G4VJX3_SCHMA Loading...

Small integral membrane protein 12

AlphaFold DB , UniProt , Accession G4VJX3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 92 aa.

						>G4VJX3_SCHMA|G4VJX3
MWPLILQFIRNNVRYVALPFAVLVGSIGFNAESWFRSQEAISSSMHNPKQTTSEARRKRQLTKDLNTPVNDLSVTSESALRYHSDPIFNKNK
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	85.1	Confident	92.3	Very high	182 Å²	182	125.3 Å²	125.3	90%	0.897	59%	0.593	S	S	*	*				0	-45.3	0	-56.8	-46.9	167.1	0	0	113.1	P3 L4	M1-P3 VanDerWaalsContact C-CD 3.48Å; M1-L4 WeakPolarHBondContact O-CB 3.39Å; M1-L4 PolarHBondContact O-N 2.95Å; M1-L4 VanDerWaalsContact O-N 3.17Å; M1-L4 HydrophobicContact SD-CD1 4.4Å
2	W	93.6	Very high	92.3	Very high	179 Å²	179	119.1 Å²	119.1	68%	0.678	57%	0.567	S	S	*	*	H	α-helix	trans	-47	-45.2	176.8	-162.4	-116.8	0	0	0	117.4	L4 I5 L6	W2-L4 VanDerWaalsContact C-N 3.28Å; W2-L4 PolarHBondContact O-N 2.96Å; W2-I5 HydrophobicContact CE3-CD1 4.15Å; W2-I5 PolarHBondContact O-N 3.46Å; W2-L6 PolarHBondContact O-N 3.29Å; W2-L6 VanDerWaalsContact O-N 3.16Å
3	P	93.7	Very high	92.3	Very high	93 Å²	93	115.8 Å²	115.8	60%	0.604	56%	0.558	S	S	*	*	H	α-helix	trans	-64.1	-30.8	-178.8	22.5	-33.8	0	0	0	113.7	M1 L6 Q7	M1-P3 VanDerWaalsContact C-CD 3.48Å; P3-L6 PolarHBondContact O-N 3.38Å; P3-Q7 WeakPolarHBondContact O-CB 3.29Å; P3-Q7 PolarHBondContact O-N 2.87Å
4	L	93.7	Very high	92.1	Very high	108 Å²	108	122.9 Å²	122.9	57%	0.565	58%	0.577	S	S	*	*	H	α-helix	trans	-67.7	-40.2	177.3	-68.8	166	0	0	0	111.2	M1 W2 Q7 F8	M1-L4 WeakPolarHBondContact O-CB 3.39Å; M1-L4 PolarHBondContact O-N 2.95Å; M1-L4 VanDerWaalsContact O-N 3.17Å; M1-L4 HydrophobicContact SD-CD1 4.4Å; W2-L4 VanDerWaalsContact C-N 3.28Å; W2-L4 PolarHBondContact O-N 2.96Å; L4-Q7 PolarHBondContact O-N 3.28Å; L4-F8 WeakPolarHBondContact O-CB 3.45Å; L4-F8 PolarHBondContact O-N 2.92Å
5	I	93.1	Very high	92.1	Very high	82 Å²	82	126.8 Å²	126.8	42%	0.421	59%	0.586	S	S	.	*	H	α-helix	trans	-63.2	-47.1	177.3	-63.1	163	0	0	0	109.8	W2 Q7 F8 I9	W2-I5 HydrophobicContact CE3-CD1 4.15Å; W2-I5 PolarHBondContact O-N 3.46Å; I5-Q7 PolarHBondContact O-N 3.44Å; I5-F8 PolarHBondContact O-N 3.41Å; I5-I9 HydrophobicContact CG2-CD1 3.83Å; I5-I9 VanDerWaalsContact O-CG1 3.3Å; I5-I9 WeakPolarHBondContact O-CG1 3.32Å; I5-I9 PolarHBondContact O-N 2.89Å
6	L	93.4	Very high	92.1	Very high	86 Å²	86	122.3 Å²	122.3	45%	0.45	57%	0.57	S	S	.	*	H	α-helix	trans	-63.7	-39.6	177.8	-69.8	176.5	0	0	0	112.5	W2 P3 I9 R10	W2-L6 PolarHBondContact O-N 3.29Å; W2-L6 VanDerWaalsContact O-N 3.16Å; P3-L6 PolarHBondContact O-N 3.38Å; L6-I9 PolarHBondContact O-N 3.48Å; L6-R10 VanDerWaalsContact O-CB 3.29Å; L6-R10 WeakPolarHBondContact O-CB 3.11Å; L6-R10 PolarHBondContact O-N 3.36Å
7	Q	93.1	Very high	92.1	Very high	120 Å²	120	117.9 Å²	117.9	56%	0.561	56%	0.559	S	S	*	*	H	α-helix	trans	-64.4	-42.6	175.9	-167.9	172.6	24.8	0	0	111.3	P3 L4 I5 I9 R10 N11	P3-Q7 WeakPolarHBondContact O-CB 3.29Å; P3-Q7 PolarHBondContact O-N 2.87Å; L4-Q7 PolarHBondContact O-N 3.28Å; I5-Q7 PolarHBondContact O-N 3.44Å; Q7-I9 PolarHBondContact O-N 3.15Å; Q7-R10 PolarHBondContact O-N 3.47Å; Q7-N11 WeakPolarHBondContact O-CB 3.42Å; Q7-N11 PolarHBondContact O-N 2.98Å; Q7-N11 PolarHBondContact O-OD1 3.16Å
8	F	91.4	Very high	92.1	Very high	133 Å²	133	118.4 Å²	118.4	58%	0.583	57%	0.565	S	S	*	*	H	α-helix	trans	-62	-44.8	176.1	-174.3	-92.8	0	0	0	112.3	L4 I5 N11 N12	L4-F8 WeakPolarHBondContact O-CB 3.45Å; L4-F8 PolarHBondContact O-N 2.92Å; I5-F8 PolarHBondContact O-N 3.41Å; F8-N11 PolarHBondContact O-N 3.28Å; F8-N12 WeakPolarHBondContact O-CB 3.49Å; F8-N12 PolarHBondContact O-N 3.5Å; F8-N12 PolarHBondContact O-ND2 2.94Å; F8-N12 VanDerWaalsContact O-ND2 3.15Å
9	I	93	Very high	92.2	Very high	64 Å²	64	116.1 Å²	116.1	33%	0.328	56%	0.561	S	S	.	*	H	α-helix	trans	-62.2	-43.6	175.6	-67	165.3	0	0	0	110.4	I5 L6 Q7 N11 N12 V13	I5-I9 HydrophobicContact CG2-CD1 3.83Å; I5-I9 VanDerWaalsContact O-CG1 3.3Å; I5-I9 WeakPolarHBondContact O-CG1 3.32Å; I5-I9 PolarHBondContact O-N 2.89Å; L6-I9 PolarHBondContact O-N 3.48Å; Q7-I9 PolarHBondContact O-N 3.15Å; I9-N11 PolarHBondContact O-N 3.17Å; I9-N12 CarbonylContact O-C 3.44Å; I9-N12 PolarHBondContact O-N 3.2Å; I9-V13 HydrophobicContact CG2-CG2 4.43Å; I9-V13 WeakPolarHBondContact O-CA 3.5Å; I9-V13 VanDerWaalsContact O-CB 3.32Å; I9-V13 WeakPolarHBondContact O-CB 3.3Å; I9-V13 PolarHBondContact O-N 3.42Å
10	R	91.2	Very high	92.3	Very high	210 Å²	210	117 Å²	117	79%	0.792	56%	0.562	S	S	*	*	H	α-helix	trans	-61.9	-43.4	178.9	-179	176.6	171.3	172.6	-2.4	111.8	L6 Q7	L6-R10 VanDerWaalsContact O-CB 3.29Å; L6-R10 WeakPolarHBondContact O-CB 3.11Å; L6-R10 PolarHBondContact O-N 3.36Å; Q7-R10 PolarHBondContact O-N 3.47Å
11	N	94	Very high	92.5	Very high	121 Å²	121	114.2 Å²	114.2	65%	0.647	56%	0.559	S	S	*	*	H	α-helix	trans	-71.3	-34.1	-179.9	-75.3	49.6	0	0	0	112.3	Q7 F8 I9	Q7-N11 WeakPolarHBondContact O-CB 3.42Å; Q7-N11 PolarHBondContact O-N 2.98Å; Q7-N11 PolarHBondContact O-OD1 3.16Å; F8-N11 PolarHBondContact O-N 3.28Å; I9-N11 PolarHBondContact O-N 3.17Å
12	N	92.4	Very high	93	Very high	51 Å²	51	110 Å²	110	27%	0.273	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	25.8	-175.9	-64.1	-74	0	0	0	113.1	F8 I9 R14 Y15 V16	F8-N12 WeakPolarHBondContact O-CB 3.49Å; F8-N12 PolarHBondContact O-N 3.5Å; F8-N12 PolarHBondContact O-ND2 2.94Å; F8-N12 VanDerWaalsContact O-ND2 3.15Å; I9-N12 CarbonylContact O-C 3.44Å; I9-N12 PolarHBondContact O-N 3.2Å; N12-R14 PolarHBondContact O-N 2.96Å; N12-R14 VanDerWaalsContact O-N 3.08Å; N12-Y15 HydrophobicContact CB-CD2 4.17Å; N12-Y15 PolarHBondContact O-N 2.76Å; N12-V16 PolarHBondContact O-N 2.95Å; N12-V16 VanDerWaalsContact O-N 3.14Å
13	V	91.9	Very high	93.1	Very high	76 Å²	76	106.4 Å²	106.4	46%	0.461	54%	0.536	S	S	.	.	H	α-helix	trans	-58.1	-34.8	-167.4	96.5	0	0	0	0	112.4	I9 Y15 V16 A17	I9-V13 HydrophobicContact CG2-CG2 4.43Å; I9-V13 WeakPolarHBondContact O-CA 3.5Å; I9-V13 VanDerWaalsContact O-CB 3.32Å; I9-V13 WeakPolarHBondContact O-CB 3.3Å; I9-V13 PolarHBondContact O-N 3.42Å; V13-Y15 VanDerWaalsContact C-N 3.33Å; V13-Y15 PolarHBondContact O-N 3.36Å; V13-V16 PolarHBondContact O-N 3.14Å; V13-A17 WeakPolarHBondContact O-CA 3.32Å; V13-A17 WeakPolarHBondContact O-CB 3.47Å; V13-A17 PolarHBondContact O-N 3.15Å
14	R	89.4	Confident	93.2	Very high	216 Å²	216	105.4 Å²	105.4	82%	0.815	53%	0.528	S	S	*	.	H	α-helix	trans	-64.1	-37.2	178.5	-69.1	-179.3	-167.9	175.9	3.6	112.6	N12	N12-R14 PolarHBondContact O-N 2.96Å; N12-R14 VanDerWaalsContact O-N 3.08Å
15	Y	92.7	Very high	93.3	Very high	181 Å²	181	102.3 Å²	102.3	71%	0.71	52%	0.523	S	S	*	.	H	α-helix	trans	-79.8	-26.9	-179.4	-56.2	-70.8	0	0	0	112.4	N12 V13 P19	N12-Y15 HydrophobicContact CB-CD2 4.17Å; N12-Y15 PolarHBondContact O-N 2.76Å; V13-Y15 VanDerWaalsContact C-N 3.33Å; V13-Y15 PolarHBondContact O-N 3.36Å; Y15-P19 WeakPolarHBondContact O-CD 3.43Å; Y15-P19 WeakPolarHBondContact O-CG 3.2Å
16	V	92.2	Very high	93.4	Very high	55 Å²	55	101.2 Å²	101.2	33%	0.333	52%	0.522	S	S	.	.	H	α-helix	trans	-88.3	-40	178.5	-179.7	0	0	0	0	111.4	N12 V13 L18 P19 F20	N12-V16 PolarHBondContact O-N 2.95Å; N12-V16 VanDerWaalsContact O-N 3.14Å; V13-V16 PolarHBondContact O-N 3.14Å; V16-L18 PolarHBondContact O-N 3.08Å; V16-P19 WeakPolarHBondContact O-CD 3.17Å; V16-P19 WeakPolarHBondContact O-CG 3Å; V16-F20 WeakPolarHBondContact O-CB 2.98Å; V16-F20 PolarHBondContact O-N 3.5Å; V16-F20 VanDerWaalsContact O-N 3.15Å
17	A	92.3	Very high	93.5	Very high	47 Å²	47	102 Å²	102	39%	0.388	53%	0.526	S	S	.	.	H	α-helix	trans	-67.3	-37	-175.4	0	0	0	0	0	112.6	V13 F20 A21	V13-A17 WeakPolarHBondContact O-CA 3.32Å; V13-A17 WeakPolarHBondContact O-CB 3.47Å; V13-A17 PolarHBondContact O-N 3.15Å; A17-F20 PolarHBondContact O-N 3.47Å; A17-A21 WeakPolarHBondContact O-CB 3.18Å; A17-A21 PolarHBondContact O-N 2.98Å
18	L	91.8	Very high	93.5	Very high	127 Å²	127	98.1 Å²	98.1	67%	0.665	52%	0.518	S	S	*	.	H	α-helix	trans	-62.9	-57.1	179.4	-170.7	81.3	0	0	0	112.9	V16 F20 A21 V22	V16-L18 PolarHBondContact O-N 3.08Å; L18-F20 VanDerWaalsContact C-N 3.26Å; L18-F20 PolarHBondContact O-N 3.19Å; L18-A21 PolarHBondContact O-N 2.78Å; L18-V22 WeakPolarHBondContact O-CG2 3.34Å; L18-V22 PolarHBondContact O-N 3.36Å
19	P	94.3	Very high	93.4	Very high	74 Å²	74	99.1 Å²	99.1	48%	0.481	52%	0.522	S	S	.	.	H	α-helix	trans	-63.7	-34.2	177.3	25.7	-34.4	0	0	0	111.8	Y15 V16 V22 L23	Y15-P19 WeakPolarHBondContact O-CD 3.43Å; Y15-P19 WeakPolarHBondContact O-CG 3.2Å; V16-P19 WeakPolarHBondContact O-CD 3.17Å; V16-P19 WeakPolarHBondContact O-CG 3Å; P19-V22 PolarHBondContact O-N 3.47Å; P19-L23 WeakPolarHBondContact O-CB 3.42Å; P19-L23 PolarHBondContact O-N 2.86Å
20	F	94	Very high	93.2	Very high	135 Å²	135	101 Å²	101	59%	0.592	53%	0.533	S	S	*	.	H	α-helix	trans	-62.2	-44.1	173.9	-176.2	-102	0	0	0	111.9	V16 A17 L18 L23 V24	V16-F20 WeakPolarHBondContact O-CB 2.98Å; V16-F20 PolarHBondContact O-N 3.5Å; V16-F20 VanDerWaalsContact O-N 3.15Å; A17-F20 PolarHBondContact O-N 3.47Å; L18-F20 VanDerWaalsContact C-N 3.26Å; L18-F20 PolarHBondContact O-N 3.19Å; F20-L23 PolarHBondContact O-N 2.79Å; F20-V24 HydrophobicContact CD1-CG2 4.13Å; F20-V24 HydrophobicContact CD2-CG2 4.38Å; F20-V24 HydrophobicContact CE1-CG2 3.76Å; F20-V24 HydrophobicContact CE2-CG2 4.03Å; F20-V24 HydrophobicContact CG-CG2 4.43Å; F20-V24 HydrophobicContact CZ-CG2 3.7Å; F20-V24 WeakPolarHBondContact O-CB 3.39Å; F20-V24 VanDerWaalsContact O-CG2 3.28Å; F20-V24 WeakPolarHBondContact O-CG2 3.22Å; F20-V24 PolarHBondContact O-N 2.84Å
21	A	95.5	Very high	93	Very high	59 Å²	59	92.7 Å²	92.7	49%	0.488	51%	0.509	S	S	.	.	H	α-helix	trans	-64.7	-39.4	176.4	0	0	0	0	0	112.1	A17 L18 G25	A17-A21 WeakPolarHBondContact O-CB 3.18Å; A17-A21 PolarHBondContact O-N 2.98Å; L18-A21 PolarHBondContact O-N 2.78Å; A21-G25 WeakPolarHBondContact O-CA 3.44Å; A21-G25 PolarHBondContact O-N 2.73Å
22	V	96.3	Very high	92.5	Very high	92 Å²	92	92.6 Å²	92.6	56%	0.558	51%	0.505	S	S	*	.	H	α-helix	trans	-63.5	-43.4	174.3	172.7	0	0	0	0	110.9	L18 P19 S26	L18-V22 WeakPolarHBondContact O-CG2 3.34Å; L18-V22 PolarHBondContact O-N 3.36Å; P19-V22 PolarHBondContact O-N 3.47Å; V22-S26 VanDerWaalsContact O-CB 3.28Å; V22-S26 WeakPolarHBondContact O-CB 3.28Å; V22-S26 PolarHBondContact O-N 2.91Å; V22-S26 PolarHBondContact O-OG 2.87Å
23	L	96.4	Very high	91.8	Very high	105 Å²	105	93.2 Å²	93.2	55%	0.55	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-52.4	178.1	-165.8	89.1	0	0	0	110.9	P19 F20 G25 S26 I27	P19-L23 WeakPolarHBondContact O-CB 3.42Å; P19-L23 PolarHBondContact O-N 2.86Å; F20-L23 PolarHBondContact O-N 2.79Å; L23-G25 VanDerWaalsContact C-N 3.33Å; L23-G25 PolarHBondContact O-N 3.24Å; L23-S26 PolarHBondContact O-N 3.46Å; L23-I27 HydrophobicContact CD2-CD1 4.14Å; L23-I27 HydrophobicContact CG-CD1 3.94Å; L23-I27 WeakPolarHBondContact O-CB 3.28Å; L23-I27 VanDerWaalsContact O-CG1 3.28Å; L23-I27 WeakPolarHBondContact O-CG1 3.49Å; L23-I27 PolarHBondContact O-N 3.29Å
24	V	96.2	Very high	91.1	Very high	72 Å²	72	97.1 Å²	97.1	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-63.8	-39.8	179.5	173.6	0	0	0	0	111.1	F20 I27 G28	F20-V24 HydrophobicContact CD1-CG2 4.13Å; F20-V24 HydrophobicContact CD2-CG2 4.38Å; F20-V24 HydrophobicContact CE1-CG2 3.76Å; F20-V24 HydrophobicContact CE2-CG2 4.03Å; F20-V24 HydrophobicContact CG-CG2 4.43Å; F20-V24 HydrophobicContact CZ-CG2 3.7Å; F20-V24 WeakPolarHBondContact O-CB 3.39Å; F20-V24 VanDerWaalsContact O-CG2 3.28Å; F20-V24 WeakPolarHBondContact O-CG2 3.22Å; F20-V24 PolarHBondContact O-N 2.84Å; V24-I27 PolarHBondContact O-N 2.85Å; V24-G28 PolarHBondContact O-N 2.77Å
25	G	96	Very high	90.5	Very high	43 Å²	43	93.4 Å²	93.4	44%	0.443	51%	0.509	S	S	.	.	H	α-helix	trans	-64.4	-41	175.3	0	0	0	0	0	112.1	A21 L23 F29	A21-G25 WeakPolarHBondContact O-CA 3.44Å; A21-G25 PolarHBondContact O-N 2.73Å; L23-G25 VanDerWaalsContact C-N 3.33Å; L23-G25 PolarHBondContact O-N 3.24Å; G25-F29 WeakPolarHBondContact O-CB 3.28Å; G25-F29 PolarHBondContact O-N 3.36Å
26	S	95	Very high	89.1	Confident	58 Å²	58	93.8 Å²	93.8	41%	0.406	51%	0.509	S	S	.	.	H	α-helix	trans	-66.7	-46.7	175.8	-58.6	0	0	0	0	111.2	V22 L23 G28 F29 N30	V22-S26 VanDerWaalsContact O-CB 3.28Å; V22-S26 WeakPolarHBondContact O-CB 3.28Å; V22-S26 PolarHBondContact O-N 2.91Å; V22-S26 PolarHBondContact O-OG 2.87Å; L23-S26 PolarHBondContact O-N 3.46Å; S26-G28 PolarHBondContact O-N 3.1Å; S26-F29 PolarHBondContact O-N 3.37Å; S26-N30 WeakPolarHBondContact O-CB 3.23Å; S26-N30 PolarHBondContact O-N 3.5Å; S26-N30 PolarHBondContact O-ND2 2.8Å
27	I	94.4	Very high	87.6	Confident	104 Å²	104	92.4 Å²	92.4	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-45.5	176.7	-67.6	164.1	0	0	0	110.3	L23 V24 N30 A31	L23-I27 HydrophobicContact CD2-CD1 4.14Å; L23-I27 HydrophobicContact CG-CD1 3.94Å; L23-I27 WeakPolarHBondContact O-CB 3.28Å; L23-I27 VanDerWaalsContact O-CG1 3.28Å; L23-I27 WeakPolarHBondContact O-CG1 3.49Å; L23-I27 PolarHBondContact O-N 3.29Å; V24-I27 PolarHBondContact O-N 2.85Å; I27-N30 PolarHBondContact O-N 2.82Å; I27-A31 VanDerWaalsContact O-CB 3.23Å; I27-A31 WeakPolarHBondContact O-CB 3.42Å; I27-A31 PolarHBondContact O-N 2.96Å
28	G	93.1	Very high	85.9	Confident	38 Å²	38	95 Å²	95	39%	0.392	51%	0.506	S	S	.	.	H	α-helix	trans	-62.8	-43	177.6	0	0	0	0	0	112.6	V24 S26 N30 A31 E32	V24-G28 PolarHBondContact O-N 2.77Å; S26-G28 PolarHBondContact O-N 3.1Å; G28-N30 PolarHBondContact O-N 3.46Å; G28-A31 PolarHBondContact O-N 3.48Å; G28-E32 WeakPolarHBondContact O-CB 3.12Å; G28-E32 PolarHBondContact O-N 3.41Å
29	F	89	Confident	84	Confident	153 Å²	153	97 Å²	97	67%	0.671	51%	0.512	S	S	*	.	H	α-helix	trans	-63.1	-41.2	175.6	-177.8	-98.7	0	0	0	112.1	G25 S26 S33	G25-F29 WeakPolarHBondContact O-CB 3.28Å; G25-F29 PolarHBondContact O-N 3.36Å; S26-F29 PolarHBondContact O-N 3.37Å; F29-S33 VanDerWaalsContact O-CB 3.26Å; F29-S33 WeakPolarHBondContact O-CB 3.2Å; F29-S33 PolarHBondContact O-N 2.77Å
30	N	88.3	Confident	81.9	Confident	105 Å²	105	95 Å²	95	56%	0.561	50%	0.503	S	S	*	.	H	α-helix	trans	-70.9	-39.8	176.4	-77.1	-76.8	0	0	0	112.1	S26 I27 G28 S33 W34	S26-N30 WeakPolarHBondContact O-CB 3.23Å; S26-N30 PolarHBondContact O-N 3.5Å; S26-N30 PolarHBondContact O-ND2 2.8Å; I27-N30 PolarHBondContact O-N 2.82Å; G28-N30 PolarHBondContact O-N 3.46Å; N30-S33 WeakPolarHBondContact O-CB 3.26Å; N30-S33 PolarHBondContact O-N 3.32Å; N30-W34 WeakPolarHBondContact O-CB 2.97Å; N30-W34 PolarHBondContact O-N 2.82Å
31	A	88.2	Confident	79.8	Confident	34 Å²	34	94.5 Å²	94.5	28%	0.281	50%	0.504	S	S	.	.	H	α-helix	trans	-64.9	-46.2	176.1	0	0	0	0	0	111	I27 G28 S33 W34 F35	I27-A31 VanDerWaalsContact O-CB 3.23Å; I27-A31 WeakPolarHBondContact O-CB 3.42Å; I27-A31 PolarHBondContact O-N 2.96Å; G28-A31 PolarHBondContact O-N 3.48Å; A31-S33 VanDerWaalsContact C-N 3.33Å; A31-S33 PolarHBondContact O-N 2.94Å; A31-W34 PolarHBondContact O-N 3.39Å; A31-W34 VanDerWaalsContact O-N 3.1Å; A31-F35 HydrophobicContact CB-CE2 4.49Å; A31-F35 WeakPolarHBondContact O-CD2 3.44Å; A31-F35 PolarHBondContact O-N 2.73Å
32	E	82.6	Confident	77.6	Confident	120 Å²	120	95.4 Å²	95.4	56%	0.561	51%	0.507	S	S	*	.	H	α-helix	trans	-57.9	-46.4	173.3	-179.3	61.4	-148.1	0	0	110.8	G28 W34 F35 R36	G28-E32 WeakPolarHBondContact O-CB 3.12Å; G28-E32 PolarHBondContact O-N 3.41Å; E32-W34 VanDerWaalsContact C-N 3.29Å; E32-W34 PolarHBondContact O-N 3.37Å; E32-F35 PolarHBondContact O-N 3.21Å; E32-R36 WeakPolarHBondContact O-CB 3.38Å; E32-R36 PolarHBondContact O-N 2.88Å
33	S	78.2	Confident	75.5	Confident	63 Å²	63	96.9 Å²	96.9	44%	0.441	52%	0.522	S	S	.	.	H	α-helix	trans	-58.4	-42.4	174.3	-177	0	0	0	0	111.3	F29 N30 A31 S37	F29-S33 VanDerWaalsContact O-CB 3.26Å; F29-S33 WeakPolarHBondContact O-CB 3.2Å; F29-S33 PolarHBondContact O-N 2.77Å; N30-S33 WeakPolarHBondContact O-CB 3.26Å; N30-S33 PolarHBondContact O-N 3.32Å; A31-S33 VanDerWaalsContact C-N 3.33Å; A31-S33 PolarHBondContact O-N 2.94Å; S33-S37 WeakPolarHBondContact O-CA 3.17Å; S33-S37 WeakPolarHBondContact O-CB 3.47Å; S33-S37 PolarHBondContact O-N 3.39Å; S33-S37 PolarHBondContact O-OG 3.42Å
34	W	77.3	Confident	73.3	Confident	158 Å²	158	96.7 Å²	96.7	60%	0.598	53%	0.529	S	S	*	.	H	α-helix	trans	-69.9	-43.9	179.9	-172	33.5	0	0	0	113.1	N30 A31 E32 S37 Q38	N30-W34 WeakPolarHBondContact O-CB 2.97Å; N30-W34 PolarHBondContact O-N 2.82Å; A31-W34 PolarHBondContact O-N 3.39Å; A31-W34 VanDerWaalsContact O-N 3.1Å; E32-W34 VanDerWaalsContact C-N 3.29Å; E32-W34 PolarHBondContact O-N 3.37Å; W34-S37 WeakPolarHBondContact CA-OG 3.45Å; W34-S37 PolarHBondContact O-N 2.84Å; W34-S37 PolarHBondContact O-OG 2.88Å; W34-Q38 WeakPolarHBondContact O-CG 3.1Å; W34-Q38 PolarHBondContact O-N 3.44Å
35	F	75.9	Confident	71	Confident	139 Å²	139	101.9 Å²	101.9	61%	0.61	55%	0.551	S	S	*	*	H	α-helix	trans	-62.7	-46.8	175	-78	-65.1	0	0	0	111.4	A31 E32 S37	A31-F35 HydrophobicContact CB-CE2 4.49Å; A31-F35 WeakPolarHBondContact O-CD2 3.44Å; A31-F35 PolarHBondContact O-N 2.73Å; E32-F35 PolarHBondContact O-N 3.21Å; F35-S37 VanDerWaalsContact C-N 3.3Å; F35-S37 PolarHBondContact O-N 3.38Å
36	R	65.1	Low	68.7	Low	188 Å²	188	105.1 Å²	105.1	71%	0.709	55%	0.554	S	S	*	*	H	α-helix	trans	-67.1	-33.1	178.1	-168.6	170.7	-176.3	-152.7	0.6	112.7	E32 A40	E32-R36 WeakPolarHBondContact O-CB 3.38Å; E32-R36 PolarHBondContact O-N 2.88Å; R36-A40 PolarHBondContact O-N 3.36Å
37	S	59.9	Low	66.6	Low	27 Å²	27	107.9 Å²	107.9	19%	0.189	57%	0.565	C	S	.	*	H	α-helix	trans	-83.7	-26.2	-178.4	67.3	0	0	0	0	113.1	S33 W34 F35 E39 A40 I41	S33-S37 WeakPolarHBondContact O-CA 3.17Å; S33-S37 WeakPolarHBondContact O-CB 3.47Å; S33-S37 PolarHBondContact O-N 3.39Å; S33-S37 PolarHBondContact O-OG 3.42Å; W34-S37 WeakPolarHBondContact CA-OG 3.45Å; W34-S37 PolarHBondContact O-N 2.84Å; W34-S37 PolarHBondContact O-OG 2.88Å; F35-S37 VanDerWaalsContact C-N 3.3Å; F35-S37 PolarHBondContact O-N 3.38Å; S37-E39 VanDerWaalsContact C-N 3.27Å; S37-E39 PolarHBondContact O-N 2.65Å; S37-A40 CarbonylContact O-C 3.45Å; S37-A40 PolarHBondContact O-N 3.18Å; S37-I41 VanDerWaalsContact CB-CD1 3.46Å; S37-I41 WeakPolarHBondContact O-CA 3.49Å; S37-I41 WeakPolarHBondContact O-CB 3.45Å; S37-I41 WeakPolarHBondContact O-CG1 3.15Å; S37-I41 PolarHBondContact O-N 2.64Å
38	Q	55.8	Low	64.8	Low	100 Å²	100	106.3 Å²	106.3	47%	0.467	56%	0.561	S	S	.	*	H	α-helix	trans	-63.1	-35.7	172.6	-80.9	-167.8	80.5	0	0	112.2	W34 A40 S42	W34-Q38 WeakPolarHBondContact O-CG 3.1Å; W34-Q38 PolarHBondContact O-N 3.44Å; Q38-A40 VanDerWaalsContact C-N 3.31Å; Q38-S42 WeakPolarHBondContact O-CB 3.43Å; Q38-S42 PolarHBondContact O-N 3.03Å
39	E	53.2	Low	63.1	Low	170 Å²	170	114.2 Å²	114.2	79%	0.794	59%	0.585	S	S	*	*	H	α-helix	trans	-74.4	-20	172.3	-77.5	163.5	172.6	0	0	113.3	S37	S37-E39 VanDerWaalsContact C-N 3.27Å; S37-E39 PolarHBondContact O-N 2.65Å
40	A	48.6	Very low	61.6	Low	33 Å²	33	109.7 Å²	109.7	27%	0.273	57%	0.566	S	S	.	*	H	α-helix	trans	-98.6	-20.5	177.2	0	0	0	0	0	114.9	R36 S37 Q38 H46	R36-A40 PolarHBondContact O-N 3.36Å; S37-A40 CarbonylContact O-C 3.45Å; S37-A40 PolarHBondContact O-N 3.18Å; Q38-A40 VanDerWaalsContact C-N 3.31Å; A40-H46 WeakPolarHBondContact O-CB 3.13Å
41	I	50.4	Low	60.4	Low	123 Å²	123	108 Å²	108	63%	0.631	56%	0.559	S	S	*	*	H	α-helix	trans	-100.7	-21.1	-176.6	-61.4	167.9	0	0	0	110.7	S37 S43	S37-I41 VanDerWaalsContact CB-CD1 3.46Å; S37-I41 WeakPolarHBondContact O-CA 3.49Å; S37-I41 WeakPolarHBondContact O-CB 3.45Å; S37-I41 WeakPolarHBondContact O-CG1 3.15Å; S37-I41 PolarHBondContact O-N 2.64Å; I41-S43 WeakPolarHBondContact O-CA 3.49Å; I41-S43 PolarHBondContact O-N 3.07Å
42	S	49.4	Very low	59.4	Low	78 Å²	78	112.5 Å²	112.5	55%	0.545	58%	0.583	S	S	.	*	S	Bend	trans	-57.8	107.5	167.5	-165.5	0	0	0	0	108.5	Q38 S44	Q38-S42 WeakPolarHBondContact O-CB 3.43Å; Q38-S42 PolarHBondContact O-N 3.03Å; S42-S44 PolarHBondContact O-N 3.39Å
43	S	52.4	Low	58.8	Low	124 Å²	124	110.4 Å²	110.4	87%	0.867	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	16.6	-156.6	52	0	0	0	0	114.9	I41	I41-S43 WeakPolarHBondContact O-CA 3.49Å; I41-S43 PolarHBondContact O-N 3.07Å
44	S	51	Low	58.5	Low	101 Å²	101	112 Å²	112	71%	0.706	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-19.8	-175.6	63.2	0	0	0	0	115.1	S42	S42-S44 PolarHBondContact O-N 3.39Å
45	M	47.5	Very low	58.1	Low	181 Å²	181	105.7 Å²	105.7	89%	0.892	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.4	0.5	-177.5	-88.6	-174.3	169.8	0	0	118	N47	M45-N47 PolarHBondContact O-N 2.63Å
46	H	47.4	Very low	58.1	Low	111 Å²	111	107.7 Å²	107.7	51%	0.514	57%	0.567	S	S	.	*			trans	-82.2	86.4	177.5	-148.7	80.3	0	0	0	111	A40 P48	A40-H46 WeakPolarHBondContact O-CB 3.13Å; H46-P48 WeakPolarHBondContact O-CD 2.98Å
47	N	51.2	Low	58.7	Low	116 Å²	116	107 Å²	107	62%	0.62	57%	0.565	S	S	*	*			trans	-73.3	94.6	150	-173.9	-3.9	0	0	0	105.2	M45 K49	M45-N47 PolarHBondContact O-N 2.63Å; N47-K49 PolarHBondContact O-N 2.92Å
48	P	56.6	Low	59.5	Low	70 Å²	70	111.2 Å²	111.2	46%	0.455	58%	0.579	S	S	.	*			trans	-53.7	126.1	175.3	25.4	-33.6	0	0	0	105.5	H46 Q50	H46-P48 WeakPolarHBondContact O-CD 2.98Å; P48-Q50 VanDerWaalsContact C-N 3.27Å; P48-Q50 VanDerWaalsContact O-CA 3.25Å; P48-Q50 WeakPolarHBondContact O-CA 3.25Å; P48-Q50 PolarHBondContact O-N 3.45Å
49	K	57.3	Low	60.5	Low	205 Å²	205	115.6 Å²	115.6	89%	0.891	59%	0.592	S	S	*	*			trans	-40.1	98.9	-178.8	-80.5	-177.2	177.2	-178.8	0	108	N47 T51	N47-K49 PolarHBondContact O-N 2.92Å; K49-T51 PolarHBondContact O-N 2.94Å
50	Q	57.7	Low	61.7	Low	58 Å²	58	112.9 Å²	112.9	27%	0.271	58%	0.579	S	S	.	*			trans	-64.5	115.2	-166.6	-168.6	176.5	5.2	0	0	104.8	P48 T52 E54 A55	P48-Q50 VanDerWaalsContact C-N 3.27Å; P48-Q50 VanDerWaalsContact O-CA 3.25Å; P48-Q50 WeakPolarHBondContact O-CA 3.25Å; P48-Q50 PolarHBondContact O-N 3.45Å; Q50-T52 PolarHBondContact O-N 3.47Å; Q50-E54 HydrophobicContact CG-CB 3.63Å; Q50-E54 PolarHBondContact NE2-O 2.9Å; Q50-A55 HydrophobicContact CB-CB 4.38Å; Q50-A55 HydrophobicContact CG-CB 3.89Å; Q50-A55 VanDerWaalsContact NE2-N 3.19Å
51	T	62.5	Low	63.2	Low	69 Å²	69	116.3 Å²	116.3	42%	0.423	59%	0.592	S	S	.	*			trans	-54.4	142.3	176.7	63.3	0	0	0	0	106.6	K49 S53 E54 A55	K49-T51 PolarHBondContact O-N 2.94Å; T51-S53 PolarHBondContact O-N 2.85Å; T51-S53 PolarHBondContact OG1-OG 3.44Å; T51-S53 VanDerWaalsContact OG1-OG 3.08Å; T51-E54 PolarHBondContact O-N 3.47Å; T51-E54 WeakPolarHBondContact OG1-CG 3.34Å; T51-E54 PolarHBondContact OG1-OE1 2.89Å; T51-A55 PolarHBondContact O-N 3.08Å
52	T	68.3	Low	64.4	Low	128 Å²	128	114.1 Å²	114.1	79%	0.785	59%	0.585	S	S	*	*	H	α-helix	trans	-54.5	-29.1	-172.4	50.7	0	0	0	0	112.1	Q50 R56	Q50-T52 PolarHBondContact O-N 3.47Å; T52-R56 WeakPolarHBondContact O-CB 3.37Å; T52-R56 PolarHBondContact O-N 2.86Å
53	S	69.7	Low	65.7	Low	77 Å²	77	117.6 Å²	117.6	54%	0.538	59%	0.59	S	S	.	*	H	α-helix	trans	-65.8	-48.3	172.2	52.1	0	0	0	0	113.1	T51 A55 R56 R57	T51-S53 PolarHBondContact O-N 2.85Å; T51-S53 PolarHBondContact OG1-OG 3.44Å; T51-S53 VanDerWaalsContact OG1-OG 3.08Å; S53-A55 VanDerWaalsContact C-N 3.32Å; S53-A55 PolarHBondContact O-N 2.97Å; S53-R56 PolarHBondContact O-N 3.06Å; S53-R57 WeakPolarHBondContact O-CB 3.36Å; S53-R57 PolarHBondContact O-N 2.98Å
54	E	70.3	Confident	66.5	Low	96 Å²	96	117 Å²	117	45%	0.449	58%	0.577	S	S	.	*	H	α-helix	trans	-64.2	-37.6	175	-74.7	173.3	-149.1	0	0	111.7	Q50 T51 R56 R57 K58	Q50-E54 HydrophobicContact CG-CB 3.63Å; Q50-E54 PolarHBondContact NE2-O 2.9Å; T51-E54 PolarHBondContact O-N 3.47Å; T51-E54 WeakPolarHBondContact OG1-CG 3.34Å; T51-E54 PolarHBondContact OG1-OE1 2.89Å; E54-R56 VanDerWaalsContact C-N 3.31Å; E54-R57 PolarHBondContact O-N 2.94Å; E54-K58 PolarHBondContact O-N 3.15Å
55	A	70.8	Confident	67.5	Low	25 Å²	25	119.5 Å²	119.5	21%	0.207	58%	0.582	C	S	.	*	H	α-helix	trans	-60.7	-43.8	175	0	0	0	0	0	111	Q50 T51 S53 R59	Q50-A55 HydrophobicContact CB-CB 4.38Å; Q50-A55 HydrophobicContact CG-CB 3.89Å; Q50-A55 VanDerWaalsContact NE2-N 3.19Å; T51-A55 PolarHBondContact O-N 3.08Å; S53-A55 VanDerWaalsContact C-N 3.32Å; S53-A55 PolarHBondContact O-N 2.97Å; A55-R59 WeakPolarHBondContact O-CG 3.42Å; A55-R59 PolarHBondContact O-N 3Å; A55-R59 VanDerWaalsContact O-N 3.15Å
56	R	75.4	Confident	68.3	Low	182 Å²	182	117 Å²	117	69%	0.687	57%	0.572	S	S	*	*	H	α-helix	trans	-67.2	-42.4	176.4	-151.9	171.3	-169.7	174	1.5	111.8	T52 S53 E54 R59 Q60	T52-R56 WeakPolarHBondContact O-CB 3.37Å; T52-R56 PolarHBondContact O-N 2.86Å; S53-R56 PolarHBondContact O-N 3.06Å; E54-R56 VanDerWaalsContact C-N 3.31Å; R56-R59 PolarHBondContact O-N 3.28Å; R56-Q60 WeakPolarHBondContact O-CG 3.35Å; R56-Q60 PolarHBondContact O-N 3Å
57	R	77.4	Confident	69.1	Low	174 Å²	174	115.7 Å²	115.7	66%	0.657	57%	0.572	S	S	*	*	H	α-helix	trans	-65.4	-42.3	178.4	-169.1	179.4	-178.5	178.4	1.2	112.3	S53 E54 R59 Q60 L61	S53-R57 WeakPolarHBondContact O-CB 3.36Å; S53-R57 PolarHBondContact O-N 2.98Å; E54-R57 PolarHBondContact O-N 2.94Å; R57-R59 VanDerWaalsContact C-N 3.34Å; R57-R59 PolarHBondContact O-N 2.89Å; R57-Q60 PolarHBondContact O-N 2.89Å; R57-L61 HydrophobicContact CG-CD1 4.29Å; R57-L61 PolarHBondContact O-N 3Å
58	K	77.6	Confident	69.3	Low	114 Å²	114	115 Å²	115	50%	0.496	57%	0.574	S	S	.	*	H	α-helix	trans	-61.3	-43.4	173.9	-74	-164.3	-159.2	164.9	0	111.2	E54 Q60 L61 T62	E54-K58 PolarHBondContact O-N 3.15Å; K58-Q60 VanDerWaalsContact C-N 3.31Å; K58-Q60 PolarHBondContact O-N 3.3Å; K58-L61 PolarHBondContact O-N 3.49Å; K58-T62 WeakPolarHBondContact O-CG2 3.33Å; K58-T62 PolarHBondContact O-N 3.2Å; K58-T62 PolarHBondContact O-OG1 3.2Å
59	R	76.7	Confident	69.3	Low	192 Å²	192	119.2 Å²	119.2	73%	0.725	60%	0.598	S	S	*	*	H	α-helix	trans	-60.3	-39.6	176	-74.1	178.1	-177.6	178	1.6	112.5	A55 R56 R57 T62 K63	A55-R59 WeakPolarHBondContact O-CG 3.42Å; A55-R59 PolarHBondContact O-N 3Å; A55-R59 VanDerWaalsContact O-N 3.15Å; R56-R59 PolarHBondContact O-N 3.28Å; R57-R59 VanDerWaalsContact C-N 3.34Å; R57-R59 PolarHBondContact O-N 2.89Å; R59-T62 WeakPolarHBondContact CA-OG1 3.43Å; R59-T62 PolarHBondContact O-OG1 2.91Å; R59-K63 WeakPolarHBondContact O-CB 3.44Å; R59-K63 PolarHBondContact O-N 3.34Å
60	Q	78.4	Confident	68.8	Low	113 Å²	113	115.1 Å²	115.1	53%	0.528	59%	0.586	S	S	.	*	H	α-helix	trans	-64.9	-51.3	174.8	-73.4	172.5	-29.6	0	0	111.1	R56 R57 K58 T62 K63 D64	R56-Q60 WeakPolarHBondContact O-CG 3.35Å; R56-Q60 PolarHBondContact O-N 3Å; R57-Q60 PolarHBondContact O-N 2.89Å; K58-Q60 VanDerWaalsContact C-N 3.31Å; K58-Q60 PolarHBondContact O-N 3.3Å; Q60-T62 VanDerWaalsContact C-N 3.34Å; Q60-T62 PolarHBondContact O-N 2.76Å; Q60-K63 WeakPolarHBondContact O-CA 3.41Å; Q60-K63 WeakPolarHBondContact O-CB 3.36Å; Q60-K63 PolarHBondContact O-N 3.04Å; Q60-D64 PolarHBondContact O-N 2.99Å
61	L	78.7	Confident	68.3	Low	105 Å²	105	117.9 Å²	117.9	55%	0.55	60%	0.602	S	S	.	*	H	α-helix	trans	-57.6	-43.2	177.1	-88	160.8	0	0	0	113	R57 K58 K63 D64 L65	R57-L61 HydrophobicContact CG-CD1 4.29Å; R57-L61 PolarHBondContact O-N 3Å; K58-L61 PolarHBondContact O-N 3.49Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 2.86Å; L61-D64 PolarHBondContact O-N 3.17Å; L61-L65 WeakPolarHBondContact O-CB 3.49Å; L61-L65 PolarHBondContact O-N 3.06Å
62	T	75.2	Confident	67.9	Low	77 Å²	77	123.6 Å²	123.6	47%	0.472	63%	0.629	S	S	.	*	H	α-helix	trans	-66	-33	175.9	51.5	0	0	0	0	112.2	K58 R59 Q60 N66	K58-T62 WeakPolarHBondContact O-CG2 3.33Å; K58-T62 PolarHBondContact O-N 3.2Å; K58-T62 PolarHBondContact O-OG1 3.2Å; R59-T62 WeakPolarHBondContact CA-OG1 3.43Å; R59-T62 PolarHBondContact O-OG1 2.91Å; Q60-T62 VanDerWaalsContact C-N 3.34Å; Q60-T62 PolarHBondContact O-N 2.76Å; T62-N66 VanDerWaalsContact O-CB 3.23Å; T62-N66 WeakPolarHBondContact O-CB 3.23Å; T62-N66 PolarHBondContact O-N 3.41Å; T62-N66 PolarHBondContact O-ND2 2.91Å
63	K	77	Confident	66.6	Low	152 Å²	152	121.2 Å²	121.2	66%	0.661	62%	0.618	S	S	*	*	H	α-helix	trans	-71.4	-44	177.6	-171.3	176.9	-179.4	-178.1	0	110.7	R59 Q60 L61 N66 T67	R59-K63 WeakPolarHBondContact O-CB 3.44Å; R59-K63 PolarHBondContact O-N 3.34Å; Q60-K63 WeakPolarHBondContact O-CA 3.41Å; Q60-K63 WeakPolarHBondContact O-CB 3.36Å; Q60-K63 PolarHBondContact O-N 3.04Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 2.86Å; K63-N66 PolarHBondContact O-N 3.31Å; K63-T67 PolarHBondContact O-N 3.27Å; K63-T67 VanDerWaalsContact O-N 3.14Å; K63-T67 PolarHBondContact O-OG1 3.34Å
64	D	70.8	Confident	65.6	Low	112 Å²	112	124 Å²	124	60%	0.599	63%	0.631	S	S	*	*	H	α-helix	trans	-64.2	-41.3	178.2	-64.2	-16.9	0	0	0	111	Q60 L61 T67	Q60-D64 PolarHBondContact O-N 2.99Å; L61-D64 PolarHBondContact O-N 3.17Å; D64-T67 WeakPolarHBondContact O-CB 3.11Å; D64-T67 PolarHBondContact O-N 2.87Å
65	L	70.2	Confident	64.4	Low	152 Å²	152	124.4 Å²	124.4	80%	0.796	64%	0.641	S	S	*	*	H	α-helix	trans	-71.5	-33.5	178.5	-162.1	71	0	0	0	113.1	L61 T67	L61-L65 WeakPolarHBondContact O-CB 3.49Å; L61-L65 PolarHBondContact O-N 3.06Å; L65-T67 PolarHBondContact O-N 2.91Å
66	N	65.7	Low	63.5	Low	129 Å²	129	129.3 Å²	129.3	69%	0.69	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-1.2	173.7	-70.1	-16.1	0	0	0	112.8	T62 K63 P68	T62-N66 VanDerWaalsContact O-CB 3.23Å; T62-N66 WeakPolarHBondContact O-CB 3.23Å; T62-N66 PolarHBondContact O-N 3.41Å; T62-N66 PolarHBondContact O-ND2 2.91Å; K63-N66 PolarHBondContact O-N 3.31Å; N66-P68 WeakPolarHBondContact O-CD 3.37Å
67	T	63.2	Low	62.3	Low	84 Å²	84	129.1 Å²	129.1	52%	0.515	68%	0.68	S	S	.	*	S	Bend	trans	-86.2	102.7	170	-48	0	0	0	0	106.5	K63 D64 L65 V69	K63-T67 PolarHBondContact O-N 3.27Å; K63-T67 VanDerWaalsContact O-N 3.14Å; K63-T67 PolarHBondContact O-OG1 3.34Å; D64-T67 WeakPolarHBondContact O-CB 3.11Å; D64-T67 PolarHBondContact O-N 2.87Å; L65-T67 PolarHBondContact O-N 2.91Å; T67-V69 PolarHBondContact O-N 2.72Å; T67-V69 VanDerWaalsContact O-N 3.15Å
68	P	56.2	Low	60.9	Low	101 Å²	101	125.6 Å²	125.6	66%	0.656	68%	0.682	S	S	*	*			trans	-57.4	126.3	177.1	24.4	-32.8	0	0	0	108.2	N66 N70	N66-P68 WeakPolarHBondContact O-CD 3.37Å; P68-N70 PolarHBondContact O-N 2.9Å
69	V	56.5	Low	59.5	Low	158 Å²	158	124.1 Å²	124.1	96%	0.958	69%	0.691	S	S	*	*	S	Bend	trans	-69.6	70.6	163.4	-176.1	0	0	0	0	106.3	T67	T67-V69 PolarHBondContact O-N 2.72Å; T67-V69 VanDerWaalsContact O-N 3.15Å
70	N	47	Very low	58.2	Low	120 Å²	120	120.9 Å²	120.9	64%	0.642	69%	0.688	S	S	*	*			trans	-143.8	121.9	164.4	-157.1	24.6	0	0	0	108.4	P68	P68-N70 PolarHBondContact O-N 2.9Å
71	D	47	Very low	56.5	Low	116 Å²	116	127.1 Å²	127.1	62%	0.62	71%	0.706	S	S	*	*			trans	74.1	92	170.4	-61.1	-35.1	0	0	0	118.2	S73	D71-S73 PolarHBondContact O-N 3.2Å
72	L	53.7	Low	55.1	Low	189 Å²	189	130.9 Å²	130.9	99%	0.99	72%	0.715	S	S	*	*				-48	76.9	126	-74.2	97.4	0	0	0	110.2
73	S	42.2	Very low	54	Low	77 Å²	77	134.7 Å²	134.7	54%	0.538	73%	0.727	S	S	.	*			trans	-161.4	115.8	153.3	62.8	0	0	0	0	110.1	D71	D71-S73 PolarHBondContact O-N 3.2Å
74	V	48.6	Very low	53.1	Low	136 Å²	136	132.2 Å²	132.2	82%	0.824	73%	0.728	S	S	*	*	S	Bend	trans	62	91.9	159.7	-157.9	0	0	0	0	113.9
75	T	43.7	Very low	52.9	Low	105 Å²	105	132.1 Å²	132.1	64%	0.644	73%	0.728	S	S	*	*				-166	95.8	95.1	-68.4	0	0	0	0	109.2	E77	T75-E77 HydrophobicContact CG2-CB 4.18Å; T75-E77 PolarHBondContact O-N 3.05Å
76	S	51.8	Low	52.8	Low	128 Å²	128	129.9 Å²	129.9	90%	0.895	72%	0.722	S	S	*	*			trans	-74.2	15.7	162.2	-67.5	0	0	0	0	112.6
77	E	49.7	Very low	53	Low	178 Å²	178	130.9 Å²	130.9	83%	0.832	73%	0.726	S	S	*	*			trans	-127.2	51.7	-175.9	-68.1	-173.2	167.9	0	0	112.2	T75	T75-E77 HydrophobicContact CG2-CB 4.18Å; T75-E77 PolarHBondContact O-N 3.05Å
78	S	48.9	Very low	53.3	Low	100 Å²	100	134.5 Å²	134.5	70%	0.699	74%	0.735	S	S	*	*			trans	-130.5	55.1	145.7	177.8	0	0	0	0	107.8	L80	S78-L80 PolarHBondContact O-N 3.39Å
79	A	48.1	Very low	54.3	Low	82 Å²	82	135.6 Å²	135.6	68%	0.678	74%	0.735	S	S	*	*			trans	-44.7	118	158.6	0	0	0	0	0	107.1	R81	A79-R81 PolarHBondContact O-N 2.97Å
80	L	49	Very low	54.9	Low	125 Å²	125	137 Å²	137	65%	0.654	73%	0.729	S	S	*	*			trans	-36.7	110.8	172.3	-84.6	71.2	0	0	0	108.1	S78 Y82	S78-L80 PolarHBondContact O-N 3.39Å; L80-Y82 HydrophobicContact CB-CD2 3.77Å; L80-Y82 HydrophobicContact CB-CE2 3.88Å; L80-Y82 HydrophobicContact CD2-CD2 4.22Å; L80-Y82 HydrophobicContact CD2-CE2 3.51Å; L80-Y82 HydrophobicContact CG-CE2 4.37Å; L80-Y82 PolarHBondContact O-N 3Å
81	R	44	Very low	56.1	Low	243 Å²	243	139 Å²	139	92%	0.917	74%	0.739	S	S	*	*			trans	-64.5	80.6	159.5	-77.4	-171.6	163.7	-163.8	-3.7	105.9	A79 H83	A79-R81 PolarHBondContact O-N 2.97Å; R81-H83 PolarHBondContact O-N 3.45Å
82	Y	49	Very low	56.7	Low	185 Å²	185	145.3 Å²	145.3	73%	0.725	76%	0.761	S	S	*	*			trans	-57.9	101	155.2	-86	-87	0	0	0	104.3	L80 S84	L80-Y82 HydrophobicContact CB-CD2 3.77Å; L80-Y82 HydrophobicContact CB-CE2 3.88Å; L80-Y82 HydrophobicContact CD2-CD2 4.22Å; L80-Y82 HydrophobicContact CD2-CE2 3.51Å; L80-Y82 HydrophobicContact CG-CE2 4.37Å; L80-Y82 PolarHBondContact O-N 3Å; Y82-S84 PolarHBondContact O-N 3.05Å
83	H	51.4	Low	56.9	Low	157 Å²	157	143.2 Å²	143.2	73%	0.727	75%	0.75	S	S	*	*			trans	-62.6	79.2	157.9	-120.4	-54.2	0	0	0	105.8	R81 D85	R81-H83 PolarHBondContact O-N 3.45Å; H83-D85 IonicContact CE1-OD1 3.17Å; H83-D85 IonicContact CE1-OD2 3.76Å; H83-D85 PolarHBondContact CE1-OD2 3.2Å; H83-D85 VanDerWaalsContact ND1-CG 3.26Å; H83-D85 IonicContact ND1-OD1 3Å; H83-D85 PolarHBondContact ND1-OD1 2.78Å; H83-D85 IonicContact ND1-OD2 3.2Å; H83-D85 PolarHBondContact ND1-OD2 3.39Å; H83-D85 PolarHBondContact O-N 3.45Å
84	S	59.1	Low	57.6	Low	99 Å²	99	146.6 Å²	146.6	69%	0.692	76%	0.761	S	S	*	*			trans	-84.8	59.3	163.7	62.9	0	0	0	0	106.9	Y82 P86	Y82-S84 PolarHBondContact O-N 3.05Å; S84-P86 WeakPolarHBondContact O-CD 3.43Å
85	D	66.4	Low	58.1	Low	110 Å²	110	147.2 Å²	147.2	59%	0.588	76%	0.757	S	S	*	*			trans	-71.8	118.8	158.5	-66.5	-10.1	0	0	0	104.4	H83 I87	H83-D85 IonicContact CE1-OD1 3.17Å; H83-D85 IonicContact CE1-OD2 3.76Å; H83-D85 PolarHBondContact CE1-OD2 3.2Å; H83-D85 VanDerWaalsContact ND1-CG 3.26Å; H83-D85 IonicContact ND1-OD1 3Å; H83-D85 PolarHBondContact ND1-OD1 2.78Å; H83-D85 IonicContact ND1-OD2 3.2Å; H83-D85 PolarHBondContact ND1-OD2 3.39Å; H83-D85 PolarHBondContact O-N 3.45Å; D85-I87 PolarHBondContact O-N 3.14Å
86	P	68.1	Low	59	Low	105 Å²	105	149.7 Å²	149.7	68%	0.682	76%	0.764	S	S	*	*			trans	-61.3	119.6	177.7	24.3	-31.1	0	0	0	107.9	S84 F88	S84-P86 WeakPolarHBondContact O-CD 3.43Å; P86-F88 PolarHBondContact O-N 3.15Å
87	I	69.2	Low	59.4	Low	150 Å²	150	151.1 Å²	151.1	77%	0.769	76%	0.756	S	S	*	*	S	Bend	trans	-53	-22.8	175.2	-62.9	171.2	0	0	0	111	D85	D85-I87 PolarHBondContact O-N 3.14Å
88	F	70.6	Confident	60.1	Low	161 Å²	161	149.3 Å²	149.3	71%	0.706	75%	0.751	S	S	*	*			trans	-125.2	107.3	-177.9	-60.7	-78	0	0	0	111.3	P86 K90	P86-F88 PolarHBondContact O-N 3.15Å; F88-K90 PolarHBondContact O-N 2.83Å
89	N	75.6	Confident	60.9	Low	123 Å²	123	152.8 Å²	152.8	66%	0.658	76%	0.755	S	S	*	*			trans	-75.2	112.7	163.4	-177.6	-5.9	0	0	0	108.6	N91	N89-N91 VanDerWaalsContact C-N 3.29Å; N89-N91 PolarHBondContact O-N 3.22Å; N89-N91 PolarHBondContact OD1-N 2.77Å
90	K	70.1	Confident	61.9	Low	189 Å²	189	158.2 Å²	158.2	82%	0.822	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	2	179.3	-69	-172.1	178.8	-172.9	0	114.5	F88 K92	F88-K90 PolarHBondContact O-N 2.83Å; K90-K92 VanDerWaalsContact C-N 3.3Å
91	N	71.1	Confident	62.9	Low	162 Å²	162	161 Å²	161	87%	0.866	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	23.2	174.1	-76.9	10.9	0	0	0	113	N89	N89-N91 VanDerWaalsContact C-N 3.29Å; N89-N91 PolarHBondContact O-N 3.22Å; N89-N91 PolarHBondContact OD1-N 2.77Å
92	K	60.5	Low	64.6	Low	248 Å²	248	153.5 Å²	153.5	100%	1.078	76%	0.756	S	S	*	*			trans	-118.9	0	162.5	-162.2	-168.4	-175.9	-156	0	108.1	K90	K90-K92 VanDerWaalsContact C-N 3.3Å

Retrieved 92 of 92 residues in 16.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).