A0A087X1Q2_HUMAN Loading...

Follistatin like 3

AlphaFold DB , UniProt , Accession A0A087X1Q2, Species HUMAN (Homo sapiens, Human), Gene FSTL3, Length 84 aa.

						>A0A087X1Q2_HUMAN|A0A087X1Q2|FSTL3
MLGGRPRCECAPDCSGLPARLQVCGSDGATYRDECELRAARCRGHPDLSVMYRGRCRKSCEHVVCPRPQSCVVDQTGSAHCVVC
					

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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	52.9	Low	80.4	Confident	239 Å²	239	142 Å²	142	100%	1.177	81%	0.805	S	S	*	*				0	119.7	0	-55.1	-81.7	-156.5	0	0	106
2	L	57.2	Low	81.6	Confident	158 Å²	158	133.8 Å²	133.8	83%	0.827	76%	0.761	S	S	*	*			cis	-159.2	117.5	11.5	-164.1	78.4	0	0	0	105.3	G4	L2-G4 VanDerWaalsContact C-N 3.27Å; L2-G4 PolarHBondContact O-N 2.88Å
3	G	60.9	Low	82.6	Confident	87 Å²	87	132.5 Å²	132.5	90%	0.897	75%	0.751	S	S	*	*			trans	-74.2	80	174.9	0	0	0	0	0	110.2	R5	G3-R5 PolarHBondContact O-N 3.43Å
4	G	77.3	Confident	83.5	Confident	64 Å²	64	125.2 Å²	125.2	66%	0.66	71%	0.712	S	S	*	*			trans	-82.9	103	177.3	0	0	0	0	0	110.8	L2	L2-G4 VanDerWaalsContact C-N 3.27Å; L2-G4 PolarHBondContact O-N 2.88Å
5	R	84.4	Confident	84.1	Confident	228 Å²	228	123.9 Å²	123.9	86%	0.86	71%	0.713	S	S	*	*			trans	-79.6	124	164.2	-69.8	-174.2	-173.5	-174.4	2.1	108.2	G3 R7	G3-R5 PolarHBondContact O-N 3.43Å; R5-R7 PolarHBondContact O-N 3.39Å
6	P	88	Confident	84.6	Confident	133 Å²	133	120.8 Å²	120.8	86%	0.864	72%	0.716	S	S	*	*			trans	-61.2	139.1	175.1	26.6	-33.3	0	0	0	109.5
7	R	89.1	Confident	85.1	Confident	214 Å²	214	115.6 Å²	115.6	81%	0.808	69%	0.685	S	S	*	*			trans	-122.6	137.1	175.1	-67.9	-170.7	174.6	-139.3	-0.3	109.1	R5	R5-R7 PolarHBondContact O-N 3.39Å
8	C	91.4	Very high	85.3	Confident	141 Å²	141	112.6 Å²	112.6	95%	0.953	67%	0.669	S	S	*	*			trans	-79	128.9	167.1	-60.9	0	0	0	0	108.1
9	E	93.6	Very high	85.2	Confident	168 Å²	168	110.8 Å²	110.8	79%	0.785	67%	0.668	S	S	*	*			trans	-118.4	147.7	175.7	-66.6	-174.8	-178	0	0	110	A11	E9-A11 PolarHBondContact O-N 2.77Å
10	C	95.3	Very high	85.3	Confident	35 Å²	35	116.1 Å²	116.1	24%	0.236	68%	0.675	C	S	.	*			trans	-76	107.6	176.8	-74.2	0	0	0	0	110.4	C42 R43	C10-C42 VanDerWaalsContact CA-SG 3.53Å; C10-C42 HydrophobicContact CB-CB 3.62Å; C10-C42 WeakPolarHBondContact CB-SG 3.03Å; C10-C42 WeakPolarHBondContact SG-CB 3.38Å; C10-C42 PolarHBondContact SG-O 3.45Å; C10-C42 CovalentContact SG-SG 2.04Å; C10-C42 PolarHBondContact SG-SG 2.61Å; C10-R43 HydrophobicContact CB-CG 4.05Å; C10-R43 PolarHBondContact SG-N 3.28Å
11	A	94.7	Very high	85.7	Confident	95 Å²	95	114.2 Å²	114.2	79%	0.785	66%	0.662	S	S	*	*			trans	-124.1	77.8	175.1	0	0	0	0	0	109.9	E9	E9-A11 PolarHBondContact O-N 2.77Å
12	P	94.7	Very high	87.8	Confident	43 Å²	43	107.1 Å²	107.1	28%	0.279	63%	0.626	S	S	.	*			trans	-66.7	147.8	176.3	29.4	-34.5	0	0	0	111	C14 R38 A39	P12-C14 PolarHBondContact O-N 3.1Å; P12-C14 PolarHBondContact O-SG 2.8Å; P12-C14 VanDerWaalsContact O-SG 3.39Å; P12-R38 HydrophobicContact CB-CB 3.85Å; P12-R38 HydrophobicContact CG-CB 3.94Å; P12-A39 HydrophobicContact CG-CB 4.19Å
13	D	94.3	Very high	89.8	Confident	118 Å²	118	99.7 Å²	99.7	63%	0.631	59%	0.587	S	S	*	*			trans	-70.1	124.2	169.3	-178.2	14.9	0	0	0	110.4	S15 R38	D13-S15 WeakPolarHBondContact OD1-CB 3.34Å; D13-S15 PolarHBondContact OD1-N 3.41Å; D13-S15 PolarHBondContact OD1-OG 3.07Å; D13-S15 PolarHBondContact OD2-OG 2.89Å; D13-R38 PolarHBondContact O-NH1 2.95Å
14	C	94.8	Very high	91.6	Very high	30 Å²	30	95.5 Å²	95.5	20%	0.203	55%	0.545	C	S	.	.			trans	-127.1	8	-176.9	-59	0	0	0	0	113	P12 G16 L17 C35	P12-C14 PolarHBondContact O-N 3.1Å; P12-C14 PolarHBondContact O-SG 2.8Å; P12-C14 VanDerWaalsContact O-SG 3.39Å; C14-G16 PolarHBondContact O-N 3.43Å; C14-L17 HydrophobicContact CB-CD1 4.4Å; C14-L17 PolarHBondContact O-N 3.31Å; C14-L17 VanDerWaalsContact O-N 3.09Å; C14-C35 HydrophobicContact CB-CB 3.66Å; C14-C35 WeakPolarHBondContact CB-SG 3.36Å; C14-C35 VanDerWaalsContact SG-CA 3.56Å; C14-C35 WeakPolarHBondContact SG-CB 3.47Å; C14-C35 CovalentContact SG-SG 2.02Å; C14-C35 PolarHBondContact SG-SG 2.94Å
15	S	93.5	Very high	92.5	Very high	105 Å²	105	92.5 Å²	92.5	73%	0.734	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-29.9	-175.8	54.5	0	0	0	0	113.9	D13	D13-S15 WeakPolarHBondContact OD1-CB 3.34Å; D13-S15 PolarHBondContact OD1-N 3.41Å; D13-S15 PolarHBondContact OD1-OG 3.07Å; D13-S15 PolarHBondContact OD2-OG 2.89Å
16	G	91.6	Very high	93.1	Very high	74 Å²	74	84.2 Å²	84.2	76%	0.763	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	6.9	177.8	0	0	0	0	0	115.6	C14	C14-G16 PolarHBondContact O-N 3.43Å
17	L	92.5	Very high	93.5	Very high	34 Å²	34	81.7 Å²	81.7	18%	0.178	47%	0.469	C	S	.	.	S	Bend	trans	-99.7	138.7	-174.8	-68.8	-179.1	0	0	0	112.6	C14 A19 E34 C35 R38	C14-L17 HydrophobicContact CB-CD1 4.4Å; C14-L17 PolarHBondContact O-N 3.31Å; C14-L17 VanDerWaalsContact O-N 3.09Å; L17-A19 PolarHBondContact O-N 2.87Å; L17-A19 VanDerWaalsContact O-N 3.16Å; L17-E34 HydrophobicContact CD1-CB 3.88Å; L17-E34 HydrophobicContact CD1-CG 3.88Å; L17-E34 HydrophobicContact CD2-CB 4.39Å; L17-E34 VanDerWaalsContact CD2-CD 3.45Å; L17-E34 HydrophobicContact CD2-CG 4.26Å; L17-E34 WeakPolarHBondContact CD2-OE1 3.44Å; L17-E34 WeakPolarHBondContact CD2-OE2 3.08Å; L17-C35 HydrophobicContact CD1-CB 4.4Å; L17-R38 VanDerWaalsContact CD1-CZ 3.44Å
18	P	89.1	Confident	93.9	Very high	61 Å²	61	73.3 Å²	73.3	40%	0.396	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-64.6	118.2	173.2	25.7	-31.4	0	0	0	110	L21	P18-L21 HydrophobicContact CB-CB 4.27Å; P18-L21 HydrophobicContact CB-CD2 4.37Å; P18-L21 HydrophobicContact CG-CB 4.39Å; P18-L21 HydrophobicContact CG-CD2 4Å
19	A	84.4	Confident	94.1	Very high	79 Å²	79	68.3 Å²	68.3	65%	0.653	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	148.4	176.7	0	0	0	0	0	111.3	L17 L21	L17-A19 PolarHBondContact O-N 2.87Å; L17-A19 VanDerWaalsContact O-N 3.16Å; A19-L21 PolarHBondContact O-N 3.08Å; A19-L21 VanDerWaalsContact O-N 3.08Å
20	R	86.7	Confident	94.4	Very high	215 Å²	215	63.2 Å²	63.2	81%	0.811	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	11.4	177	-54.5	-176	170.2	108.3	-1.7	115.6	Q22 R32	R20-Q22 PolarHBondContact O-N 2.84Å; R20-R32 CarbonylContact C-O 3.05Å
21	L	94.1	Very high	94.5	Very high	77 Å²	77	62.7 Å²	62.7	40%	0.403	39%	0.393	S	S	.	.			trans	-91	102.5	172	-172.1	70.7	0	0	0	109.1	P18 A19 R32 D33	P18-L21 HydrophobicContact CB-CB 4.27Å; P18-L21 HydrophobicContact CB-CD2 4.37Å; P18-L21 HydrophobicContact CG-CB 4.39Å; P18-L21 HydrophobicContact CG-CD2 4Å; A19-L21 PolarHBondContact O-N 3.08Å; A19-L21 VanDerWaalsContact O-N 3.08Å; L21-R32 CarbonylContact C-O 3.59Å; L21-D33 WeakPolarHBondContact O-CA 3.05Å
22	Q	97.4	Very high	94.6	Very high	90 Å²	90	65.7 Å²	65.7	42%	0.421	38%	0.384	S	S	.	.			trans	-54.9	149.7	-179.5	-71.9	169.5	93.9	0	0	112.2	R20 T30 Y31 R32 G54	R20-Q22 PolarHBondContact O-N 2.84Å; Q22-T30 HydrophobicContact CB-CG2 4.35Å; Q22-T30 HydrophobicContact CG-CG2 4.42Å; Q22-Y31 WeakPolarHBondContact CA-O 3.05Å; Q22-Y31 WeakPolarHBondContact CB-O 3.22Å; Q22-R32 WeakPolarHBondContact CA-O 3.42Å; Q22-R32 PolarHBondContact N-O 3.27Å; Q22-G54 CarbonylContact O-C 3.53Å; Q22-G54 WeakPolarHBondContact O-CA 3.5Å; Q22-G54 PolarHBondContact O-N 3.1Å
23	V	97.7	Very high	94.8	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.012	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	149.8	174.9	-63.2	0	0	0	0	110.3	Y31 E34 L37 V50 G54	V23-Y31 PolarHBondContact N-O 2.96Å; V23-Y31 PolarHBondContact O-N 3.31Å; V23-E34 HydrophobicContact CG1-CB 4.35Å; V23-L37 HydrophobicContact CG2-CB 4.21Å; V23-L37 HydrophobicContact CG2-CD1 3.86Å; V23-V50 HydrophobicContact CB-CG1 4.06Å; V23-V50 HydrophobicContact CB-CG2 4.15Å; V23-V50 HydrophobicContact CG1-CG1 4.19Å; V23-V50 HydrophobicContact CG1-CG2 4.25Å; V23-V50 HydrophobicContact CG2-CG2 4.13Å; V23-G54 CarbonylContact C-O 3.44Å; V23-G54 VanDerWaalsContact CA-O 3.25Å; V23-G54 WeakPolarHBondContact CA-O 3.25Å
24	C	98.2	Very high	94.9	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.2	170.5	-174.1	0	0	0	0	108.3	M51 Y52 G54 C56	C24-M51 PolarHBondContact O-N 2.76Å; C24-M51 VanDerWaalsContact SG-CE 3.56Å; C24-Y52 HydrophobicContact CB-CD1 4.33Å; C24-Y52 HydrophobicContact CB-CD2 3.69Å; C24-Y52 HydrophobicContact CB-CE1 4.1Å; C24-Y52 HydrophobicContact CB-CE2 3.39Å; C24-Y52 HydrophobicContact CB-CG 4.15Å; C24-Y52 PolarHBondContact N-O 2.95Å; C24-Y52 VanDerWaalsContact SG-CZ 3.53Å; C24-G54 PolarHBondContact N-O 2.8Å; C24-C56 WeakPolarHBondContact CA-SG 3.34Å; C24-C56 HydrophobicContact CB-CB 4.03Å; C24-C56 WeakPolarHBondContact CB-SG 3.28Å; C24-C56 WeakPolarHBondContact SG-CA 3.24Å; C24-C56 WeakPolarHBondContact SG-CB 3.13Å; C24-C56 CovalentContact SG-SG 2.04Å; C24-C56 PolarHBondContact SG-SG 3.43Å
25	G	98	Very high	95	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	159	176	0	0	0	0	0	112.2	D27 G28 A29 S49	G25-D27 PolarHBondContact O-N 2.04Å; G25-G28 PolarHBondContact O-N 2.88Å; G25-A29 PolarHBondContact N-O 3.26Å; G25-S49 CarbonylContact C-O 3.5Å; G25-S49 WeakPolarHBondContact CA-O 3.19Å
26	S	97.1	Very high	95.2	Very high	55 Å²	55	59.5 Å²	59.5	39%	0.385	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-12.6	171.4	53.5	0	0	0	0	113.7	G28 D47 S49	S26-G28 VanDerWaalsContact C-N 3.33Å; S26-D47 PolarHBondContact OG-O 3.33Å; S26-S49 PolarHBondContact N-O 3.31Å; S26-S49 PolarHBondContact OG-N 3.4Å; S26-S49 PolarHBondContact OG-O 3.3Å; S26-S49 PolarHBondContact OG-OG 3.04Å
27	D	96.3	Very high	95.5	Very high	79 Å²	79	56.1 Å²	56.1	42%	0.422	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	1.3	172.1	67.4	-18.2	0	0	0	113.4	G25 A29 Y31 L48	G25-D27 PolarHBondContact O-N 2.04Å; D27-A29 VanDerWaalsContact C-N 3.25Å; D27-A29 PolarHBondContact O-N 3.02Å; D27-A29 WeakPolarHBondContact OD1-CB 3.4Å; D27-A29 PolarHBondContact OD1-N 3.42Å; D27-A29 WeakPolarHBondContact OD2-CB 3.25Å; D27-Y31 PolarHBondContact OD2-OH 3.24Å; D27-L48 HydrophobicContact CB-CD1 4Å; D27-L48 VanDerWaalsContact CG-CD1 3.48Å; D27-L48 WeakPolarHBondContact OD1-CD1 3.1Å
28	G	96.1	Very high	95.7	Very high	39 Å²	39	57.8 Å²	57.8	40%	0.402	31%	0.305	S	S	.	.	S	Bend	trans	77	6.1	-177.4	0	0	0	0	0	114.4	G25 S26 C56	G25-G28 PolarHBondContact O-N 2.88Å; S26-G28 VanDerWaalsContact C-N 3.33Å; G28-C56 VanDerWaalsContact C-SG 3.52Å; G28-C56 PolarHBondContact O-SG 2.04Å
29	A	97.2	Very high	96.1	Very high	36 Å²	36	55.4 Å²	55.4	30%	0.298	29%	0.29	S	S	.	.			trans	-88	145.6	175.3	0	0	0	0	0	111.6	G25 D27 Y31 C56	G25-A29 PolarHBondContact N-O 3.26Å; D27-A29 VanDerWaalsContact C-N 3.25Å; D27-A29 PolarHBondContact O-N 3.02Å; D27-A29 WeakPolarHBondContact OD1-CB 3.4Å; D27-A29 PolarHBondContact OD1-N 3.42Å; D27-A29 WeakPolarHBondContact OD2-CB 3.25Å; A29-Y31 HydrophobicContact CB-CE2 3.89Å; A29-Y31 WeakPolarHBondContact O-CD2 2.98Å; A29-C56 VanDerWaalsContact C-SG 3.51Å; A29-C56 PolarHBondContact O-SG 3.38Å
30	T	98.1	Very high	96.7	Very high	61 Å²	61	52.3 Å²	52.3	37%	0.374	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	127.6	171.5	-62.9	0	0	0	0	109.7	Q22 R55 C56	Q22-T30 HydrophobicContact CB-CG2 4.35Å; Q22-T30 HydrophobicContact CG-CG2 4.42Å; T30-R55 HydrophobicContact CG2-CB 3.65Å; T30-C56 PolarHBondContact OG1-N 2.04Å
31	Y	98	Very high	97.2	Very high	24 Å²	24	47.2 Å²	47.2	9%	0.094	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	144.8	173.3	-63	-92.9	0	0	0	109.6	Q22 V23 D27 A29 D33 E36 L37 A40 L48	Q22-Y31 WeakPolarHBondContact CA-O 3.05Å; Q22-Y31 WeakPolarHBondContact CB-O 3.22Å; V23-Y31 PolarHBondContact N-O 2.96Å; V23-Y31 PolarHBondContact O-N 3.31Å; D27-Y31 PolarHBondContact OD2-OH 3.24Å; A29-Y31 HydrophobicContact CB-CE2 3.89Å; A29-Y31 WeakPolarHBondContact O-CD2 2.98Å; Y31-D33 PolarHBondContact O-N 3.17Å; Y31-E36 HydrophobicContact CD1-CB 4.47Å; Y31-E36 HydrophobicContact CD1-CG 4.06Å; Y31-L37 HydrophobicContact CD1-CB 4.06Å; Y31-L37 HydrophobicContact CD2-CB 4.06Å; Y31-L37 HydrophobicContact CD2-CD1 3.74Å; Y31-L37 HydrophobicContact CD2-CG 4.09Å; Y31-L37 HydrophobicContact CE2-CD1 4.04Å; Y31-L37 HydrophobicContact CE2-CG 4.22Å; Y31-L37 HydrophobicContact CG-CB 3.79Å; Y31-L37 HydrophobicContact CG-CD1 4.32Å; Y31-L37 HydrophobicContact CG-CG 4.32Å; Y31-A40 HydrophobicContact CE1-CB 3.63Å; Y31-L48 HydrophobicContact CE1-CD2 4.3Å; Y31-L48 HydrophobicContact CE2-CD1 4.13Å; Y31-L48 HydrophobicContact CE2-CD2 4.24Å; Y31-L48 WeakPolarHBondContact OH-CD2 3.49Å
32	R	97.6	Very high	97.4	Very high	158 Å²	158	47.1 Å²	47.1	60%	0.596	25%	0.251	S	S	*	.	S	Bend	trans	-57.8	-36.6	178.9	-172.6	-172.5	71.9	-165.1	-3.1	111.8	R20 L21 Q22 E36	R20-R32 CarbonylContact C-O 3.05Å; L21-R32 CarbonylContact C-O 3.59Å; Q22-R32 WeakPolarHBondContact CA-O 3.42Å; Q22-R32 PolarHBondContact N-O 3.27Å; R32-E36 WeakPolarHBondContact CA-OE2 3.42Å; R32-E36 WeakPolarHBondContact CB-OE2 3.45Å; R32-E36 PolarHBondContact N-OE2 2.89Å
33	D	97.4	Very high	97.3	Very high	9 Å²	9	51.1 Å²	51.1	5%	0.048	26%	0.262	C	S	.	.	S	Bend	trans	-158.3	169.2	177.2	53	59.9	0	0	0	111.3	L21 Y31 C35 E36 L37	L21-D33 WeakPolarHBondContact O-CA 3.05Å; Y31-D33 PolarHBondContact O-N 3.17Å; D33-C35 PolarHBondContact O-N 3.02Å; D33-C35 WeakPolarHBondContact OD1-CA 3.45Å; D33-C35 VanDerWaalsContact OD1-CB 3.25Å; D33-C35 WeakPolarHBondContact OD1-CB 3.33Å; D33-C35 PolarHBondContact OD1-N 3.01Å; D33-C35 VanDerWaalsContact OD1-N 3.14Å; D33-E36 PolarHBondContact O-N 3.21Å; D33-E36 PolarHBondContact OD1-N 2.87Å; D33-L37 PolarHBondContact O-N 3.09Å
34	E	97.4	Very high	97.1	Very high	37 Å²	37	53.6 Å²	53.6	17%	0.173	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-27	178.2	-171.9	-179.5	149.9	0	0	112.5	L17 V23 L37 R38 V50	L17-E34 HydrophobicContact CD1-CB 3.88Å; L17-E34 HydrophobicContact CD1-CG 3.88Å; L17-E34 HydrophobicContact CD2-CB 4.39Å; L17-E34 VanDerWaalsContact CD2-CD 3.45Å; L17-E34 HydrophobicContact CD2-CG 4.26Å; L17-E34 WeakPolarHBondContact CD2-OE1 3.44Å; L17-E34 WeakPolarHBondContact CD2-OE2 3.08Å; V23-E34 HydrophobicContact CG1-CB 4.35Å; E34-L37 PolarHBondContact O-N 3.4Å; E34-R38 WeakPolarHBondContact O-CG 3.49Å; E34-R38 PolarHBondContact O-N 3.48Å; E34-R38 IonicContact OE1-CZ 3.37Å; E34-R38 IonicContact OE1-NE 3.24Å; E34-R38 PolarHBondContact OE1-NE 3.33Å; E34-R38 IonicContact OE1-NH2 2.74Å; E34-R38 PolarHBondContact OE1-NH2 3.39Å; E34-V50 HydrophobicContact CG-CG2 3.94Å
35	C	97.1	Very high	96.9	Very high	40 Å²	40	58.4 Å²	58.4	27%	0.27	31%	0.31	S	S	.	.	H	α-helix	trans	-68	-42.5	178.4	-172.9	0	0	0	0	111.3	C14 L17 D33 L37 R38 A39	C14-C35 HydrophobicContact CB-CB 3.66Å; C14-C35 WeakPolarHBondContact CB-SG 3.36Å; C14-C35 VanDerWaalsContact SG-CA 3.56Å; C14-C35 WeakPolarHBondContact SG-CB 3.47Å; C14-C35 CovalentContact SG-SG 2.02Å; C14-C35 PolarHBondContact SG-SG 2.94Å; L17-C35 HydrophobicContact CD1-CB 4.4Å; D33-C35 PolarHBondContact O-N 3.02Å; D33-C35 WeakPolarHBondContact OD1-CA 3.45Å; D33-C35 VanDerWaalsContact OD1-CB 3.25Å; D33-C35 WeakPolarHBondContact OD1-CB 3.33Å; D33-C35 PolarHBondContact OD1-N 3.01Å; D33-C35 VanDerWaalsContact OD1-N 3.14Å; C35-L37 VanDerWaalsContact C-N 3.33Å; C35-L37 PolarHBondContact O-N 3.36Å; C35-R38 PolarHBondContact O-N 2.03Å; C35-A39 PolarHBondContact O-N 2.82Å
36	E	97.1	Very high	96.8	Very high	80 Å²	80	63.1 Å²	63.1	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-59.9	-44.2	173.8	-171.4	-175	-162.5	0	0	111.5	Y31 R32 D33 R38 A39 A40	Y31-E36 HydrophobicContact CD1-CB 4.47Å; Y31-E36 HydrophobicContact CD1-CG 4.06Å; R32-E36 WeakPolarHBondContact CA-OE2 3.42Å; R32-E36 WeakPolarHBondContact CB-OE2 3.45Å; R32-E36 PolarHBondContact N-OE2 2.89Å; D33-E36 PolarHBondContact O-N 3.21Å; D33-E36 PolarHBondContact OD1-N 2.87Å; E36-R38 PolarHBondContact O-N 2.91Å; E36-A39 PolarHBondContact O-N 2.85Å; E36-A40 PolarHBondContact O-N 2.96Å
37	L	98.1	Very high	96.7	Very high	3 Å²	3	67.3 Å²	67.3	2%	0.016	36%	0.358	C	S	.	.	H	α-helix	trans	-59.3	-46.4	174.9	-175.9	153.2	0	0	0	111.2	V23 Y31 D33 E34 C35 A39 A40 R41 L48 V50	V23-L37 HydrophobicContact CG2-CB 4.21Å; V23-L37 HydrophobicContact CG2-CD1 3.86Å; Y31-L37 HydrophobicContact CD1-CB 4.06Å; Y31-L37 HydrophobicContact CD2-CB 4.06Å; Y31-L37 HydrophobicContact CD2-CD1 3.74Å; Y31-L37 HydrophobicContact CD2-CG 4.09Å; Y31-L37 HydrophobicContact CE2-CD1 4.04Å; Y31-L37 HydrophobicContact CE2-CG 4.22Å; Y31-L37 HydrophobicContact CG-CB 3.79Å; Y31-L37 HydrophobicContact CG-CD1 4.32Å; Y31-L37 HydrophobicContact CG-CG 4.32Å; D33-L37 PolarHBondContact O-N 3.09Å; E34-L37 PolarHBondContact O-N 3.4Å; C35-L37 VanDerWaalsContact C-N 3.33Å; C35-L37 PolarHBondContact O-N 3.36Å; L37-A39 VanDerWaalsContact C-N 3.28Å; L37-A39 PolarHBondContact O-N 3.36Å; L37-A40 PolarHBondContact O-N 2.81Å; L37-R41 WeakPolarHBondContact O-CB 3.48Å; L37-R41 PolarHBondContact O-N 2.84Å; L37-L48 HydrophobicContact CD1-CG 4.41Å; L37-L48 HydrophobicContact CD2-CD2 4.32Å; L37-L48 HydrophobicContact CD2-CG 4.02Å; L37-L48 HydrophobicContact CG-CD2 3.93Å; L37-L48 HydrophobicContact CG-CG 3.92Å; L37-V50 HydrophobicContact CD1-CG2 3.81Å; L37-V50 HydrophobicContact CD2-CG2 4.35Å
38	R	97.4	Very high	96.8	Very high	69 Å²	69	63.9 Å²	63.9	26%	0.26	34%	0.34	S	S	.	.	H	α-helix	trans	-60.7	-37.3	176.7	-72.9	176	-178.1	-165	1	112.3	P12 D13 L17 E34 C35 E36 R41 C42	P12-R38 HydrophobicContact CB-CB 3.85Å; P12-R38 HydrophobicContact CG-CB 3.94Å; D13-R38 PolarHBondContact O-NH1 2.95Å; L17-R38 VanDerWaalsContact CD1-CZ 3.44Å; E34-R38 WeakPolarHBondContact O-CG 3.49Å; E34-R38 PolarHBondContact O-N 3.48Å; E34-R38 IonicContact OE1-CZ 3.37Å; E34-R38 IonicContact OE1-NE 3.24Å; E34-R38 PolarHBondContact OE1-NE 3.33Å; E34-R38 IonicContact OE1-NH2 2.74Å; E34-R38 PolarHBondContact OE1-NH2 3.39Å; C35-R38 PolarHBondContact O-N 2.03Å; E36-R38 PolarHBondContact O-N 2.91Å; R38-R41 PolarHBondContact O-N 3.49Å; R38-C42 PolarHBondContact O-N 2.94Å; R38-C42 VanDerWaalsContact O-N 3.08Å
39	A	96.7	Very high	96.9	Very high	10 Å²	10	64.8 Å²	64.8	8%	0.083	34%	0.34	C	S	.	.	H	α-helix	trans	-68.4	-41.6	175.7	0	0	0	0	0	111.4	P12 C35 E36 L37 R41 C42 R43	P12-A39 HydrophobicContact CG-CB 4.19Å; C35-A39 PolarHBondContact O-N 2.82Å; E36-A39 PolarHBondContact O-N 2.85Å; L37-A39 VanDerWaalsContact C-N 3.28Å; L37-A39 PolarHBondContact O-N 3.36Å; A39-R41 VanDerWaalsContact C-N 3.35Å; A39-C42 PolarHBondContact O-N 3.1Å; A39-R43 WeakPolarHBondContact O-CG 3.42Å; A39-R43 PolarHBondContact O-N 3.01Å; A39-R43 VanDerWaalsContact O-N 3.1Å
40	A	97.3	Very high	96.9	Very high	15 Å²	15	65.6 Å²	65.6	12%	0.124	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-39.9	174.4	0	0	0	0	0	112.4	Y31 E36 L37 R43 G44 H45 L48	Y31-A40 HydrophobicContact CE1-CB 3.63Å; E36-A40 PolarHBondContact O-N 2.96Å; L37-A40 PolarHBondContact O-N 2.81Å; A40-R43 PolarHBondContact O-N 3.45Å; A40-G44 PolarHBondContact O-N 2.89Å; A40-H45 PolarHBondContact O-ND1 3.19Å; A40-L48 HydrophobicContact CB-CD2 3.8Å
41	R	97.9	Very high	96.8	Very high	107 Å²	107	63.6 Å²	63.6	40%	0.404	33%	0.328	S	S	.	.	H	α-helix	trans	-56.8	-52.7	173.2	-178.7	178.1	72	-169.2	2.3	111.3	L37 R38 A39 R43 G44 H45 L48	L37-R41 WeakPolarHBondContact O-CB 3.48Å; L37-R41 PolarHBondContact O-N 2.84Å; R38-R41 PolarHBondContact O-N 3.49Å; A39-R41 VanDerWaalsContact C-N 3.35Å; R41-R43 VanDerWaalsContact C-N 3.29Å; R41-R43 PolarHBondContact O-N 3.47Å; R41-G44 PolarHBondContact O-N 2.7Å; R41-H45 VanDerWaalsContact CA-O 3.31Å; R41-H45 WeakPolarHBondContact CA-O 3.02Å; R41-H45 VanDerWaalsContact CG-O 3.28Å; R41-H45 WeakPolarHBondContact CG-O 3.23Å; R41-H45 CarbonylContact O-C 3.42Å; R41-H45 PolarHBondContact O-N 2.88Å; R41-H45 VanDerWaalsContact O-N 3.09Å; R41-L48 HydrophobicContact CB-CB 4.17Å; R41-L48 HydrophobicContact CB-CD2 4.41Å; R41-L48 WeakPolarHBondContact CD-O 3.49Å; R41-L48 HydrophobicContact CG-CB 4.42Å
42	C	97.4	Very high	96.8	Very high	76 Å²	76	62.7 Å²	62.7	51%	0.514	32%	0.324	S	S	.	.	H	α-helix	trans	-60.4	-35.6	179.3	171.8	0	0	0	0	113.2	C10 R38 A39 G44	C10-C42 VanDerWaalsContact CA-SG 3.53Å; C10-C42 HydrophobicContact CB-CB 3.62Å; C10-C42 WeakPolarHBondContact CB-SG 3.03Å; C10-C42 WeakPolarHBondContact SG-CB 3.38Å; C10-C42 PolarHBondContact SG-O 3.45Å; C10-C42 CovalentContact SG-SG 2.04Å; C10-C42 PolarHBondContact SG-SG 2.61Å; R38-C42 PolarHBondContact O-N 2.94Å; R38-C42 VanDerWaalsContact O-N 3.08Å; A39-C42 PolarHBondContact O-N 3.1Å; C42-G44 VanDerWaalsContact C-N 3.32Å; C42-G44 PolarHBondContact O-N 3.27Å
43	R	95.6	Very high	96.7	Very high	174 Å²	174	63 Å²	63	66%	0.657	33%	0.326	S	S	*	.	H	α-helix	trans	-74.1	-16.7	-176	-73.1	179.7	-162.6	116.3	0.7	114.6	C10 A39 A40 R41	C10-R43 HydrophobicContact CB-CG 4.05Å; C10-R43 PolarHBondContact SG-N 3.28Å; A39-R43 WeakPolarHBondContact O-CG 3.42Å; A39-R43 PolarHBondContact O-N 3.01Å; A39-R43 VanDerWaalsContact O-N 3.1Å; A40-R43 PolarHBondContact O-N 3.45Å; R41-R43 VanDerWaalsContact C-N 3.29Å; R41-R43 PolarHBondContact O-N 3.47Å
44	G	93.5	Very high	96.7	Very high	53 Å²	53	63.9 Å²	63.9	55%	0.546	34%	0.336	S	S	.	.	H	α-helix	trans	159.1	10	-179.3	0	0	0	0	0	116.9	A40 R41 C42 P46	A40-G44 PolarHBondContact O-N 2.89Å; R41-G44 PolarHBondContact O-N 2.7Å; C42-G44 VanDerWaalsContact C-N 3.32Å; C42-G44 PolarHBondContact O-N 3.27Å; G44-P46 VanDerWaalsContact C-CD 3.5Å; G44-P46 WeakPolarHBondContact O-CD 3.4Å
45	H	94.8	Very high	96.7	Very high	102 Å²	102	68.2 Å²	68.2	47%	0.472	35%	0.351	S	S	.	.			trans	-122.4	68.3	178.1	-56.8	82.9	0	0	0	109.6	A40 R41 D47 L48	A40-H45 PolarHBondContact O-ND1 3.19Å; R41-H45 VanDerWaalsContact CA-O 3.31Å; R41-H45 WeakPolarHBondContact CA-O 3.02Å; R41-H45 VanDerWaalsContact CG-O 3.28Å; R41-H45 WeakPolarHBondContact CG-O 3.23Å; R41-H45 CarbonylContact O-C 3.42Å; R41-H45 PolarHBondContact O-N 2.88Å; R41-H45 VanDerWaalsContact O-N 3.09Å; H45-D47 PolarHBondContact O-N 3.47Å; H45-D47 VanDerWaalsContact O-N 3.1Å; H45-L48 HydrophobicContact CB-CB 3.7Å; H45-L48 HydrophobicContact CB-CD2 4.16Å; H45-L48 WeakPolarHBondContact O-CB 3.12Å; H45-L48 PolarHBondContact O-N 3.48Å
46	P	94.3	Very high	96.7	Very high	98 Å²	98	67.8 Å²	67.8	64%	0.636	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.4	-168.6	22.3	-33.7	0	0	0	113.9	G44 L48	G44-P46 VanDerWaalsContact C-CD 3.5Å; G44-P46 WeakPolarHBondContact O-CD 3.4Å; P46-L48 VanDerWaalsContact C-N 3.35Å
47	D	96.6	Very high	96.7	Very high	143 Å²	143	68 Å²	68	77%	0.765	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	1.2	-179.1	-53.1	-47	0	0	0	113.8	S26 H45 S49	S26-D47 PolarHBondContact OG-O 3.33Å; H45-D47 PolarHBondContact O-N 3.47Å; H45-D47 VanDerWaalsContact O-N 3.1Å; D47-S49 PolarHBondContact O-N 3.34Å
48	L	97.9	Very high	96.6	Very high	7 Å²	7	74.5 Å²	74.5	4%	0.037	37%	0.374	C	S	.	.			trans	-65.8	123.5	178.3	-179.1	65.7	0	0	0	110.2	D27 Y31 L37 A40 R41 H45 P46	D27-L48 HydrophobicContact CB-CD1 4Å; D27-L48 VanDerWaalsContact CG-CD1 3.48Å; D27-L48 WeakPolarHBondContact OD1-CD1 3.1Å; Y31-L48 HydrophobicContact CE1-CD2 4.3Å; Y31-L48 HydrophobicContact CE2-CD1 4.13Å; Y31-L48 HydrophobicContact CE2-CD2 4.24Å; Y31-L48 WeakPolarHBondContact OH-CD2 3.49Å; L37-L48 HydrophobicContact CD1-CG 4.41Å; L37-L48 HydrophobicContact CD2-CD2 4.32Å; L37-L48 HydrophobicContact CD2-CG 4.02Å; L37-L48 HydrophobicContact CG-CD2 3.93Å; L37-L48 HydrophobicContact CG-CG 3.92Å; A40-L48 HydrophobicContact CB-CD2 3.8Å; R41-L48 HydrophobicContact CB-CB 4.17Å; R41-L48 HydrophobicContact CB-CD2 4.41Å; R41-L48 WeakPolarHBondContact CD-O 3.49Å; R41-L48 HydrophobicContact CG-CB 4.42Å; H45-L48 HydrophobicContact CB-CB 3.7Å; H45-L48 HydrophobicContact CB-CD2 4.16Å; H45-L48 WeakPolarHBondContact O-CB 3.12Å; H45-L48 PolarHBondContact O-N 3.48Å; P46-L48 VanDerWaalsContact C-N 3.35Å
49	S	96.9	Very high	96.6	Very high	58 Å²	58	73.5 Å²	73.5	41%	0.406	38%	0.377	S	S	.	.			trans	-136.9	163.6	179	58.9	0	0	0	0	110.5	G25 S26 D47 M51	G25-S49 CarbonylContact C-O 3.5Å; G25-S49 WeakPolarHBondContact CA-O 3.19Å; S26-S49 PolarHBondContact N-O 3.31Å; S26-S49 PolarHBondContact OG-N 3.4Å; S26-S49 PolarHBondContact OG-O 3.3Å; S26-S49 PolarHBondContact OG-OG 3.04Å; D47-S49 PolarHBondContact O-N 3.34Å; S49-M51 PolarHBondContact O-N 3.46Å
50	V	97.5	Very high	96.6	Very high	53 Å²	53	75.1 Å²	75.1	32%	0.321	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	118.2	171.3	174.9	0	0	0	0	108.1	V23 E34 L37	V23-V50 HydrophobicContact CB-CG1 4.06Å; V23-V50 HydrophobicContact CB-CG2 4.15Å; V23-V50 HydrophobicContact CG1-CG1 4.19Å; V23-V50 HydrophobicContact CG1-CG2 4.25Å; V23-V50 HydrophobicContact CG2-CG2 4.13Å; E34-V50 HydrophobicContact CG-CG2 3.94Å; L37-V50 HydrophobicContact CD1-CG2 3.81Å; L37-V50 HydrophobicContact CD2-CG2 4.35Å
51	M	97.3	Very high	96.4	Very high	19 Å²	19	81.7 Å²	81.7	9%	0.094	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-46.6	173.2	-174	167.3	52.1	0	0	110.9	C24 S49 H80 C81	C24-M51 PolarHBondContact O-N 2.76Å; C24-M51 VanDerWaalsContact SG-CE 3.56Å; S49-M51 PolarHBondContact O-N 3.46Å; M51-H80 HydrophobicContact SD-CB 4.09Å; M51-C81 HydrophobicContact CG-CB 3.9Å; M51-C81 PolarHBondContact SD-N 3.32Å; M51-C81 VanDerWaalsContact SD-N 3.39Å
52	Y	97.2	Very high	96.2	Very high	5 Å²	5	82.8 Å²	82.8	2%	0.02	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	163.4	171	51.7	-99.3	0	0	0	112	C24 C56 R57 V63 A79 C81	C24-Y52 HydrophobicContact CB-CD1 4.33Å; C24-Y52 HydrophobicContact CB-CD2 3.69Å; C24-Y52 HydrophobicContact CB-CE1 4.1Å; C24-Y52 HydrophobicContact CB-CE2 3.39Å; C24-Y52 HydrophobicContact CB-CG 4.15Å; C24-Y52 PolarHBondContact N-O 2.95Å; C24-Y52 VanDerWaalsContact SG-CZ 3.53Å; Y52-C56 WeakPolarHBondContact OH-CA 3.43Å; Y52-R57 PolarHBondContact OH-N 3.08Å; Y52-V63 HydrophobicContact CD1-CG1 3.65Å; Y52-V63 HydrophobicContact CD2-CG1 4.17Å; Y52-V63 HydrophobicContact CE1-CG1 3.71Å; Y52-V63 HydrophobicContact CE2-CG1 4.23Å; Y52-V63 HydrophobicContact CE2-CG2 4.24Å; Y52-V63 HydrophobicContact CG-CG1 3.89Å; Y52-A79 WeakPolarHBondContact CE1-O 2.99Å; Y52-A79 PolarHBondContact OH-O 3.3Å; Y52-C81 VanDerWaalsContact CD1-SG 3.51Å
53	R	96.4	Very high	96.2	Very high	166 Å²	166	79.9 Å²	79.9	63%	0.626	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	145	175.4	-64.2	-178.2	-178.3	-85.8	-1.4	110.9
54	G	96.1	Very high	96.2	Very high	26 Å²	26	77.5 Å²	77.5	27%	0.268	41%	0.41	S	S	.	.	S	Bend	trans	90.7	173.7	-174.1	0	0	0	0	0	112.6	Q22 V23 C24	Q22-G54 CarbonylContact O-C 3.53Å; Q22-G54 WeakPolarHBondContact O-CA 3.5Å; Q22-G54 PolarHBondContact O-N 3.1Å; V23-G54 CarbonylContact C-O 3.44Å; V23-G54 VanDerWaalsContact CA-O 3.25Å; V23-G54 WeakPolarHBondContact CA-O 3.25Å; C24-G54 PolarHBondContact N-O 2.8Å
55	R	97.3	Very high	96.4	Very high	128 Å²	128	76 Å²	76	48%	0.483	39%	0.391	S	S	.	.	S	Bend	trans	-65.4	153.4	176.2	72	-178.1	-165.9	-149.8	5.2	112	T30	T30-R55 HydrophobicContact CG2-CB 3.65Å
56	C	97.8	Very high	96.3	Very high	31 Å²	31	74.3 Å²	74.3	21%	0.209	39%	0.389	C	S	.	.			trans	-59.2	142	171.8	-58.8	0	0	0	0	111.5	C24 G28 A29 T30 Y52	C24-C56 WeakPolarHBondContact CA-SG 3.34Å; C24-C56 HydrophobicContact CB-CB 4.03Å; C24-C56 WeakPolarHBondContact CB-SG 3.28Å; C24-C56 WeakPolarHBondContact SG-CA 3.24Å; C24-C56 WeakPolarHBondContact SG-CB 3.13Å; C24-C56 CovalentContact SG-SG 2.04Å; C24-C56 PolarHBondContact SG-SG 3.43Å; G28-C56 VanDerWaalsContact C-SG 3.52Å; G28-C56 PolarHBondContact O-SG 2.04Å; A29-C56 VanDerWaalsContact C-SG 3.51Å; A29-C56 PolarHBondContact O-SG 3.38Å; T30-C56 PolarHBondContact OG1-N 2.04Å; Y52-C56 WeakPolarHBondContact OH-CA 3.43Å
57	R	97.6	Very high	96.3	Very high	86 Å²	86	81 Å²	81	33%	0.325	40%	0.401	S	S	.	.			trans	-119.8	157.1	-173.9	-61.3	-59.7	-176.3	147.9	-1.3	112.1	Y52 S59 V63 A79	Y52-R57 PolarHBondContact OH-N 3.08Å; R57-S59 WeakPolarHBondContact CB-O 3.19Å; R57-V63 HydrophobicContact CB-CG2 3.71Å; R57-V63 HydrophobicContact CG-CG2 3.78Å; R57-A79 HydrophobicContact CB-CB 4.4Å; R57-A79 PolarHBondContact O-N 3.01Å
58	K	96.3	Very high	96.2	Very high	138 Å²	138	79.3 Å²	79.3	60%	0.6	40%	0.398	S	S	*	.	S	Bend	trans	-99.1	19.4	175.3	-68.5	-62.8	-167.9	175	0	113.3	T76 G77 S78	K58-T76 PolarHBondContact NZ-O 2.02Å; K58-T76 PolarHBondContact NZ-OG1 2.93Å; K58-G77 CarbonylContact C-O 3.57Å; K58-G77 WeakPolarHBondContact CA-O 3.31Å; K58-S78 PolarHBondContact NZ-OG 3.16Å
59	S	96.2	Very high	96.2	Very high	48 Å²	48	82 Å²	82	34%	0.336	41%	0.41	S	S	.	.	S	Bend	trans	-166.4	160.7	174.9	67.8	0	0	0	0	109.6	R57 E61 V63 A79	R57-S59 WeakPolarHBondContact CB-O 3.19Å; S59-E61 VanDerWaalsContact C-N 3.33Å; S59-V63 WeakPolarHBondContact O-CG2 3.36Å; S59-A79 WeakPolarHBondContact O-CB 3.31Å
60	C	96.6	Very high	96.2	Very high	44 Å²	44	82 Å²	82	30%	0.297	41%	0.41	S	S	.	.	S	Bend	trans	-83.1	-3	176.5	-74.9	0	0	0	0	114.6	H62 V63 C71	C60-H62 VanDerWaalsContact C-N 3.26Å; C60-H62 PolarHBondContact O-N 2.84Å; C60-V63 PolarHBondContact O-N 3.17Å; C60-C71 WeakPolarHBondContact CA-SG 3.18Å; C60-C71 HydrophobicContact CB-CB 3.76Å; C60-C71 WeakPolarHBondContact CB-SG 3.04Å; C60-C71 WeakPolarHBondContact SG-CB 3.45Å; C60-C71 CovalentContact SG-SG 2.04Å; C60-C71 PolarHBondContact SG-SG 3.5Å
61	E	94.3	Very high	96.2	Very high	154 Å²	154	81.3 Å²	81.3	72%	0.72	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-34.2	-171.4	-170.1	-178.6	-174.3	0	0	113.8	S59	S59-E61 VanDerWaalsContact C-N 3.33Å
62	H	92.9	Very high	96.1	Very high	129 Å²	129	83.4 Å²	83.4	60%	0.597	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.2	25.7	-178	-61	108.5	0	0	0	112.3	C60	C60-H62 VanDerWaalsContact C-N 3.26Å; C60-H62 PolarHBondContact O-N 2.84Å
63	V	96.9	Very high	96.1	Very high	15 Å²	15	87 Å²	87	9%	0.091	44%	0.444	C	S	.	.			trans	-107.2	119.7	-179.2	177.7	0	0	0	0	109	Y52 R57 S59 C60 A79	Y52-V63 HydrophobicContact CD1-CG1 3.65Å; Y52-V63 HydrophobicContact CD2-CG1 4.17Å; Y52-V63 HydrophobicContact CE1-CG1 3.71Å; Y52-V63 HydrophobicContact CE2-CG1 4.23Å; Y52-V63 HydrophobicContact CE2-CG2 4.24Å; Y52-V63 HydrophobicContact CG-CG1 3.89Å; R57-V63 HydrophobicContact CB-CG2 3.71Å; R57-V63 HydrophobicContact CG-CG2 3.78Å; S59-V63 WeakPolarHBondContact O-CG2 3.36Å; C60-V63 PolarHBondContact O-N 3.17Å; V63-A79 HydrophobicContact CG2-CB 3.83Å
64	V	96.6	Very high	96.1	Very high	124 Å²	124	81.3 Å²	81.3	75%	0.752	43%	0.425	S	S	*	.			trans	-104.5	106.2	176.1	-177.7	0	0	0	0	108.3
65	C	96.3	Very high	96.1	Very high	23 Å²	23	88.7 Å²	88.7	16%	0.155	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-80.9	139.7	177.4	-62.9	0	0	0	0	111.6	R67 Q69 C71 C81	C65-R67 PolarHBondContact O-N 3.35Å; C65-Q69 HydrophobicContact CB-CB 4.09Å; C65-C71 VanDerWaalsContact SG-CB 3.59Å; C65-C81 WeakPolarHBondContact CA-SG 3.34Å; C65-C81 HydrophobicContact CB-CB 3.66Å; C65-C81 WeakPolarHBondContact CB-SG 3.41Å; C65-C81 VanDerWaalsContact SG-CA 3.55Å; C65-C81 WeakPolarHBondContact SG-CB 2.97Å; C65-C81 CovalentContact SG-SG 2.03Å; C65-C81 PolarHBondContact SG-SG 2.7Å
66	P	94.3	Very high	95.9	Very high	65 Å²	65	86.4 Å²	86.4	42%	0.422	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-59.6	133.5	167.8	-20.3	32.3	0	0	0	110.6	Q69	P66-Q69 WeakPolarHBondContact O-CA 3.5Å; P66-Q69 WeakPolarHBondContact O-CB 3.37Å; P66-Q69 VanDerWaalsContact O-CG 3.31Å; P66-Q69 WeakPolarHBondContact O-CG 3.22Å; P66-Q69 PolarHBondContact O-N 2.96Å
67	R	93.6	Very high	95.7	Very high	240 Å²	240	86 Å²	86	91%	0.906	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	143.8	174.1	-66.4	-173.8	-172	-105.6	2.6	110.1	C65	C65-R67 PolarHBondContact O-N 3.35Å
68	P	95.4	Very high	95.7	Very high	106 Å²	106	83.1 Å²	83.1	69%	0.688	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	cis	-91.5	22.2	6.7	38.1	-37.3	0	0	0	114.7
69	Q	97.1	Very high	95.7	Very high	63 Å²	63	76.7 Å²	76.7	29%	0.294	42%	0.42	S	S	.	.			trans	-76	150.2	-174.2	-54.4	168.3	17.2	0	0	112	C65 P66 C81 V82 V83	C65-Q69 HydrophobicContact CB-CB 4.09Å; P66-Q69 WeakPolarHBondContact O-CA 3.5Å; P66-Q69 WeakPolarHBondContact O-CB 3.37Å; P66-Q69 VanDerWaalsContact O-CG 3.31Å; P66-Q69 WeakPolarHBondContact O-CG 3.22Å; P66-Q69 PolarHBondContact O-N 2.96Å; Q69-C81 HydrophobicContact CB-CB 4.28Å; Q69-V82 CarbonylContact C-O 3.58Å; Q69-V82 VanDerWaalsContact CA-O 3.23Å; Q69-V82 WeakPolarHBondContact CA-O 3.5Å; Q69-V82 WeakPolarHBondContact CB-O 3.37Å; Q69-V83 HydrophobicContact CG-CG2 3.82Å
70	S	96.4	Very high	95.8	Very high	58 Å²	58	76.6 Å²	76.6	41%	0.406	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	149.7	171.5	-63.8	0	0	0	0	110.5	V82	S70-V82 PolarHBondContact N-O 3.48Å; S70-V82 PolarHBondContact O-N 3.02Å
71	C	97.4	Very high	95.8	Very high	40 Å²	40	75 Å²	75	27%	0.27	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	128.9	174.9	-169.7	0	0	0	0	110.5	C60 C65 H80	C60-C71 WeakPolarHBondContact CA-SG 3.18Å; C60-C71 HydrophobicContact CB-CB 3.76Å; C60-C71 WeakPolarHBondContact CB-SG 3.04Å; C60-C71 WeakPolarHBondContact SG-CB 3.45Å; C60-C71 CovalentContact SG-SG 2.04Å; C60-C71 PolarHBondContact SG-SG 3.5Å; C65-C71 VanDerWaalsContact SG-CB 3.59Å; C71-H80 WeakPolarHBondContact CA-O 3.47Å
72	V	96.8	Very high	95.9	Very high	62 Å²	62	70.3 Å²	70.3	38%	0.376	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	162.1	172.1	-59.7	0	0	0	0	109.8	A79 H80 V82	V72-A79 CarbonylContact O-C 2.87Å; V72-A79 WeakPolarHBondContact O-CA 3.25Å; V72-H80 HydrophobicContact CG2-CB 4.08Å; V72-H80 PolarHBondContact N-O 3.08Å; V72-H80 PolarHBondContact O-N 3.49Å; V72-V82 HydrophobicContact CG1-CG2 4.04Å; V72-V82 HydrophobicContact CG2-CG1 4.31Å; V72-V82 HydrophobicContact CG2-CG2 3.72Å
73	V	96.9	Very high	96.1	Very high	82 Å²	82	69 Å²	69	50%	0.497	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.5	172.5	-66.4	0	0	0	0	110.5	S78	V73-S78 CarbonylContact C-O 3.49Å; V73-S78 VanDerWaalsContact CA-O 3.25Å; V73-S78 WeakPolarHBondContact CA-O 3Å
74	D	95.1	Very high	95.3	Very high	45 Å²	45	75.4 Å²	75.4	24%	0.241	43%	0.43	C	S	.	.			trans	-83	-179.2	173.4	70.3	22.8	0	0	0	112.4	T76 G77 S78 H80	D74-T76 PolarHBondContact O-N 3.47Å; D74-T76 VanDerWaalsContact O-N 3.1Å; D74-T76 VanDerWaalsContact OD1-C 3.29Å; D74-T76 VanDerWaalsContact OD1-CA 3.22Å; D74-T76 WeakPolarHBondContact OD1-CA 3.32Å; D74-T76 WeakPolarHBondContact OD1-CB 3.01Å; D74-T76 PolarHBondContact OD1-N 2.83Å; D74-T76 PolarHBondContact OD1-OG1 3.14Å; D74-T76 PolarHBondContact OD2-OG1 3.22Å; D74-G77 PolarHBondContact O-N 3.39Å; D74-G77 PolarHBondContact OD1-N 2.74Å; D74-S78 PolarHBondContact N-O 3.39Å; D74-S78 PolarHBondContact OD1-N 2.93Å; D74-S78 VanDerWaalsContact OD2-CB 3.24Å; D74-S78 WeakPolarHBondContact OD2-CB 3.48Å; D74-S78 PolarHBondContact OD2-OG 3.38Å; D74-H80 IonicContact OD2-CD2 3.76Å; D74-H80 IonicContact OD2-CE1 3.85Å; D74-H80 IonicContact OD2-NE2 2.84Å; D74-H80 PolarHBondContact OD2-NE2 3.2Å
75	Q	95.9	Very high	95.3	Very high	182 Å²	182	73 Å²	73	85%	0.85	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.7	178.7	73.4	-80.6	13.8	0	0	114.4
76	T	94	Very high	95.2	Very high	80 Å²	80	75.6 Å²	75.6	49%	0.491	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	5.7	176.5	77.6	0	0	0	0	112.4	K58 D74 S78	K58-T76 PolarHBondContact NZ-O 2.02Å; K58-T76 PolarHBondContact NZ-OG1 2.93Å; D74-T76 PolarHBondContact O-N 3.47Å; D74-T76 VanDerWaalsContact O-N 3.1Å; D74-T76 VanDerWaalsContact OD1-C 3.29Å; D74-T76 VanDerWaalsContact OD1-CA 3.22Å; D74-T76 WeakPolarHBondContact OD1-CA 3.32Å; D74-T76 WeakPolarHBondContact OD1-CB 3.01Å; D74-T76 PolarHBondContact OD1-N 2.83Å; D74-T76 PolarHBondContact OD1-OG1 3.14Å; D74-T76 PolarHBondContact OD2-OG1 3.22Å; T76-S78 VanDerWaalsContact C-N 3.27Å; T76-S78 PolarHBondContact O-N 3.25Å; T76-S78 PolarHBondContact OG1-OG 3.24Å
77	G	93.9	Very high	95.3	Very high	23 Å²	23	76.2 Å²	76.2	24%	0.237	43%	0.428	C	S	.	.			trans	74.8	6.2	-175.4	0	0	0	0	0	114.6	K58 D74	K58-G77 CarbonylContact C-O 3.57Å; K58-G77 WeakPolarHBondContact CA-O 3.31Å; D74-G77 PolarHBondContact O-N 3.39Å; D74-G77 PolarHBondContact OD1-N 2.74Å
78	S	96.4	Very high	95.4	Very high	25 Å²	25	66.6 Å²	66.6	18%	0.175	40%	0.4	C	S	.	.			trans	-71.8	136	179.6	-44.5	0	0	0	0	110.5	K58 V73 D74 T76 H80	K58-S78 PolarHBondContact NZ-OG 3.16Å; V73-S78 CarbonylContact C-O 3.49Å; V73-S78 VanDerWaalsContact CA-O 3.25Å; V73-S78 WeakPolarHBondContact CA-O 3Å; D74-S78 PolarHBondContact N-O 3.39Å; D74-S78 PolarHBondContact OD1-N 2.93Å; D74-S78 VanDerWaalsContact OD2-CB 3.24Å; D74-S78 WeakPolarHBondContact OD2-CB 3.48Å; D74-S78 PolarHBondContact OD2-OG 3.38Å; T76-S78 VanDerWaalsContact C-N 3.27Å; T76-S78 PolarHBondContact O-N 3.25Å; T76-S78 PolarHBondContact OG1-OG 3.24Å; S78-H80 PolarHBondContact O-CD2 3.09Å
79	A	97.8	Very high	95.4	Very high	2 Å²	2	64.1 Å²	64.1	2%	0.017	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	131.8	-178.7	0	0	0	0	0	111.8	Y52 R57 S59 V63 V72	Y52-A79 WeakPolarHBondContact CE1-O 2.99Å; Y52-A79 PolarHBondContact OH-O 3.3Å; R57-A79 HydrophobicContact CB-CB 4.4Å; R57-A79 PolarHBondContact O-N 3.01Å; S59-A79 WeakPolarHBondContact O-CB 3.31Å; V63-A79 HydrophobicContact CG2-CB 3.83Å; V72-A79 CarbonylContact O-C 2.87Å; V72-A79 WeakPolarHBondContact O-CA 3.25Å
80	H	97.3	Very high	95.3	Very high	46 Å²	46	64.2 Å²	64.2	21%	0.213	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	137.4	-178.1	-62.5	-83.9	0	0	0	110.6	M51 C71 V72 D74 S78 V82	M51-H80 HydrophobicContact SD-CB 4.09Å; C71-H80 WeakPolarHBondContact CA-O 3.47Å; V72-H80 HydrophobicContact CG2-CB 4.08Å; V72-H80 PolarHBondContact N-O 3.08Å; V72-H80 PolarHBondContact O-N 3.49Å; D74-H80 IonicContact OD2-CD2 3.76Å; D74-H80 IonicContact OD2-CE1 3.85Å; D74-H80 IonicContact OD2-NE2 2.84Å; D74-H80 PolarHBondContact OD2-NE2 3.2Å; S78-H80 PolarHBondContact O-CD2 3.09Å; H80-V82 HydrophobicContact CB-CG1 4.33Å
81	C	97.8	Very high	95.2	Very high	11 Å²	11	64.6 Å²	64.6	7%	0.074	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	115.5	172.1	-66.1	0	0	0	0	109.2	M51 Y52 C65 Q69	M51-C81 HydrophobicContact CG-CB 3.9Å; M51-C81 PolarHBondContact SD-N 3.32Å; M51-C81 VanDerWaalsContact SD-N 3.39Å; Y52-C81 VanDerWaalsContact CD1-SG 3.51Å; C65-C81 WeakPolarHBondContact CA-SG 3.34Å; C65-C81 HydrophobicContact CB-CB 3.66Å; C65-C81 WeakPolarHBondContact CB-SG 3.41Å; C65-C81 VanDerWaalsContact SG-CA 3.55Å; C65-C81 WeakPolarHBondContact SG-CB 2.97Å; C65-C81 CovalentContact SG-SG 2.03Å; C65-C81 PolarHBondContact SG-SG 2.7Å; Q69-C81 HydrophobicContact CB-CB 4.28Å
82	V	96.1	Very high	95	Very high	56 Å²	56	66.5 Å²	66.5	34%	0.339	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	151.2	-174.9	-61.2	0	0	0	0	110.5	Q69 S70 V72 H80	Q69-V82 CarbonylContact C-O 3.58Å; Q69-V82 VanDerWaalsContact CA-O 3.23Å; Q69-V82 WeakPolarHBondContact CA-O 3.5Å; Q69-V82 WeakPolarHBondContact CB-O 3.37Å; S70-V82 PolarHBondContact N-O 3.48Å; S70-V82 PolarHBondContact O-N 3.02Å; V72-V82 HydrophobicContact CG1-CG2 4.04Å; V72-V82 HydrophobicContact CG2-CG1 4.31Å; V72-V82 HydrophobicContact CG2-CG2 3.72Å; H80-V82 HydrophobicContact CB-CG1 4.33Å
83	V	95.6	Very high	94.9	Very high	100 Å²	100	66.9 Å²	66.9	61%	0.606	40%	0.397	S	S	*	.			trans	-80.5	131.4	167.9	-177.2	0	0	0	0	107.7	Q69	Q69-V83 HydrophobicContact CG-CG2 3.82Å
84	C	81.8	Confident	94.7	Very high	151 Å²	151	65.5 Å²	65.5	100%	1.02	39%	0.388	S	S	*	.			trans	-99.9	0	176.7	-62.2	0	0	0	0	111

Retrieved 84 of 84 residues in 83.2 ms (Link to these results)

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