A0A5K4F6D9_SCHMA Loading...

Ovule protein

AlphaFold DB , UniProt , Accession A0A5K4F6D9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 79 aa.

						>A0A5K4F6D9_SCHMA|A0A5K4F6D9
MDVVNMMKCMYCSNVSICLSPTLSANYLYLNVYLSSTDVEYDVIKNHDSLICYFIQISKYSKVRIEDLTWYRTEELRVS
					

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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	41.8	Very low	40.4	Very low	191 Å²	191	110.1 Å²	110.1	94%	0.941	55%	0.547	S	S	*	.				0	96.4	0	-120.7	-175.2	169.6	0	0	103.2	V3 Y27	M1-V3 PolarHBondContact O-N 3.27Å; M1-Y27 HydrophobicContact CE-CE1 4.33Å
2	D	34.9	Very low	40.5	Very low	127 Å²	127	105.4 Å²	105.4	68%	0.679	53%	0.531	S	S	*	.			trans	-98.9	97	-163.3	-55.2	-21.4	0	0	0	107.9
3	V	41.6	Very low	41.3	Very low	85 Å²	85	102.4 Å²	102.4	52%	0.515	53%	0.526	S	S	.	.			trans	-79.1	118.5	171.3	175.9	0	0	0	0	106.7	M1 I17	M1-V3 PolarHBondContact O-N 3.27Å; V3-I17 HydrophobicContact CG1-CG2 4.09Å
4	V	44.1	Very low	41.8	Very low	34 Å²	34	98.4 Å²	98.4	21%	0.206	51%	0.506	C	S	.	.			trans	-92.5	-21.6	-162.4	-170.6	0	0	0	0	113	C18 L50	V4-C18 HydrophobicContact CB-CB 4.47Å; V4-C18 WeakPolarHBondContact CB-O 3.08Å; V4-C18 PolarHBondContact N-O 3.23Å; V4-L50 HydrophobicContact CB-CD1 4.34Å; V4-L50 HydrophobicContact CB-CD2 3.89Å; V4-L50 HydrophobicContact CG1-CD1 3.51Å; V4-L50 HydrophobicContact CG1-CD2 3.75Å; V4-L50 HydrophobicContact CG1-CG 4.3Å; V4-L50 HydrophobicContact CG2-CD2 3.78Å
5	N	44.5	Very low	42.6	Very low	69 Å²	69	91.9 Å²	91.9	37%	0.369	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	134.9	171.4	-151.2	-9.9	0	0	0	110.4	I17 C18	N5-I17 VanDerWaalsContact O-CA 3.29Å; N5-I17 WeakPolarHBondContact O-CA 3.26Å; N5-C18 HydrophobicContact CB-CB 3.87Å; N5-C18 PolarHBondContact O-N 3.42Å
6	M	43.7	Very low	43.1	Very low	17 Å²	17	87.1 Å²	87.1	8%	0.084	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	110	172.2	-168.3	164.1	137.1	0	0	111.9	V15 S16 I17 V32 L34 Y41	M6-V15 HydrophobicContact CE-CG1 3.44Å; M6-V15 VanDerWaalsContact CE-CG1 3.44Å; M6-V15 HydrophobicContact CE-CG2 4.28Å; M6-V15 HydrophobicContact CG-CG1 3.24Å; M6-V15 HydrophobicContact SD-CG1 3.5Å; M6-V15 WeakPolarHBondContact SD-CG1 3.16Å; M6-S16 WeakPolarHBondContact CA-O 2.95Å; M6-S16 WeakPolarHBondContact CG-O 3.18Å; M6-I17 HydrophobicContact CG-CG1 4.1Å; M6-I17 HydrophobicContact SD-CD1 3.88Å; M6-I17 HydrophobicContact SD-CG1 3.93Å; M6-V32 HydrophobicContact CE-CG1 3.86Å; M6-V32 HydrophobicContact SD-CG1 4.13Å; M6-L34 HydrophobicContact CE-CD2 3.41Å; M6-L34 VanDerWaalsContact CE-CD2 3.41Å; M6-L34 HydrophobicContact CE-CG 4.44Å; M6-Y41 HydrophobicContact CB-CD1 4.17Å; M6-Y41 HydrophobicContact CB-CE1 3.74Å; M6-Y41 HydrophobicContact CG-CE1 4.18Å; M6-Y41 WeakPolarHBondContact O-CD2 3.11Å; M6-Y41 WeakPolarHBondContact O-CE2 3.09Å
7	M	39.5	Very low	44.1	Very low	126 Å²	126	82.2 Å²	82.2	62%	0.621	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	120.3	-175.7	-162.5	167.3	148.8	0	0	109.5	S16	M7-S16 PolarHBondContact N-O 3.19Å; M7-S16 PolarHBondContact O-N 2.04Å
8	K	43	Very low	44.8	Very low	89 Å²	89	78.1 Å²	78.1	39%	0.387	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.8	179	-156.6	-176.2	-174.3	-166.7	0	109.3	V15 L34	K8-V15 HydrophobicContact CG-CG2 4.26Å; K8-L34 HydrophobicContact CD-CD2 3.78Å
9	C	36.5	Very low	45.4	Very low	59 Å²	59	74.7 Å²	74.7	40%	0.399	39%	0.387	S	S	.	.			trans	-89	137.6	168.1	134.5	0	0	0	0	108.8	Y11 C12	C9-Y11 PolarHBondContact O-N 3.4Å; C9-C12 HydrophobicContact CB-CB 3.43Å; C9-C12 VanDerWaalsContact CB-CB 3.43Å; C9-C12 WeakPolarHBondContact CB-SG 2.96Å; C9-C12 PolarHBondContact O-N 2.86Å; C9-C12 WeakPolarHBondContact SG-CB 3.35Å; C9-C12 PolarHBondContact SG-N 3Å; C9-C12 VanDerWaalsContact SG-N 3.4Å; C9-C12 CovalentContact SG-SG 2.04Å; C9-C12 PolarHBondContact SG-SG 3.33Å
10	M	36.7	Very low	45.8	Very low	187 Å²	187	72.7 Å²	72.7	92%	0.921	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-17.9	-172	-110.7	178.7	-178.8	0	0	114.8
11	Y	38	Very low	46.1	Very low	227 Å²	227	71.3 Å²	71.3	89%	0.89	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	1.5	174.6	-66.9	-80.4	0	0	0	113.5	C9	C9-Y11 PolarHBondContact O-N 3.4Å
12	C	42.1	Very low	46.7	Very low	54 Å²	54	67.4 Å²	67.4	37%	0.365	36%	0.362	S	S	.	.			trans	-98.4	121.4	-172	-62.4	0	0	0	0	109.2	C9 N14	C9-C12 HydrophobicContact CB-CB 3.43Å; C9-C12 VanDerWaalsContact CB-CB 3.43Å; C9-C12 WeakPolarHBondContact CB-SG 2.96Å; C9-C12 PolarHBondContact O-N 2.86Å; C9-C12 WeakPolarHBondContact SG-CB 3.35Å; C9-C12 PolarHBondContact SG-N 3Å; C9-C12 VanDerWaalsContact SG-N 3.4Å; C9-C12 CovalentContact SG-SG 2.04Å; C9-C12 PolarHBondContact SG-SG 3.33Å; C12-N14 PolarHBondContact O-N 2.97Å
13	S	50.3	Low	47.4	Very low	66 Å²	66	64 Å²	64	46%	0.462	34%	0.343	S	S	.	.	S	Bend	trans	-63	2.9	166.6	-44.8	0	0	0	0	112.6	Q56 I57	S13-Q56 CarbonylContact O-C 3.51Å; S13-Q56 VanDerWaalsContact O-CA 3.26Å; S13-Q56 WeakPolarHBondContact O-CA 3.29Å; S13-I57 PolarHBondContact O-N 3.44Å
14	N	48.4	Very low	47.8	Very low	47 Å²	47	61.4 Å²	61.4	25%	0.251	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.9	-166.9	-58.3	-6.2	0	0	0	111	C12 F54 I55 Q56	C12-N14 PolarHBondContact O-N 2.97Å; N14-F54 HydrophobicContact CB-CD1 3.85Å; N14-F54 HydrophobicContact CB-CE1 3.35Å; N14-F54 HydrophobicContact CB-CZ 4.28Å; N14-I55 CarbonylContact C-O 3.36Å; N14-I55 VanDerWaalsContact CA-O 3.29Å; N14-I55 WeakPolarHBondContact CA-O 3.26Å; N14-Q56 VanDerWaalsContact OD1-CB 3.26Å; N14-Q56 WeakPolarHBondContact OD1-CB 3.36Å; N14-Q56 WeakPolarHBondContact OD1-CG 3.45Å; N14-Q56 PolarHBondContact OD1-NE2 2.7Å
15	V	53.2	Low	48	Very low	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	121.1	-175.7	175.5	0	0	0	0	107.5	M6 K8 I17 L34 I55 I57	M6-V15 HydrophobicContact CE-CG1 3.44Å; M6-V15 VanDerWaalsContact CE-CG1 3.44Å; M6-V15 HydrophobicContact CE-CG2 4.28Å; M6-V15 HydrophobicContact CG-CG1 3.24Å; M6-V15 HydrophobicContact SD-CG1 3.5Å; M6-V15 WeakPolarHBondContact SD-CG1 3.16Å; K8-V15 HydrophobicContact CG-CG2 4.26Å; V15-I17 HydrophobicContact CG1-CD1 4.14Å; V15-I17 HydrophobicContact CG1-CG1 3.76Å; V15-L34 HydrophobicContact CG2-CD1 3.99Å; V15-L34 HydrophobicContact CG2-CD2 4.07Å; V15-L34 HydrophobicContact CG2-CG 4.49Å; V15-I55 PolarHBondContact N-O 3.39Å; V15-I55 PolarHBondContact O-N 2.91Å; V15-I57 HydrophobicContact CB-CD1 3.9Å; V15-I57 HydrophobicContact CB-CG1 4.44Å; V15-I57 HydrophobicContact CG1-CD1 4.37Å; V15-I57 HydrophobicContact CG2-CD1 3.76Å; V15-I57 HydrophobicContact CG2-CG1 4.27Å
16	S	51.8	Low	47.9	Very low	15 Å²	15	66.9 Å²	66.9	11%	0.105	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	138.1	164.6	-88.8	0	0	0	0	109.7	M6 M7 Y53 F54	M6-S16 WeakPolarHBondContact CA-O 2.95Å; M6-S16 WeakPolarHBondContact CG-O 3.18Å; M7-S16 PolarHBondContact N-O 3.19Å; M7-S16 PolarHBondContact O-N 2.04Å; S16-Y53 CarbonylContact C-O 3.38Å; S16-Y53 WeakPolarHBondContact CA-O 3.32Å; S16-F54 WeakPolarHBondContact OG-CD2 3.02Å; S16-F54 WeakPolarHBondContact OG-CE2 2.94Å
17	I	59.8	Low	48	Very low	4 Å²	4	71.8 Å²	71.8	2%	0.021	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120.7	171.4	-59	-174.1	0	0	0	109.3	V3 N5 M6 V15 L19 L30 V32 C52 Y53 I55	V3-I17 HydrophobicContact CG1-CG2 4.09Å; N5-I17 VanDerWaalsContact O-CA 3.29Å; N5-I17 WeakPolarHBondContact O-CA 3.26Å; M6-I17 HydrophobicContact CG-CG1 4.1Å; M6-I17 HydrophobicContact SD-CD1 3.88Å; M6-I17 HydrophobicContact SD-CG1 3.93Å; V15-I17 HydrophobicContact CG1-CD1 4.14Å; V15-I17 HydrophobicContact CG1-CG1 3.76Å; I17-L19 HydrophobicContact CG2-CD2 4.18Å; I17-L19 HydrophobicContact CG2-CG 4.27Å; I17-L30 HydrophobicContact CB-CD2 4.28Å; I17-L30 HydrophobicContact CD1-CD2 3.5Å; I17-L30 HydrophobicContact CG1-CD2 4.46Å; I17-L30 HydrophobicContact CG2-CD2 3.89Å; I17-V32 HydrophobicContact CD1-CB 4.24Å; I17-V32 HydrophobicContact CD1-CG1 3.87Å; I17-V32 HydrophobicContact CD1-CG2 3.29Å; I17-C52 CarbonylContact O-C 3.54Å; I17-C52 WeakPolarHBondContact O-CA 3.45Å; I17-Y53 PolarHBondContact N-O 3.46Å; I17-Y53 PolarHBondContact O-N 2.77Å; I17-I55 HydrophobicContact CB-CD1 4.5Å; I17-I55 HydrophobicContact CD1-CD1 3.65Å; I17-I55 HydrophobicContact CG1-CD1 4.13Å
18	C	56.3	Low	48.4	Very low	9 Å²	9	70.7 Å²	70.7	6%	0.061	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.9	175.7	-58	0	0	0	0	111.3	V4 N5 L50 I51 C52	V4-C18 HydrophobicContact CB-CB 4.47Å; V4-C18 WeakPolarHBondContact CB-O 3.08Å; V4-C18 PolarHBondContact N-O 3.23Å; N5-C18 HydrophobicContact CB-CB 3.87Å; N5-C18 PolarHBondContact O-N 3.42Å; C18-L50 HydrophobicContact CB-CB 4.49Å; C18-I51 CarbonylContact C-O 3.58Å; C18-I51 WeakPolarHBondContact CA-O 2.99Å; C18-C52 HydrophobicContact CB-CB 4.16Å; C18-C52 WeakPolarHBondContact CB-SG 3.23Å; C18-C52 WeakPolarHBondContact SG-CB 2.74Å; C18-C52 CovalentContact SG-SG 2.05Å; C18-C52 PolarHBondContact SG-SG 2.83Å
19	L	56.3	Low	48.2	Very low	14 Å²	14	71.3 Å²	71.3	7%	0.073	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147.5	179.3	-60.6	173.5	0	0	0	110.5	I17 L30 I51 Y53	I17-L19 HydrophobicContact CG2-CD2 4.18Å; I17-L19 HydrophobicContact CG2-CG 4.27Å; L19-L30 HydrophobicContact CD1-CD1 3.77Å; L19-L30 HydrophobicContact CD2-CD1 4.11Å; L19-I51 PolarHBondContact N-O 3.26Å; L19-I51 PolarHBondContact O-N 3.49Å; L19-Y53 HydrophobicContact CB-CE2 4.35Å; L19-Y53 HydrophobicContact CD1-CD2 4.12Å; L19-Y53 HydrophobicContact CD1-CE2 3.73Å; L19-Y53 HydrophobicContact CG-CD2 4.43Å; L19-Y53 HydrophobicContact CG-CE2 4.23Å
20	S	53.6	Low	48.9	Very low	34 Å²	34	69.8 Å²	69.8	24%	0.238	37%	0.371	C	S	.	.			trans	-66.1	137.5	166.6	171.8	0	0	0	0	110.7	T22 L23 S24	S20-T22 PolarHBondContact O-N 3.47Å; S20-T22 PolarHBondContact OG-OG1 2.76Å; S20-L23 WeakPolarHBondContact O-CA 3.29Å; S20-L23 WeakPolarHBondContact O-CB 3.22Å; S20-L23 PolarHBondContact O-N 3.04Å; S20-S24 PolarHBondContact O-N 3.09Å
21	P	51.9	Low	49	Very low	44 Å²	44	65.4 Å²	65.4	29%	0.286	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-25.1	-179.3	9.3	-15.9	0	0	0	113.3	L23 S24 S49 I51	P21-L23 PolarHBondContact O-N 3.25Å; P21-S24 WeakPolarHBondContact CA-OG 3.5Å; P21-S24 PolarHBondContact O-N 2.74Å; P21-S24 PolarHBondContact O-OG 2.78Å; P21-S24 VanDerWaalsContact O-OG 3.05Å; P21-S49 WeakPolarHBondContact CD-O 3.37Å; P21-S49 VanDerWaalsContact CG-O 3.23Å; P21-S49 WeakPolarHBondContact CG-O 3.38Å; P21-I51 HydrophobicContact CB-CD1 4.15Å; P21-I51 HydrophobicContact CB-CG1 4.47Å
22	T	54.1	Low	49.4	Very low	108 Å²	108	55.2 Å²	55.2	66%	0.663	31%	0.313	S	S	*	.	H	α-helix	trans	-67.6	-23.9	172.1	38.3	0	0	0	0	112.7	S20	S20-T22 PolarHBondContact O-N 3.47Å; S20-T22 PolarHBondContact OG-OG1 2.76Å
23	L	49.9	Very low	49.3	Very low	57 Å²	57	60.7 Å²	60.7	30%	0.298	33%	0.328	S	S	.	.	H	α-helix	trans	-86.6	-38.9	174.2	-73.7	163.1	0	0	0	111.7	S20 P21 A25 N26 Y27	S20-L23 WeakPolarHBondContact O-CA 3.29Å; S20-L23 WeakPolarHBondContact O-CB 3.22Å; S20-L23 PolarHBondContact O-N 3.04Å; P21-L23 PolarHBondContact O-N 3.25Å; L23-A25 PolarHBondContact O-N 3.03Å; L23-A25 VanDerWaalsContact O-N 3.12Å; L23-N26 PolarHBondContact O-N 3.04Å; L23-N26 VanDerWaalsContact O-N 3.08Å; L23-Y27 HydrophobicContact CD2-CD2 4.24Å; L23-Y27 HydrophobicContact CD2-CE2 3.66Å; L23-Y27 VanDerWaalsContact O-CD2 3.32Å; L23-Y27 WeakPolarHBondContact O-CD2 3.39Å
24	S	50.4	Low	48.8	Very low	29 Å²	29	58.6 Å²	58.6	20%	0.203	31%	0.311	C	S	.	.	H	α-helix	trans	-61.7	-24.8	-178.2	62.4	0	0	0	0	113.8	S20 P21	S20-S24 PolarHBondContact O-N 3.09Å; P21-S24 WeakPolarHBondContact CA-OG 3.5Å; P21-S24 PolarHBondContact O-N 2.74Å; P21-S24 PolarHBondContact O-OG 2.78Å; P21-S24 VanDerWaalsContact O-OG 3.05Å
25	A	48.4	Very low	48.3	Very low	85 Å²	85	59 Å²	59	70%	0.702	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-21.4	177.7	0	0	0	0	0	114.3	L23	L23-A25 PolarHBondContact O-N 3.03Å; L23-A25 VanDerWaalsContact O-N 3.12Å
26	N	42.5	Very low	47.3	Very low	134 Å²	134	64.4 Å²	64.4	72%	0.717	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	-4.3	-172.1	-80.9	-33.1	0	0	0	114.6	L23	L23-N26 PolarHBondContact O-N 3.04Å; L23-N26 VanDerWaalsContact O-N 3.08Å
27	Y	46.6	Very low	46.4	Very low	120 Å²	120	68.1 Å²	68.1	47%	0.471	38%	0.377	S	S	.	.			trans	-126	125.7	-177.2	-66.3	-81.2	0	0	0	110.7	M1 L23 I65	M1-Y27 HydrophobicContact CE-CE1 4.33Å; L23-Y27 HydrophobicContact CD2-CD2 4.24Å; L23-Y27 HydrophobicContact CD2-CE2 3.66Å; L23-Y27 VanDerWaalsContact O-CD2 3.32Å; L23-Y27 WeakPolarHBondContact O-CD2 3.39Å; Y27-I65 WeakPolarHBondContact O-CD1 3.48Å
28	L	46	Very low	45.1	Very low	102 Å²	102	75.5 Å²	75.5	53%	0.534	42%	0.417	S	S	.	.	S	Bend	trans	-83.3	-23.3	175.4	-88.4	128.6	0	0	0	113.3	I65	L28-I65 PolarHBondContact O-N 3.41Å
29	Y	39.6	Very low	44	Very low	102 Å²	102	78 Å²	78	40%	0.4	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	137.7	-170.1	-61.1	-89.4	0	0	0	110.6	K62 R64	Y29-K62 HydrophobicContact CD1-CG 4.43Å; Y29-R64 HydrophobicContact CD1-CG 3.64Å; Y29-R64 HydrophobicContact CE1-CB 4.45Å; Y29-R64 HydrophobicContact CE1-CG 3.19Å
30	L	51.1	Low	42.6	Very low	27 Å²	27	86.4 Å²	86.4	14%	0.141	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121.9	170.7	-161.2	81.5	0	0	0	108.9	I17 L19 V32 I55 V63 I65	I17-L30 HydrophobicContact CB-CD2 4.28Å; I17-L30 HydrophobicContact CD1-CD2 3.5Å; I17-L30 HydrophobicContact CG1-CD2 4.46Å; I17-L30 HydrophobicContact CG2-CD2 3.89Å; L19-L30 HydrophobicContact CD1-CD1 3.77Å; L19-L30 HydrophobicContact CD2-CD1 4.11Å; L30-V32 HydrophobicContact CD2-CG2 3.65Å; L30-V32 HydrophobicContact CG-CG2 4.13Å; L30-I55 HydrophobicContact CD2-CD1 4.04Å; L30-V63 PolarHBondContact N-O 3.14Å; L30-V63 VanDerWaalsContact N-O 3.17Å; L30-I65 HydrophobicContact CB-CD1 4.32Å; L30-I65 HydrophobicContact CB-CG1 4.09Å
31	N	40	Very low	41.6	Very low	95 Å²	95	89.1 Å²	89.1	51%	0.508	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	112.1	172.5	-75.7	-24.4	0	0	0	108.7	Y33 K62	N31-Y33 HydrophobicContact CB-CE2 4Å; N31-K62 WeakPolarHBondContact OD1-CG 3.41Å
32	V	46	Very low	40.4	Very low	13 Å²	13	94.5 Å²	94.5	8%	0.079	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114.2	177.9	-171	0	0	0	0	109.1	M6 I17 L30 I55 I57	M6-V32 HydrophobicContact CE-CG1 3.86Å; M6-V32 HydrophobicContact SD-CG1 4.13Å; I17-V32 HydrophobicContact CD1-CB 4.24Å; I17-V32 HydrophobicContact CD1-CG1 3.87Å; I17-V32 HydrophobicContact CD1-CG2 3.29Å; L30-V32 HydrophobicContact CD2-CG2 3.65Å; L30-V32 HydrophobicContact CG-CG2 4.13Å; V32-I55 HydrophobicContact CG2-CD1 4.1Å; V32-I57 HydrophobicContact CB-CD1 3.83Å; V32-I57 HydrophobicContact CG1-CD1 3.45Å; V32-I57 VanDerWaalsContact CG1-CD1 3.45Å; V32-I57 HydrophobicContact CG2-CD1 4.36Å
33	Y	38.8	Very low	39.2	Very low	170 Å²	170	93.4 Å²	93.4	67%	0.667	50%	0.495	S	S	*	.			trans	-97.9	103.7	175.9	-71	-87.3	0	0	0	109.6	N31 S35 Y60	N31-Y33 HydrophobicContact CB-CE2 4Å; Y33-S35 PolarHBondContact O-N 2.77Å; Y33-Y60 HydrophobicContact CD1-CD1 4.3Å; Y33-Y60 HydrophobicContact CD1-CE1 4.16Å
34	L	41	Very low	38.2	Very low	22 Å²	22	96.7 Å²	96.7	12%	0.115	51%	0.512	C	S	.	.			trans	-87.8	91.7	169.9	-75.5	179.5	0	0	0	109.4	M6 K8 V15 I57	M6-L34 HydrophobicContact CE-CD2 3.41Å; M6-L34 VanDerWaalsContact CE-CD2 3.41Å; M6-L34 HydrophobicContact CE-CG 4.44Å; K8-L34 HydrophobicContact CD-CD2 3.78Å; V15-L34 HydrophobicContact CG2-CD1 3.99Å; V15-L34 HydrophobicContact CG2-CD2 4.07Å; V15-L34 HydrophobicContact CG2-CG 4.49Å; L34-I57 HydrophobicContact CD1-CB 3.68Å; L34-I57 HydrophobicContact CD1-CD1 3.86Å; L34-I57 HydrophobicContact CD1-CG1 4.28Å; L34-I57 HydrophobicContact CD1-CG2 3.74Å; L34-I57 HydrophobicContact CG-CD1 4.19Å; L34-I57 HydrophobicContact CG-CG2 4.48Å
35	S	36.4	Very low	37.3	Very low	55 Å²	55	104.5 Å²	104.5	39%	0.385	54%	0.542	S	S	.	.			trans	-64	137.6	160.9	171.6	0	0	0	0	109.1	Y33 T37	Y33-S35 PolarHBondContact O-N 2.77Å; S35-T37 PolarHBondContact O-N 3.45Å; S35-T37 PolarHBondContact OG-N 3Å; S35-T37 PolarHBondContact OG-O 3.39Å; S35-T37 PolarHBondContact OG-OG1 3.11Å
36	S	33.5	Very low	36.5	Very low	113 Å²	113	105.4 Å²	105.4	79%	0.79	54%	0.535	S	S	*	.	S	Bend	trans	-72	-0.1	178.5	45.6	0	0	0	0	114.2
37	T	32.3	Very low	36.1	Very low	93 Å²	93	105.6 Å²	105.6	57%	0.571	53%	0.532	S	S	*	.	S	Bend	trans	-129.6	123.2	-178.6	41.5	0	0	0	0	108.7	S35	S35-T37 PolarHBondContact O-N 3.45Å; S35-T37 PolarHBondContact OG-N 3Å; S35-T37 PolarHBondContact OG-O 3.39Å; S35-T37 PolarHBondContact OG-OG1 3.11Å
38	D	32.7	Very low	36.1	Very low	160 Å²	160	107.7 Å²	107.7	86%	0.856	55%	0.551	S	S	*	*			trans	31.1	98.2	165	-60.9	-40.9	0	0	0	116
39	V	33.3	Very low	36.3	Very low	60 Å²	60	106.2 Å²	106.2	36%	0.364	55%	0.549	S	S	.	.			trans	-101.6	103.9	165.1	-161.9	0	0	0	0	106.9	Y41	V39-Y41 HydrophobicContact CB-CE1 3.69Å; V39-Y41 HydrophobicContact CG1-CD1 3.76Å; V39-Y41 HydrophobicContact CG1-CE1 3.12Å; V39-Y41 WeakPolarHBondContact O-CE2 3.49Å
40	E	26.8	Very low	36.9	Very low	192 Å²	192	103.2 Å²	103.2	90%	0.897	54%	0.54	S	S	*	.			trans	-84.5	135.7	173.9	-153.5	173.2	-157.4	0	0	108.2
41	Y	33.1	Very low	37	Very low	91 Å²	91	104.3 Å²	104.3	36%	0.357	55%	0.545	S	S	.	.			trans	-132.3	133.5	179.9	-28.5	-90.9	0	0	0	111.4	M6 V39	M6-Y41 HydrophobicContact CB-CD1 4.17Å; M6-Y41 HydrophobicContact CB-CE1 3.74Å; M6-Y41 HydrophobicContact CG-CE1 4.18Å; M6-Y41 WeakPolarHBondContact O-CD2 3.11Å; M6-Y41 WeakPolarHBondContact O-CE2 3.09Å; V39-Y41 HydrophobicContact CB-CE1 3.69Å; V39-Y41 HydrophobicContact CG1-CD1 3.76Å; V39-Y41 HydrophobicContact CG1-CE1 3.12Å; V39-Y41 WeakPolarHBondContact O-CE2 3.49Å
42	D	25.8	Very low	37.8	Very low	157 Å²	157	99.9 Å²	99.9	84%	0.84	52%	0.522	S	S	*	.			trans	-92.6	113.9	174.3	-129.5	-18.3	0	0	0	109.1	I44	D42-I44 PolarHBondContact O-N 3.14Å
43	V	29.8	Very low	38.2	Very low	84 Å²	84	100 Å²	100	51%	0.509	52%	0.521	S	S	.	.			trans	-85.3	97.7	-176.7	-179.5	0	0	0	0	109.4	K45	V43-K45 HydrophobicContact CG1-CG 4.27Å; V43-K45 PolarHBondContact O-N 2.84Å
44	I	28.7	Very low	38.9	Very low	127 Å²	127	96 Å²	96	65%	0.651	51%	0.507	S	S	*	.			trans	-88.3	97.3	165.8	-56.1	177.7	0	0	0	107.8	D42 N46	D42-I44 PolarHBondContact O-N 3.14Å; I44-N46 HydrophobicContact CG2-CB 4.46Å; I44-N46 PolarHBondContact O-N 2.05Å
45	K	30.4	Very low	39.6	Very low	193 Å²	193	95.1 Å²	95.1	84%	0.839	50%	0.502	S	S	*	.			trans	-64.6	102.6	166.4	-78.5	-178.1	177.4	177.6	0	108.2	V43	V43-K45 HydrophobicContact CG1-CG 4.27Å; V43-K45 PolarHBondContact O-N 2.84Å
46	N	31.2	Very low	40.2	Very low	104 Å²	104	99.4 Å²	99.4	56%	0.556	52%	0.516	S	S	*	.			trans	-141.7	121.8	162.8	-134.6	-1.2	0	0	0	112.2	I44	I44-N46 HydrophobicContact CG2-CB 4.46Å; I44-N46 PolarHBondContact O-N 2.05Å
47	H	35.9	Very low	41.2	Very low	138 Å²	138	94.5 Å²	94.5	64%	0.639	48%	0.481	S	S	*	.			trans	75.9	137.4	161.8	-76.3	-71.3	0	0	0	121.4	S49	H47-S49 PolarHBondContact O-N 2.98Å
48	D	45.5	Very low	41.8	Very low	164 Å²	164	94.3 Å²	94.3	88%	0.877	48%	0.484	S	S	*	.	S	Bend	trans	-61	26.3	-170.8	-59	-64.8	0	0	0	117
49	S	51.1	Low	42.4	Very low	70 Å²	70	95.2 Å²	95.2	49%	0.49	48%	0.48	S	S	.	.			trans	-155.2	78.7	-177.4	37.9	0	0	0	0	108.2	P21 H47	P21-S49 WeakPolarHBondContact CD-O 3.37Å; P21-S49 VanDerWaalsContact CG-O 3.23Å; P21-S49 WeakPolarHBondContact CG-O 3.38Å; H47-S49 PolarHBondContact O-N 2.98Å
50	L	51.8	Low	43	Very low	39 Å²	39	99.4 Å²	99.4	20%	0.204	49%	0.49	C	S	.	.			trans	-118.3	128.4	170.1	-71.4	168.4	0	0	0	108	V4 C18 T73	V4-L50 HydrophobicContact CB-CD1 4.34Å; V4-L50 HydrophobicContact CB-CD2 3.89Å; V4-L50 HydrophobicContact CG1-CD1 3.51Å; V4-L50 HydrophobicContact CG1-CD2 3.75Å; V4-L50 HydrophobicContact CG1-CG 4.3Å; V4-L50 HydrophobicContact CG2-CD2 3.78Å; C18-L50 HydrophobicContact CB-CB 4.49Å; L50-T73 PolarHBondContact O-OG1 3.26Å
51	I	52.1	Low	44	Very low	51 Å²	51	92.2 Å²	92.2	26%	0.262	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	116.9	173.9	-58	178.7	0	0	0	107.2	C18 L19 P21 Y53 W70	C18-I51 CarbonylContact C-O 3.58Å; C18-I51 WeakPolarHBondContact CA-O 2.99Å; L19-I51 PolarHBondContact N-O 3.26Å; L19-I51 PolarHBondContact O-N 3.49Å; P21-I51 HydrophobicContact CB-CD1 4.15Å; P21-I51 HydrophobicContact CB-CG1 4.47Å; I51-Y53 HydrophobicContact CB-CE2 4.23Å; I51-Y53 HydrophobicContact CG2-CD2 4.42Å; I51-Y53 HydrophobicContact CG2-CE1 4.07Å; I51-Y53 HydrophobicContact CG2-CE2 3.69Å; I51-W70 HydrophobicContact CG2-CB 4.11Å
52	C	57.1	Low	44.6	Very low	2 Å²	2	94.8 Å²	94.8	1%	0.014	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.3	179.6	-61.1	0	0	0	0	110.5	I17 C18 Y71 L76	I17-C52 CarbonylContact O-C 3.54Å; I17-C52 WeakPolarHBondContact O-CA 3.45Å; C18-C52 HydrophobicContact CB-CB 4.16Å; C18-C52 WeakPolarHBondContact CB-SG 3.23Å; C18-C52 WeakPolarHBondContact SG-CB 2.74Å; C18-C52 CovalentContact SG-SG 2.05Å; C18-C52 PolarHBondContact SG-SG 2.83Å; C52-Y71 PolarHBondContact O-N 2.79Å; C52-L76 HydrophobicContact CB-CD1 3.56Å
53	Y	54.5	Low	45.9	Very low	15 Å²	15	88.5 Å²	88.5	6%	0.059	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.7	-179.4	-61	-82.1	0	0	0	109.3	S16 I17 L19 I51 I65 L68 W70	S16-Y53 CarbonylContact C-O 3.38Å; S16-Y53 WeakPolarHBondContact CA-O 3.32Å; I17-Y53 PolarHBondContact N-O 3.46Å; I17-Y53 PolarHBondContact O-N 2.77Å; L19-Y53 HydrophobicContact CB-CE2 4.35Å; L19-Y53 HydrophobicContact CD1-CD2 4.12Å; L19-Y53 HydrophobicContact CD1-CE2 3.73Å; L19-Y53 HydrophobicContact CG-CD2 4.43Å; L19-Y53 HydrophobicContact CG-CE2 4.23Å; I51-Y53 HydrophobicContact CB-CE2 4.23Å; I51-Y53 HydrophobicContact CG2-CD2 4.42Å; I51-Y53 HydrophobicContact CG2-CE1 4.07Å; I51-Y53 HydrophobicContact CG2-CE2 3.69Å; Y53-I65 HydrophobicContact CE1-CG2 3.94Å; Y53-L68 HydrophobicContact CD1-CB 3.39Å; Y53-L68 HydrophobicContact CD1-CD1 3.86Å; Y53-L68 HydrophobicContact CD1-CG 4.26Å; Y53-L68 HydrophobicContact CE1-CB 4.1Å; Y53-L68 HydrophobicContact CG-CB 4.1Å; Y53-L68 HydrophobicContact CG-CD1 3.85Å; Y53-W70 HydrophobicContact CD1-CB 4.38Å; Y53-W70 HydrophobicContact CE1-CB 4.18Å
54	F	53.2	Low	46.9	Very low	85 Å²	85	90.4 Å²	90.4	37%	0.373	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121	170.1	-135.3	-97.3	0	0	0	108.6	N14 S16 T69 Y71 L76	N14-F54 HydrophobicContact CB-CD1 3.85Å; N14-F54 HydrophobicContact CB-CE1 3.35Å; N14-F54 HydrophobicContact CB-CZ 4.28Å; S16-F54 WeakPolarHBondContact OG-CD2 3.02Å; S16-F54 WeakPolarHBondContact OG-CE2 2.94Å; F54-T69 PolarHBondContact N-O 3.17Å; F54-Y71 HydrophobicContact CB-CD2 4.15Å; F54-Y71 HydrophobicContact CB-CE2 3.74Å; F54-L76 HydrophobicContact CD2-CD2 4.46Å; F54-L76 HydrophobicContact CE2-CD2 4.39Å
55	I	55.5	Low	47.9	Very low	4 Å²	4	85.2 Å²	85.2	2%	0.021	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120	-174.8	-39.7	-168.8	0	0	0	109	N14 V15 I17 L30 V32 I57 V63 L68	N14-I55 CarbonylContact C-O 3.36Å; N14-I55 VanDerWaalsContact CA-O 3.29Å; N14-I55 WeakPolarHBondContact CA-O 3.26Å; V15-I55 PolarHBondContact N-O 3.39Å; V15-I55 PolarHBondContact O-N 2.91Å; I17-I55 HydrophobicContact CB-CD1 4.5Å; I17-I55 HydrophobicContact CD1-CD1 3.65Å; I17-I55 HydrophobicContact CG1-CD1 4.13Å; L30-I55 HydrophobicContact CD2-CD1 4.04Å; V32-I55 HydrophobicContact CG2-CD1 4.1Å; I55-I57 HydrophobicContact CB-CD1 4.27Å; I55-I57 HydrophobicContact CB-CG1 3.96Å; I55-I57 HydrophobicContact CG2-CD1 4.1Å; I55-I57 HydrophobicContact CG2-CG1 3.54Å; I55-I57 PolarHBondContact O-N 3.48Å; I55-V63 HydrophobicContact CG2-CG2 4.03Å; I55-L68 HydrophobicContact CB-CD2 4.15Å; I55-L68 HydrophobicContact CD1-CD1 3.75Å; I55-L68 HydrophobicContact CD1-CD2 3.82Å; I55-L68 HydrophobicContact CD1-CG 4.46Å; I55-L68 HydrophobicContact CG1-CD1 4.21Å; I55-L68 HydrophobicContact CG1-CD2 3.6Å; I55-L68 HydrophobicContact CG2-CD2 3.87Å
56	Q	50.8	Low	49	Very low	145 Å²	145	82.8 Å²	82.8	68%	0.678	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	103.3	169.6	-171.8	153.8	19	0	0	108.7	S13 N14	S13-Q56 CarbonylContact O-C 3.51Å; S13-Q56 VanDerWaalsContact O-CA 3.26Å; S13-Q56 WeakPolarHBondContact O-CA 3.29Å; N14-Q56 VanDerWaalsContact OD1-CB 3.26Å; N14-Q56 WeakPolarHBondContact OD1-CB 3.36Å; N14-Q56 WeakPolarHBondContact OD1-CG 3.45Å; N14-Q56 PolarHBondContact OD1-NE2 2.7Å
57	I	53.4	Low	49.9	Very low	10 Å²	10	83.4 Å²	83.4	5%	0.051	41%	0.408	C	S	.	.			trans	-104	111.9	-173.7	-46.8	-178.8	0	0	0	109.3	S13 V15 V32 L34 I55	S13-I57 PolarHBondContact O-N 3.44Å; V15-I57 HydrophobicContact CB-CD1 3.9Å; V15-I57 HydrophobicContact CB-CG1 4.44Å; V15-I57 HydrophobicContact CG1-CD1 4.37Å; V15-I57 HydrophobicContact CG2-CD1 3.76Å; V15-I57 HydrophobicContact CG2-CG1 4.27Å; V32-I57 HydrophobicContact CB-CD1 3.83Å; V32-I57 HydrophobicContact CG1-CD1 3.45Å; V32-I57 VanDerWaalsContact CG1-CD1 3.45Å; V32-I57 HydrophobicContact CG2-CD1 4.36Å; L34-I57 HydrophobicContact CD1-CB 3.68Å; L34-I57 HydrophobicContact CD1-CD1 3.86Å; L34-I57 HydrophobicContact CD1-CG1 4.28Å; L34-I57 HydrophobicContact CD1-CG2 3.74Å; L34-I57 HydrophobicContact CG-CD1 4.19Å; L34-I57 HydrophobicContact CG-CG2 4.48Å; I55-I57 HydrophobicContact CB-CD1 4.27Å; I55-I57 HydrophobicContact CB-CG1 3.96Å; I55-I57 HydrophobicContact CG2-CD1 4.1Å; I55-I57 HydrophobicContact CG2-CG1 3.54Å; I55-I57 PolarHBondContact O-N 3.48Å
58	S	45.1	Very low	50.6	Low	89 Å²	89	77.4 Å²	77.4	62%	0.622	38%	0.381	S	S	*	.			trans	-85	144.2	155.2	62.2	0	0	0	0	108.7	Y60 S61	S58-Y60 PolarHBondContact O-N 2.88Å; S58-S61 PolarHBondContact O-OG 3.29Å; S58-S61 VanDerWaalsContact O-OG 3.09Å
59	K	45.9	Very low	50.7	Low	179 Å²	179	73.5 Å²	73.5	78%	0.778	36%	0.363	S	S	*	.	S	Bend	trans	-29	106.7	-170.9	-123.5	177.5	179.9	180	0	112.8
60	Y	45	Very low	50.5	Low	149 Å²	149	78.4 Å²	78.4	58%	0.584	37%	0.37	S	S	*	.	S	Bend	trans	62.1	96.7	-179.6	-57.1	-86.6	0	0	0	115.4	Y33 S58	Y33-Y60 HydrophobicContact CD1-CD1 4.3Å; Y33-Y60 HydrophobicContact CD1-CE1 4.16Å; S58-Y60 PolarHBondContact O-N 2.88Å
61	S	48.1	Very low	50.1	Low	41 Å²	41	80.8 Å²	80.8	29%	0.287	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.7	174.4	-62.3	0	0	0	0	110.7	S58	S58-S61 PolarHBondContact O-OG 3.29Å; S58-S61 VanDerWaalsContact O-OG 3.09Å
62	K	46.4	Very low	49.5	Very low	145 Å²	145	86.4 Å²	86.4	63%	0.63	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	113	165.6	-174	172.8	-172.2	-174.5	0	106.9	Y29 N31	Y29-K62 HydrophobicContact CD1-CG 4.43Å; N31-K62 WeakPolarHBondContact OD1-CG 3.41Å
63	V	52.1	Low	48.6	Very low	25 Å²	25	90 Å²	90	15%	0.152	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.2	-172.7	-167.4	0	0	0	0	109.4	L30 I55 L68	L30-V63 PolarHBondContact N-O 3.14Å; L30-V63 VanDerWaalsContact N-O 3.17Å; I55-V63 HydrophobicContact CG2-CG2 4.03Å; V63-L68 HydrophobicContact CB-CD2 4.38Å; V63-L68 HydrophobicContact CG1-CD2 3.44Å; V63-L68 VanDerWaalsContact CG1-CD2 3.44Å; V63-L68 HydrophobicContact CG1-CG 3.99Å
64	R	51.3	Low	47.6	Very low	123 Å²	123	96.6 Å²	96.6	46%	0.464	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	136.3	169.6	-83.5	-176.4	-124.6	-155.8	0.8	108.5	Y29 E66 D67	Y29-R64 HydrophobicContact CD1-CG 3.64Å; Y29-R64 HydrophobicContact CE1-CB 4.45Å; Y29-R64 HydrophobicContact CE1-CG 3.19Å; R64-E66 PolarHBondContact O-N 3.22Å; R64-D67 HydrophobicContact CB-CB 4.42Å; R64-D67 WeakPolarHBondContact CB-OD2 3.39Å; R64-D67 PolarHBondContact O-N 2.91Å; R64-D67 VanDerWaalsContact O-N 3.09Å
65	I	50.1	Low	46.8	Very low	19 Å²	19	99.1 Å²	99.1	10%	0.097	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-63.5	-28.8	179	-71.1	163.5	0	0	0	111.1	Y27 L28 L30 Y53 D67 L68	Y27-I65 WeakPolarHBondContact O-CD1 3.48Å; L28-I65 PolarHBondContact O-N 3.41Å; L30-I65 HydrophobicContact CB-CD1 4.32Å; L30-I65 HydrophobicContact CB-CG1 4.09Å; Y53-I65 HydrophobicContact CE1-CG2 3.94Å; I65-D67 VanDerWaalsContact C-N 3.28Å; I65-D67 PolarHBondContact O-N 3.09Å; I65-L68 HydrophobicContact CG1-CD1 4.37Å; I65-L68 WeakPolarHBondContact O-CB 3.14Å; I65-L68 PolarHBondContact O-N 2.86Å; I65-L68 VanDerWaalsContact O-N 3.14Å
66	E	52.2	Low	45.9	Very low	142 Å²	142	101.4 Å²	101.4	66%	0.664	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-65.1	-29.8	175.8	-59.1	174.4	-168.7	0	0	113.4	R64	R64-E66 PolarHBondContact O-N 3.22Å
67	D	51.1	Low	45	Very low	116 Å²	116	105.4 Å²	105.4	62%	0.62	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-83.2	-6.7	178.1	-62.4	-30.5	0	0	0	111.6	R64 I65	R64-D67 HydrophobicContact CB-CB 4.42Å; R64-D67 WeakPolarHBondContact CB-OD2 3.39Å; R64-D67 PolarHBondContact O-N 2.91Å; R64-D67 VanDerWaalsContact O-N 3.09Å; I65-D67 VanDerWaalsContact C-N 3.28Å; I65-D67 PolarHBondContact O-N 3.09Å
68	L	51	Low	43.9	Very low	13 Å²	13	110.4 Å²	110.4	7%	0.068	51%	0.513	C	S	.	.	S	Bend	trans	-86	131.4	178.8	-60.9	177.8	0	0	0	110.6	Y53 I55 V63 I65 W70	Y53-L68 HydrophobicContact CD1-CB 3.39Å; Y53-L68 HydrophobicContact CD1-CD1 3.86Å; Y53-L68 HydrophobicContact CD1-CG 4.26Å; Y53-L68 HydrophobicContact CE1-CB 4.1Å; Y53-L68 HydrophobicContact CG-CB 4.1Å; Y53-L68 HydrophobicContact CG-CD1 3.85Å; I55-L68 HydrophobicContact CB-CD2 4.15Å; I55-L68 HydrophobicContact CD1-CD1 3.75Å; I55-L68 HydrophobicContact CD1-CD2 3.82Å; I55-L68 HydrophobicContact CD1-CG 4.46Å; I55-L68 HydrophobicContact CG1-CD1 4.21Å; I55-L68 HydrophobicContact CG1-CD2 3.6Å; I55-L68 HydrophobicContact CG2-CD2 3.87Å; V63-L68 HydrophobicContact CB-CD2 4.38Å; V63-L68 HydrophobicContact CG1-CD2 3.44Å; V63-L68 VanDerWaalsContact CG1-CD2 3.44Å; V63-L68 HydrophobicContact CG1-CG 3.99Å; I65-L68 HydrophobicContact CG1-CD1 4.37Å; I65-L68 WeakPolarHBondContact O-CB 3.14Å; I65-L68 PolarHBondContact O-N 2.86Å; I65-L68 VanDerWaalsContact O-N 3.14Å; L68-W70 PolarHBondContact O-N 3.2Å
69	T	46.2	Very low	43.2	Very low	81 Å²	81	114.9 Å²	114.9	50%	0.497	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	115.7	169.5	-38.4	0	0	0	0	108.5	F54 Y71	F54-T69 PolarHBondContact N-O 3.17Å; T69-Y71 HydrophobicContact CG2-CE1 4.37Å; T69-Y71 HydrophobicContact CG2-CE2 3.95Å; T69-Y71 WeakPolarHBondContact O-CD2 3.49Å
70	W	47.9	Very low	43.1	Very low	173 Å²	173	111.7 Å²	111.7	66%	0.655	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	137.2	173.3	55.6	-84.4	0	0	0	109	I51 Y53 L68	I51-W70 HydrophobicContact CG2-CB 4.11Å; Y53-W70 HydrophobicContact CD1-CB 4.38Å; Y53-W70 HydrophobicContact CE1-CB 4.18Å; L68-W70 PolarHBondContact O-N 3.2Å
71	Y	43.2	Very low	43	Very low	89 Å²	89	109.7 Å²	109.7	35%	0.349	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.7	171.2	-63.1	-86.6	0	0	0	108.2	C52 F54 T69 T73	C52-Y71 PolarHBondContact O-N 2.79Å; F54-Y71 HydrophobicContact CB-CD2 4.15Å; F54-Y71 HydrophobicContact CB-CE2 3.74Å; T69-Y71 HydrophobicContact CG2-CE1 4.37Å; T69-Y71 HydrophobicContact CG2-CE2 3.95Å; T69-Y71 WeakPolarHBondContact O-CD2 3.49Å; Y71-T73 PolarHBondContact O-N 3.48Å
72	R	38.6	Very low	42.7	Very low	170 Å²	170	113.5 Å²	113.5	64%	0.642	54%	0.543	S	S	*	.			trans	-65.6	137	169.1	-118	-179.2	-159.3	-171.7	6.4	107.5	E74 E75	R72-E74 PolarHBondContact O-N 3.05Å; R72-E75 PolarHBondContact O-N 3.08Å
73	T	38.9	Very low	42.5	Very low	76 Å²	76	111.6 Å²	111.6	47%	0.466	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-20.8	-175.9	-15.1	0	0	0	0	113	L50 Y71	L50-T73 PolarHBondContact O-OG1 3.26Å; Y71-T73 PolarHBondContact O-N 3.48Å
74	E	34.6	Very low	41.9	Very low	155 Å²	155	117.1 Å²	117.1	72%	0.724	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-28.1	173.8	-60.6	-175.7	150.7	0	0	113.9	R72	R72-E74 PolarHBondContact O-N 3.05Å
75	E	34.5	Very low	41.2	Very low	138 Å²	138	116.7 Å²	116.7	65%	0.645	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-18.4	179.6	-65.3	-176.8	156.3	0	0	112.8	R72 R77	R72-E75 PolarHBondContact O-N 3.08Å; E75-R77 PolarHBondContact O-N 3.39Å; E75-R77 VanDerWaalsContact O-N 3.11Å
76	L	36.9	Very low	40.6	Very low	52 Å²	52	123.6 Å²	123.6	27%	0.272	60%	0.603	S	S	.	*			trans	-80.6	23.9	178	-84.6	160	0	0	0	113.2	C52 F54 V78	C52-L76 HydrophobicContact CB-CD1 3.56Å; F54-L76 HydrophobicContact CD2-CD2 4.46Å; F54-L76 HydrophobicContact CE2-CD2 4.39Å; L76-V78 WeakPolarHBondContact O-CG2 3.32Å; L76-V78 PolarHBondContact O-N 3.12Å
77	R	32.1	Very low	39.7	Very low	229 Å²	229	122.2 Å²	122.2	86%	0.864	60%	0.598	S	S	*	*			trans	-67.9	85.5	163.7	-80.7	-174	174	167.4	1	108.4	E75 S79	E75-R77 PolarHBondContact O-N 3.39Å; E75-R77 VanDerWaalsContact O-N 3.11Å; R77-S79 PolarHBondContact O-N 3.05Å
78	V	30.8	Very low	38.8	Very low	114 Å²	114	122.8 Å²	122.8	69%	0.691	60%	0.596	S	S	*	*			trans	-46.2	120.6	171.9	-168.7	0	0	0	0	108.4	L76	L76-V78 WeakPolarHBondContact O-CG2 3.32Å; L76-V78 PolarHBondContact O-N 3.12Å
79	S	30.4	Very low	37.6	Very low	183 Å²	183	132.7 Å²	132.7	100%	1.28	64%	0.644	S	S	*	*			trans	-88.9	0	159.6	23.9	0	0	0	0	109.3	R77	R77-S79 PolarHBondContact O-N 3.05Å

Retrieved 79 of 79 residues in 77.3 ms (Link to these results)

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