102.5 Å²	102.5	17%	0.171	45%	0.453	C	S	.	.	S	Bend	trans	-75.1	132.8	-178.5	-70.4	-45	0	0	0	110	Q68 R70 E71 W75 Y76	Q68-D73 HydrophobicContact CB-CB 3.78Å; Q68-D73 HydrophobicContact CG-CB 4.32Å; R70-D73 VanDerWaalsContact CB-OD2 3.32Å; R70-D73 WeakPolarHBondContact CB-OD2 3.31Å; R70-D73 IonicContact CZ-OD1 3.45Å; R70-D73 IonicContact CZ-OD2 2.71Å; R70-D73 IonicContact NE-OD1 3.52Å; R70-D73 IonicContact NE-OD2 3.07Å; R70-D73 PolarHBondContact NE-OD2 3.04Å; R70-D73 IonicContact NH2-OD1 2.79Å; R70-D73 PolarHBondContact NH2-OD1 3.49Å; R70-D73 IonicContact NH2-OD2 2.65Å; R70-D73 PolarHBondContact NH2-OD2 2.93Å; R70-D73 WeakPolarHBondContact O-CB 3.33Å; R70-D73 PolarHBondContact O-N 2.82Å; E71-D73 VanDerWaalsContact C-N 3.33Å; D73-W75 PolarHBondContact O-N 2.97Å; D73-Y76 WeakPolarHBondContact O-CB 3.46Å; D73-Y76 PolarHBondContact O-N 3.26Å
74	K	91.4	Very high	93.3	Very high	174 Å²	174	103.5 Å²	103.5	76%	0.757	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-30.8	178.8	179.9	179.9	174.1	-178.3	0	113.9
75	W	89.9	Confident	94	Very high	168 Å²	168	101.5 Å²	101.5	64%	0.636	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	31.8	-175.7	-52.2	114.5	0	0	0	112.2	Q68 D73 V77	Q68-W75 HydrophobicContact CG-CB 4.39Å; D73-W75 PolarHBondContact O-N 2.97Å; W75-V77 PolarHBondContact O-N 3.44Å
76	Y	95.1	Very high	94.4	Very high	83 Å²	83	101.3 Å²	101.3	33%	0.325	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-54.3	134.2	175.1	170.9	-103.1	0	0	0	111.5	Q68 R69 R70 E71 D73 S78	Q68-Y76 WeakPolarHBondContact O-CA 3.35Å; R69-Y76 WeakPolarHBondContact O-CE2 3.34Å; R70-Y76 VanDerWaalsContact C-CD2 3.46Å; R70-Y76 WeakPolarHBondContact O-CD2 3.44Å; E71-Y76 HydrophobicContact CG-CD2 4.29Å; E71-Y76 HydrophobicContact CG-CE1 4.2Å; E71-Y76 HydrophobicContact CG-CE2 3.84Å; D73-Y76 WeakPolarHBondContact O-CB 3.46Å; D73-Y76 PolarHBondContact O-N 3.26Å; Y76-S78 WeakPolarHBondContact OH-CB 3.22Å
77	V	95	Very high	94.3	Very high	29 Å²	29	95 Å²	95	18%	0.176	44%	0.435	C	S	.	.			trans	-135.3	130.4	169.4	-179.6	0	0	0	0	107.9	V67 Q68 R69 W75 E81 F82 F87	V67-V77 HydrophobicContact CG1-CB 3.73Å; V67-V77 HydrophobicContact CG1-CG1 4.37Å; V67-V77 HydrophobicContact CG1-CG2 4.44Å; Q68-V77 PolarHBondContact O-N 3.38Å; R69-V77 VanDerWaalsContact CD-O 3.29Å; R69-V77 WeakPolarHBondContact CD-O 3.4Å; R69-V77 PolarHBondContact NH1-O 2.98Å; W75-V77 PolarHBondContact O-N 3.44Å; V77-E81 HydrophobicContact CG1-CB 3.73Å; V77-F82 HydrophobicContact CG1-CB 3.73Å; V77-F87 HydrophobicContact CG2-CZ 3.92Å
78	S	96	Very high	94.1	Very high	15 Å²	15	99 Å²	99	11%	0.105	46%	0.461	C	S	.	.			trans	-74.3	160.6	179.4	65.6	0	0	0	0	112.2	R69 Y76 E80 E81 F82	R69-S78 PolarHBondContact NH1-O 2.85Å; Y76-S78 WeakPolarHBondContact OH-CB 3.22Å; S78-E80 WeakPolarHBondContact CB-OE2 3.09Å; S78-E80 PolarHBondContact O-N 2.65Å; S78-E81 WeakPolarHBondContact CB-OE2 3.4Å; S78-E81 PolarHBondContact N-OE2 3.49Å; S78-E81 PolarHBondContact O-N 3.17Å; S78-E81 VanDerWaalsContact OG-CG 3.28Å; S78-E81 WeakPolarHBondContact OG-CG 3.37Å; S78-E81 PolarHBondContact OG-N 2.65Å; S78-E81 PolarHBondContact OG-OE2 3.19Å; S78-F82 PolarHBondContact O-N 2.87Å; S78-F82 VanDerWaalsContact O-N 3.15Å
79	Y	96.5	Very high	93.7	Very high	131 Å²	131	103.3 Å²	103.3	51%	0.514	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-24	176.4	-82.5	-76.1	0	0	0	111.7	R69 F82 N83	R69-Y79 HydrophobicContact CG-CE2 4.3Å; Y79-F82 CarbonylContact O-C 3.43Å; Y79-N83 WeakPolarHBondContact O-CA 3.36Å; Y79-N83 PolarHBondContact O-N 2.94Å
80	E	95.6	Very high	93	Very high	171 Å²	171	104 Å²	104	80%	0.799	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-39.6	175.3	-66.6	72.4	-163.8	0	0	112	S78	S78-E80 WeakPolarHBondContact CB-OE2 3.09Å; S78-E80 PolarHBondContact O-N 2.65Å
81	E	95.7	Very high	92.2	Very high	138 Å²	138	101.7 Å²	101.7	65%	0.645	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-37.8	177	-72.4	166.5	114.8	0	0	112.6	V77 S78	V77-E81 HydrophobicContact CG1-CB 3.73Å; S78-E81 WeakPolarHBondContact CB-OE2 3.4Å; S78-E81 PolarHBondContact N-OE2 3.49Å; S78-E81 PolarHBondContact O-N 3.17Å; S78-E81 VanDerWaalsContact OG-CG 3.28Å; S78-E81 WeakPolarHBondContact OG-CG 3.37Å; S78-E81 PolarHBondContact OG-N 2.65Å; S78-E81 PolarHBondContact OG-OE2 3.19Å
82	F	95.5	Very high	91.4	Very high	58 Å²	58	96.3 Å²	96.3	25%	0.254	46%	0.463	S	S	.	.			trans	-150.4	111.4	-178.1	-169.8	-103.3	0	0	0	109.4	V67 R69 V77 S78 Y79 E84 F87	V67-F82 HydrophobicContact CG2-CD1 3.66Å; V67-F82 HydrophobicContact CG2-CE1 3.72Å; R69-F82 PolarHBondContact NH1-O 2.97Å; R69-F82 VanDerWaalsContact NH1-O 3.14Å; R69-F82 PolarHBondContact NH2-O 2.99Å; V77-F82 HydrophobicContact CG1-CB 3.73Å; S78-F82 PolarHBondContact O-N 2.87Å; S78-F82 VanDerWaalsContact O-N 3.15Å; Y79-F82 CarbonylContact O-C 3.43Å; F82-E84 HydrophobicContact CD1-CB 4.1Å; F82-E84 WeakPolarHBondContact CD1-O 3.42Å; F82-E84 HydrophobicContact CE1-CB 3.49Å; F82-E84 VanDerWaalsContact CE1-CB 3.49Å; F82-E84 HydrophobicContact CE1-CG 4.48Å; F82-E84 HydrophobicContact CZ-CB 3.78Å; F82-E84 HydrophobicContact CZ-CG 4.34Å; F82-F87 HydrophobicContact CD1-CD1 4.16Å; F82-F87 HydrophobicContact CD1-CE1 4.01Å; F82-F87 AromaticContact CE1-CD1 3.76Å; F82-F87 HydrophobicContact CE1-CD1 3.76Å; F82-F87 HydrophobicContact CE1-CE1 4.1Å; F82-F87 HydrophobicContact CE2-CD1 4.47Å; F82-F87 HydrophobicContact CG-CE1 4.3Å; F82-F87 AromaticContact CZ-CD1 3.96Å; F82-F87 HydrophobicContact CZ-CD1 3.96Å
83	N	95.4	Very high	90.3	Very high	124 Å²	124	91.2 Å²	91.2	66%	0.663	45%	0.449	S	S	*	.			trans	-82.9	-12.7	-171.6	64.3	-1.5	0	0	0	114.3	Y79	Y79-N83 WeakPolarHBondContact O-CA 3.36Å; Y79-N83 PolarHBondContact O-N 2.94Å
84	E	95.4	Very high	89.8	Confident	117 Å²	117	94.2 Å²	94.2	55%	0.547	47%	0.473	S	S	.	.	S	Bend	trans	-83.5	156.5	178.9	-65	-71.1	-175.1	0	0	112.2	R69 F82	R69-E84 PolarHBondContact NH2-O 3.48Å; F82-E84 HydrophobicContact CD1-CB 4.1Å; F82-E84 WeakPolarHBondContact CD1-O 3.42Å; F82-E84 HydrophobicContact CE1-CB 3.49Å; F82-E84 VanDerWaalsContact CE1-CB 3.49Å; F82-E84 HydrophobicContact CE1-CG 4.48Å; F82-E84 HydrophobicContact CZ-CB 3.78Å; F82-E84 HydrophobicContact CZ-CG 4.34Å
85	T	94.7	Very high	89.7	Confident	76 Å²	76	88.8 Å²	88.8	47%	0.466	46%	0.457	S	S	.	.	S	Bend	trans	-89.7	-12.3	-177.9	60	0	0	0	0	114.4	V67	V67-T85 PolarHBondContact N-O 2.93Å
86	V	92.7	Very high	89.7	Confident	52 Å²	52	82.4 Å²	82.4	32%	0.315	43%	0.433	S	S	.	.	B	Isolated β-bridge	trans	-135.7	131.8	-176.1	-176.9	0	0	0	0	108.2	E64 R66	E64-V86 HydrophobicContact CB-CG1 4.13Å; R66-V86 HydrophobicContact CG-CG2 4.48Å
87	F	90	Very high	89.6	Confident	52 Å²	52	81.8 Å²	81.8	23%	0.228	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-67.4	147.5	172.2	-70.4	-60.5	0	0	0	110.5	M65 V67 V77 F82 F90	M65-F87 HydrophobicContact CB-CD2 4.33Å; M65-F87 PolarHBondContact O-N 3.44Å; V67-F87 HydrophobicContact CB-CE2 4.28Å; V67-F87 HydrophobicContact CB-CZ 4.31Å; V67-F87 HydrophobicContact CG1-CE1 4.47Å; V67-F87 HydrophobicContact CG1-CE2 4.26Å; V67-F87 HydrophobicContact CG1-CZ 3.89Å; V67-F87 HydrophobicContact CG2-CD1 4.11Å; V67-F87 HydrophobicContact CG2-CD2 4.06Å; V67-F87 HydrophobicContact CG2-CE1 3.98Å; V67-F87 HydrophobicContact CG2-CE2 3.95Å; V67-F87 HydrophobicContact CG2-CG 4.15Å; V67-F87 HydrophobicContact CG2-CZ 3.9Å; V77-F87 HydrophobicContact CG2-CZ 3.92Å; F82-F87 HydrophobicContact CD1-CD1 4.16Å; F82-F87 HydrophobicContact CD1-CE1 4.01Å; F82-F87 AromaticContact CE1-CD1 3.76Å; F82-F87 HydrophobicContact CE1-CD1 3.76Å; F82-F87 HydrophobicContact CE1-CE1 4.1Å; F82-F87 HydrophobicContact CE2-CD1 4.47Å; F82-F87 HydrophobicContact CG-CE1 4.3Å; F82-F87 AromaticContact CZ-CD1 3.96Å; F82-F87 HydrophobicContact CZ-CD1 3.96Å; F87-F90 HydrophobicContact CB-CD1 4.18Å; F87-F90 HydrophobicContact CB-CE1 4.08Å; F87-F90 HydrophobicContact CD2-CE1 4.37Å
88	P	89.6	Confident	89.5	Confident	94 Å²	94	81.9 Å²	81.9	61%	0.61	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-57.5	157.9	165.5	29.1	-35.4	0	0	0	109.5	F90	P88-F90 WeakPolarHBondContact O-CD1 3.05Å; P88-F90 PolarHBondContact O-N 3.48Å; P88-F90 VanDerWaalsContact O-N 3.17Å
89	R	84.5	Confident	89.4	Confident	157 Å²	157	83.8 Å²	83.8	59%	0.592	45%	0.45	S	S	*	.	S	Bend	trans	-53.3	126	175.9	-66.7	-179.4	-177.8	-175.8	-3.2	110.4	Y62 E64	Y62-R89 HydrophobicContact CE1-CB 4.27Å; Y62-R89 HydrophobicContact CE1-CG 4.31Å; Y62-R89 HydrophobicContact CE2-CB 3.98Å; Y62-R89 WeakPolarHBondContact OH-CB 3.33Å; Y62-R89 WeakPolarHBondContact OH-CD 3.44Å; E64-R89 HydrophobicContact CG-CG 3.6Å; E64-R89 IonicContact OE1-CZ 3.49Å; E64-R89 IonicContact OE1-NE 2.65Å; E64-R89 PolarHBondContact OE1-NE 3.13Å; E64-R89 IonicContact OE1-NH2 3.28Å; E64-R89 PolarHBondContact OE1-NH2 3.09Å
90	F	80.9	Confident	89.3	Confident	72 Å²	72	78.5 Å²	78.5	32%	0.316	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	168.8	-176.5	74.8	-69.5	0	0	0	111	M65 F87 P88	M65-F90 HydrophobicContact CB-CE1 3.87Å; M65-F90 HydrophobicContact CB-CZ 4.22Å; M65-F90 HydrophobicContact CG-CE1 3.84Å; M65-F90 HydrophobicContact CG-CZ 4.05Å; M65-F90 HydrophobicContact SD-CE1 3.89Å; M65-F90 HydrophobicContact SD-CZ 3.46Å; M65-F90 WeakPolarHBondContact SD-CZ 3.39Å; F87-F90 HydrophobicContact CB-CD1 4.18Å; F87-F90 HydrophobicContact CB-CE1 4.08Å; F87-F90 HydrophobicContact CD2-CE1 4.37Å; P88-F90 WeakPolarHBondContact O-CD1 3.05Å; P88-F90 PolarHBondContact O-N 3.48Å; P88-F90 VanDerWaalsContact O-N 3.17Å
91	C	79.4	Confident	89.2	Confident	89 Å²	89	78.6 Å²	78.6	60%	0.601	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	106.7	172.1	-166.4	0	0	0	0	108.3	M61	M61-C91 VanDerWaalsContact CE-SG 3.55Å; M61-C91 CarbonylContact O-C 3.53Å; M61-C91 VanDerWaalsContact O-CA 3.31Å; M61-C91 WeakPolarHBondContact O-CA 3.44Å
92	S	77.5	Confident	89.1	Confident	46 Å²	46	73.8 Å²	73.8	32%	0.322	42%	0.416	S	S	.	.			trans	-82.1	-26.1	-168.7	63.4	0	0	0	0	114.5	D60 M61	D60-S92 PolarHBondContact O-OG 2.84Å; M61-S92 WeakPolarHBondContact CA-OG 3.12Å; M61-S92 PolarHBondContact O-N 2.59Å; M61-S92 PolarHBondContact O-OG 3.26Å
93	G	72.7	Confident	89	Confident	38 Å²	38	71 Å²	71	39%	0.392	40%	0.404	S	S	.	.	S	Bend	trans	-132.9	-161.6	-166	0	0	0	0	0	114.5	M61	M61-G93 WeakPolarHBondContact CE-O 3.19Å; M61-G93 WeakPolarHBondContact SD-CA 3.31Å
94	S	81.7	Confident	88.9	Confident	95 Å²	95	70.1 Å²	70.1	66%	0.664	40%	0.396	S	S	*	.			trans	-97.2	137.2	-178.4	-60.5	0	0	0	0	111.1	M61	M61-S94 PolarHBondContact SD-N 2.86Å; M61-S94 VanDerWaalsContact SD-N 3.44Å; M61-S94 VanDerWaalsContact SD-O 3.34Å
95	S	89.2	Confident	88.7	Confident	60 Å²	60	67.2 Å²	67.2	42%	0.42	39%	0.387	S	S	.	.			trans	-128.5	156.2	166.5	58.5	0	0	0	0	108.7	K56	K56-S95 WeakPolarHBondContact O-CA 3.39Å; K56-S95 VanDerWaalsContact O-CB 3.24Å; K56-S95 WeakPolarHBondContact O-CB 3.46Å
96	Y	91	Very high	88.7	Confident	33 Å²	33	64.1 Å²	64.1	13%	0.129	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	149	173	58.7	-91.8	0	0	0	110.5	F41 K56 I123 T124	F41-Y96 AromaticContact CE2-CE2 3.8Å; F41-Y96 HydrophobicContact CE2-CE2 3.8Å; F41-Y96 HydrophobicContact CZ-CD2 4.34Å; F41-Y96 AromaticContact CZ-CE2 3.5Å; F41-Y96 HydrophobicContact CZ-CE2 3.5Å; K56-Y96 HydrophobicContact CB-CD2 4.31Å; K56-Y96 HydrophobicContact CB-CE1 4.14Å; K56-Y96 HydrophobicContact CB-CE2 3.95Å; K56-Y96 HydrophobicContact CD-CD1 4.33Å; K56-Y96 HydrophobicContact CD-CE1 3.59Å; K56-Y96 HydrophobicContact CG-CE1 4.04Å; K56-Y96 HydrophobicContact CG-CE2 4.38Å; K56-Y96 PolarHBondContact N-O 3.26Å; K56-Y96 PolarHBondContact O-N 2.92Å; Y96-I123 HydrophobicContact CE2-CG2 3.91Å; Y96-T124 HydrophobicContact CD1-CG2 4.19Å; Y96-T124 HydrophobicContact CD2-CG2 3.66Å; Y96-T124 HydrophobicContact CE2-CG2 4.02Å; Y96-T124 HydrophobicContact CG-CG2 3.74Å
97	C	92.7	Very high	88.7	Confident	70 Å²	70	62.1 Å²	62.1	47%	0.473	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.1	-172.7	-176.9	0	0	0	0	109.1	I54 L55	I54-C97 WeakPolarHBondContact O-CA 3.43Å; L55-C97 HydrophobicContact CD1-CB 3.9Å
98	L	92.2	Very high	88.9	Confident	32 Å²	32	63.5 Å²	63.5	17%	0.168	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	151.3	175.9	-59.1	173.2	0	0	0	109.1	F41 Y53 I54 L106 I123	F41-L98 HydrophobicContact CD1-CD1 4.2Å; F41-L98 HydrophobicContact CE1-CD1 3.68Å; F41-L98 HydrophobicContact CE1-CG 4.47Å; F41-L98 HydrophobicContact CE2-CD1 4.28Å; F41-L98 HydrophobicContact CZ-CD1 3.77Å; Y53-L98 CarbonylContact C-O 3.57Å; Y53-L98 WeakPolarHBondContact CA-O 3.23Å; I54-L98 PolarHBondContact N-O 3.06Å; I54-L98 PolarHBondContact O-N 3.33Å; L98-L106 HydrophobicContact CD1-CD1 3.98Å; L98-I123 HydrophobicContact CD1-CG2 4.41Å
99	T	94.7	Very high	89	Confident	55 Å²	55	59 Å²	59	34%	0.337	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	147	163	61.8	0	0	0	0	108.6	Y53 Q101 A102	Y53-T99 HydrophobicContact CD1-CG2 4.07Å; Y53-T99 HydrophobicContact CE1-CG2 3.91Å; T99-Q101 PolarHBondContact O-N 2.77Å; T99-A102 WeakPolarHBondContact O-CB 3.35Å; T99-A102 PolarHBondContact O-N 3.45Å; T99-A102 WeakPolarHBondContact OG1-CB 3.32Å; T99-A102 PolarHBondContact OG1-N 2.07Å
100	T	94.3	Very high	89.5	Confident	19 Å²	19	53 Å²	53	12%	0.117	32%	0.316	C	S	.	.	H	α-helix	trans	-58.4	-30.9	174.6	-56	0	0	0	0	111.7	A51 K52 I54 A102 V103	A51-T100 WeakPolarHBondContact O-CB 3.21Å; A51-T100 PolarHBondContact O-OG1 2.88Å; K52-T100 PolarHBondContact O-N 2.91Å; I54-T100 HydrophobicContact CD1-CG2 4.26Å; T100-A102 VanDerWaalsContact C-N 3.28Å; T100-A102 PolarHBondContact O-N 3.47Å; T100-V103 WeakPolarHBondContact O-CB 3.4Å; T100-V103 PolarHBondContact O-N 3.16Å
101	Q	93	Very high	89.9	Confident	173 Å²	173	57.8 Å²	57.8	81%	0.808	34%	0.34	S	S	*	.	H	α-helix	trans	-64.4	-28.2	174.7	-67.7	177.4	-18.6	0	0	113.5	T99 V103 P105	T99-Q101 PolarHBondContact O-N 2.77Å; Q101-V103 VanDerWaalsContact C-N 3.32Å; Q101-P105 WeakPolarHBondContact O-CD 3.34Å
102	A	93.3	Very high	90.5	Very high	38 Å²	38	59.2 Å²	59.2	31%	0.314	34%	0.341	S	S	.	.	H	α-helix	trans	-79.5	-13.9	177.6	0	0	0	0	0	113	T99 T100 L106	T99-A102 WeakPolarHBondContact O-CB 3.35Å; T99-A102 PolarHBondContact O-N 3.45Å; T99-A102 WeakPolarHBondContact OG1-CB 3.32Å; T99-A102 PolarHBondContact OG1-N 2.07Å; T100-A102 VanDerWaalsContact C-N 3.28Å; T100-A102 PolarHBondContact O-N 3.47Å; A102-L106 WeakPolarHBondContact O-CB 3.47Å; A102-L106 PolarHBondContact O-N 3.15Å
103	V	93.7	Very high	91.2	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-49.5	-176.5	175.5	0	0	0	0	111.5	F41 A45 I54 T100 Q101 L106 L107	F41-V103 HydrophobicContact CB-CG1 4.03Å; F41-V103 HydrophobicContact CD1-CG2 4.27Å; A45-V103 HydrophobicContact CB-CB 4.04Å; A45-V103 HydrophobicContact CB-CG1 3.65Å; A45-V103 HydrophobicContact CB-CG2 4.49Å; I54-V103 HydrophobicContact CD1-CG2 3.7Å; T100-V103 WeakPolarHBondContact O-CB 3.4Å; T100-V103 PolarHBondContact O-N 3.16Å; Q101-V103 VanDerWaalsContact C-N 3.32Å; V103-L106 WeakPolarHBondContact O-CB 3.47Å; V103-L106 PolarHBondContact O-N 2.72Å; V103-L106 VanDerWaalsContact O-N 3.12Å; V103-L107 HydrophobicContact CG1-CD1 3.75Å; V103-L107 HydrophobicContact CG1-CD2 4.42Å; V103-L107 HydrophobicContact CG1-CG 3.91Å; V103-L107 VanDerWaalsContact O-CG 3.32Å; V103-L107 WeakPolarHBondContact O-CG 3.29Å; V103-L107 PolarHBondContact O-N 3.48Å
104	Q	92.9	Very high	92.3	Very high	105 Å²	105	61.3 Å²	61.3	49%	0.491	35%	0.346	S	S	.	.	H	α-helix	trans	-60.8	-48.9	-175.7	-169.9	64.3	52.9	0	0	112.8	L106 L107 D108	Q104-L106 PolarHBondContact O-N 3.02Å; Q104-L107 PolarHBondContact O-N 3.4Å; Q104-L107 VanDerWaalsContact O-N 3.09Å; Q104-D108 PolarHBondContact NE2-OD1 3.15Å; Q104-D108 PolarHBondContact O-N 2.71Å
105	P	92.6	Very high	92.9	Very high	55 Å²	55	61.7 Å²	61.7	36%	0.357	34%	0.336	S	S	.	.	H	α-helix	trans	-57.1	-34.8	174.5	-25.9	35.1	0	0	0	113.8	Q101 S109 P132	Q101-P105 WeakPolarHBondContact O-CD 3.34Å; P105-S109 PolarHBondContact O-N 2.95Å; P105-S109 PolarHBondContact O-OG 2.8Å; P105-P132 HydrophobicContact CB-CG 4.31Å
106	L	93.4	Very high	93.2	Very high	12 Å²	12	61.1 Å²	61.1	6%	0.063	33%	0.328	C	S	.	.	H	α-helix	trans	-68.3	-43.4	176.6	-174.7	151.7	0	0	0	111.5	L98 A102 V103 Q104 S109 I123 L127	L98-L106 HydrophobicContact CD1-CD1 3.98Å; A102-L106 WeakPolarHBondContact O-CB 3.47Å; A102-L106 PolarHBondContact O-N 3.15Å; V103-L106 WeakPolarHBondContact O-CB 3.47Å; V103-L106 PolarHBondContact O-N 2.72Å; V103-L106 VanDerWaalsContact O-N 3.12Å; Q104-L106 PolarHBondContact O-N 3.02Å; L106-S109 PolarHBondContact O-N 3.4Å; L106-I123 HydrophobicContact CD1-CG2 3.73Å; L106-I123 HydrophobicContact CD2-CD1 4.24Å; L106-I123 HydrophobicContact CD2-CG2 4.35Å; L106-L127 HydrophobicContact CD2-CB 4.39Å; L106-L127 HydrophobicContact CD2-CD1 3.58Å; L106-L127 HydrophobicContact CG-CB 3.9Å; L106-L127 HydrophobicContact CG-CD1 4.04Å
107	L	93.1	Very high	93.4	Very high	9 Å²	9	64.2 Å²	64.2	5%	0.047	34%	0.339	C	S	.	.	H	α-helix	trans	-64.9	-40.6	176	-60.5	176.6	0	0	0	111.2	Y38 N42 V103 Q104 S109 V110	Y38-L107 HydrophobicContact CD2-CD2 3.35Å; Y38-L107 HydrophobicContact CE2-CB 4.07Å; Y38-L107 HydrophobicContact CE2-CD2 3.25Å; Y38-L107 HydrophobicContact CE2-CG 4.19Å; Y38-L107 HydrophobicContact CG-CD2 4.25Å; N42-L107 HydrophobicContact CB-CD1 3.89Å; N42-L107 HydrophobicContact CB-CD2 4.11Å; V103-L107 HydrophobicContact CG1-CD1 3.75Å; V103-L107 HydrophobicContact CG1-CD2 4.42Å; V103-L107 HydrophobicContact CG1-CG 3.91Å; V103-L107 VanDerWaalsContact O-CG 3.32Å; V103-L107 WeakPolarHBondContact O-CG 3.29Å; V103-L107 PolarHBondContact O-N 3.48Å; Q104-L107 PolarHBondContact O-N 3.4Å; Q104-L107 VanDerWaalsContact O-N 3.09Å; L107-S109 PolarHBondContact O-N 3.33Å; L107-V110 WeakPolarHBondContact O-CB 3.46Å; L107-V110 WeakPolarHBondContact O-CG2 2.9Å; L107-V110 PolarHBondContact O-N 3.35Å; L107-V110 VanDerWaalsContact O-N 3.14Å
108	D	93.3	Very high	93.4	Very high	82 Å²	82	64.1 Å²	64.1	44%	0.439	33%	0.334	S	S	.	.	H	α-helix	trans	-63	-28.3	178.3	-62.7	-20.9	0	0	0	111.9	Q104 V110	Q104-D108 PolarHBondContact NE2-OD1 3.15Å; Q104-D108 PolarHBondContact O-N 2.71Å; D108-V110 VanDerWaalsContact C-N 3.29Å; D108-V110 PolarHBondContact O-N 3.22Å
109	S	93.5	Very high	93.4	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-75.8	-13.4	178.8	-60.8	0	0	0	0	113.8	P105 L106 L107 E111 L112 T113	P105-S109 PolarHBondContact O-N 2.95Å; P105-S109 PolarHBondContact O-OG 2.8Å; L106-S109 PolarHBondContact O-N 3.4Å; L107-S109 PolarHBondContact O-N 3.33Å; S109-E111 VanDerWaalsContact C-N 3.35Å; S109-E111 PolarHBondContact O-N 3.17Å; S109-L112 PolarHBondContact O-N 3.39Å; S109-L112 VanDerWaalsContact O-N 3.15Å; S109-T113 PolarHBondContact O-N 2.95Å; S109-T113 PolarHBondContact O-OG1 3.17Å
110	V	93.2	Very high	93.2	Very high	31 Å²	31	64.4 Å²	64.4	19%	0.188	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-63.2	-39.3	-177.3	170.3	0	0	0	0	112.3	Y38 L107 D108 L112 T113 L127	Y38-V110 HydrophobicContact CD2-CG2 3.63Å; Y38-V110 HydrophobicContact CE2-CB 4.23Å; Y38-V110 HydrophobicContact CE2-CG1 4.4Å; Y38-V110 HydrophobicContact CE2-CG2 3.67Å; L107-V110 WeakPolarHBondContact O-CB 3.46Å; L107-V110 WeakPolarHBondContact O-CG2 2.9Å; L107-V110 PolarHBondContact O-N 3.35Å; L107-V110 VanDerWaalsContact O-N 3.14Å; D108-V110 VanDerWaalsContact C-N 3.29Å; D108-V110 PolarHBondContact O-N 3.22Å; V110-L112 PolarHBondContact O-N 2.86Å; V110-T113 PolarHBondContact O-N 2.83Å; V110-L127 HydrophobicContact CB-CD2 4.48Å; V110-L127 HydrophobicContact CG2-CD1 3.67Å; V110-L127 HydrophobicContact CG2-CD2 3.89Å; V110-L127 HydrophobicContact CG2-CG 4.46Å
111	E	90.4	Very high	93.2	Very high	172 Å²	172	66.7 Å²	66.7	80%	0.804	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-69.7	-19.5	179.1	-64.7	-64.1	151.9	0	0	112.6	S109	S109-E111 VanDerWaalsContact C-N 3.35Å; S109-E111 PolarHBondContact O-N 3.17Å
112	L	92.5	Very high	93.3	Very high	119 Å²	119	58.8 Å²	58.8	62%	0.623	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-96.4	-7.9	-178.7	-56.5	177.2	0	0	0	112.9	S109 V110 I130	S109-L112 PolarHBondContact O-N 3.39Å; S109-L112 VanDerWaalsContact O-N 3.15Å; V110-L112 PolarHBondContact O-N 2.86Å; L112-I130 HydrophobicContact CB-CD1 4.38Å; L112-I130 HydrophobicContact CD1-CG2 4Å
113	T	92.4	Very high	93.2	Very high	15 Å²	15	57 Å²	57	9%	0.092	30%	0.295	C	S	.	.	S	Bend	trans	-115.4	125.6	-171.1	-48.3	0	0	0	0	110.6	S109 V110 F115 Y122 L126 L127 I130	S109-T113 PolarHBondContact O-N 2.95Å; S109-T113 PolarHBondContact O-OG1 3.17Å; V110-T113 PolarHBondContact O-N 2.83Å; T113-F115 PolarHBondContact O-N 3.29Å; T113-Y122 HydrophobicContact CG2-CD2 4.33Å; T113-Y122 HydrophobicContact CG2-CE2 3.66Å; T113-L126 HydrophobicContact CG2-CB 3.71Å; T113-L126 HydrophobicContact CG2-CD1 4.42Å; T113-L127 HydrophobicContact CG2-CD2 4.07Å; T113-L127 VanDerWaalsContact OG1-CD2 3.32Å; T113-L127 WeakPolarHBondContact OG1-CD2 3.28Å; T113-I130 HydrophobicContact CG2-CD1 4.33Å; T113-I130 WeakPolarHBondContact OG1-CD1 3.45Å
114	P	94.6	Very high	93.2	Very high	113 Å²	113	60 Å²	60	73%	0.734	31%	0.314	S	S	*	.			trans	-54.8	127	167.9	-25.2	34.9	0	0	0	110.8	L116 Y122	P114-L116 PolarHBondContact O-N 3.33Å; P114-Y122 WeakPolarHBondContact O-CE2 3.4Å
115	F	95	Very high	93.2	Very high	103 Å²	103	56 Å²	56	45%	0.452	30%	0.301	S	S	.	.			trans	-57.5	130.9	-179	178.2	-98.4	0	0	0	111.5	L35 T113 W117 Y122	L35-F115 HydrophobicContact CD2-CE2 3.88Å; L35-F115 HydrophobicContact CG-CE2 3.82Å; L35-F115 HydrophobicContact CG-CZ 4.04Å; T113-F115 PolarHBondContact O-N 3.29Å; F115-W117 HydrophobicContact CE1-CB 4.08Å; F115-W117 HydrophobicContact CZ-CB 4.43Å; F115-Y122 HydrophobicContact CD2-CE1 4.35Å
116	L	95.3	Very high	93.2	Very high	47 Å²	47	57 Å²	57	25%	0.246	30%	0.302	C	S	.	.			trans	-122.4	138.4	168.7	178.9	64.8	0	0	0	108	S34 P114 L118 V121 Y122 L126	S34-L116 WeakPolarHBondContact CB-O 3.36Å; S34-L116 PolarHBondContact OG-O 3.32Å; P114-L116 PolarHBondContact O-N 3.33Å; L116-L118 HydrophobicContact CD2-CB 4.22Å; L116-L118 HydrophobicContact CG-CB 4.16Å; L116-V121 HydrophobicContact CD2-CB 3.87Å; L116-V121 HydrophobicContact CD2-CG1 3.52Å; L116-Y122 HydrophobicContact CB-CD2 3.79Å; L116-Y122 HydrophobicContact CB-CG 4.32Å; L116-L126 HydrophobicContact CB-CD1 4.02Å; L116-L126 HydrophobicContact CD2-CD1 3.85Å
117	W	94.8	Very high	93.2	Very high	99 Å²	99	56.5 Å²	56.5	38%	0.375	30%	0.3	S	S	.	.	S	Bend	trans	-80.6	-24.4	-174.7	63.3	-88	0	0	0	114	H31 S34 F115 D119	H31-W117 VanDerWaalsContact O-CB 3.24Å; H31-W117 WeakPolarHBondContact O-CB 3.44Å; S34-W117 PolarHBondContact N-O 3.5Å; S34-W117 VanDerWaalsContact OG-C 3.26Å; S34-W117 PolarHBondContact OG-O 3.33Å; F115-W117 HydrophobicContact CE1-CB 4.08Å; F115-W117 HydrophobicContact CZ-CB 4.43Å; W117-D119 PolarHBondContact O-N 3.11Å
118	L	93.1	Very high	93	Very high	67 Å²	67	58.7 Å²	58.7	35%	0.351	32%	0.316	S	S	.	.			trans	-67.3	104.7	173.6	-63	169.5	0	0	0	109.6	L116 V121 Y122	L116-L118 HydrophobicContact CD2-CB 4.22Å; L116-L118 HydrophobicContact CG-CB 4.16Å; L118-V121 HydrophobicContact CB-CB 4.12Å; L118-V121 HydrophobicContact CB-CG2 4.17Å; L118-V121 HydrophobicContact CD1-CG2 4.39Å; L118-V121 PolarHBondContact O-N 2.94Å; L118-Y122 WeakPolarHBondContact O-CB 3.35Å; L118-Y122 PolarHBondContact O-N 3.42Å
119	D	92.5	Very high	92.7	Very high	18 Å²	18	61 Å²	61	10%	0.096	33%	0.328	C	S	.	.	H	α-helix	trans	-66.4	-44.1	-168.9	65.4	-32.6	0	0	0	113.5	L33 S34 A37 K56 W117 Y122 I123	L33-D119 HydrophobicContact CB-CB 3.97Å; S34-D119 WeakPolarHBondContact OG-CA 3.32Å; S34-D119 PolarHBondContact OG-N 3.24Å; A37-D119 HydrophobicContact CB-CB 4.2Å; K56-D119 WeakPolarHBondContact CE-OD2 3.44Å; K56-D119 IonicContact NZ-OD2 3.9Å; K56-D119 PolarHBondContact NZ-OD2 3.19Å; W117-D119 PolarHBondContact O-N 3.11Å; D119-Y122 PolarHBondContact O-N 3.46Å; D119-I123 WeakPolarHBondContact O-CB 3.47Å; D119-I123 WeakPolarHBondContact O-CG1 3.4Å; D119-I123 PolarHBondContact O-N 2.72Å
120	D	91.2	Very high	91.8	Very high	76 Å²	76	63.2 Å²	63.2	41%	0.406	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-48.9	176.8	60.7	-13.9	0	0	0	112	T124	D120-T124 WeakPolarHBondContact O-CB 3.31Å; D120-T124 PolarHBondContact O-N 3.01Å; D120-T124 PolarHBondContact O-OG1 3.46Å
121	V	93.1	Very high	90.2	Very high	66 Å²	66	69.1 Å²	69.1	40%	0.4	37%	0.365	S	S	.	.	I	π-helix	trans	-63.8	-42.8	177.1	-178.3	0	0	0	0	111	L116 L118 G125 L126	L116-V121 HydrophobicContact CD2-CB 3.87Å; L116-V121 HydrophobicContact CD2-CG1 3.52Å; L118-V121 HydrophobicContact CB-CB 4.12Å; L118-V121 HydrophobicContact CB-CG2 4.17Å; L118-V121 HydrophobicContact CD1-CG2 4.39Å; L118-V121 PolarHBondContact O-N 2.94Å; V121-G125 CarbonylContact O-C 3.52Å; V121-G125 WeakPolarHBondContact O-CA 3.38Å; V121-G125 PolarHBondContact O-N 3.06Å; V121-G125 VanDerWaalsContact O-N 3.08Å; V121-L126 PolarHBondContact O-N 2.95Å
122	Y	94.6	Very high	88.6	Confident	7 Å²	7	63.9 Å²	63.9	3%	0.027	35%	0.346	C	S	.	.	I	π-helix	trans	-68	-55.4	-178.6	-171.3	-119.4	0	0	0	111.4	T113 P114 F115 L116 L118 D119 L126 L127	T113-Y122 HydrophobicContact CG2-CD2 4.33Å; T113-Y122 HydrophobicContact CG2-CE2 3.66Å; P114-Y122 WeakPolarHBondContact O-CE2 3.4Å; F115-Y122 HydrophobicContact CD2-CE1 4.35Å; L116-Y122 HydrophobicContact CB-CD2 3.79Å; L116-Y122 HydrophobicContact CB-CG 4.32Å; L118-Y122 WeakPolarHBondContact O-CB 3.35Å; L118-Y122 PolarHBondContact O-N 3.42Å; D119-Y122 PolarHBondContact O-N 3.46Å; Y122-L126 HydrophobicContact CD2-CB 4.26Å; Y122-L126 HydrophobicContact CD2-CD1 4.04Å; Y122-L126 PolarHBondContact O-N 3.14Å; Y122-L126 VanDerWaalsContact O-N 3.15Å; Y122-L127 HydrophobicContact CD1-CD1 4.02Å; Y122-L127 HydrophobicContact CD1-CG 4.27Å; Y122-L127 HydrophobicContact CE1-CD1 3.8Å; Y122-L127 HydrophobicContact CE1-CD2 4.15Å; Y122-L127 HydrophobicContact CE1-CG 4.1Å; Y122-L127 HydrophobicContact CE2-CD2 4.1Å; Y122-L127 HydrophobicContact CE2-CG 4.42Å; Y122-L127 WeakPolarHBondContact O-CG 3.39Å; Y122-L127 PolarHBondContact O-N 2.66Å
123	I	93.1	Very high	86.7	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	38%	0.378	C	S	.	.	I	π-helix	trans	-69.5	-52.4	-175.1	-59.5	-63.1	0	0	0	111.4	A37 F41 Y96 L98 L106 D119 L127	A37-I123 HydrophobicContact CB-CD1 4.11Å; A37-I123 HydrophobicContact CB-CG1 3.93Å; F41-I123 HydrophobicContact CD2-CG2 4.45Å; F41-I123 HydrophobicContact CE2-CG2 3.91Å; Y96-I123 HydrophobicContact CE2-CG2 3.91Å; L98-I123 HydrophobicContact CD1-CG2 4.41Å; L106-I123 HydrophobicContact CD1-CG2 3.73Å; L106-I123 HydrophobicContact CD2-CD1 4.24Å; L106-I123 HydrophobicContact CD2-CG2 4.35Å; D119-I123 WeakPolarHBondContact O-CB 3.47Å; D119-I123 WeakPolarHBondContact O-CG1 3.4Å; D119-I123 PolarHBondContact O-N 2.72Å; I123-L127 HydrophobicContact CD1-CD1 3.83Å
124	T	92.1	Very high	86.4	Confident	65 Å²	65	70.9 Å²	70.9	40%	0.399	39%	0.392	S	S	.	.	I	π-helix	trans	-90	-15.4	-171.7	73	0	0	0	0	113.4	Y96 D120 S128	Y96-T124 HydrophobicContact CD1-CG2 4.19Å; Y96-T124 HydrophobicContact CD2-CG2 3.66Å; Y96-T124 HydrophobicContact CE2-CG2 4.02Å; Y96-T124 HydrophobicContact CG-CG2 3.74Å; D120-T124 WeakPolarHBondContact O-CB 3.31Å; D120-T124 PolarHBondContact O-N 3.01Å; D120-T124 PolarHBondContact O-OG1 3.46Å; T124-S128 VanDerWaalsContact C-OG 3.24Å; T124-S128 WeakPolarHBondContact O-CB 3.42Å; T124-S128 PolarHBondContact O-OG 2.79Å
125	G	92.7	Very high	86	Confident	21 Å²	21	68.7 Å²	68.7	22%	0.216	37%	0.374	C	S	.	.	I	π-helix	trans	-107	-70.7	177.3	0	0	0	0	0	112.8	V121 S128 N129	V121-G125 CarbonylContact O-C 3.52Å; V121-G125 WeakPolarHBondContact O-CA 3.38Å; V121-G125 PolarHBondContact O-N 3.06Å; V121-G125 VanDerWaalsContact O-N 3.08Å; G125-S128 PolarHBondContact O-OG 2.66Å; G125-S128 VanDerWaalsContact O-OG 3.1Å; G125-N129 WeakPolarHBondContact O-CB 3.13Å; G125-N129 VanDerWaalsContact O-CG 3.28Å; G125-N129 PolarHBondContact O-N 3.43Å; G125-N129 PolarHBondContact O-ND2 3.2Å
126	L	93.4	Very high	85.5	Confident	74 Å²	74	66.8 Å²	66.8	39%	0.387	37%	0.37	S	S	.	.	I	π-helix	trans	-69.7	-48.9	-169.4	-62.9	178.3	0	0	0	112.8	T113 L116 V121 Y122	T113-L126 HydrophobicContact CG2-CB 3.71Å; T113-L126 HydrophobicContact CG2-CD1 4.42Å; L116-L126 HydrophobicContact CB-CD1 4.02Å; L116-L126 HydrophobicContact CD2-CD1 3.85Å; V121-L126 PolarHBondContact O-N 2.95Å; Y122-L126 HydrophobicContact CD2-CB 4.26Å; Y122-L126 HydrophobicContact CD2-CD1 4.04Å; Y122-L126 PolarHBondContact O-N 3.14Å; Y122-L126 VanDerWaalsContact O-N 3.15Å
127	L	92.7	Very high	84.9	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.01	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-33.2	-179.3	-60.9	-176.2	0	0	0	112.8	L106 V110 T113 Y122 I123 N129	L106-L127 HydrophobicContact CD2-CB 4.39Å; L106-L127 HydrophobicContact CD2-CD1 3.58Å; L106-L127 HydrophobicContact CG-CB 3.9Å; L106-L127 HydrophobicContact CG-CD1 4.04Å; V110-L127 HydrophobicContact CB-CD2 4.48Å; V110-L127 HydrophobicContact CG2-CD1 3.67Å; V110-L127 HydrophobicContact CG2-CD2 3.89Å; V110-L127 HydrophobicContact CG2-CG 4.46Å; T113-L127 HydrophobicContact CG2-CD2 4.07Å; T113-L127 VanDerWaalsContact OG1-CD2 3.32Å; T113-L127 WeakPolarHBondContact OG1-CD2 3.28Å; Y122-L127 HydrophobicContact CD1-CD1 4.02Å; Y122-L127 HydrophobicContact CD1-CG 4.27Å; Y122-L127 HydrophobicContact CE1-CD1 3.8Å; Y122-L127 HydrophobicContact CE1-CD2 4.15Å; Y122-L127 HydrophobicContact CE1-CG 4.1Å; Y122-L127 HydrophobicContact CE2-CD2 4.1Å; Y122-L127 HydrophobicContact CE2-CG 4.42Å; Y122-L127 WeakPolarHBondContact O-CG 3.39Å; Y122-L127 PolarHBondContact O-N 2.66Å; I123-L127 HydrophobicContact CD1-CD1 3.83Å; L127-N129 VanDerWaalsContact C-N 3.31Å; L127-N129 PolarHBondContact O-N 2.77Å
128	S	89.9	Confident	84.3	Confident	56 Å²	56	66 Å²	66	39%	0.392	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-23.9	-177.8	69.6	0	0	0	0	113.5	T124 G125	T124-S128 VanDerWaalsContact C-OG 3.24Å; T124-S128 WeakPolarHBondContact O-CB 3.42Å; T124-S128 PolarHBondContact O-OG 2.79Å; G125-S128 PolarHBondContact O-OG 2.66Å; G125-S128 VanDerWaalsContact O-OG 3.1Å
129	N	86.1	Confident	83.7	Confident	129 Å²	129	65.9 Å²	65.9	69%	0.69	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.9	-177.6	-77.6	-43.7	0	0	0	113.4	G125 L127	G125-N129 WeakPolarHBondContact O-CB 3.13Å; G125-N129 VanDerWaalsContact O-CG 3.28Å; G125-N129 PolarHBondContact O-N 3.43Å; G125-N129 PolarHBondContact O-ND2 3.2Å; L127-N129 VanDerWaalsContact C-N 3.31Å; L127-N129 PolarHBondContact O-N 2.77Å
130	I	76.2	Confident	83.1	Confident	47 Å²	47	69.4 Å²	69.4	24%	0.241	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-88	116.4	176	-66.8	166.3	0	0	0	107.7	L112 T113 P132	L112-I130 HydrophobicContact CB-CD1 4.38Å; L112-I130 HydrophobicContact CD1-CG2 4Å; T113-I130 HydrophobicContact CG2-CD1 4.33Å; T113-I130 WeakPolarHBondContact OG1-CD1 3.45Å; I130-P132 WeakPolarHBondContact O-CD 3.44Å
131	Q	59.6	Low	82.5	Confident	156 Å²	156	68.8 Å²	68.8	73%	0.729	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-81.1	117.2	165.5	-63.5	-68.9	-62.6	0	0	106.6	T133	Q131-T133 PolarHBondContact O-N 3.28Å
132	P	56.1	Low	81.6	Confident	62 Å²	62	69.1 Å²	69.1	40%	0.403	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-56.6	125.7	164.4	-17	30	0	0	0	107.5	P105 I130	P105-P132 HydrophobicContact CB-CG 4.31Å; I130-P132 WeakPolarHBondContact O-CD 3.44Å
133	T	52.8	Low	80.4	Confident	210 Å²	210	74.7 Å²	74.7	100%	1.288	43%	0.432	S	S	*	.			trans	-60	0	176.3	51.7	0	0	0	0	112.2	Q131	Q131-T133 PolarHBondContact O-N 3.28Å

Retrieved 133 of 133 residues in 105.9 ms (Link to these results)

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