G4VQN7_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession G4VQN7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 70 aa.

						>G4VQN7_SCHMA|G4VQN7
MIQRILVCIVIFTFLDVLMYCNSHPVKPLLKDLAEKAPIGIPQNCGPRCRYYYDYLKSGRRGKMYVYYRT
					

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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	51.7	Low	54.5	Low	214 Å²	214	121.5 Å²	121.5	100%	1.054	61%	0.611	S	S	*	*				0	-38.3	0	-85.1	179.5	-142.2	0	0	113.9	Q3 R4	M1-Q3 VanDerWaalsContact C-N 3.33Å; M1-Q3 PolarHBondContact O-N 2.95Å; M1-R4 PolarHBondContact O-N 2.81Å
2	I	53.1	Low	55.2	Low	135 Å²	135	116.2 Å²	116.2	69%	0.692	58%	0.582	S	S	*	*	H	α-helix	trans	-59.2	-35.8	-174.1	-69.3	159.5	0	0	0	114.2	R4 I5 L6	I2-R4 PolarHBondContact O-N 2.81Å; I2-I5 PolarHBondContact O-N 2.75Å; I2-L6 HydrophobicContact CG2-CD1 4.31Å; I2-L6 PolarHBondContact O-N 2.82Å; I2-L6 VanDerWaalsContact O-N 3.13Å
3	Q	49.3	Very low	55.9	Low	167 Å²	167	113.2 Å²	113.2	78%	0.78	57%	0.574	S	S	*	*	H	α-helix	trans	-65.8	-36	-176.5	-146.5	174.6	0.5	0	0	113.3	M1 L6 V7	M1-Q3 VanDerWaalsContact C-N 3.33Å; M1-Q3 PolarHBondContact O-N 2.95Å; Q3-L6 PolarHBondContact O-N 2.94Å; Q3-V7 PolarHBondContact O-N 3.4Å
4	R	48.7	Very low	56.6	Low	213 Å²	213	115.1 Å²	115.1	80%	0.804	58%	0.577	S	S	*	*	H	α-helix	trans	-68	-36.6	175.3	-79.2	-174	167.1	-176.5	-4	112.2	M1 I2 L6 V7 C8	M1-R4 PolarHBondContact O-N 2.81Å; I2-R4 PolarHBondContact O-N 2.81Å; R4-L6 VanDerWaalsContact C-N 3.32Å; R4-V7 PolarHBondContact O-N 2.01Å; R4-C8 PolarHBondContact O-N 3.16Å
5	I	54	Low	57.1	Low	105 Å²	105	107.9 Å²	107.9	54%	0.538	54%	0.54	S	S	.	.	H	α-helix	trans	-64.6	-42.5	178	-62.2	171.2	0	0	0	109.7	I2 V7 C8 I9	I2-I5 PolarHBondContact O-N 2.75Å; I5-V7 PolarHBondContact O-N 3.3Å; I5-C8 PolarHBondContact O-N 2.89Å; I5-I9 HydrophobicContact CG2-CD1 3.75Å; I5-I9 HydrophobicContact CG2-CG1 4.37Å; I5-I9 VanDerWaalsContact O-CG1 3.27Å; I5-I9 WeakPolarHBondContact O-CG1 3.25Å; I5-I9 PolarHBondContact O-N 2.89Å
6	L	47.5	Very low	57.5	Low	103 Å²	103	106 Å²	106	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-61.6	-44.3	179.1	-118	140.1	0	0	0	112.6	I2 Q3 R4 C8 I9 V10	I2-L6 HydrophobicContact CG2-CD1 4.31Å; I2-L6 PolarHBondContact O-N 2.82Å; I2-L6 VanDerWaalsContact O-N 3.13Å; Q3-L6 PolarHBondContact O-N 2.94Å; R4-L6 VanDerWaalsContact C-N 3.32Å; L6-C8 PolarHBondContact O-N 2.68Å; L6-I9 PolarHBondContact O-N 3.46Å; L6-V10 WeakPolarHBondContact O-CG2 3.46Å; L6-V10 PolarHBondContact O-N 2.69Å
7	V	55.8	Low	58	Low	84 Å²	84	105.4 Å²	105.4	51%	0.509	54%	0.535	S	S	.	.	H	α-helix	trans	-61.5	-44.7	176.5	175	0	0	0	0	111.2	Q3 R4 I5 I9 V10 I11	Q3-V7 PolarHBondContact O-N 3.4Å; R4-V7 PolarHBondContact O-N 2.01Å; I5-V7 PolarHBondContact O-N 3.3Å; V7-I9 VanDerWaalsContact C-N 3.33Å; V7-I9 PolarHBondContact O-N 2.81Å; V7-V10 PolarHBondContact O-N 3.33Å; V7-I11 HydrophobicContact CG1-CD1 3.84Å; V7-I11 VanDerWaalsContact O-CG1 3.31Å; V7-I11 WeakPolarHBondContact O-CG1 2.97Å; V7-I11 PolarHBondContact O-N 3.39Å; V7-I11 VanDerWaalsContact O-N 3.12Å
8	C	56.9	Low	58.2	Low	73 Å²	73	103.1 Å²	103.1	49%	0.493	52%	0.524	S	S	.	.	H	α-helix	trans	-61.2	-41.5	176.1	-73.4	0	0	0	0	112.2	R4 I5 L6 I11 F12	R4-C8 PolarHBondContact O-N 3.16Å; I5-C8 PolarHBondContact O-N 2.89Å; L6-C8 PolarHBondContact O-N 2.68Å; C8-I11 PolarHBondContact O-N 2.93Å; C8-F12 WeakPolarHBondContact O-CD2 3.39Å; C8-F12 PolarHBondContact O-N 3.21Å
9	I	58.4	Low	58.4	Low	75 Å²	75	101.9 Å²	101.9	39%	0.385	52%	0.517	S	S	.	.	H	α-helix	trans	-62.1	-46.4	179.1	-68.9	166.4	0	0	0	110.6	I5 L6 V7 I11 F12 T13	I5-I9 HydrophobicContact CG2-CD1 3.75Å; I5-I9 HydrophobicContact CG2-CG1 4.37Å; I5-I9 VanDerWaalsContact O-CG1 3.27Å; I5-I9 WeakPolarHBondContact O-CG1 3.25Å; I5-I9 PolarHBondContact O-N 2.89Å; L6-I9 PolarHBondContact O-N 3.46Å; V7-I9 VanDerWaalsContact C-N 3.33Å; V7-I9 PolarHBondContact O-N 2.81Å; I9-I11 VanDerWaalsContact C-N 3.32Å; I9-I11 PolarHBondContact O-N 3.14Å; I9-F12 PolarHBondContact O-N 3.5Å; I9-T13 PolarHBondContact O-N 3.39Å; I9-T13 PolarHBondContact O-OG1 3.08Å
10	V	59	Low	58.7	Low	78 Å²	78	107.5 Å²	107.5	47%	0.473	53%	0.533	S	S	.	.	H	α-helix	trans	-61.7	-40.8	-179.9	174	0	0	0	0	111.6	L6 V7 T13 F14	L6-V10 WeakPolarHBondContact O-CG2 3.46Å; L6-V10 PolarHBondContact O-N 2.69Å; V7-V10 PolarHBondContact O-N 3.33Å; V10-T13 WeakPolarHBondContact CA-OG1 3.02Å; V10-T13 PolarHBondContact O-OG1 2.86Å; V10-T13 VanDerWaalsContact O-OG1 3.1Å; V10-F14 PolarHBondContact O-N 2.84Å; V10-F14 VanDerWaalsContact O-N 3.09Å
11	I	65.7	Low	58.9	Low	89 Å²	89	107 Å²	107	46%	0.456	54%	0.539	S	S	.	.	H	α-helix	trans	-65.3	-41.8	177.8	-66.6	168.1	0	0	0	110.5	V7 C8 I9 F14 L15	V7-I11 HydrophobicContact CG1-CD1 3.84Å; V7-I11 VanDerWaalsContact O-CG1 3.31Å; V7-I11 WeakPolarHBondContact O-CG1 2.97Å; V7-I11 PolarHBondContact O-N 3.39Å; V7-I11 VanDerWaalsContact O-N 3.12Å; C8-I11 PolarHBondContact O-N 2.93Å; I9-I11 VanDerWaalsContact C-N 3.32Å; I9-I11 PolarHBondContact O-N 3.14Å; I11-F14 PolarHBondContact O-N 2.84Å; I11-L15 HydrophobicContact CG2-CD1 4Å; I11-L15 WeakPolarHBondContact O-CB 2.76Å; I11-L15 WeakPolarHBondContact O-CG 3.18Å; I11-L15 PolarHBondContact O-N 3.37Å
12	F	63	Low	59.1	Low	58 Å²	58	104.3 Å²	104.3	25%	0.254	53%	0.529	S	S	.	.	H	α-helix	trans	-68.4	-41.2	179.6	-96.8	-77.4	0	0	0	113	C8 I9 F14 L15 D16 Y52 M64 V66	C8-F12 WeakPolarHBondContact O-CD2 3.39Å; C8-F12 PolarHBondContact O-N 3.21Å; I9-F12 PolarHBondContact O-N 3.5Å; F12-F14 VanDerWaalsContact C-N 3.31Å; F12-F14 PolarHBondContact O-N 3.28Å; F12-L15 PolarHBondContact O-N 3.22Å; F12-D16 PolarHBondContact O-N 3.13Å; F12-Y52 HydrophobicContact CD1-CE1 4.46Å; F12-Y52 HydrophobicContact CE1-CD1 4.23Å; F12-Y52 HydrophobicContact CE1-CE1 4.35Å; F12-M64 HydrophobicContact CE1-CE 4.38Å; F12-M64 HydrophobicContact CE1-SD 4.25Å; F12-M64 HydrophobicContact CE2-CE 4.39Å; F12-M64 HydrophobicContact CZ-CE 3.63Å; F12-M64 HydrophobicContact CZ-SD 4.05Å; F12-V66 HydrophobicContact CD1-CG1 3.5Å; F12-V66 VanDerWaalsContact CD1-CG1 3.5Å; F12-V66 HydrophobicContact CE1-CG1 3.3Å; F12-V66 HydrophobicContact CG-CG1 4.37Å; F12-V66 HydrophobicContact CZ-CG1 4.04Å
13	T	64.1	Low	59.2	Low	78 Å²	78	98.7 Å²	98.7	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-64.2	-38	174.3	35.7	0	0	0	0	111.8	I9 V10 D16 V17	I9-T13 PolarHBondContact O-N 3.39Å; I9-T13 PolarHBondContact O-OG1 3.08Å; V10-T13 WeakPolarHBondContact CA-OG1 3.02Å; V10-T13 PolarHBondContact O-OG1 2.86Å; V10-T13 VanDerWaalsContact O-OG1 3.1Å; T13-D16 PolarHBondContact O-N 3.15Å; T13-V17 WeakPolarHBondContact O-CG2 3.23Å; T13-V17 PolarHBondContact O-N 3.07Å; T13-V17 VanDerWaalsContact O-N 3.12Å
14	F	64.8	Low	59.6	Low	140 Å²	140	98.4 Å²	98.4	61%	0.614	50%	0.5	S	S	*	.	H	α-helix	trans	-63.6	-43.1	174.4	-119.7	-87.3	0	0	0	112.2	V10 I11 F12 D16 L18	V10-F14 PolarHBondContact O-N 2.84Å; V10-F14 VanDerWaalsContact O-N 3.09Å; I11-F14 PolarHBondContact O-N 2.84Å; F12-F14 VanDerWaalsContact C-N 3.31Å; F12-F14 PolarHBondContact O-N 3.28Å; F14-D16 VanDerWaalsContact C-N 3.28Å; F14-D16 PolarHBondContact O-N 3.38Å; F14-L18 HydrophobicContact CD1-CD1 4.1Å; F14-L18 VanDerWaalsContact O-CB 3.23Å; F14-L18 WeakPolarHBondContact O-CB 3.46Å; F14-L18 WeakPolarHBondContact O-CD1 3.25Å; F14-L18 VanDerWaalsContact O-CG 3.27Å; F14-L18 WeakPolarHBondContact O-CG 3.22Å; F14-L18 PolarHBondContact O-N 3.12Å
15	L	64.5	Low	60.4	Low	6 Å²	6	93 Å²	93	3%	0.031	49%	0.493	C	S	.	.	H	α-helix	trans	-61.2	-37.4	175.5	-79	167.2	0	0	0	112.1	I11 F12 L18 M19 V26 L29 L30 L33	I11-L15 HydrophobicContact CG2-CD1 4Å; I11-L15 WeakPolarHBondContact O-CB 2.76Å; I11-L15 WeakPolarHBondContact O-CG 3.18Å; I11-L15 PolarHBondContact O-N 3.37Å; F12-L15 PolarHBondContact O-N 3.22Å; L15-L18 PolarHBondContact O-N 2.87Å; L15-M19 WeakPolarHBondContact O-CB 3.21Å; L15-M19 PolarHBondContact O-N 3.39Å; L15-V26 HydrophobicContact CD2-CG1 3.55Å; L15-L29 HydrophobicContact CD2-CD2 3.87Å; L15-L30 HydrophobicContact CD1-CD2 4.26Å; L15-L30 HydrophobicContact CD2-CD2 3.99Å; L15-L30 HydrophobicContact CD2-CG 4.22Å; L15-L33 HydrophobicContact CD1-CD1 3.89Å
16	D	63.2	Low	61	Low	78 Å²	78	88.6 Å²	88.6	42%	0.417	47%	0.471	S	S	.	.	H	α-helix	trans	-66.9	-48.1	179.5	-121.3	-9.5	0	0	0	112.6	F12 T13 F14 L18 M19 Y20 Y52	F12-D16 PolarHBondContact O-N 3.13Å; T13-D16 PolarHBondContact O-N 3.15Å; F14-D16 VanDerWaalsContact C-N 3.28Å; F14-D16 PolarHBondContact O-N 3.38Å; D16-L18 VanDerWaalsContact C-N 3.25Å; D16-L18 PolarHBondContact O-N 3.42Å; D16-M19 PolarHBondContact O-N 3.3Å; D16-Y20 PolarHBondContact O-N 3.43Å; D16-Y52 WeakPolarHBondContact CA-OH 3.24Å; D16-Y52 PolarHBondContact N-OH 3.06Å; D16-Y52 VanDerWaalsContact N-OH 3.13Å; D16-Y52 WeakPolarHBondContact OD1-CE2 3.43Å; D16-Y52 PolarHBondContact OD1-OH 2.98Å
17	V	65.6	Low	62.1	Low	95 Å²	95	89.7 Å²	89.7	58%	0.576	47%	0.471	S	S	*	.	H	α-helix	trans	-59.6	-42.7	174.9	174.2	0	0	0	0	110.2	T13 Y20 C21	T13-V17 WeakPolarHBondContact O-CG2 3.23Å; T13-V17 PolarHBondContact O-N 3.07Å; T13-V17 VanDerWaalsContact O-N 3.12Å; V17-Y20 PolarHBondContact O-N 2.96Å; V17-C21 WeakPolarHBondContact O-CB 3.4Å; V17-C21 PolarHBondContact O-N 3.46Å
18	L	62.3	Low	62.9	Low	65 Å²	65	89.5 Å²	89.5	34%	0.34	47%	0.471	S	S	.	.	H	α-helix	trans	-63.9	-45.5	178.4	-84.2	167.7	0	0	0	112	F14 L15 D16 Y20 C21 S23 V26	F14-L18 HydrophobicContact CD1-CD1 4.1Å; F14-L18 VanDerWaalsContact O-CB 3.23Å; F14-L18 WeakPolarHBondContact O-CB 3.46Å; F14-L18 WeakPolarHBondContact O-CD1 3.25Å; F14-L18 VanDerWaalsContact O-CG 3.27Å; F14-L18 WeakPolarHBondContact O-CG 3.22Å; F14-L18 PolarHBondContact O-N 3.12Å; L15-L18 PolarHBondContact O-N 2.87Å; D16-L18 VanDerWaalsContact C-N 3.25Å; D16-L18 PolarHBondContact O-N 3.42Å; L18-Y20 VanDerWaalsContact C-N 3.3Å; L18-Y20 PolarHBondContact O-N 2.95Å; L18-C21 PolarHBondContact O-N 3.42Å; L18-C21 VanDerWaalsContact O-N 3.07Å; L18-S23 VanDerWaalsContact C-OG 3.25Å; L18-S23 WeakPolarHBondContact O-CB 3.49Å; L18-S23 PolarHBondContact O-OG 2.99Å; L18-V26 HydrophobicContact CB-CG1 4.31Å; L18-V26 HydrophobicContact CB-CG2 3.77Å; L18-V26 HydrophobicContact CD1-CG2 3.96Å; L18-V26 HydrophobicContact CD2-CG2 4.04Å; L18-V26 HydrophobicContact CG-CG2 4.14Å
19	M	63	Low	63.7	Low	80 Å²	80	90.8 Å²	90.8	39%	0.394	47%	0.473	S	S	.	.	H	α-helix	trans	-59	-41.6	177.5	-124	179.5	110	0	0	112	L15 D16 C21 L30 Y52 Y53	L15-M19 WeakPolarHBondContact O-CB 3.21Å; L15-M19 PolarHBondContact O-N 3.39Å; D16-M19 PolarHBondContact O-N 3.3Å; M19-C21 VanDerWaalsContact C-N 3.32Å; M19-L30 HydrophobicContact CG-CD1 3.71Å; M19-L30 HydrophobicContact SD-CD1 3.54Å; M19-L30 VanDerWaalsContact SD-CD1 3.54Å; M19-Y52 HydrophobicContact SD-CE1 4.19Å; M19-Y53 HydrophobicContact CE-CD2 4.07Å; M19-Y53 HydrophobicContact SD-CD2 4.15Å
20	Y	63.8	Low	64.3	Low	214 Å²	214	87.2 Å²	87.2	84%	0.839	46%	0.455	S	S	*	.	H	α-helix	trans	-66.1	-34	175.7	-116.2	-86.5	0	0	0	112.7	D16 V17 L18 N22	D16-Y20 PolarHBondContact O-N 3.43Å; V17-Y20 PolarHBondContact O-N 2.96Å; L18-Y20 VanDerWaalsContact C-N 3.3Å; L18-Y20 PolarHBondContact O-N 2.95Å; Y20-N22 PolarHBondContact O-N 3.29Å; Y20-N22 VanDerWaalsContact O-N 3.15Å
21	C	62	Low	65	Low	97 Å²	97	86.3 Å²	86.3	66%	0.655	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	20.8	-179.5	-81.5	0	0	0	0	115	V17 L18 M19	V17-C21 WeakPolarHBondContact O-CB 3.4Å; V17-C21 PolarHBondContact O-N 3.46Å; L18-C21 PolarHBondContact O-N 3.42Å; L18-C21 VanDerWaalsContact O-N 3.07Å; M19-C21 VanDerWaalsContact C-N 3.32Å
22	N	56.5	Low	65.5	Low	158 Å²	158	85.8 Å²	85.8	85%	0.845	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	40.5	170.5	-129.8	-5.2	0	0	0	114.1	Y20 H24	Y20-N22 PolarHBondContact O-N 3.29Å; Y20-N22 VanDerWaalsContact O-N 3.15Å; N22-H24 PolarHBondContact O-N 3.21Å; N22-H24 VanDerWaalsContact O-N 3.15Å
23	S	54.5	Low	65.9	Low	17 Å²	17	85.9 Å²	85.9	12%	0.119	45%	0.445	C	S	.	.			trans	-87.6	90.5	-165.4	56.7	0	0	0	0	114.7	L18 V26	L18-S23 VanDerWaalsContact C-OG 3.25Å; L18-S23 WeakPolarHBondContact O-CB 3.49Å; L18-S23 PolarHBondContact O-OG 2.99Å; S23-V26 VanDerWaalsContact CB-CG2 3.45Å; S23-V26 PolarHBondContact O-N 3.24Å; S23-V26 VanDerWaalsContact O-N 3.12Å; S23-V26 VanDerWaalsContact OG-CB 3.24Å; S23-V26 WeakPolarHBondContact OG-CB 3.42Å; S23-V26 WeakPolarHBondContact OG-CG2 3.37Å
24	H	59.1	Low	66.3	Low	160 Å²	160	82.2 Å²	82.2	74%	0.741	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.8	-41.7	157.2	-126.7	-94.7	0	0	0	114.3	N22 V26 P28	N22-H24 PolarHBondContact O-N 3.21Å; N22-H24 VanDerWaalsContact O-N 3.15Å; H24-V26 VanDerWaalsContact C-N 3.29Å; H24-V26 PolarHBondContact O-N 3.43Å; H24-P28 WeakPolarHBondContact O-CD 3.14Å
25	P	65	Low	66.7	Low	101 Å²	101	79.3 Å²	79.3	66%	0.656	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-15.4	-179.3	24.6	-34.4	0	0	0	115	P28	P25-P28 WeakPolarHBondContact O-CD 3.46Å; P25-P28 VanDerWaalsContact O-CG 3.27Å; P25-P28 WeakPolarHBondContact O-CG 3.43Å
26	V	66.7	Low	67.1	Low	11 Å²	11	86.5 Å²	86.5	7%	0.067	44%	0.442	C	S	.	.	H	α-helix	trans	-97.9	-23.5	-172	177	0	0	0	0	111.5	L15 L18 S23 H24 L29 L30	L15-V26 HydrophobicContact CD2-CG1 3.55Å; L18-V26 HydrophobicContact CB-CG1 4.31Å; L18-V26 HydrophobicContact CB-CG2 3.77Å; L18-V26 HydrophobicContact CD1-CG2 3.96Å; L18-V26 HydrophobicContact CD2-CG2 4.04Å; L18-V26 HydrophobicContact CG-CG2 4.14Å; S23-V26 VanDerWaalsContact CB-CG2 3.45Å; S23-V26 PolarHBondContact O-N 3.24Å; S23-V26 VanDerWaalsContact O-N 3.12Å; S23-V26 VanDerWaalsContact OG-CB 3.24Å; S23-V26 WeakPolarHBondContact OG-CB 3.42Å; S23-V26 WeakPolarHBondContact OG-CG2 3.37Å; H24-V26 VanDerWaalsContact C-N 3.29Å; H24-V26 PolarHBondContact O-N 3.43Å; V26-L29 PolarHBondContact O-N 3.43Å; V26-L29 VanDerWaalsContact O-N 3.07Å; V26-L30 HydrophobicContact CG1-CD1 3.78Å; V26-L30 HydrophobicContact CG1-CG 3.9Å; V26-L30 WeakPolarHBondContact O-CB 3.4Å; V26-L30 WeakPolarHBondContact O-CG 3.19Å; V26-L30 PolarHBondContact O-N 3.13Å
27	K	69.7	Low	67.2	Low	127 Å²	127	83.7 Å²	83.7	55%	0.552	43%	0.429	S	S	*	.	H	α-helix	trans	-49.9	-47.9	169.5	-80.8	-175.1	175.5	177.1	0	113.8	L29 K31 Y53	K27-L29 VanDerWaalsContact C-N 3.34Å; K27-K31 WeakPolarHBondContact O-CB 3.38Å; K27-K31 PolarHBondContact O-N 3.31Å; K27-Y53 PolarHBondContact O-OH 3.09Å
28	P	74.3	Confident	67.1	Low	79 Å²	79	83.8 Å²	83.8	51%	0.513	43%	0.432	S	S	.	.	H	α-helix	trans	-65.1	-36.4	176.7	22.3	-31.5	0	0	0	112.4	H24 P25 K31 D32	H24-P28 WeakPolarHBondContact O-CD 3.14Å; P25-P28 WeakPolarHBondContact O-CD 3.46Å; P25-P28 VanDerWaalsContact O-CG 3.27Å; P25-P28 WeakPolarHBondContact O-CG 3.43Å; P28-K31 PolarHBondContact O-N 3.49Å; P28-D32 WeakPolarHBondContact O-CB 3.48Å; P28-D32 PolarHBondContact O-N 2.97Å
29	L	72.9	Confident	67.1	Low	100 Å²	100	88.4 Å²	88.4	52%	0.524	46%	0.455	S	S	.	.	H	α-helix	trans	-67.9	-46.2	178.1	-153.3	106.5	0	0	0	111.9	L15 V26 K27 K31 D32 L33	L15-L29 HydrophobicContact CD2-CD2 3.87Å; V26-L29 PolarHBondContact O-N 3.43Å; V26-L29 VanDerWaalsContact O-N 3.07Å; K27-L29 VanDerWaalsContact C-N 3.34Å; L29-K31 VanDerWaalsContact C-N 3.29Å; L29-K31 PolarHBondContact O-N 3.21Å; L29-D32 PolarHBondContact O-N 3.4Å; L29-L33 HydrophobicContact CD2-CD1 4.22Å; L29-L33 WeakPolarHBondContact O-CB 3.08Å; L29-L33 WeakPolarHBondContact O-CG 3.42Å; L29-L33 PolarHBondContact O-N 3.46Å
30	L	70.5	Confident	66.9	Low	1 Å²	1	86.2 Å²	86.2	1%	0.005	45%	0.454	C	S	.	.	H	α-helix	trans	-63	-37	175	-74.8	170.8	0	0	0	112	L15 M19 V26 A34 Y52 Y53	L15-L30 HydrophobicContact CD1-CD2 4.26Å; L15-L30 HydrophobicContact CD2-CD2 3.99Å; L15-L30 HydrophobicContact CD2-CG 4.22Å; M19-L30 HydrophobicContact CG-CD1 3.71Å; M19-L30 HydrophobicContact SD-CD1 3.54Å; M19-L30 VanDerWaalsContact SD-CD1 3.54Å; V26-L30 HydrophobicContact CG1-CD1 3.78Å; V26-L30 HydrophobicContact CG1-CG 3.9Å; V26-L30 WeakPolarHBondContact O-CB 3.4Å; V26-L30 WeakPolarHBondContact O-CG 3.19Å; V26-L30 PolarHBondContact O-N 3.13Å; L30-A34 WeakPolarHBondContact O-CB 3.41Å; L30-A34 PolarHBondContact O-N 3.42Å; L30-Y52 HydrophobicContact CD2-CD1 4.31Å; L30-Y52 HydrophobicContact CD2-CE1 3.77Å; L30-Y53 HydrophobicContact CB-CD1 3.91Å; L30-Y53 HydrophobicContact CB-CD2 4.09Å; L30-Y53 HydrophobicContact CB-CE1 3.69Å; L30-Y53 HydrophobicContact CB-CE2 3.89Å; L30-Y53 HydrophobicContact CB-CG 4.1Å; L30-Y53 HydrophobicContact CD1-CD2 3.79Å; L30-Y53 HydrophobicContact CD1-CE2 3.72Å; L30-Y53 HydrophobicContact CD1-CG 4.47Å; L30-Y53 HydrophobicContact CG-CD2 4.43Å; L30-Y53 HydrophobicContact CG-CE2 4.43Å
31	K	73.4	Confident	66.8	Low	59 Å²	59	81 Å²	81	26%	0.257	44%	0.44	S	S	.	.	H	α-helix	trans	-63.4	-47.7	173.6	169	-178.4	161.4	165	0	111.6	K27 P28 L29 L33 A34 E35 Y55	K27-K31 WeakPolarHBondContact O-CB 3.38Å; K27-K31 PolarHBondContact O-N 3.31Å; P28-K31 PolarHBondContact O-N 3.49Å; L29-K31 VanDerWaalsContact C-N 3.29Å; L29-K31 PolarHBondContact O-N 3.21Å; K31-L33 VanDerWaalsContact C-N 3.3Å; K31-L33 PolarHBondContact O-N 2.94Å; K31-A34 PolarHBondContact O-N 3.43Å; K31-E35 PolarHBondContact O-N 3.45Å; K31-Y55 HydrophobicContact CB-CD2 4.15Å; K31-Y55 HydrophobicContact CB-CE2 4.49Å; K31-Y55 HydrophobicContact CB-CG 4.36Å; K31-Y55 HydrophobicContact CD-CD2 3.8Å; K31-Y55 HydrophobicContact CD-CE1 4.28Å; K31-Y55 HydrophobicContact CD-CE2 3.29Å; K31-Y55 HydrophobicContact CD-CG 4.45Å; K31-Y55 WeakPolarHBondContact CE-OH 3.27Å; K31-Y55 HydrophobicContact CG-CD1 4.01Å; K31-Y55 HydrophobicContact CG-CD2 3.6Å; K31-Y55 HydrophobicContact CG-CE1 3.97Å; K31-Y55 HydrophobicContact CG-CE2 3.57Å; K31-Y55 HydrophobicContact CG-CG 3.8Å; K31-Y55 PolarHBondContact NZ-OH 3.4Å
32	D	76	Confident	66.9	Low	78 Å²	78	78.9 Å²	78.9	42%	0.417	42%	0.424	S	S	.	.	H	α-helix	trans	-63.2	-40.5	179.8	-155.9	70.7	0	0	0	111.1	P28 L29 E35 K36	P28-D32 WeakPolarHBondContact O-CB 3.48Å; P28-D32 PolarHBondContact O-N 2.97Å; L29-D32 PolarHBondContact O-N 3.4Å; D32-E35 PolarHBondContact O-N 3.49Å; D32-K36 WeakPolarHBondContact O-CG 3.43Å; D32-K36 PolarHBondContact O-N 3.38Å; D32-K36 VanDerWaalsContact O-N 3.15Å; D32-K36 WeakPolarHBondContact OD2-CE 3.13Å; D32-K36 IonicContact OD2-NZ 2.71Å; D32-K36 PolarHBondContact OD2-NZ 3.28Å
33	L	73	Confident	67.1	Low	60 Å²	60	80.9 Å²	80.9	31%	0.314	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-43.1	172.5	-80.3	167.9	0	0	0	112.5	L15 L29 K31 K36 A37 M64	L15-L33 HydrophobicContact CD1-CD1 3.89Å; L29-L33 HydrophobicContact CD2-CD1 4.22Å; L29-L33 WeakPolarHBondContact O-CB 3.08Å; L29-L33 WeakPolarHBondContact O-CG 3.42Å; L29-L33 PolarHBondContact O-N 3.46Å; K31-L33 VanDerWaalsContact C-N 3.3Å; K31-L33 PolarHBondContact O-N 2.94Å; L33-K36 PolarHBondContact O-N 3.15Å; L33-A37 WeakPolarHBondContact O-CB 3.27Å; L33-A37 PolarHBondContact O-N 2.75Å; L33-M64 HydrophobicContact CB-CE 3.66Å; L33-M64 HydrophobicContact CB-SD 3.88Å; L33-M64 HydrophobicContact CD1-CE 4.24Å; L33-M64 HydrophobicContact CD2-CE 3.96Å; L33-M64 HydrophobicContact CG-CE 4.17Å
34	A	71.4	Confident	67.6	Low	0 Å²	0	86.4 Å²	86.4	0%	0	46%	0.457	C	S	.	.	H	α-helix	trans	-69.6	-34.9	178.8	0	0	0	0	0	112.6	L30 K31 K36 A37 Y53 G62	L30-A34 WeakPolarHBondContact O-CB 3.41Å; L30-A34 PolarHBondContact O-N 3.42Å; K31-A34 PolarHBondContact O-N 3.43Å; A34-K36 VanDerWaalsContact C-N 3.32Å; A34-A37 PolarHBondContact O-N 2.9Å; A34-Y53 HydrophobicContact CB-CD1 4.06Å; A34-G62 WeakPolarHBondContact O-CA 3.49Å
35	E	73.7	Confident	67.8	Low	79 Å²	79	79.8 Å²	79.8	37%	0.369	43%	0.428	S	S	.	.	H	α-helix	trans	-66.8	-32.3	173.2	-90.4	-174.2	164.6	0	0	112.5	K31 D32 Y55	K31-E35 PolarHBondContact O-N 3.45Å; D32-E35 PolarHBondContact O-N 3.49Å; E35-Y55 HydrophobicContact CG-CD1 3.89Å; E35-Y55 HydrophobicContact CG-CE1 3.79Å; E35-Y55 VanDerWaalsContact OE1-CE1 3.32Å; E35-Y55 WeakPolarHBondContact OE1-CE1 3.42Å
36	K	72.8	Confident	67.7	Low	158 Å²	158	76.6 Å²	76.6	69%	0.687	41%	0.413	S	S	*	.	H	α-helix	trans	-85.9	-15	175.8	-70.8	171.1	179.5	159	0	113.4	D32 L33 A34	D32-K36 WeakPolarHBondContact O-CG 3.43Å; D32-K36 PolarHBondContact O-N 3.38Å; D32-K36 VanDerWaalsContact O-N 3.15Å; D32-K36 WeakPolarHBondContact OD2-CE 3.13Å; D32-K36 IonicContact OD2-NZ 2.71Å; D32-K36 PolarHBondContact OD2-NZ 3.28Å; L33-K36 PolarHBondContact O-N 3.15Å; A34-K36 VanDerWaalsContact C-N 3.32Å
37	A	66	Low	67.7	Low	18 Å²	18	82.9 Å²	82.9	15%	0.149	45%	0.454	C	S	.	.	S	Bend	trans	-70.7	144.4	179.6	0	0	0	0	0	110.8	L33 A34 I39 M64	L33-A37 WeakPolarHBondContact O-CB 3.27Å; L33-A37 PolarHBondContact O-N 2.75Å; A34-A37 PolarHBondContact O-N 2.9Å; A37-I39 PolarHBondContact O-N 2.86Å; A37-M64 HydrophobicContact CB-CG 4.25Å
38	P	62	Low	67.5	Low	98 Å²	98	83.2 Å²	83.2	64%	0.636	45%	0.452	S	S	*	.			trans	-58.2	135.6	177.3	22.2	-31	0	0	0	110.8	G40	P38-G40 PolarHBondContact O-N 3.2Å; P38-G40 VanDerWaalsContact O-N 3.08Å
39	I	62.4	Low	67.2	Low	161 Å²	161	80.7 Å²	80.7	83%	0.826	44%	0.436	S	S	*	.	S	Bend	trans	-71.6	106.2	-178.9	-56.6	169.8	0	0	0	108.2	A37	A37-I39 PolarHBondContact O-N 2.86Å
40	G	59.7	Low	66.7	Low	35 Å²	35	84.1 Å²	84.1	36%	0.361	44%	0.442	S	S	.	.	S	Bend	trans	125.5	168.6	177.6	0	0	0	0	0	113.1	P38 P42 Y65	P38-G40 PolarHBondContact O-N 3.2Å; P38-G40 VanDerWaalsContact O-N 3.08Å; G40-P42 WeakPolarHBondContact O-CD 3.07Å; G40-Y65 WeakPolarHBondContact O-CE2 3.27Å
41	I	62.5	Low	66.4	Low	105 Å²	105	89.8 Å²	89.8	54%	0.538	46%	0.464	S	S	.	.	S	Bend	trans	-66.4	126.3	170.3	-71.7	173.4	0	0	0	107	Q43 C45 Y65	I41-Q43 PolarHBondContact O-N 2.83Å; I41-C45 HydrophobicContact CG2-CB 3.46Å; I41-C45 VanDerWaalsContact CG2-CB 3.46Å; I41-Y65 HydrophobicContact CB-CE2 4.46Å; I41-Y65 HydrophobicContact CD1-CE1 4.03Å; I41-Y65 HydrophobicContact CG1-CD1 4.02Å; I41-Y65 HydrophobicContact CG1-CD2 4.35Å; I41-Y65 HydrophobicContact CG1-CE1 3.43Å; I41-Y65 VanDerWaalsContact CG1-CE1 3.43Å; I41-Y65 HydrophobicContact CG1-CE2 3.81Å; I41-Y65 HydrophobicContact CG1-CG 4.45Å; I41-Y65 WeakPolarHBondContact CG1-OH 2.95Å
42	P	63.2	Low	66.1	Low	51 Å²	51	88.1 Å²	88.1	33%	0.331	46%	0.457	S	S	.	.			trans	-50.4	132.6	173.8	-24.1	30.5	0	0	0	109.8	G40 N44 C45	G40-P42 WeakPolarHBondContact O-CD 3.07Å; P42-N44 PolarHBondContact O-N 3.35Å; P42-C45 HydrophobicContact CB-CB 4.35Å; P42-C45 VanDerWaalsContact O-CB 3.25Å; P42-C45 WeakPolarHBondContact O-CB 2.93Å; P42-C45 PolarHBondContact O-N 2.93Å
43	Q	61.6	Low	65.7	Low	200 Å²	200	86.1 Å²	86.1	94%	0.935	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-23.8	-176.4	-88	180	-10.4	0	0	113.9	I41	I41-Q43 PolarHBondContact O-N 2.83Å
44	N	63.5	Low	65.5	Low	134 Å²	134	85.1 Å²	85.1	72%	0.717	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-6.6	179.8	-62.3	-1.7	0	0	0	113.6	P42 G46 Y67	P42-N44 PolarHBondContact O-N 3.35Å; N44-G46 VanDerWaalsContact C-N 3.31Å; N44-G46 PolarHBondContact O-N 3.46Å; N44-Y67 PolarHBondContact O-OH 3.27Å
45	C	63.2	Low	65.3	Low	20 Å²	20	86.2 Å²	86.2	14%	0.135	44%	0.443	C	S	.	.			trans	-64.2	91.8	176.9	-103.4	0	0	0	0	109.5	I41 P42 C49 Y67	I41-C45 HydrophobicContact CG2-CB 3.46Å; I41-C45 VanDerWaalsContact CG2-CB 3.46Å; P42-C45 HydrophobicContact CB-CB 4.35Å; P42-C45 VanDerWaalsContact O-CB 3.25Å; P42-C45 WeakPolarHBondContact O-CB 2.93Å; P42-C45 PolarHBondContact O-N 2.93Å; C45-C49 VanDerWaalsContact CA-SG 3.53Å; C45-C49 HydrophobicContact CB-CB 3.43Å; C45-C49 VanDerWaalsContact CB-CB 3.43Å; C45-C49 WeakPolarHBondContact CB-SG 3.49Å; C45-C49 WeakPolarHBondContact SG-CB 3.5Å; C45-C49 CovalentContact SG-SG 2.01Å; C45-C49 PolarHBondContact SG-SG 3.15Å; C45-Y67 VanDerWaalsContact CA-OH 3.23Å; C45-Y67 WeakPolarHBondContact CA-OH 3.32Å; C45-Y67 PolarHBondContact N-OH 3.35Å; C45-Y67 VanDerWaalsContact N-OH 3.16Å
46	G	63	Low	64.8	Low	34 Å²	34	88 Å²	88	35%	0.351	45%	0.454	S	S	.	.			trans	-60.8	-178.6	169.9	0	0	0	0	0	112.2	N44 R48 C49	N44-G46 VanDerWaalsContact C-N 3.31Å; N44-G46 PolarHBondContact O-N 3.46Å; G46-R48 PolarHBondContact O-N 2.96Å; G46-C49 PolarHBondContact O-N 3.15Å
47	P	67.4	Low	64.2	Low	143 Å²	143	86.1 Å²	86.1	93%	0.929	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-10.3	-173.5	23.8	-34.5	0	0	0	114.8
48	R	66	Low	63.5	Low	135 Å²	135	91.1 Å²	91.1	51%	0.509	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-1.4	177.6	-62.7	-175.8	180	-174.6	-5.5	113.9	G46 R50 Y68 T70	G46-R48 PolarHBondContact O-N 2.96Å; R48-R50 PolarHBondContact O-N 2.77Å; R48-Y68 VanDerWaalsContact O-CB 3.22Å; R48-Y68 WeakPolarHBondContact O-CB 3.12Å; R48-Y68 PolarHBondContact O-N 2.84Å; R48-T70 PolarHBondContact NH1-OG1 3.12Å
49	C	66.4	Low	63.5	Low	25 Å²	25	90.5 Å²	90.5	17%	0.169	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	120.3	173.1	-90.9	0	0	0	0	110.9	C45 G46 V66 Y67	C45-C49 VanDerWaalsContact CA-SG 3.53Å; C45-C49 HydrophobicContact CB-CB 3.43Å; C45-C49 VanDerWaalsContact CB-CB 3.43Å; C45-C49 WeakPolarHBondContact CB-SG 3.49Å; C45-C49 WeakPolarHBondContact SG-CB 3.5Å; C45-C49 CovalentContact SG-SG 2.01Å; C45-C49 PolarHBondContact SG-SG 3.15Å; G46-C49 PolarHBondContact O-N 3.15Å; C49-V66 WeakPolarHBondContact CA-O 3.46Å; C49-Y67 VanDerWaalsContact SG-CD2 3.56Å; C49-Y67 VanDerWaalsContact SG-CE2 3.52Å
50	R	63.7	Low	63.1	Low	172 Å²	172	91.3 Å²	91.3	65%	0.649	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	144.3	169.1	-92.6	-174.4	176.8	-179.3	0.6	110.2	R48 Y52 Y65 V66	R48-R50 PolarHBondContact O-N 2.77Å; R50-Y52 PolarHBondContact O-N 3.39Å; R50-Y65 WeakPolarHBondContact O-CA 3.37Å; R50-V66 PolarHBondContact N-O 3.28Å; R50-V66 PolarHBondContact O-N 2.93Å
51	Y	64.5	Low	63.3	Low	121 Å²	121	96 Å²	96	48%	0.475	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	126.2	167.9	164.1	-91.5	0	0	0	109.4	Y53 D54 K63 Y65	Y51-Y53 WeakPolarHBondContact CE2-O 3.45Å; Y51-Y53 VanDerWaalsContact CZ-C 3.48Å; Y51-D54 HydrophobicContact CE2-CB 3.41Å; Y51-D54 VanDerWaalsContact CE2-CB 3.41Å; Y51-D54 VanDerWaalsContact CE2-N 3.28Å; Y51-D54 VanDerWaalsContact CZ-CB 3.43Å; Y51-D54 WeakPolarHBondContact OH-CA 3.43Å; Y51-D54 WeakPolarHBondContact OH-CB 3.41Å; Y51-D54 PolarHBondContact OH-N 2.83Å; Y51-K63 HydrophobicContact CE2-CG 4.42Å; Y51-Y65 HydrophobicContact CD2-CE1 4.44Å
52	Y	66.8	Low	63.3	Low	24 Å²	24	91.1 Å²	91.1	9%	0.094	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-48.5	-179.1	-166.3	-110.1	0	0	0	111.4	F12 D16 M19 L30 R50 M64 V66	F12-Y52 HydrophobicContact CD1-CE1 4.46Å; F12-Y52 HydrophobicContact CE1-CD1 4.23Å; F12-Y52 HydrophobicContact CE1-CE1 4.35Å; D16-Y52 WeakPolarHBondContact CA-OH 3.24Å; D16-Y52 PolarHBondContact N-OH 3.06Å; D16-Y52 VanDerWaalsContact N-OH 3.13Å; D16-Y52 WeakPolarHBondContact OD1-CE2 3.43Å; D16-Y52 PolarHBondContact OD1-OH 2.98Å; M19-Y52 HydrophobicContact SD-CE1 4.19Å; L30-Y52 HydrophobicContact CD2-CD1 4.31Å; L30-Y52 HydrophobicContact CD2-CE1 3.77Å; R50-Y52 PolarHBondContact O-N 3.39Å; Y52-M64 WeakPolarHBondContact CB-O 3.34Å; Y52-M64 PolarHBondContact N-O 3.07Å; Y52-V66 HydrophobicContact CD2-CB 4.39Å; Y52-V66 HydrophobicContact CD2-CG1 3.9Å; Y52-V66 HydrophobicContact CD2-CG2 3.58Å; Y52-V66 HydrophobicContact CE2-CG2 4.49Å; Y52-V66 HydrophobicContact CG-CG1 3.95Å; Y52-V66 HydrophobicContact CG-CG2 4.11Å
53	Y	67.5	Low	63.4	Low	35 Å²	35	91.4 Å²	91.4	14%	0.137	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	132.9	-171.9	-163.3	-98.6	0	0	0	111.4	M19 K27 L30 A34 Y51 K63 M64	M19-Y53 HydrophobicContact CE-CD2 4.07Å; M19-Y53 HydrophobicContact SD-CD2 4.15Å; K27-Y53 PolarHBondContact O-OH 3.09Å; L30-Y53 HydrophobicContact CB-CD1 3.91Å; L30-Y53 HydrophobicContact CB-CD2 4.09Å; L30-Y53 HydrophobicContact CB-CE1 3.69Å; L30-Y53 HydrophobicContact CB-CE2 3.89Å; L30-Y53 HydrophobicContact CB-CG 4.1Å; L30-Y53 HydrophobicContact CD1-CD2 3.79Å; L30-Y53 HydrophobicContact CD1-CE2 3.72Å; L30-Y53 HydrophobicContact CD1-CG 4.47Å; L30-Y53 HydrophobicContact CG-CD2 4.43Å; L30-Y53 HydrophobicContact CG-CE2 4.43Å; A34-Y53 HydrophobicContact CB-CD1 4.06Å; Y51-Y53 WeakPolarHBondContact CE2-O 3.45Å; Y51-Y53 VanDerWaalsContact CZ-C 3.48Å; Y53-K63 CarbonylContact O-C 3.6Å; Y53-K63 WeakPolarHBondContact O-CA 3.38Å; Y53-M64 PolarHBondContact N-O 2.95Å; Y53-M64 PolarHBondContact O-N 3.39Å
54	D	68.9	Low	63.6	Low	39 Å²	39	83 Å²	83	21%	0.209	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.4	174.7	-168.8	-16	0	0	0	104.5	Y51 R61 G62 K63	Y51-D54 HydrophobicContact CE2-CB 3.41Å; Y51-D54 VanDerWaalsContact CE2-CB 3.41Å; Y51-D54 VanDerWaalsContact CE2-N 3.28Å; Y51-D54 VanDerWaalsContact CZ-CB 3.43Å; Y51-D54 WeakPolarHBondContact OH-CA 3.43Å; Y51-D54 WeakPolarHBondContact OH-CB 3.41Å; Y51-D54 PolarHBondContact OH-N 2.83Å; D54-R61 WeakPolarHBondContact OD1-CG 3.38Å; D54-R61 IonicContact OD1-NE 3.5Å; D54-R61 PolarHBondContact OD1-NE 3.19Å; D54-R61 IonicContact OD2-CZ 3.42Å; D54-R61 IonicContact OD2-NE 3.14Å; D54-R61 PolarHBondContact OD2-NE 3.48Å; D54-R61 VanDerWaalsContact OD2-NE 3.14Å; D54-R61 IonicContact OD2-NH2 2.81Å; D54-R61 PolarHBondContact OD2-NH2 3.27Å; D54-G62 WeakPolarHBondContact CA-O 3.5Å; D54-K63 HydrophobicContact CB-CG 4.36Å; D54-K63 VanDerWaalsContact OD2-CE 3.25Å; D54-K63 WeakPolarHBondContact OD2-CE 3.49Å
55	Y	66.7	Low	63.7	Low	24 Å²	24	78.8 Å²	78.8	9%	0.094	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	113.6	170.8	169.5	-108.4	0	0	0	110.3	K31 E35 K57 R61 G62	K31-Y55 HydrophobicContact CB-CD2 4.15Å; K31-Y55 HydrophobicContact CB-CE2 4.49Å; K31-Y55 HydrophobicContact CB-CG 4.36Å; K31-Y55 HydrophobicContact CD-CD2 3.8Å; K31-Y55 HydrophobicContact CD-CE1 4.28Å; K31-Y55 HydrophobicContact CD-CE2 3.29Å; K31-Y55 HydrophobicContact CD-CG 4.45Å; K31-Y55 WeakPolarHBondContact CE-OH 3.27Å; K31-Y55 HydrophobicContact CG-CD1 4.01Å; K31-Y55 HydrophobicContact CG-CD2 3.6Å; K31-Y55 HydrophobicContact CG-CE1 3.97Å; K31-Y55 HydrophobicContact CG-CE2 3.57Å; K31-Y55 HydrophobicContact CG-CG 3.8Å; K31-Y55 PolarHBondContact NZ-OH 3.4Å; E35-Y55 HydrophobicContact CG-CD1 3.89Å; E35-Y55 HydrophobicContact CG-CE1 3.79Å; E35-Y55 VanDerWaalsContact OE1-CE1 3.32Å; E35-Y55 WeakPolarHBondContact OE1-CE1 3.42Å; Y55-K57 HydrophobicContact CE1-CB 3.95Å; Y55-K57 HydrophobicContact CE2-CB 3.71Å; Y55-K57 HydrophobicContact CE2-CD 4.4Å; Y55-K57 WeakPolarHBondContact OH-CB 3.47Å; Y55-K57 WeakPolarHBondContact OH-CD 3.31Å; Y55-R61 WeakPolarHBondContact O-CA 3.23Å; Y55-G62 PolarHBondContact N-O 3.04Å; Y55-G62 PolarHBondContact O-N 3.1Å
56	L	62.5	Low	63.8	Low	116 Å²	116	79.6 Å²	79.6	61%	0.607	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	76.5	177.5	-104	150.8	0	0	0	120.2	R61	L56-R61 HydrophobicContact CD1-CB 4.43Å; L56-R61 HydrophobicContact CD1-CG 3.65Å; L56-R61 VanDerWaalsContact CD1-NE 3.26Å; L56-R61 HydrophobicContact CG-CB 4.48Å; L56-R61 HydrophobicContact CG-CG 4.09Å
57	K	59.8	Low	63.6	Low	119 Å²	119	84.2 Å²	84.2	52%	0.517	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	123.7	175.9	-154.6	178.1	-175.1	-177.2	0	115.6	Y55 G59 R60	Y55-K57 HydrophobicContact CE1-CB 3.95Å; Y55-K57 HydrophobicContact CE2-CB 3.71Å; Y55-K57 HydrophobicContact CE2-CD 4.4Å; Y55-K57 WeakPolarHBondContact OH-CB 3.47Å; Y55-K57 WeakPolarHBondContact OH-CD 3.31Å; K57-G59 PolarHBondContact O-N 3.12Å; K57-G59 VanDerWaalsContact O-N 3.15Å; K57-R60 PolarHBondContact N-O 3.48Å; K57-R60 PolarHBondContact O-N 3.37Å
58	S	51.9	Low	63.1	Low	123 Å²	123	84.1 Å²	84.1	86%	0.86	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	31.7	63.8	168	-59.5	0	0	0	0	114.6	R60	S58-R60 PolarHBondContact O-N 3.04Å
59	G	61.4	Low	62.2	Low	85 Å²	85	88 Å²	88	88%	0.876	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	-10.2	173.8	0	0	0	0	0	116	K57	K57-G59 PolarHBondContact O-N 3.12Å; K57-G59 VanDerWaalsContact O-N 3.15Å
60	R	55.8	Low	61.3	Low	177 Å²	177	93.7 Å²	93.7	67%	0.668	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.9	172	-72.7	-175.7	178.2	174.3	-0.3	110.7	K57 S58	K57-R60 PolarHBondContact N-O 3.48Å; K57-R60 PolarHBondContact O-N 3.37Å; S58-R60 PolarHBondContact O-N 3.04Å
61	R	63.5	Low	61.2	Low	135 Å²	135	89.8 Å²	89.8	51%	0.509	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	117.5	177.3	-165	176.3	-168.4	170.8	6.9	109	D54 Y55 L56 K63	D54-R61 WeakPolarHBondContact OD1-CG 3.38Å; D54-R61 IonicContact OD1-NE 3.5Å; D54-R61 PolarHBondContact OD1-NE 3.19Å; D54-R61 IonicContact OD2-CZ 3.42Å; D54-R61 IonicContact OD2-NE 3.14Å; D54-R61 PolarHBondContact OD2-NE 3.48Å; D54-R61 VanDerWaalsContact OD2-NE 3.14Å; D54-R61 IonicContact OD2-NH2 2.81Å; D54-R61 PolarHBondContact OD2-NH2 3.27Å; Y55-R61 WeakPolarHBondContact O-CA 3.23Å; L56-R61 HydrophobicContact CD1-CB 4.43Å; L56-R61 HydrophobicContact CD1-CG 3.65Å; L56-R61 VanDerWaalsContact CD1-NE 3.26Å; L56-R61 HydrophobicContact CG-CB 4.48Å; L56-R61 HydrophobicContact CG-CG 4.09Å; R61-K63 VanDerWaalsContact CZ-CE 3.5Å; R61-K63 VanDerWaalsContact NE-CE 3.29Å
62	G	62.6	Low	61	Low	2 Å²	2	88.1 Å²	88.1	2%	0.021	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125.6	177.1	0	0	0	0	0	109.7	A34 D54 Y55	A34-G62 WeakPolarHBondContact O-CA 3.49Å; D54-G62 WeakPolarHBondContact CA-O 3.5Å; Y55-G62 PolarHBondContact N-O 3.04Å; Y55-G62 PolarHBondContact O-N 3.1Å
63	K	65.2	Low	60.7	Low	57 Å²	57	91.7 Å²	91.7	25%	0.248	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	125.9	177.6	-71.1	-171.4	179.3	-175.3	0	110.4	Y51 Y53 D54 R61 Y65	Y51-K63 HydrophobicContact CE2-CG 4.42Å; Y53-K63 CarbonylContact O-C 3.6Å; Y53-K63 WeakPolarHBondContact O-CA 3.38Å; D54-K63 HydrophobicContact CB-CG 4.36Å; D54-K63 VanDerWaalsContact OD2-CE 3.25Å; D54-K63 WeakPolarHBondContact OD2-CE 3.49Å; R61-K63 VanDerWaalsContact CZ-CE 3.5Å; R61-K63 VanDerWaalsContact NE-CE 3.29Å; K63-Y65 HydrophobicContact CB-CD2 4.47Å; K63-Y65 HydrophobicContact CB-CE2 3.64Å; K63-Y65 WeakPolarHBondContact CD-OH 3.21Å
64	M	66.1	Low	60.3	Low	24 Å²	24	95 Å²	95	12%	0.118	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.1	172.7	-119.2	-175.5	170.6	0	0	109.8	F12 L33 A37 Y52 Y53	F12-M64 HydrophobicContact CE1-CE 4.38Å; F12-M64 HydrophobicContact CE1-SD 4.25Å; F12-M64 HydrophobicContact CE2-CE 4.39Å; F12-M64 HydrophobicContact CZ-CE 3.63Å; F12-M64 HydrophobicContact CZ-SD 4.05Å; L33-M64 HydrophobicContact CB-CE 3.66Å; L33-M64 HydrophobicContact CB-SD 3.88Å; L33-M64 HydrophobicContact CD1-CE 4.24Å; L33-M64 HydrophobicContact CD2-CE 3.96Å; L33-M64 HydrophobicContact CG-CE 4.17Å; A37-M64 HydrophobicContact CB-CG 4.25Å; Y52-M64 WeakPolarHBondContact CB-O 3.34Å; Y52-M64 PolarHBondContact N-O 3.07Å; Y53-M64 PolarHBondContact N-O 2.95Å; Y53-M64 PolarHBondContact O-N 3.39Å
65	Y	65.7	Low	59.8	Low	44 Å²	44	98.5 Å²	98.5	17%	0.173	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	138.7	177.4	-60.6	-89.1	0	0	0	109.2	G40 I41 R50 Y51 K63	G40-Y65 WeakPolarHBondContact O-CE2 3.27Å; I41-Y65 HydrophobicContact CB-CE2 4.46Å; I41-Y65 HydrophobicContact CD1-CE1 4.03Å; I41-Y65 HydrophobicContact CG1-CD1 4.02Å; I41-Y65 HydrophobicContact CG1-CD2 4.35Å; I41-Y65 HydrophobicContact CG1-CE1 3.43Å; I41-Y65 VanDerWaalsContact CG1-CE1 3.43Å; I41-Y65 HydrophobicContact CG1-CE2 3.81Å; I41-Y65 HydrophobicContact CG1-CG 4.45Å; I41-Y65 WeakPolarHBondContact CG1-OH 2.95Å; R50-Y65 WeakPolarHBondContact O-CA 3.37Å; Y51-Y65 HydrophobicContact CD2-CE1 4.44Å; K63-Y65 HydrophobicContact CB-CD2 4.47Å; K63-Y65 HydrophobicContact CB-CE2 3.64Å; K63-Y65 WeakPolarHBondContact CD-OH 3.21Å
66	V	65	Low	59.3	Low	37 Å²	37	103.5 Å²	103.5	22%	0.224	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	144	175.1	-74.2	0	0	0	0	110.3	F12 C49 R50 Y52	F12-V66 HydrophobicContact CD1-CG1 3.5Å; F12-V66 VanDerWaalsContact CD1-CG1 3.5Å; F12-V66 HydrophobicContact CE1-CG1 3.3Å; F12-V66 HydrophobicContact CG-CG1 4.37Å; F12-V66 HydrophobicContact CZ-CG1 4.04Å; C49-V66 WeakPolarHBondContact CA-O 3.46Å; R50-V66 PolarHBondContact N-O 3.28Å; R50-V66 PolarHBondContact O-N 2.93Å; Y52-V66 HydrophobicContact CD2-CB 4.39Å; Y52-V66 HydrophobicContact CD2-CG1 3.9Å; Y52-V66 HydrophobicContact CD2-CG2 3.58Å; Y52-V66 HydrophobicContact CE2-CG2 4.49Å; Y52-V66 HydrophobicContact CG-CG1 3.95Å; Y52-V66 HydrophobicContact CG-CG2 4.11Å
67	Y	58.7	Low	59.1	Low	131 Å²	131	102.6 Å²	102.6	51%	0.514	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.8	172.6	-83.5	-94.6	0	0	0	110.3	N44 C45 C49 R69	N44-Y67 PolarHBondContact O-OH 3.27Å; C45-Y67 VanDerWaalsContact CA-OH 3.23Å; C45-Y67 WeakPolarHBondContact CA-OH 3.32Å; C45-Y67 PolarHBondContact N-OH 3.35Å; C45-Y67 VanDerWaalsContact N-OH 3.16Å; C49-Y67 VanDerWaalsContact SG-CD2 3.56Å; C49-Y67 VanDerWaalsContact SG-CE2 3.52Å; Y67-R69 PolarHBondContact O-N 2.71Å
68	Y	55.4	Low	59	Low	142 Å²	142	101.3 Å²	101.3	56%	0.557	50%	0.497	S	S	*	.			trans	-69.3	112	165.4	-145.3	-92	0	0	0	108.7	R48 T70	R48-Y68 VanDerWaalsContact O-CB 3.22Å; R48-Y68 WeakPolarHBondContact O-CB 3.12Å; R48-Y68 PolarHBondContact O-N 2.84Å; Y68-T70 PolarHBondContact O-N 3.07Å
69	R	48.8	Very low	59.6	Low	216 Å²	216	99.5 Å²	99.5	82%	0.815	47%	0.467	S	S	*	.			trans	-85.2	107.6	168.2	-152.5	177.3	-170.8	-180	0.8	106.8	Y67	Y67-R69 PolarHBondContact O-N 2.71Å
70	T	47.4	Very low	59.5	Low	144 Å²	144	100.8 Å²	100.8	88%	0.883	43%	0.43	S	S	*	.			trans	-64	0	164.9	50.8	0	0	0	0	110.2	R48 Y68	R48-T70 PolarHBondContact NH1-OG1 3.12Å; Y68-T70 PolarHBondContact O-N 3.07Å

Retrieved 70 of 70 residues in 20.7 ms (Link to these results)

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