A0A075B6D1_MOUSE Loading...

T cell receptor alpha variable 7-6

AlphaFold DB , UniProt , Accession A0A075B6D1, Species MOUSE (Mus musculus, Mouse), Gene Trav7-6, Length 91 aa.

						>A0A075B6D1_MOUSE|A0A075B6D1|Trav7-6
QEKVQQSPESLIVPEGAMVSLNCSFSDSASQSIWWYQQHPGKGPKALISIFSNGNKKEGRLTVYLNRASLHVSLHIKDSQPSDSAVYLCAV
					

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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	Q	53.8	Low	89.2	Confident	235 Å²	235	112.4 Å²	112.4	100%	1.098	58%	0.575	S	S	*	*				0	118.3	0	-171.7	162.6	56	0	0	106.3	K3	Q1-K3 PolarHBondContact O-N 3.2Å
2	E	66.7	Low	89.9	Confident	104 Å²	104	117.3 Å²	117.3	49%	0.486	60%	0.6	S	S	.	*			trans	-63.9	125.4	177.1	-79.3	172.6	118.1	0	0	109.2	D27 S30	E2-D27 HydrophobicContact CG-CB 3.73Å; E2-S30 PolarHBondContact OE1-OG 2.96Å
3	K	87.7	Confident	90.4	Very high	145 Å²	145	112.4 Å²	112.4	63%	0.63	58%	0.579	S	S	*	*			trans	-119.2	126.5	177.2	-167.7	177.4	-177.3	-172.9	0	108.2	Q1 F25 S26	Q1-K3 PolarHBondContact O-N 3.2Å; K3-F25 WeakPolarHBondContact O-CA 3.26Å; K3-S26 PolarHBondContact N-OG 3.25Å; K3-S26 VanDerWaalsContact N-OG 3.13Å; K3-S26 PolarHBondContact O-N 3.26Å; K3-S26 VanDerWaalsContact O-N 3.16Å
4	V	93.7	Very high	90.9	Very high	56 Å²	56	111.3 Å²	111.3	34%	0.339	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.7	145.3	166.3	-68.2	0	0	0	0	109.1	S24 F25 V91	V4-S24 CarbonylContact C-O 3.54Å; V4-S24 VanDerWaalsContact CA-O 3.3Å; V4-S24 WeakPolarHBondContact CA-O 3.49Å; V4-F25 HydrophobicContact CG1-CB 4.19Å; V4-V91 HydrophobicContact CG1-CB 4.37Å; V4-V91 HydrophobicContact CG1-CG1 4Å; V4-V91 HydrophobicContact CG1-CG2 3.58Å
5	Q	96.4	Very high	91.3	Very high	133 Å²	133	113.9 Å²	113.9	62%	0.621	59%	0.591	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-129.5	118	171.7	-176.9	179.4	-43.3	0	0	108.3	C23 S24	Q5-C23 WeakPolarHBondContact O-CA 3.29Å; Q5-S24 PolarHBondContact N-O 3.47Å; Q5-S24 PolarHBondContact O-N 3.19Å
6	Q	97.6	Very high	91.8	Very high	67 Å²	67	109.4 Å²	109.4	31%	0.313	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.1	147.1	-179.6	-69.1	-174.7	-119.8	0	0	111.7	N22 C23 Y87 C89	Q6-N22 CarbonylContact C-O 3.56Å; Q6-N22 VanDerWaalsContact CA-O 3.27Å; Q6-N22 WeakPolarHBondContact CA-O 3.48Å; Q6-C23 HydrophobicContact CG-CB 4.26Å; Q6-Y87 PolarHBondContact NE2-O 3.49Å; Q6-C89 VanDerWaalsContact CD-N 3.35Å; Q6-C89 HydrophobicContact CG-CB 3.88Å
7	S	98.1	Very high	92.1	Very high	55 Å²	55	104.6 Å²	104.6	39%	0.385	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-151	148.6	172	67.1	0	0	0	0	112.3	N22	S7-N22 PolarHBondContact N-O 2.91Å; S7-N22 WeakPolarHBondContact O-CB 3.46Å; S7-N22 PolarHBondContact O-N 2.86Å
8	P	97.8	Very high	92.5	Very high	59 Å²	59	104.4 Å²	104.4	38%	0.383	56%	0.557	S	S	.	*			cis	-69.8	164.9	-9.9	33.7	-37.3	0	0	0	112	L11	P8-L11 HydrophobicContact CG-CB 3.94Å
9	E	96.4	Very high	92.7	Very high	200 Å²	200	99.6 Å²	99.6	94%	0.935	53%	0.532	S	S	*	.	S	Bend	trans	-68.4	-36.7	175.4	-176.9	178.5	-176.8	0	0	111.8
10	S	96.5	Very high	93	Very high	105 Å²	105	96.9 Å²	96.9	73%	0.734	52%	0.521	S	S	*	.			trans	-146.4	154.6	174	62.2	0	0	0	0	110.3
11	L	96.4	Very high	93.3	Very high	77 Å²	77	93.2 Å²	93.2	40%	0.403	50%	0.501	S	S	.	.			trans	-153.5	129	-171.6	163.2	60.2	0	0	0	108.6	P8 V13 V19 L21	P8-L11 HydrophobicContact CG-CB 3.94Å; L11-V13 HydrophobicContact CD1-CG1 3.39Å; L11-V13 HydrophobicContact CD2-CG1 4.15Å; L11-V13 HydrophobicContact CG-CG1 3.76Å; L11-V19 HydrophobicContact CD2-CB 4.28Å; L11-V19 HydrophobicContact CD2-CG1 3.59Å; L11-V19 HydrophobicContact CD2-CG2 4.07Å; L11-L21 HydrophobicContact CD2-CD2 4.14Å
12	I	97.4	Very high	95.4	Very high	171 Å²	171	84.1 Å²	84.1	88%	0.877	46%	0.46	S	S	*	.			trans	-113.8	126.4	170.1	-58.2	174	0	0	0	107.1
13	V	96.1	Very high	96.8	Very high	54 Å²	54	79.1 Å²	79.1	33%	0.327	44%	0.437	S	S	.	.			trans	-128.4	149.6	178.8	-66	0	0	0	0	111	L11 A17 V19	L11-V13 HydrophobicContact CD1-CG1 3.39Å; L11-V13 HydrophobicContact CD2-CG1 4.15Å; L11-V13 HydrophobicContact CG-CG1 3.76Å; V13-A17 HydrophobicContact CB-CB 4.32Å; V13-V19 HydrophobicContact CB-CG2 4.16Å; V13-V19 HydrophobicContact CG1-CG2 3.73Å; V13-V19 HydrophobicContact CG2-CG2 3.5Å
14	P	97.6	Very high	97.3	Very high	97 Å²	97	74.9 Å²	74.9	63%	0.63	43%	0.425	S	S	*	.			trans	-71.8	155.7	169.3	25.6	-24.9	0	0	0	111.3	A17	P14-A17 HydrophobicContact CG-CB 3.95Å; P14-A17 WeakPolarHBondContact O-CB 3.38Å; P14-A17 PolarHBondContact O-N 3.22Å
15	E	97.8	Very high	97.3	Very high	150 Å²	150	72.7 Å²	72.7	70%	0.701	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	143.9	171.3	-169.2	175.3	161.2	0	0	110.8	A17 S79	E15-A17 PolarHBondContact O-N 2.72Å; E15-S79 CarbonylContact C-O 3.45Å; E15-S79 WeakPolarHBondContact CA-O 3.35Å; E15-S79 WeakPolarHBondContact CG-O 3.15Å
16	G	98	Very high	97	Very high	42 Å²	42	69.6 Å²	69.6	43%	0.433	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	-10.9	-176.3	0	0	0	0	0	114.8	S79	G16-S79 PolarHBondContact N-O 3.43Å
17	A	98.2	Very high	96.4	Very high	28 Å²	28	69.1 Å²	69.1	23%	0.231	40%	0.404	C	S	.	.			trans	-69.5	172.9	176.6	0	0	0	0	0	112.5	V13 P14 E15 D78 S79	V13-A17 HydrophobicContact CB-CB 4.32Å; P14-A17 HydrophobicContact CG-CB 3.95Å; P14-A17 WeakPolarHBondContact O-CB 3.38Å; P14-A17 PolarHBondContact O-N 3.22Å; E15-A17 PolarHBondContact O-N 2.72Å; A17-D78 PolarHBondContact O-N 2.84Å; A17-S79 WeakPolarHBondContact O-CB 3.38Å; A17-S79 PolarHBondContact O-N 2.82Å; A17-S79 PolarHBondContact O-OG 3.16Å; A17-S79 VanDerWaalsContact O-OG 3.08Å
18	M	98	Very high	95.6	Very high	102 Å²	102	70.6 Å²	70.6	50%	0.502	41%	0.414	S	S	.	.			trans	-105	129.5	172.1	-179.5	170.4	146.8	0	0	110	H75 I76 K77	M18-H75 HydrophobicContact CE-CB 3.97Å; M18-H75 WeakPolarHBondContact CE-ND1 3.26Å; M18-I76 CarbonylContact C-O 3.56Å; M18-I76 WeakPolarHBondContact CA-O 3.34Å; M18-K77 HydrophobicContact CG-CG 4.43Å; M18-K77 HydrophobicContact SD-CG 4.2Å
19	V	97.7	Very high	94.9	Very high	13 Å²	13	71.2 Å²	71.2	8%	0.079	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	142.8	173.4	164.7	0	0	0	0	109.6	L11 V13 L21 H75 I76 S79	L11-V19 HydrophobicContact CD2-CB 4.28Å; L11-V19 HydrophobicContact CD2-CG1 3.59Å; L11-V19 HydrophobicContact CD2-CG2 4.07Å; V13-V19 HydrophobicContact CB-CG2 4.16Å; V13-V19 HydrophobicContact CG1-CG2 3.73Å; V13-V19 HydrophobicContact CG2-CG2 3.5Å; V19-L21 HydrophobicContact CG1-CD1 4.48Å; V19-L21 HydrophobicContact CG1-CD2 4.2Å; V19-L21 HydrophobicContact CG1-CG 3.91Å; V19-H75 CarbonylContact O-C 3.6Å; V19-H75 VanDerWaalsContact O-CA 3.26Å; V19-H75 WeakPolarHBondContact O-CA 3.43Å; V19-I76 HydrophobicContact CB-CB 4.14Å; V19-I76 HydrophobicContact CB-CG1 4.47Å; V19-I76 HydrophobicContact CG1-CD1 4.44Å; V19-I76 HydrophobicContact CG1-CG1 4.46Å; V19-I76 PolarHBondContact N-O 3.08Å; V19-I76 PolarHBondContact O-N 3.47Å; V19-S79 WeakPolarHBondContact CG2-OG 3.05Å
20	S	98.2	Very high	94.1	Very high	44 Å²	44	62 Å²	62	31%	0.308	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	121.6	169.3	-173.6	0	0	0	0	109.5	H75	S20-H75 PolarHBondContact OG-NE2 3.2Å
21	L	98.5	Very high	93.5	Very high	20 Å²	20	64.8 Å²	64.8	11%	0.105	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	136.7	173.8	-58.8	174.7	0	0	0	108.5	L11 V19 W35 S73 L74 Y87	L11-L21 HydrophobicContact CD2-CD2 4.14Å; V19-L21 HydrophobicContact CG1-CD1 4.48Å; V19-L21 HydrophobicContact CG1-CD2 4.2Å; V19-L21 HydrophobicContact CG1-CG 3.91Å; L21-W35 HydrophobicContact CB-CH2 3.77Å; L21-W35 HydrophobicContact CB-CZ3 4.05Å; L21-W35 HydrophobicContact CD1-CZ3 4.27Å; L21-S73 CarbonylContact O-C 3.52Å; L21-S73 WeakPolarHBondContact O-CA 3.21Å; L21-S73 WeakPolarHBondContact O-CB 3.27Å; L21-L74 HydrophobicContact CB-CB 4.46Å; L21-L74 HydrophobicContact CD1-CD2 4.36Å; L21-L74 PolarHBondContact N-O 3.11Å; L21-L74 PolarHBondContact O-N 3.32Å; L21-Y87 VanDerWaalsContact CD1-CB 3.41Å; L21-Y87 HydrophobicContact CD1-CD1 4Å; L21-Y87 HydrophobicContact CD1-CD2 3.89Å; L21-Y87 HydrophobicContact CD1-CG 3.5Å
22	N	98.3	Very high	93.1	Very high	44 Å²	44	62.7 Å²	62.7	24%	0.235	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	149.7	-176.2	-58.6	-71.2	0	0	0	110.1	Q6 S7 H71	Q6-N22 CarbonylContact C-O 3.56Å; Q6-N22 VanDerWaalsContact CA-O 3.27Å; Q6-N22 WeakPolarHBondContact CA-O 3.48Å; S7-N22 PolarHBondContact N-O 2.91Å; S7-N22 WeakPolarHBondContact O-CB 3.46Å; S7-N22 PolarHBondContact O-N 2.86Å; N22-H71 PolarHBondContact OD1-CE1 2.83Å; N22-H71 PolarHBondContact OD1-NE2 3.06Å
23	C	97.4	Very high	92.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	119.5	176.4	173.2	0	0	0	0	108.6	Q5 Q6 W35 V72 C89	Q5-C23 WeakPolarHBondContact O-CA 3.29Å; Q6-C23 HydrophobicContact CG-CB 4.26Å; C23-W35 HydrophobicContact CB-CH2 3.96Å; C23-W35 HydrophobicContact CB-CZ2 3.72Å; C23-V72 HydrophobicContact CB-CG1 3.55Å; C23-V72 PolarHBondContact N-O 2.86Å; C23-V72 WeakPolarHBondContact O-CG1 3.46Å; C23-V72 PolarHBondContact O-N 2.88Å; C23-V72 VanDerWaalsContact O-O 3.13Å; C23-C89 HydrophobicContact CB-CB 3.49Å; C23-C89 VanDerWaalsContact CB-CB 3.49Å; C23-C89 WeakPolarHBondContact CB-SG 3.33Å; C23-C89 WeakPolarHBondContact SG-CB 3.45Å; C23-C89 CovalentContact SG-SG 2.04Å; C23-C89 PolarHBondContact SG-SG 2.94Å
24	S	96.4	Very high	92.9	Very high	55 Å²	55	56 Å²	56	39%	0.385	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	144.1	170	-59.3	0	0	0	0	109.2	V4 Q5 L70	V4-S24 CarbonylContact C-O 3.54Å; V4-S24 VanDerWaalsContact CA-O 3.3Å; V4-S24 WeakPolarHBondContact CA-O 3.49Å; Q5-S24 PolarHBondContact N-O 3.47Å; Q5-S24 PolarHBondContact O-N 3.19Å; S24-L70 WeakPolarHBondContact CA-O 3.02Å
25	F	94.4	Very high	93	Very high	10 Å²	10	51.4 Å²	51.4	4%	0.044	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	159.8	179.4	54.1	-84.7	0	0	0	111.6	K3 V4 D27 I33 L65 L70 V91	K3-F25 WeakPolarHBondContact O-CA 3.26Å; V4-F25 HydrophobicContact CG1-CB 4.19Å; F25-D27 VanDerWaalsContact CD2-O 3.26Å; F25-D27 WeakPolarHBondContact CD2-O 3.32Å; F25-D27 WeakPolarHBondContact CE2-O 3.27Å; F25-I33 HydrophobicContact CD1-CD1 4.2Å; F25-I33 HydrophobicContact CE1-CD1 3.47Å; F25-I33 VanDerWaalsContact CE1-CD1 3.47Å; F25-I33 HydrophobicContact CZ-CD1 3.7Å; F25-L65 HydrophobicContact CE1-CD1 4.07Å; F25-L65 HydrophobicContact CZ-CD1 3.95Å; F25-L70 VanDerWaalsContact CD1-O 3.26Å; F25-L70 WeakPolarHBondContact CD1-O 3.29Å; F25-L70 HydrophobicContact CD2-CB 4.09Å; F25-L70 HydrophobicContact CD2-CD2 4.12Å; F25-L70 WeakPolarHBondContact CE1-O 3.27Å; F25-L70 HydrophobicContact CE2-CB 3.99Å; F25-L70 HydrophobicContact CE2-CD2 3.59Å; F25-L70 HydrophobicContact CE2-CG 4.4Å; F25-L70 HydrophobicContact CG-CB 4.4Å; F25-L70 HydrophobicContact CZ-CB 4.21Å; F25-L70 HydrophobicContact CZ-CD2 4.24Å; F25-L70 PolarHBondContact N-O 2.91Å; F25-L70 WeakPolarHBondContact O-CB 3.33Å; F25-V91 HydrophobicContact CB-CB 4.26Å; F25-V91 HydrophobicContact CB-CG1 3.73Å; F25-V91 HydrophobicContact CB-CG2 3.85Å; F25-V91 HydrophobicContact CD1-CG1 3.82Å; F25-V91 HydrophobicContact CD2-CG1 4.34Å; F25-V91 HydrophobicContact CG-CB 4.38Å; F25-V91 HydrophobicContact CG-CG1 3.73Å; F25-V91 HydrophobicContact CG-CG2 4.44Å
26	S	90.1	Very high	93	Very high	69 Å²	69	47.5 Å²	47.5	48%	0.483	28%	0.283	S	S	.	.	S	Bend	trans	-99.5	-19.2	-175.4	61	0	0	0	0	114.6	K3	K3-S26 PolarHBondContact N-OG 3.25Å; K3-S26 VanDerWaalsContact N-OG 3.13Å; K3-S26 PolarHBondContact O-N 3.26Å; K3-S26 VanDerWaalsContact O-N 3.16Å
27	D	85.7	Confident	93	Very high	57 Å²	57	47 Å²	47	31%	0.305	27%	0.269	S	S	.	.			trans	-104.9	114.8	-174.1	-167	-11.4	0	0	0	111.6	E2 F25 A29 S30	E2-D27 HydrophobicContact CG-CB 3.73Å; F25-D27 VanDerWaalsContact CD2-O 3.26Å; F25-D27 WeakPolarHBondContact CD2-O 3.32Å; F25-D27 WeakPolarHBondContact CE2-O 3.27Å; D27-A29 VanDerWaalsContact C-N 3.25Å; D27-A29 PolarHBondContact O-N 3.32Å; D27-A29 VanDerWaalsContact OD1-CB 3.24Å; D27-A29 WeakPolarHBondContact OD1-CB 3.5Å; D27-A29 PolarHBondContact OD1-N 2.92Å; D27-S30 PolarHBondContact O-OG 3.46Å
28	S	81.6	Confident	93	Very high	86 Å²	86	48.6 Å²	48.6	60%	0.601	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-19.9	176.2	55.5	0	0	0	0	113.5	S30 R67	S28-S30 VanDerWaalsContact C-N 3.32Å; S28-R67 PolarHBondContact O-NH1 2.92Å
29	A	83	Confident	93	Very high	72 Å²	72	46.8 Å²	46.8	60%	0.595	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.7	-177.6	0	0	0	0	0	113.2	D27 Q31	D27-A29 VanDerWaalsContact C-N 3.25Å; D27-A29 PolarHBondContact O-N 3.32Å; D27-A29 VanDerWaalsContact OD1-CB 3.24Å; D27-A29 WeakPolarHBondContact OD1-CB 3.5Å; D27-A29 PolarHBondContact OD1-N 2.92Å; A29-Q31 PolarHBondContact O-N 3.3Å; A29-Q31 VanDerWaalsContact O-N 3.16Å
30	S	79.1	Confident	93	Very high	6 Å²	6	51.7 Å²	51.7	4%	0.042	29%	0.294	C	S	.	.			trans	-55.4	119.2	177.9	-52	0	0	0	0	110.9	E2 D27 S28 R67 V91	E2-S30 PolarHBondContact OE1-OG 2.96Å; D27-S30 PolarHBondContact O-OG 3.46Å; S28-S30 VanDerWaalsContact C-N 3.32Å; S30-R67 PolarHBondContact O-NH1 2.88Å; S30-R67 PolarHBondContact O-NH2 2.9Å; S30-V91 WeakPolarHBondContact CB-OXT 3.24Å
31	Q	83.2	Confident	92.9	Very high	164 Å²	164	53.8 Å²	53.8	77%	0.766	32%	0.323	S	S	*	.			trans	-81.2	-35.2	-171.7	-64.9	-175.8	25.3	0	0	112.2	A29 R67	A29-Q31 PolarHBondContact O-N 3.3Å; A29-Q31 VanDerWaalsContact O-N 3.16Å; Q31-R67 PolarHBondContact O-NH2 2.83Å; Q31-R67 VanDerWaalsContact O-NH2 3.12Å
32	S	88.9	Confident	92.9	Very high	33 Å²	33	59.5 Å²	59.5	23%	0.231	35%	0.346	C	S	.	.			trans	-136	125.2	-171.7	66.9	0	0	0	0	111.4	W34 F51	S32-W34 PolarHBondContact OG-NE1 3.3Å; S32-F51 VanDerWaalsContact CB-CD1 3.4Å
33	I	93.6	Very high	92.8	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.8	174.1	-56.9	-175.2	0	0	0	108.6	F25 S49 I50 L65 V72 A90 V91	F25-I33 HydrophobicContact CD1-CD1 4.2Å; F25-I33 HydrophobicContact CE1-CD1 3.47Å; F25-I33 VanDerWaalsContact CE1-CD1 3.47Å; F25-I33 HydrophobicContact CZ-CD1 3.7Å; I33-S49 CarbonylContact O-C 3.55Å; I33-S49 WeakPolarHBondContact O-CA 3.39Å; I33-S49 VanDerWaalsContact O-CB 3.24Å; I33-S49 WeakPolarHBondContact O-CB 3.25Å; I33-I50 HydrophobicContact CB-CG2 4.08Å; I33-I50 PolarHBondContact N-O 2.87Å; I33-I50 PolarHBondContact O-N 2.91Å; I33-L65 HydrophobicContact CD1-CD1 3.39Å; I33-L65 HydrophobicContact CD1-CD2 3.91Å; I33-L65 HydrophobicContact CD1-CG 4.22Å; I33-V72 HydrophobicContact CD1-CB 4Å; I33-V72 HydrophobicContact CD1-CG1 4.19Å; I33-V72 HydrophobicContact CD1-CG2 4.39Å; I33-V72 HydrophobicContact CG2-CB 4.23Å; I33-V72 HydrophobicContact CG2-CG1 3.78Å; I33-V72 HydrophobicContact CG2-CG2 4.02Å; I33-A90 CarbonylContact C-O 3.59Å; I33-A90 WeakPolarHBondContact CA-O 3.4Å; I33-V91 HydrophobicContact CD1-CG1 4.21Å; I33-V91 HydrophobicContact CG1-CG1 3.96Å; I33-V91 HydrophobicContact CG2-CG1 4.2Å
34	W	96.3	Very high	92.8	Very high	82 Å²	82	62.9 Å²	62.9	31%	0.311	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.2	179.5	-69.9	84.4	0	0	0	110.9	S32 Y36 A46 S49 A90	S32-W34 PolarHBondContact OG-NE1 3.3Å; W34-Y36 HydrophobicContact CB-CD2 4.15Å; W34-Y36 HydrophobicContact CB-CE2 3.4Å; W34-Y36 VanDerWaalsContact CB-CE2 3.4Å; W34-Y36 HydrophobicContact CG-CE2 4.3Å; W34-A46 HydrophobicContact CE3-CB 3.99Å; W34-A46 HydrophobicContact CZ3-CB 3.92Å; W34-S49 VanDerWaalsContact CD2-CB 3.42Å; W34-S49 VanDerWaalsContact CE3-CB 3.49Å; W34-S49 WeakPolarHBondContact CH2-OG 3.34Å; W34-A90 PolarHBondContact N-O 2.71Å; W34-A90 PolarHBondContact O-N 2.84Å
35	W	98.2	Very high	92.9	Very high	1 Å²	1	67 Å²	67	0%	0.004	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	136.2	161	-76.4	91.5	0	0	0	109.2	L21 C23 L47 I48 V72 L74 L88 C89	L21-W35 HydrophobicContact CB-CH2 3.77Å; L21-W35 HydrophobicContact CB-CZ3 4.05Å; L21-W35 HydrophobicContact CD1-CZ3 4.27Å; C23-W35 HydrophobicContact CB-CH2 3.96Å; C23-W35 HydrophobicContact CB-CZ2 3.72Å; W35-L47 WeakPolarHBondContact O-CA 3.39Å; W35-L47 VanDerWaalsContact O-CB 3.27Å; W35-L47 WeakPolarHBondContact O-CB 3.33Å; W35-L47 PolarHBondContact O-N 3.47Å; W35-I48 HydrophobicContact CB-CG2 4.04Å; W35-I48 PolarHBondContact N-O 2.78Å; W35-I48 PolarHBondContact O-N 2.78Å; W35-V72 HydrophobicContact CZ2-CG1 4.47Å; W35-L74 HydrophobicContact CB-CD2 4.1Å; W35-L74 HydrophobicContact CD2-CB 3.68Å; W35-L74 HydrophobicContact CD2-CD2 3.84Å; W35-L74 HydrophobicContact CD2-CG 4.36Å; W35-L74 VanDerWaalsContact CE2-CB 3.5Å; W35-L74 HydrophobicContact CE3-CB 4.2Å; W35-L74 HydrophobicContact CE3-CD2 3.9Å; W35-L74 HydrophobicContact CG-CB 4.01Å; W35-L74 HydrophobicContact CG-CD2 3.93Å; W35-L74 HydrophobicContact CG-CG 4.43Å; W35-L74 HydrophobicContact CH2-CB 4.36Å; W35-L74 HydrophobicContact CZ2-CB 3.87Å; W35-L88 CarbonylContact C-O 3.6Å; W35-L88 WeakPolarHBondContact CA-O 3.33Å; W35-C89 HydrophobicContact CD2-CB 4.35Å; W35-C89 HydrophobicContact CE3-CB 4.18Å; W35-C89 HydrophobicContact CH2-CB 3.94Å; W35-C89 HydrophobicContact CZ2-CB 4.08Å; W35-C89 HydrophobicContact CZ3-CB 3.99Å
36	Y	98.3	Very high	93.1	Very high	69 Å²	69	69.6 Å²	69.6	27%	0.271	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	144.5	174.2	-62.6	-99.6	0	0	0	110	W34 P44 K45 A46 Y87 L88 A90	W34-Y36 HydrophobicContact CB-CD2 4.15Å; W34-Y36 HydrophobicContact CB-CE2 3.4Å; W34-Y36 VanDerWaalsContact CB-CE2 3.4Å; W34-Y36 HydrophobicContact CG-CE2 4.3Å; Y36-P44 HydrophobicContact CD1-CB 4.23Å; Y36-P44 HydrophobicContact CG-CB 4.41Å; Y36-K45 CarbonylContact C-O 3.51Å; Y36-K45 WeakPolarHBondContact CA-O 3.33Å; Y36-A46 HydrophobicContact CD1-CB 4.27Å; Y36-A46 HydrophobicContact CE1-CB 4.04Å; Y36-Y87 CarbonylContact O-C 3.5Å; Y36-Y87 WeakPolarHBondContact O-CA 3.39Å; Y36-L88 PolarHBondContact N-O 3.16Å; Y36-L88 PolarHBondContact O-N 2.96Å; Y36-A90 HydrophobicContact CD2-CB 4.43Å; Y36-A90 HydrophobicContact CE2-CB 3.86Å
37	Q	98.4	Very high	93.4	Very high	31 Å²	31	68.4 Å²	68.4	15%	0.145	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	131.7	171.2	-170.6	-174.5	39.3	0	0	109.2	H39 K45 L47 A85 Y87	Q37-H39 VanDerWaalsContact CD-CE1 3.48Å; Q37-H39 PolarHBondContact OE1-CE1 2.96Å; Q37-H39 VanDerWaalsContact OE1-CE1 3.32Å; Q37-K45 PolarHBondContact N-O 2.85Å; Q37-K45 PolarHBondContact O-N 2.98Å; Q37-L47 HydrophobicContact CB-CB 4.38Å; Q37-L47 HydrophobicContact CB-CD1 4.23Å; Q37-L47 HydrophobicContact CB-CD2 4.42Å; Q37-A85 HydrophobicContact CG-CB 3.49Å; Q37-A85 VanDerWaalsContact CG-CB 3.49Å; Q37-Y87 HydrophobicContact CB-CE1 4.26Å; Q37-Y87 HydrophobicContact CG-CE1 4.01Å; Q37-Y87 PolarHBondContact NE2-OH 2.87Å
38	Q	98.5	Very high	94	Very high	62 Å²	62	65.9 Å²	65.9	29%	0.29	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	105.2	179.9	-174.8	178.9	22.5	0	0	110.4	K42 P44 A85 V86	Q38-K42 VanDerWaalsContact CG-O 3.28Å; Q38-K42 WeakPolarHBondContact CG-O 3.46Å; Q38-K42 PolarHBondContact NE2-O 2.95Å; Q38-P44 HydrophobicContact CG-CG 4.45Å; Q38-A85 WeakPolarHBondContact O-CB 3.12Å; Q38-V86 HydrophobicContact CB-CB 4.28Å; Q38-V86 PolarHBondContact N-O 3.12Å; Q38-V86 PolarHBondContact O-N 3.02Å
39	H	98	Very high	94.7	Very high	63 Å²	63	62.2 Å²	62.2	29%	0.292	36%	0.363	S	S	.	.			trans	-73.9	154.4	171.1	-65.6	100	0	0	0	111.6	Q37 G41 K42 S82	Q37-H39 VanDerWaalsContact CD-CE1 3.48Å; Q37-H39 PolarHBondContact OE1-CE1 2.96Å; Q37-H39 VanDerWaalsContact OE1-CE1 3.32Å; H39-G41 PolarHBondContact O-N 3.04Å; H39-K42 HydrophobicContact CB-CB 4.45Å; H39-K42 HydrophobicContact CB-CG 4.28Å; H39-K42 WeakPolarHBondContact O-CB 3.37Å; H39-K42 PolarHBondContact O-N 3.32Å; H39-S82 PolarHBondContact NE2-O 2.93Å
40	P	96.7	Very high	95.4	Very high	117 Å²	117	59.3 Å²	59.3	76%	0.76	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	131.5	177.5	-27.6	35.2	0	0	0	113.1	K42	P40-K42 PolarHBondContact O-N 3.44Å
41	G	96.9	Very high	96.1	Very high	88 Å²	88	64.1 Å²	64.1	91%	0.907	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	9.6	-179.8	0	0	0	0	0	115.2	H39	H39-G41 PolarHBondContact O-N 3.04Å
42	K	97.1	Very high	96.5	Very high	139 Å²	139	60.6 Å²	60.6	60%	0.604	35%	0.351	S	S	*	.	S	Bend	trans	-116.4	160.5	176.2	-56	-62.3	179.9	-175	0	111	Q38 H39 P40	Q38-K42 VanDerWaalsContact CG-O 3.28Å; Q38-K42 WeakPolarHBondContact CG-O 3.46Å; Q38-K42 PolarHBondContact NE2-O 2.95Å; H39-K42 HydrophobicContact CB-CB 4.45Å; H39-K42 HydrophobicContact CB-CG 4.28Å; H39-K42 WeakPolarHBondContact O-CB 3.37Å; H39-K42 PolarHBondContact O-N 3.32Å; P40-K42 PolarHBondContact O-N 3.44Å
43	G	96.9	Very high	96.8	Very high	47 Å²	47	63.7 Å²	63.7	49%	0.485	37%	0.365	S	S	.	.			trans	-75.8	160.6	170.2	0	0	0	0	0	112.1
44	P	98	Very high	96.9	Very high	69 Å²	69	65.1 Å²	65.1	45%	0.448	38%	0.38	S	S	.	.			trans	-60.2	135	173.7	-20.5	32.5	0	0	0	111.6	Y36 Q38 L88	Y36-P44 HydrophobicContact CD1-CB 4.23Å; Y36-P44 HydrophobicContact CG-CB 4.41Å; Q38-P44 HydrophobicContact CG-CG 4.45Å; P44-L88 HydrophobicContact CB-CD1 4.3Å; P44-L88 HydrophobicContact CG-CD1 4Å
45	K	98.2	Very high	97	Very high	141 Å²	141	66.1 Å²	66.1	61%	0.613	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.1	173.7	-68.2	-176.2	177.8	-178.7	0	109.9	Y36 Q37 L47	Y36-K45 CarbonylContact C-O 3.51Å; Y36-K45 WeakPolarHBondContact CA-O 3.33Å; Q37-K45 PolarHBondContact N-O 2.85Å; Q37-K45 PolarHBondContact O-N 2.98Å; K45-L47 PolarHBondContact O-N 2.97Å
46	A	97.5	Very high	96.9	Very high	64 Å²	64	69.7 Å²	69.7	53%	0.529	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	125.5	175.4	0	0	0	0	0	109.5	W34 Y36	W34-A46 HydrophobicContact CE3-CB 3.99Å; W34-A46 HydrophobicContact CZ3-CB 3.92Å; Y36-A46 HydrophobicContact CD1-CB 4.27Å; Y36-A46 HydrophobicContact CE1-CB 4.04Å
47	L	97.8	Very high	96.9	Very high	44 Å²	44	73 Å²	73	23%	0.23	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-57.9	-176.3	-177.4	69.7	0	0	0	110.8	W35 Q37 K45 L61 L74 Y87	W35-L47 WeakPolarHBondContact O-CA 3.39Å; W35-L47 VanDerWaalsContact O-CB 3.27Å; W35-L47 WeakPolarHBondContact O-CB 3.33Å; W35-L47 PolarHBondContact O-N 3.47Å; Q37-L47 HydrophobicContact CB-CB 4.38Å; Q37-L47 HydrophobicContact CB-CD1 4.23Å; Q37-L47 HydrophobicContact CB-CD2 4.42Å; K45-L47 PolarHBondContact O-N 2.97Å; L47-L61 HydrophobicContact CD1-CD1 3.68Å; L47-L61 HydrophobicContact CD2-CD1 3.99Å; L47-L61 HydrophobicContact CD2-CD2 4.44Å; L47-L61 HydrophobicContact CG-CD1 3.64Å; L47-L74 HydrophobicContact CD2-CD2 3.77Å; L47-Y87 HydrophobicContact CD2-CD1 3.94Å; L47-Y87 HydrophobicContact CD2-CE1 3.6Å
48	I	98.1	Very high	96.9	Very high	4 Å²	4	76.7 Å²	76.7	2%	0.021	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	145.9	-178.9	-176.3	163.6	0	0	0	109.4	W35 K56 E58 L61 V63 L74	W35-I48 HydrophobicContact CB-CG2 4.04Å; W35-I48 PolarHBondContact N-O 2.78Å; W35-I48 PolarHBondContact O-N 2.78Å; I48-K56 HydrophobicContact CD1-CD 4.34Å; I48-K56 HydrophobicContact CD1-CG 4.4Å; I48-K56 HydrophobicContact CG1-CD 4.27Å; I48-E58 HydrophobicContact CD1-CB 3.83Å; I48-L61 HydrophobicContact CD1-CB 4.36Å; I48-L61 HydrophobicContact CG2-CD1 4.48Å; I48-V63 HydrophobicContact CB-CG2 4.31Å; I48-V63 HydrophobicContact CD1-CG2 3.95Å; I48-V63 HydrophobicContact CG1-CG2 3.99Å; I48-V63 HydrophobicContact CG2-CG2 3.41Å; I48-V63 VanDerWaalsContact CG2-CG2 3.41Å; I48-L74 HydrophobicContact CG2-CD1 3.88Å
49	S	96.8	Very high	96.8	Very high	10 Å²	10	76.9 Å²	76.9	7%	0.07	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	153.6	175.9	59.9	0	0	0	0	113.1	I33 W34 K56	I33-S49 CarbonylContact O-C 3.55Å; I33-S49 WeakPolarHBondContact O-CA 3.39Å; I33-S49 VanDerWaalsContact O-CB 3.24Å; I33-S49 WeakPolarHBondContact O-CB 3.25Å; W34-S49 VanDerWaalsContact CD2-CB 3.42Å; W34-S49 VanDerWaalsContact CE3-CB 3.49Å; W34-S49 WeakPolarHBondContact CH2-OG 3.34Å; S49-K56 WeakPolarHBondContact O-CD 3.48Å; S49-K56 PolarHBondContact O-NZ 3.2Å
50	I	96.8	Very high	96.8	Very high	10 Å²	10	77 Å²	77	5%	0.051	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	142.9	178.2	-168.9	164.9	0	0	0	109.9	I33 S52 K56 V63 L65 V72	I33-I50 HydrophobicContact CB-CG2 4.08Å; I33-I50 PolarHBondContact N-O 2.87Å; I33-I50 PolarHBondContact O-N 2.91Å; I50-S52 WeakPolarHBondContact CG1-O 3.13Å; I50-K56 HydrophobicContact CD1-CB 4.01Å; I50-K56 HydrophobicContact CG1-CB 4.33Å; I50-V63 HydrophobicContact CB-CG1 4.17Å; I50-V63 HydrophobicContact CD1-CG1 4.4Å; I50-V63 HydrophobicContact CG2-CB 4.48Å; I50-V63 HydrophobicContact CG2-CG1 3.55Å; I50-L65 HydrophobicContact CD1-CB 3.85Å; I50-L65 HydrophobicContact CG1-CB 4.29Å; I50-L65 HydrophobicContact CG1-CD2 4.41Å; I50-L65 HydrophobicContact CG2-CB 3.94Å; I50-L65 HydrophobicContact CG2-CD2 4.02Å; I50-V72 HydrophobicContact CG2-CG2 4.39Å
51	F	93	Very high	96.9	Very high	108 Å²	108	72.7 Å²	72.7	47%	0.474	43%	0.427	S	S	.	.			trans	-118.3	-48.7	-177	-54.6	-92.3	0	0	0	110.6	S32 R67	S32-F51 VanDerWaalsContact CB-CD1 3.4Å; F51-R67 PolarHBondContact O-NE 3.24Å; F51-R67 VanDerWaalsContact O-NE 3.14Å; F51-R67 PolarHBondContact O-NH2 3.03Å
52	S	92.1	Very high	96.9	Very high	90 Å²	90	68.7 Å²	68.7	63%	0.629	39%	0.385	S	S	*	.	S	Bend	trans	-85.7	148.2	-178.9	-55.2	0	0	0	0	111.9	I50	I50-S52 WeakPolarHBondContact CG1-O 3.13Å
53	N	94.8	Very high	97	Very high	97 Å²	97	62.1 Å²	62.1	52%	0.519	36%	0.356	S	S	.	.	S	Bend	trans	-56.1	143	169.6	-167.3	73	0	0	0	110.7	L65 N66 R67	N53-L65 PolarHBondContact OD1-O 2.87Å; N53-L65 VanDerWaalsContact OD1-O 3.14Å; N53-N66 VanDerWaalsContact OD1-CA 3.29Å; N53-N66 WeakPolarHBondContact OD1-CA 3.49Å; N53-R67 HydrophobicContact CB-CG 4.37Å; N53-R67 PolarHBondContact OD1-N 3.35Å
54	G	96.7	Very high	97.1	Very high	31 Å²	31	64.1 Å²	64.1	32%	0.32	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	119.6	-141.9	-175.9	0	0	0	0	0	111.5	Y64 L65	G54-Y64 CarbonylContact O-C 3.6Å; G54-L65 PolarHBondContact N-O 2.83Å; G54-L65 PolarHBondContact O-N 2.87Å
55	N	97.6	Very high	97	Very high	103 Å²	103	61.1 Å²	61.1	55%	0.551	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.7	-178.6	68.9	-67.3	0	0	0	112.5	T62 V63 Y64	N55-T62 HydrophobicContact CB-CG2 4.42Å; N55-V63 CarbonylContact C-O 3.53Å; N55-V63 WeakPolarHBondContact CA-O 2.97Å; N55-V63 WeakPolarHBondContact CB-O 3.43Å; N55-Y64 HydrophobicContact CB-CD1 3.52Å; N55-Y64 HydrophobicContact CB-CE1 3.78Å; N55-Y64 HydrophobicContact CB-CG 4.2Å
56	K	97.8	Very high	96.9	Very high	77 Å²	77	57.8 Å²	57.8	34%	0.335	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130.2	171.9	-177.5	-175.3	171.8	-178.2	0	108.5	I48 S49 I50 T62 V63	I48-K56 HydrophobicContact CD1-CD 4.34Å; I48-K56 HydrophobicContact CD1-CG 4.4Å; I48-K56 HydrophobicContact CG1-CD 4.27Å; S49-K56 WeakPolarHBondContact O-CD 3.48Å; S49-K56 PolarHBondContact O-NZ 3.2Å; I50-K56 HydrophobicContact CD1-CB 4.01Å; I50-K56 HydrophobicContact CG1-CB 4.33Å; K56-T62 CarbonylContact O-C 3.51Å; K56-T62 WeakPolarHBondContact O-CA 2.98Å; K56-V63 PolarHBondContact N-O 2.81Å; K56-V63 PolarHBondContact O-N 3.33Å
57	K	97.9	Very high	96.7	Very high	139 Å²	139	58 Å²	58	60%	0.604	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.5	177.9	-176.7	179.7	-179.7	-167.5	0	109.9	G59 L61 T62	K57-G59 WeakPolarHBondContact CE-O 3.41Å; K57-L61 WeakPolarHBondContact CA-O 3.4Å; K57-L61 WeakPolarHBondContact CG-O 3.48Å; K57-T62 HydrophobicContact CB-CG2 4.28Å
58	E	97.3	Very high	96.5	Very high	108 Å²	108	60.6 Å²	60.6	51%	0.505	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	104.7	175.5	-165	163.8	172.2	0	0	108.9	I48 R60 L61	I48-E58 HydrophobicContact CD1-CB 3.83Å; E58-R60 PolarHBondContact O-N 2.77Å; E58-L61 PolarHBondContact N-O 2.91Å; E58-L61 WeakPolarHBondContact O-CB 3.3Å; E58-L61 PolarHBondContact O-N 2.82Å
59	G	96.9	Very high	96.3	Very high	66 Å²	66	63.5 Å²	63.5	68%	0.68	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	-120.9	-172.5	0	0	0	0	0	112.6	K57 L61	K57-G59 WeakPolarHBondContact CE-O 3.41Å; G59-L61 VanDerWaalsContact C-N 3.32Å
60	R	97.6	Very high	96.2	Very high	66 Å²	66	65.3 Å²	65.3	25%	0.249	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-13.5	178.1	-65.7	-171	-62.5	117.1	2.4	113.4	E58 K77 D78 D83	E58-R60 PolarHBondContact O-N 2.77Å; R60-K77 WeakPolarHBondContact CB-O 3.17Å; R60-K77 WeakPolarHBondContact CD-O 3.26Å; R60-K77 PolarHBondContact NH1-O 3.01Å; R60-K77 PolarHBondContact O-N 3.01Å; R60-D78 PolarHBondContact NH1-O 2.99Å; R60-D83 IonicContact CZ-OD1 3.75Å; R60-D83 IonicContact CZ-OD2 3.48Å; R60-D83 IonicContact NH1-OD1 3.71Å; R60-D83 IonicContact NH1-OD2 2.71Å; R60-D83 PolarHBondContact NH1-OD2 3.45Å; R60-D83 IonicContact NH2-OD1 2.84Å; R60-D83 PolarHBondContact NH2-OD1 2.81Å; R60-D83 IonicContact NH2-OD2 3.3Å; R60-D83 PolarHBondContact NH2-OD2 3.22Å
61	L	98.4	Very high	96.2	Very high	26 Å²	26	67.2 Å²	67.2	14%	0.136	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	140	-177.4	-53.2	175.9	0	0	0	110.5	L47 I48 K57 E58 G59 L74 H75 I76	L47-L61 HydrophobicContact CD1-CD1 3.68Å; L47-L61 HydrophobicContact CD2-CD1 3.99Å; L47-L61 HydrophobicContact CD2-CD2 4.44Å; L47-L61 HydrophobicContact CG-CD1 3.64Å; I48-L61 HydrophobicContact CD1-CB 4.36Å; I48-L61 HydrophobicContact CG2-CD1 4.48Å; K57-L61 WeakPolarHBondContact CA-O 3.4Å; K57-L61 WeakPolarHBondContact CG-O 3.48Å; E58-L61 PolarHBondContact N-O 2.91Å; E58-L61 WeakPolarHBondContact O-CB 3.3Å; E58-L61 PolarHBondContact O-N 2.82Å; G59-L61 VanDerWaalsContact C-N 3.32Å; L61-L74 HydrophobicContact CB-CD1 4.37Å; L61-L74 HydrophobicContact CD2-CD1 4.4Å; L61-H75 CarbonylContact C-O 3.58Å; L61-H75 WeakPolarHBondContact CA-O 3.19Å; L61-I76 HydrophobicContact CD2-CB 4.17Å; L61-I76 HydrophobicContact CD2-CD1 4.15Å; L61-I76 HydrophobicContact CD2-CG1 3.67Å; L61-I76 HydrophobicContact CD2-CG2 3.91Å
62	T	98.5	Very high	96.4	Very high	4 Å²	4	62.1 Å²	62.1	3%	0.025	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	125.1	167	-51	0	0	0	0	109.2	N55 K56 K57 Y64 H75	N55-T62 HydrophobicContact CB-CG2 4.42Å; K56-T62 CarbonylContact O-C 3.51Å; K56-T62 WeakPolarHBondContact O-CA 2.98Å; K57-T62 HydrophobicContact CB-CG2 4.28Å; T62-Y64 HydrophobicContact CG2-CD2 4.15Å; T62-Y64 HydrophobicContact CG2-CE1 4.12Å; T62-Y64 HydrophobicContact CG2-CE2 3.45Å; T62-Y64 VanDerWaalsContact CG2-CE2 3.45Å; T62-Y64 VanDerWaalsContact CG2-CZ 3.43Å; T62-H75 PolarHBondContact N-O 3.42Å; T62-H75 WeakPolarHBondContact O-CB 3.43Å; T62-H75 PolarHBondContact O-N 2.96Å
63	V	98.3	Very high	96.7	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.4	172.1	179.8	0	0	0	0	108.7	I48 I50 N55 K56 V72 S73 L74	I48-V63 HydrophobicContact CB-CG2 4.31Å; I48-V63 HydrophobicContact CD1-CG2 3.95Å; I48-V63 HydrophobicContact CG1-CG2 3.99Å; I48-V63 HydrophobicContact CG2-CG2 3.41Å; I48-V63 VanDerWaalsContact CG2-CG2 3.41Å; I50-V63 HydrophobicContact CB-CG1 4.17Å; I50-V63 HydrophobicContact CD1-CG1 4.4Å; I50-V63 HydrophobicContact CG2-CB 4.48Å; I50-V63 HydrophobicContact CG2-CG1 3.55Å; N55-V63 CarbonylContact C-O 3.53Å; N55-V63 WeakPolarHBondContact CA-O 2.97Å; N55-V63 WeakPolarHBondContact CB-O 3.43Å; K56-V63 PolarHBondContact N-O 2.81Å; K56-V63 PolarHBondContact O-N 3.33Å; V63-V72 HydrophobicContact CG1-CG2 3.41Å; V63-V72 VanDerWaalsContact CG1-CG2 3.41Å; V63-S73 CarbonylContact C-O 3.59Å; V63-S73 VanDerWaalsContact CA-O 3.25Å; V63-S73 WeakPolarHBondContact CA-O 3.49Å; V63-L74 HydrophobicContact CG2-CD1 3.75Å
64	Y	98.2	Very high	96.9	Very high	90 Å²	90	53.7 Å²	53.7	35%	0.353	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.1	172.9	-60	-94	0	0	0	108.6	G54 N55 T62 V72 S73 H75	G54-Y64 CarbonylContact O-C 3.6Å; N55-Y64 HydrophobicContact CB-CD1 3.52Å; N55-Y64 HydrophobicContact CB-CE1 3.78Å; N55-Y64 HydrophobicContact CB-CG 4.2Å; T62-Y64 HydrophobicContact CG2-CD2 4.15Å; T62-Y64 HydrophobicContact CG2-CE1 4.12Å; T62-Y64 HydrophobicContact CG2-CE2 3.45Å; T62-Y64 VanDerWaalsContact CG2-CE2 3.45Å; T62-Y64 VanDerWaalsContact CG2-CZ 3.43Å; Y64-V72 CarbonylContact O-C 3.53Å; Y64-V72 WeakPolarHBondContact O-CA 3.34Å; Y64-V72 WeakPolarHBondContact O-CG2 3.28Å; Y64-S73 PolarHBondContact N-O 2.84Å; Y64-S73 PolarHBondContact O-N 3.38Å; Y64-H75 AromaticContact CD2-CD2 3.84Å; Y64-H75 AromaticContact CD2-CG 3.97Å; Y64-H75 AromaticContact CD2-NE2 3.86Å; Y64-H75 HydrophobicContact CE2-CB 4.11Å; Y64-H75 AromaticContact CE2-CE1 3.85Å; Y64-H75 AromaticContact CE2-CG 3.65Å; Y64-H75 AromaticContact CE2-ND1 3.52Å
65	L	96.9	Very high	97	Very high	5 Å²	5	53.8 Å²	53.8	3%	0.026	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	121.6	176.1	170.8	53	0	0	0	109.6	F25 I33 I50 N53 G54 R67 V72	F25-L65 HydrophobicContact CE1-CD1 4.07Å; F25-L65 HydrophobicContact CZ-CD1 3.95Å; I33-L65 HydrophobicContact CD1-CD1 3.39Å; I33-L65 HydrophobicContact CD1-CD2 3.91Å; I33-L65 HydrophobicContact CD1-CG 4.22Å; I50-L65 HydrophobicContact CD1-CB 3.85Å; I50-L65 HydrophobicContact CG1-CB 4.29Å; I50-L65 HydrophobicContact CG1-CD2 4.41Å; I50-L65 HydrophobicContact CG2-CB 3.94Å; I50-L65 HydrophobicContact CG2-CD2 4.02Å; N53-L65 PolarHBondContact OD1-O 2.87Å; N53-L65 VanDerWaalsContact OD1-O 3.14Å; G54-L65 PolarHBondContact N-O 2.83Å; G54-L65 PolarHBondContact O-N 2.87Å; L65-R67 HydrophobicContact CD1-CG 4.06Å; L65-R67 HydrophobicContact CD2-CG 4.07Å; L65-R67 HydrophobicContact CG-CG 4.01Å; L65-V72 HydrophobicContact CB-CG2 4.45Å; L65-V72 HydrophobicContact CD1-CB 4.33Å
66	N	96	Very high	97	Very high	72 Å²	72	49 Å²	49	39%	0.385	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	102.7	165	-174.6	-16.6	0	0	0	109.7	N53 A68 S69 L70 H71	N53-N66 VanDerWaalsContact OD1-CA 3.29Å; N53-N66 WeakPolarHBondContact OD1-CA 3.49Å; N66-A68 VanDerWaalsContact C-N 3.35Å; N66-A68 WeakPolarHBondContact OD1-CB 3.34Å; N66-A68 PolarHBondContact OD1-N 2.87Å; N66-S69 WeakPolarHBondContact CB-OG 3.41Å; N66-S69 PolarHBondContact ND2-OG 2.8Å; N66-S69 PolarHBondContact O-N 2.04Å; N66-S69 PolarHBondContact O-OG 2.83Å; N66-S69 PolarHBondContact OD1-N 2.95Å; N66-L70 PolarHBondContact O-N 3.37Å; N66-L70 VanDerWaalsContact O-N 3.11Å; N66-H71 PolarHBondContact N-O 2.8Å; N66-H71 PolarHBondContact O-N 3.14Å
67	R	92.5	Very high	97.1	Very high	68 Å²	68	49.9 Å²	49.9	26%	0.257	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-30.3	178.9	-73.3	-171.8	168.2	-87.5	-1.8	112.7	S28 S30 Q31 F51 N53 L65 S69 L70	S28-R67 PolarHBondContact O-NH1 2.92Å; S30-R67 PolarHBondContact O-NH1 2.88Å; S30-R67 PolarHBondContact O-NH2 2.9Å; Q31-R67 PolarHBondContact O-NH2 2.83Å; Q31-R67 VanDerWaalsContact O-NH2 3.12Å; F51-R67 PolarHBondContact O-NE 3.24Å; F51-R67 VanDerWaalsContact O-NE 3.14Å; F51-R67 PolarHBondContact O-NH2 3.03Å; N53-R67 HydrophobicContact CB-CG 4.37Å; N53-R67 PolarHBondContact OD1-N 3.35Å; L65-R67 HydrophobicContact CD1-CG 4.06Å; L65-R67 HydrophobicContact CD2-CG 4.07Å; L65-R67 HydrophobicContact CG-CG 4.01Å; R67-S69 VanDerWaalsContact C-N 3.3Å; R67-S69 PolarHBondContact O-N 2.9Å; R67-L70 WeakPolarHBondContact O-CD2 3.11Å; R67-L70 PolarHBondContact O-N 2.85Å
68	A	93.8	Very high	97.1	Very high	99 Å²	99	47.3 Å²	47.3	82%	0.818	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-33.5	178.6	0	0	0	0	0	111.8	N66	N66-A68 VanDerWaalsContact C-N 3.35Å; N66-A68 WeakPolarHBondContact OD1-CB 3.34Å; N66-A68 PolarHBondContact OD1-N 2.87Å
69	S	95.1	Very high	97.1	Very high	65 Å²	65	42.4 Å²	42.4	46%	0.455	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	6.4	176.1	68.9	0	0	0	0	113.9	N66 R67 H71	N66-S69 WeakPolarHBondContact CB-OG 3.41Å; N66-S69 PolarHBondContact ND2-OG 2.8Å; N66-S69 PolarHBondContact O-N 2.04Å; N66-S69 PolarHBondContact O-OG 2.83Å; N66-S69 PolarHBondContact OD1-N 2.95Å; R67-S69 VanDerWaalsContact C-N 3.3Å; R67-S69 PolarHBondContact O-N 2.9Å; S69-H71 PolarHBondContact O-N 2.78Å; S69-H71 VanDerWaalsContact O-N 3.17Å; S69-H71 WeakPolarHBondContact OG-CB 3.42Å
70	L	94.7	Very high	97.1	Very high	47 Å²	47	42.8 Å²	42.8	25%	0.246	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.8	46.3	-174.8	-54.8	174.2	0	0	0	113.1	S24 F25 N66 R67	S24-L70 WeakPolarHBondContact CA-O 3.02Å; F25-L70 VanDerWaalsContact CD1-O 3.26Å; F25-L70 WeakPolarHBondContact CD1-O 3.29Å; F25-L70 HydrophobicContact CD2-CB 4.09Å; F25-L70 HydrophobicContact CD2-CD2 4.12Å; F25-L70 WeakPolarHBondContact CE1-O 3.27Å; F25-L70 HydrophobicContact CE2-CB 3.99Å; F25-L70 HydrophobicContact CE2-CD2 3.59Å; F25-L70 HydrophobicContact CE2-CG 4.4Å; F25-L70 HydrophobicContact CG-CB 4.4Å; F25-L70 HydrophobicContact CZ-CB 4.21Å; F25-L70 HydrophobicContact CZ-CD2 4.24Å; F25-L70 PolarHBondContact N-O 2.91Å; F25-L70 WeakPolarHBondContact O-CB 3.33Å; N66-L70 PolarHBondContact O-N 3.37Å; N66-L70 VanDerWaalsContact O-N 3.11Å; R67-L70 WeakPolarHBondContact O-CD2 3.11Å; R67-L70 PolarHBondContact O-N 2.85Å
71	H	96.7	Very high	97.1	Very high	51 Å²	51	43.9 Å²	43.9	24%	0.236	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.4	-173.5	-178.6	-100.8	0	0	0	110.8	N22 N66 S69	N22-H71 PolarHBondContact OD1-CE1 2.83Å; N22-H71 PolarHBondContact OD1-NE2 3.06Å; N66-H71 PolarHBondContact N-O 2.8Å; N66-H71 PolarHBondContact O-N 3.14Å; S69-H71 PolarHBondContact O-N 2.78Å; S69-H71 VanDerWaalsContact O-N 3.17Å; S69-H71 WeakPolarHBondContact OG-CB 3.42Å
72	V	97.2	Very high	97	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.4	171.9	65.5	0	0	0	0	109.8	C23 I33 W35 I50 V63 Y64 L65	C23-V72 HydrophobicContact CB-CG1 3.55Å; C23-V72 PolarHBondContact N-O 2.86Å; C23-V72 WeakPolarHBondContact O-CG1 3.46Å; C23-V72 PolarHBondContact O-N 2.88Å; C23-V72 VanDerWaalsContact O-O 3.13Å; I33-V72 HydrophobicContact CD1-CB 4Å; I33-V72 HydrophobicContact CD1-CG1 4.19Å; I33-V72 HydrophobicContact CD1-CG2 4.39Å; I33-V72 HydrophobicContact CG2-CB 4.23Å; I33-V72 HydrophobicContact CG2-CG1 3.78Å; I33-V72 HydrophobicContact CG2-CG2 4.02Å; W35-V72 HydrophobicContact CZ2-CG1 4.47Å; I50-V72 HydrophobicContact CG2-CG2 4.39Å; V63-V72 HydrophobicContact CG1-CG2 3.41Å; V63-V72 VanDerWaalsContact CG1-CG2 3.41Å; Y64-V72 CarbonylContact O-C 3.53Å; Y64-V72 WeakPolarHBondContact O-CA 3.34Å; Y64-V72 WeakPolarHBondContact O-CG2 3.28Å; L65-V72 HydrophobicContact CB-CG2 4.45Å; L65-V72 HydrophobicContact CD1-CB 4.33Å
73	S	98.2	Very high	96.9	Very high	10 Å²	10	46.8 Å²	46.8	7%	0.07	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	143.1	171	66.5	0	0	0	0	111.6	L21 V63 Y64 H75	L21-S73 CarbonylContact O-C 3.52Å; L21-S73 WeakPolarHBondContact O-CA 3.21Å; L21-S73 WeakPolarHBondContact O-CB 3.27Å; V63-S73 CarbonylContact C-O 3.59Å; V63-S73 VanDerWaalsContact CA-O 3.25Å; V63-S73 WeakPolarHBondContact CA-O 3.49Å; Y64-S73 PolarHBondContact N-O 2.84Å; Y64-S73 PolarHBondContact O-N 3.38Å; S73-H75 PolarHBondContact OG-CD2 3.26Å; S73-H75 PolarHBondContact OG-NE2 3.47Å
74	L	98.7	Very high	96.9	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.6	169.6	171.3	66.1	0	0	0	108.7	L21 W35 L47 I48 L61 V63 I76 Y87	L21-L74 HydrophobicContact CB-CB 4.46Å; L21-L74 HydrophobicContact CD1-CD2 4.36Å; L21-L74 PolarHBondContact N-O 3.11Å; L21-L74 PolarHBondContact O-N 3.32Å; W35-L74 HydrophobicContact CB-CD2 4.1Å; W35-L74 HydrophobicContact CD2-CB 3.68Å; W35-L74 HydrophobicContact CD2-CD2 3.84Å; W35-L74 HydrophobicContact CD2-CG 4.36Å; W35-L74 VanDerWaalsContact CE2-CB 3.5Å; W35-L74 HydrophobicContact CE3-CB 4.2Å; W35-L74 HydrophobicContact CE3-CD2 3.9Å; W35-L74 HydrophobicContact CG-CB 4.01Å; W35-L74 HydrophobicContact CG-CD2 3.93Å; W35-L74 HydrophobicContact CG-CG 4.43Å; W35-L74 HydrophobicContact CH2-CB 4.36Å; W35-L74 HydrophobicContact CZ2-CB 3.87Å; L47-L74 HydrophobicContact CD2-CD2 3.77Å; I48-L74 HydrophobicContact CG2-CD1 3.88Å; L61-L74 HydrophobicContact CB-CD1 4.37Å; L61-L74 HydrophobicContact CD2-CD1 4.4Å; V63-L74 HydrophobicContact CG2-CD1 3.75Å; L74-I76 HydrophobicContact CG-CG1 4.31Å; L74-Y87 HydrophobicContact CD2-CD1 3.75Å; L74-Y87 HydrophobicContact CD2-CE1 4.1Å
75	H	98.6	Very high	96.9	Very high	33 Å²	33	48.1 Å²	48.1	15%	0.153	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.1	178.1	-68.6	-152.2	0	0	0	108.9	M18 V19 S20 L61 T62 Y64 S73	M18-H75 HydrophobicContact CE-CB 3.97Å; M18-H75 WeakPolarHBondContact CE-ND1 3.26Å; V19-H75 CarbonylContact O-C 3.6Å; V19-H75 VanDerWaalsContact O-CA 3.26Å; V19-H75 WeakPolarHBondContact O-CA 3.43Å; S20-H75 PolarHBondContact OG-NE2 3.2Å; L61-H75 CarbonylContact C-O 3.58Å; L61-H75 WeakPolarHBondContact CA-O 3.19Å; T62-H75 PolarHBondContact N-O 3.42Å; T62-H75 WeakPolarHBondContact O-CB 3.43Å; T62-H75 PolarHBondContact O-N 2.96Å; Y64-H75 AromaticContact CD2-CD2 3.84Å; Y64-H75 AromaticContact CD2-CG 3.97Å; Y64-H75 AromaticContact CD2-NE2 3.86Å; Y64-H75 HydrophobicContact CE2-CB 4.11Å; Y64-H75 AromaticContact CE2-CE1 3.85Å; Y64-H75 AromaticContact CE2-CG 3.65Å; Y64-H75 AromaticContact CE2-ND1 3.52Å; S73-H75 PolarHBondContact OG-CD2 3.26Å; S73-H75 PolarHBondContact OG-NE2 3.47Å
76	I	98.5	Very high	96.9	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	115.7	176.4	-45.6	-179.1	0	0	0	106.9	M18 V19 L61 L74 Y87	M18-I76 CarbonylContact C-O 3.56Å; M18-I76 WeakPolarHBondContact CA-O 3.34Å; V19-I76 HydrophobicContact CB-CB 4.14Å; V19-I76 HydrophobicContact CB-CG1 4.47Å; V19-I76 HydrophobicContact CG1-CD1 4.44Å; V19-I76 HydrophobicContact CG1-CG1 4.46Å; V19-I76 PolarHBondContact N-O 3.08Å; V19-I76 PolarHBondContact O-N 3.47Å; L61-I76 HydrophobicContact CD2-CB 4.17Å; L61-I76 HydrophobicContact CD2-CD1 4.15Å; L61-I76 HydrophobicContact CD2-CG1 3.67Å; L61-I76 HydrophobicContact CD2-CG2 3.91Å; L74-I76 HydrophobicContact CG-CG1 4.31Å; I76-Y87 HydrophobicContact CD1-CD1 4.49Å; I76-Y87 HydrophobicContact CD1-CE1 3.6Å; I76-Y87 HydrophobicContact CD1-CE2 4.32Å; I76-Y87 WeakPolarHBondContact CD1-OH 3.44Å
77	K	98.2	Very high	97	Very high	96 Å²	96	49.6 Å²	49.6	42%	0.417	29%	0.292	S	S	.	.			trans	-88.6	155.7	175.7	-65.7	-172.5	175.9	-169.1	0	110.5	M18 R60 S79	M18-K77 HydrophobicContact CG-CG 4.43Å; M18-K77 HydrophobicContact SD-CG 4.2Å; R60-K77 WeakPolarHBondContact CB-O 3.17Å; R60-K77 WeakPolarHBondContact CD-O 3.26Å; R60-K77 PolarHBondContact NH1-O 3.01Å; R60-K77 PolarHBondContact O-N 3.01Å; K77-S79 PolarHBondContact O-N 3.17Å
78	D	98.1	Very high	97.3	Very high	86 Å²	86	49.1 Å²	49.1	46%	0.46	29%	0.294	S	S	.	.	S	Bend	trans	52.1	57.9	173.6	-179.6	47.8	0	0	0	110.5	A17 R60 Q80	A17-D78 PolarHBondContact O-N 2.84Å; R60-D78 PolarHBondContact NH1-O 2.99Å; D78-Q80 PolarHBondContact O-N 3.13Å
79	S	98	Very high	97.4	Very high	5 Å²	5	44.9 Å²	44.9	4%	0.035	26%	0.258	C	S	.	.			trans	-56.1	133.2	-173.6	-71.4	0	0	0	0	111.8	E15 G16 A17 V19 K77 D83	E15-S79 CarbonylContact C-O 3.45Å; E15-S79 WeakPolarHBondContact CA-O 3.35Å; E15-S79 WeakPolarHBondContact CG-O 3.15Å; G16-S79 PolarHBondContact N-O 3.43Å; A17-S79 WeakPolarHBondContact O-CB 3.38Å; A17-S79 PolarHBondContact O-N 2.82Å; A17-S79 PolarHBondContact O-OG 3.16Å; A17-S79 VanDerWaalsContact O-OG 3.08Å; V19-S79 WeakPolarHBondContact CG2-OG 3.05Å; K77-S79 PolarHBondContact O-N 3.17Å; S79-D83 WeakPolarHBondContact CA-OD2 3.35Å
80	Q	97.9	Very high	97.4	Very high	74 Å²	74	43.6 Å²	43.6	35%	0.346	25%	0.252	S	S	.	.			trans	-117.6	156.7	-178.1	-68.6	173.5	11.2	0	0	110.4	D78 S82 D83	D78-Q80 PolarHBondContact O-N 3.13Å; Q80-S82 PolarHBondContact O-N 2.97Å; Q80-D83 PolarHBondContact N-OD2 3.38Å; Q80-D83 VanDerWaalsContact O-CB 3.29Å; Q80-D83 WeakPolarHBondContact O-CB 3.43Å; Q80-D83 PolarHBondContact O-N 3.02Å
81	P	96.6	Very high	97.1	Very high	88 Å²	88	43.1 Å²	43.1	57%	0.571	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-52.5	-33.3	177	-29.2	35.9	0	0	0	114.1	D83 S84	P81-D83 PolarHBondContact O-N 2.8Å; P81-S84 WeakPolarHBondContact O-CB 3.24Å; P81-S84 PolarHBondContact O-N 2.8Å; P81-S84 PolarHBondContact O-OG 3.14Å
82	S	96.1	Very high	97.1	Very high	68 Å²	68	42.8 Å²	42.8	48%	0.476	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-66	-17.2	176.8	58.1	0	0	0	0	114.8	H39 Q80 S84	H39-S82 PolarHBondContact NE2-O 2.93Å; Q80-S82 PolarHBondContact O-N 2.97Å; S82-S84 PolarHBondContact O-N 2.77Å
83	D	97.5	Very high	97.1	Very high	24 Å²	24	45 Å²	45	13%	0.128	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-78	-9	177.1	-57.4	-28.4	0	0	0	111.8	R60 S79 Q80 P81 A85 Y87	R60-D83 IonicContact CZ-OD1 3.75Å; R60-D83 IonicContact CZ-OD2 3.48Å; R60-D83 IonicContact NH1-OD1 3.71Å; R60-D83 IonicContact NH1-OD2 2.71Å; R60-D83 PolarHBondContact NH1-OD2 3.45Å; R60-D83 IonicContact NH2-OD1 2.84Å; R60-D83 PolarHBondContact NH2-OD1 2.81Å; R60-D83 IonicContact NH2-OD2 3.3Å; R60-D83 PolarHBondContact NH2-OD2 3.22Å; S79-D83 WeakPolarHBondContact CA-OD2 3.35Å; Q80-D83 PolarHBondContact N-OD2 3.38Å; Q80-D83 VanDerWaalsContact O-CB 3.29Å; Q80-D83 WeakPolarHBondContact O-CB 3.43Å; Q80-D83 PolarHBondContact O-N 3.02Å; P81-D83 PolarHBondContact O-N 2.8Å; D83-A85 PolarHBondContact O-N 3.27Å; D83-Y87 VanDerWaalsContact O-CE2 3.27Å; D83-Y87 WeakPolarHBondContact O-CE2 3.42Å; D83-Y87 PolarHBondContact O-OH 2.81Å
84	S	97.6	Very high	97	Very high	87 Å²	87	46.9 Å²	46.9	61%	0.608	28%	0.276	S	S	*	.			trans	-65.8	100.7	176.8	-54.5	0	0	0	0	111	P81 S82	P81-S84 WeakPolarHBondContact O-CB 3.24Å; P81-S84 PolarHBondContact O-N 2.8Å; P81-S84 PolarHBondContact O-OG 3.14Å; S82-S84 PolarHBondContact O-N 2.77Å
85	A	98	Very high	96.9	Very high	30 Å²	30	49.7 Å²	49.7	25%	0.248	29%	0.292	C	S	.	.	S	Bend	trans	-160.6	168.2	-175.5	0	0	0	0	0	110.9	Q37 Q38 D83 Y87	Q37-A85 HydrophobicContact CG-CB 3.49Å; Q37-A85 VanDerWaalsContact CG-CB 3.49Å; Q38-A85 WeakPolarHBondContact O-CB 3.12Å; D83-A85 PolarHBondContact O-N 3.27Å; A85-Y87 HydrophobicContact CB-CD2 4.49Å; A85-Y87 HydrophobicContact CB-CE2 4.04Å; A85-Y87 WeakPolarHBondContact O-CD2 3.43Å
86	V	98.1	Very high	96.8	Very high	80 Å²	80	50.8 Å²	50.8	49%	0.485	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	134	162.7	177	0	0	0	0	108.2	Q38 L88	Q38-V86 HydrophobicContact CB-CB 4.28Å; Q38-V86 PolarHBondContact N-O 3.12Å; Q38-V86 PolarHBondContact O-N 3.02Å; V86-L88 HydrophobicContact CG1-CD2 3.84Å; V86-L88 HydrophobicContact CG1-CG 4.17Å
87	Y	98.2	Very high	96.7	Very high	28 Å²	28	54 Å²	54	11%	0.11	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.5	176.6	-72.8	-99.3	0	0	0	109.8	Q6 L21 Y36 Q37 L47 L74 I76 D83 A85	Q6-Y87 PolarHBondContact NE2-O 3.49Å; L21-Y87 VanDerWaalsContact CD1-CB 3.41Å; L21-Y87 HydrophobicContact CD1-CD1 4Å; L21-Y87 HydrophobicContact CD1-CD2 3.89Å; L21-Y87 HydrophobicContact CD1-CG 3.5Å; Y36-Y87 CarbonylContact O-C 3.5Å; Y36-Y87 WeakPolarHBondContact O-CA 3.39Å; Q37-Y87 HydrophobicContact CB-CE1 4.26Å; Q37-Y87 HydrophobicContact CG-CE1 4.01Å; Q37-Y87 PolarHBondContact NE2-OH 2.87Å; L47-Y87 HydrophobicContact CD2-CD1 3.94Å; L47-Y87 HydrophobicContact CD2-CE1 3.6Å; L74-Y87 HydrophobicContact CD2-CD1 3.75Å; L74-Y87 HydrophobicContact CD2-CE1 4.1Å; I76-Y87 HydrophobicContact CD1-CD1 4.49Å; I76-Y87 HydrophobicContact CD1-CE1 3.6Å; I76-Y87 HydrophobicContact CD1-CE2 4.32Å; I76-Y87 WeakPolarHBondContact CD1-OH 3.44Å; D83-Y87 VanDerWaalsContact O-CE2 3.27Å; D83-Y87 WeakPolarHBondContact O-CE2 3.42Å; D83-Y87 PolarHBondContact O-OH 2.81Å; A85-Y87 HydrophobicContact CB-CD2 4.49Å; A85-Y87 HydrophobicContact CB-CE2 4.04Å; A85-Y87 WeakPolarHBondContact O-CD2 3.43Å
88	L	97.5	Very high	96.6	Very high	59 Å²	59	51 Å²	51	31%	0.309	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.7	-176.2	-56.3	170.4	0	0	0	109.8	W35 Y36 P44 V86	W35-L88 CarbonylContact C-O 3.6Å; W35-L88 WeakPolarHBondContact CA-O 3.33Å; Y36-L88 PolarHBondContact N-O 3.16Å; Y36-L88 PolarHBondContact O-N 2.96Å; P44-L88 HydrophobicContact CB-CD1 4.3Å; P44-L88 HydrophobicContact CG-CD1 4Å; V86-L88 HydrophobicContact CG1-CD2 3.84Å; V86-L88 HydrophobicContact CG1-CG 4.17Å
89	C	96.4	Very high	96.5	Very high	9 Å²	9	48.3 Å²	48.3	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.6	173.4	176.3	0	0	0	0	109.5	Q6 C23 W35	Q6-C89 VanDerWaalsContact CD-N 3.35Å; Q6-C89 HydrophobicContact CG-CB 3.88Å; C23-C89 HydrophobicContact CB-CB 3.49Å; C23-C89 VanDerWaalsContact CB-CB 3.49Å; C23-C89 WeakPolarHBondContact CB-SG 3.33Å; C23-C89 WeakPolarHBondContact SG-CB 3.45Å; C23-C89 CovalentContact SG-SG 2.04Å; C23-C89 PolarHBondContact SG-SG 2.94Å; W35-C89 HydrophobicContact CD2-CB 4.35Å; W35-C89 HydrophobicContact CE3-CB 4.18Å; W35-C89 HydrophobicContact CH2-CB 3.94Å; W35-C89 HydrophobicContact CZ2-CB 4.08Å; W35-C89 HydrophobicContact CZ3-CB 3.99Å
90	A	94.3	Very high	96.4	Very high	38 Å²	38	51.9 Å²	51.9	31%	0.314	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138.9	171.2	0	0	0	0	0	109.5	I33 W34 Y36	I33-A90 CarbonylContact C-O 3.59Å; I33-A90 WeakPolarHBondContact CA-O 3.4Å; W34-A90 PolarHBondContact N-O 2.71Å; W34-A90 PolarHBondContact O-N 2.84Å; Y36-A90 HydrophobicContact CD2-CB 4.43Å; Y36-A90 HydrophobicContact CE2-CB 3.86Å
91	V	88.6	Confident	96.2	Very high	38 Å²	38	49.9 Å²	49.9	23%	0.23	32%	0.322	C	S	.	.			trans	-118.1	0	175.3	-59.3	0	0	0	0	109.4	V4 F25 S30 I33	V4-V91 HydrophobicContact CG1-CB 4.37Å; V4-V91 HydrophobicContact CG1-CG1 4Å; V4-V91 HydrophobicContact CG1-CG2 3.58Å; F25-V91 HydrophobicContact CB-CB 4.26Å; F25-V91 HydrophobicContact CB-CG1 3.73Å; F25-V91 HydrophobicContact CB-CG2 3.85Å; F25-V91 HydrophobicContact CD1-CG1 3.82Å; F25-V91 HydrophobicContact CD2-CG1 4.34Å; F25-V91 HydrophobicContact CG-CB 4.38Å; F25-V91 HydrophobicContact CG-CG1 3.73Å; F25-V91 HydrophobicContact CG-CG2 4.44Å; S30-V91 WeakPolarHBondContact CB-OXT 3.24Å; I33-V91 HydrophobicContact CD1-CG1 4.21Å; I33-V91 HydrophobicContact CG1-CG1 3.96Å; I33-V91 HydrophobicContact CG2-CG1 4.2Å

Retrieved 91 of 91 residues in 129.1 ms (Link to these results)

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