A0A077ZNC7_TRITR Loading...

Helix-turn-helix domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZNC7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 100 aa.

						>A0A077ZNC7_TRITR|A0A077ZNC7
MGSPLSPVLAELFMERLEEIAFESSDNHWTPRLFKRLPTHSDRYLHFSSHHPVSVKGGIVTGMVDRAIPICDPEFLNPELHYIATTLEKNGYPKPSSPPP
					

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	45.4	Very low	56.8	Low	240 Å²	240	93.4 Å²	93.4	100%	1.182	58%	0.579	S	S	*	*				0	84.5	0	-58.3	-170.4	-51	0	0	106.9	S3	M1-S3 PolarHBondContact O-N 2.81Å
2	G	44.9	Very low	57.6	Low	73 Å²	73	92.1 Å²	92.1	75%	0.753	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-72.6	124.8	177.7	0	0	0	0	0	107.9	P4	G2-P4 VanDerWaalsContact O-N 3.15Å
3	S	48.6	Very low	58.5	Low	115 Å²	115	94.8 Å²	94.8	80%	0.804	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-49.8	123.4	170	-56.9	0	0	0	0	107.5	M1 L5	M1-S3 PolarHBondContact O-N 2.81Å; S3-L5 PolarHBondContact O-N 3.41Å; S3-L5 VanDerWaalsContact O-N 3.08Å
4	P	51.7	Low	59.3	Low	113 Å²	113	95.5 Å²	95.5	73%	0.734	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-56.6	124.7	171.4	24.9	-30.7	0	0	0	105.4	G2 S6	G2-P4 VanDerWaalsContact O-N 3.15Å; P4-S6 PolarHBondContact O-N 3.27Å
5	L	51.8	Low	59.8	Low	126 Å²	126	91.6 Å²	91.6	66%	0.66	54%	0.535	S	S	*	.			trans	-40.7	120.1	164.4	-84.9	161.4	0	0	0	105.9	S3 L9	S3-L5 PolarHBondContact O-N 3.41Å; S3-L5 VanDerWaalsContact O-N 3.08Å; L5-L9 HydrophobicContact CD2-CD2 3.41Å; L5-L9 VanDerWaalsContact CD2-CD2 3.41Å; L5-L9 HydrophobicContact CD2-CG 4.08Å
6	S	63.6	Low	60.2	Low	61 Å²	61	94.9 Å²	94.9	43%	0.427	54%	0.536	S	S	.	.			trans	-41.2	132	-175.7	172.5	0	0	0	0	108.2	P4 V8 L9 A10	P4-S6 PolarHBondContact O-N 3.27Å; S6-V8 CarbonylContact O-C 3.57Å; S6-V8 PolarHBondContact O-N 3.13Å; S6-V8 PolarHBondContact OG-N 3.04Å; S6-L9 CarbonylContact O-C 3.58Å; S6-L9 WeakPolarHBondContact O-CA 3.45Å; S6-L9 WeakPolarHBondContact O-CB 3.38Å; S6-L9 PolarHBondContact O-N 3.05Å; S6-A10 PolarHBondContact O-N 2.62Å
7	P	61.9	Low	60.7	Low	82 Å²	82	93.9 Å²	93.9	53%	0.532	53%	0.528	S	S	.	.	H	α-helix	trans	-47.4	-34.9	178.1	-30.1	35.2	0	0	0	112.2	A10 E11	P7-A10 PolarHBondContact O-N 3.37Å; P7-E11 WeakPolarHBondContact O-CB 3.4Å; P7-E11 VanDerWaalsContact O-CG 3.28Å; P7-E11 WeakPolarHBondContact O-CG 3.28Å; P7-E11 PolarHBondContact O-N 3.14Å
8	V	62.7	Low	61.1	Low	50 Å²	50	92.7 Å²	92.7	30%	0.303	52%	0.517	S	S	.	.	H	α-helix	trans	-62	-42	173.4	-176.2	0	0	0	0	112.9	S6 L12	S6-V8 CarbonylContact O-C 3.57Å; S6-V8 PolarHBondContact O-N 3.13Å; S6-V8 PolarHBondContact OG-N 3.04Å; V8-L12 WeakPolarHBondContact O-CB 3.26Å; V8-L12 PolarHBondContact O-N 2.76Å
9	L	61.7	Low	61.3	Low	86 Å²	86	90.7 Å²	90.7	45%	0.45	50%	0.504	S	S	.	.	H	α-helix	trans	-73.7	-33.4	177.4	-175.7	58.5	0	0	0	111.9	L5 S6 L12 F13	L5-L9 HydrophobicContact CD2-CD2 3.41Å; L5-L9 VanDerWaalsContact CD2-CD2 3.41Å; L5-L9 HydrophobicContact CD2-CG 4.08Å; S6-L9 CarbonylContact O-C 3.58Å; S6-L9 WeakPolarHBondContact O-CA 3.45Å; S6-L9 WeakPolarHBondContact O-CB 3.38Å; S6-L9 PolarHBondContact O-N 3.05Å; L9-L12 PolarHBondContact O-N 3.41Å; L9-F13 VanDerWaalsContact O-CB 3.26Å; L9-F13 WeakPolarHBondContact O-CB 3.47Å; L9-F13 PolarHBondContact O-N 3.3Å
10	A	64.1	Low	61.6	Low	40 Å²	40	90.4 Å²	90.4	33%	0.331	50%	0.5	S	S	.	.	H	α-helix	trans	-67.8	-41.9	172.7	0	0	0	0	0	111.5	S6 P7 F13 M14	S6-A10 PolarHBondContact O-N 2.62Å; P7-A10 PolarHBondContact O-N 3.37Å; A10-F13 PolarHBondContact O-N 3.17Å; A10-M14 WeakPolarHBondContact O-CB 3.45Å; A10-M14 WeakPolarHBondContact O-CG 2.9Å; A10-M14 PolarHBondContact O-N 3.12Å
11	E	68.3	Low	61.8	Low	41 Å²	41	88.7 Å²	88.7	19%	0.192	50%	0.498	C	S	.	.	H	α-helix	trans	-58.4	-51.4	170.9	-75.5	174.6	-178.5	0	0	109.7	P7 F13 M14 E15 S41	P7-E11 WeakPolarHBondContact O-CB 3.4Å; P7-E11 VanDerWaalsContact O-CG 3.28Å; P7-E11 WeakPolarHBondContact O-CG 3.28Å; P7-E11 PolarHBondContact O-N 3.14Å; E11-F13 VanDerWaalsContact C-N 3.28Å; E11-F13 PolarHBondContact O-N 2.91Å; E11-M14 PolarHBondContact O-N 3.22Å; E11-E15 WeakPolarHBondContact O-CB 3.33Å; E11-E15 WeakPolarHBondContact O-CG 3.39Å; E11-E15 PolarHBondContact O-N 3.5Å; E11-S41 PolarHBondContact OE1-OG 2.88Å
12	L	66.1	Low	62.6	Low	78 Å²	78	80.7 Å²	80.7	41%	0.408	46%	0.457	S	S	.	.	H	α-helix	trans	-59.8	-36.9	178.4	-154.1	107.1	0	0	0	113	V8 L9 R16	V8-L12 WeakPolarHBondContact O-CB 3.26Å; V8-L12 PolarHBondContact O-N 2.76Å; L9-L12 PolarHBondContact O-N 3.41Å; L12-R16 WeakPolarHBondContact O-CB 3.26Å; L12-R16 PolarHBondContact O-N 3.35Å; L12-R16 VanDerWaalsContact O-N 3.12Å
13	F	70.3	Confident	63.6	Low	127 Å²	127	85 Å²	85	56%	0.557	46%	0.457	S	S	*	.	H	α-helix	trans	-72.8	-45	178.4	179	-100.8	0	0	0	112.5	L9 A10 E11 E15 R16 L17	L9-F13 VanDerWaalsContact O-CB 3.26Å; L9-F13 WeakPolarHBondContact O-CB 3.47Å; L9-F13 PolarHBondContact O-N 3.3Å; A10-F13 PolarHBondContact O-N 3.17Å; E11-F13 VanDerWaalsContact C-N 3.28Å; E11-F13 PolarHBondContact O-N 2.91Å; F13-E15 VanDerWaalsContact C-N 3.35Å; F13-R16 PolarHBondContact O-N 2.87Å; F13-L17 HydrophobicContact CD1-CD1 3.87Å; F13-L17 HydrophobicContact CD1-CG 4.25Å; F13-L17 HydrophobicContact CE1-CD1 3.28Å; F13-L17 HydrophobicContact CE1-CD2 4.47Å; F13-L17 HydrophobicContact CE1-CG 3.83Å; F13-L17 HydrophobicContact CE2-CG 4.48Å; F13-L17 HydrophobicContact CZ-CD1 3.78Å; F13-L17 HydrophobicContact CZ-CD2 4.14Å; F13-L17 HydrophobicContact CZ-CG 3.94Å; F13-L17 PolarHBondContact O-N 2.94Å
14	M	69.8	Low	64.2	Low	105 Å²	105	83.9 Å²	83.9	52%	0.517	45%	0.449	S	S	.	.	H	α-helix	trans	-63.8	-42.8	176.7	-76.1	-65.8	-67.7	0	0	110.9	A10 E11 R16 L17 E18	A10-M14 WeakPolarHBondContact O-CB 3.45Å; A10-M14 WeakPolarHBondContact O-CG 2.9Å; A10-M14 PolarHBondContact O-N 3.12Å; E11-M14 PolarHBondContact O-N 3.22Å; M14-R16 VanDerWaalsContact C-N 3.27Å; M14-R16 PolarHBondContact O-N 2.91Å; M14-L17 WeakPolarHBondContact O-CB 3.42Å; M14-L17 PolarHBondContact O-N 2.98Å; M14-L17 VanDerWaalsContact O-N 3.12Å; M14-L17 HydrophobicContact SD-CD1 4.19Å; M14-E18 WeakPolarHBondContact O-CG 3.46Å; M14-E18 PolarHBondContact O-N 3.47Å
15	E	66.7	Low	64.5	Low	37 Å²	37	80.6 Å²	80.6	17%	0.173	43%	0.429	C	S	.	.	H	α-helix	trans	-61.3	-36.9	175.1	-68.3	171.8	155.8	0	0	111.5	E11 F13 E18 E19 H40 R66	E11-E15 WeakPolarHBondContact O-CB 3.33Å; E11-E15 WeakPolarHBondContact O-CG 3.39Å; E11-E15 PolarHBondContact O-N 3.5Å; F13-E15 VanDerWaalsContact C-N 3.35Å; E15-E18 PolarHBondContact O-N 3.11Å; E15-E19 PolarHBondContact O-N 3.46Å; E15-E19 VanDerWaalsContact O-N 3.11Å; E15-H40 IonicContact OE1-NE2 3.9Å; E15-R66 IonicContact OE1-NH2 2.58Å; E15-R66 IonicContact OE2-CZ 2.66Å; E15-R66 IonicContact OE2-NH1 3.13Å; E15-R66 PolarHBondContact OE2-NH1 3.42Å; E15-R66 IonicContact OE2-NH2 3.74Å; E15-R66 PolarHBondContact OE2-NH2 2.94Å
16	R	66.3	Low	64.7	Low	145 Å²	145	81.7 Å²	81.7	55%	0.547	44%	0.436	S	S	.	.	H	α-helix	trans	-69.8	-35.6	174	-179.4	56.8	-179.3	-93.2	5.5	112.7	L12 F13 M14 E19 I20	L12-R16 WeakPolarHBondContact O-CB 3.26Å; L12-R16 PolarHBondContact O-N 3.35Å; L12-R16 VanDerWaalsContact O-N 3.12Å; F13-R16 PolarHBondContact O-N 2.87Å; M14-R16 VanDerWaalsContact C-N 3.27Å; M14-R16 PolarHBondContact O-N 2.91Å; R16-E19 VanDerWaalsContact CD-OE2 3.26Å; R16-E19 WeakPolarHBondContact CD-OE2 3.4Å; R16-E19 IonicContact NE-OE2 2.75Å; R16-E19 PolarHBondContact O-N 3.08Å; R16-I20 HydrophobicContact CG-CD1 4.23Å; R16-I20 WeakPolarHBondContact O-CG1 3.42Å; R16-I20 PolarHBondContact O-N 2.97Å; R16-I20 VanDerWaalsContact O-N 3.09Å
17	L	68.2	Low	64.3	Low	78 Å²	78	84 Å²	84	41%	0.408	44%	0.443	S	S	.	.	H	α-helix	trans	-66.1	-40.2	174.5	-79.4	-179.1	0	0	0	111.7	F13 M14 I20 A21	F13-L17 HydrophobicContact CD1-CD1 3.87Å; F13-L17 HydrophobicContact CD1-CG 4.25Å; F13-L17 HydrophobicContact CE1-CD1 3.28Å; F13-L17 HydrophobicContact CE1-CD2 4.47Å; F13-L17 HydrophobicContact CE1-CG 3.83Å; F13-L17 HydrophobicContact CE2-CG 4.48Å; F13-L17 HydrophobicContact CZ-CD1 3.78Å; F13-L17 HydrophobicContact CZ-CD2 4.14Å; F13-L17 HydrophobicContact CZ-CG 3.94Å; F13-L17 PolarHBondContact O-N 2.94Å; M14-L17 WeakPolarHBondContact O-CB 3.42Å; M14-L17 PolarHBondContact O-N 2.98Å; M14-L17 VanDerWaalsContact O-N 3.12Å; M14-L17 HydrophobicContact SD-CD1 4.19Å; L17-I20 PolarHBondContact O-N 3.09Å; L17-A21 WeakPolarHBondContact O-CB 3.36Å; L17-A21 PolarHBondContact O-N 3.45Å
18	E	67.5	Low	64.1	Low	72 Å²	72	89.3 Å²	89.3	34%	0.336	46%	0.461	S	S	.	.	H	α-helix	trans	-61.2	-45.8	174.9	-74.1	177.9	-173.7	0	0	110.6	M14 E15 I20 A21 F22	M14-E18 WeakPolarHBondContact O-CG 3.46Å; M14-E18 PolarHBondContact O-N 3.47Å; E15-E18 PolarHBondContact O-N 3.11Å; E18-I20 PolarHBondContact O-N 3.28Å; E18-A21 WeakPolarHBondContact O-CB 3.18Å; E18-A21 PolarHBondContact O-N 2.89Å; E18-A21 VanDerWaalsContact O-N 3.14Å; E18-F22 HydrophobicContact CB-CD2 4.38Å; E18-F22 HydrophobicContact CB-CE2 3.96Å; E18-F22 WeakPolarHBondContact O-CD2 3.42Å; E18-F22 WeakPolarHBondContact O-CG 3.39Å; E18-F22 PolarHBondContact O-N 2.91Å
19	E	65.3	Low	64	Low	54 Å²	54	97.8 Å²	97.8	25%	0.252	49%	0.487	S	S	.	.	H	α-helix	trans	-55.9	-49.6	174.7	-175.8	-178.3	-167.7	0	0	112.6	E15 R16 A21 F22 E23	E15-E19 PolarHBondContact O-N 3.46Å; E15-E19 VanDerWaalsContact O-N 3.11Å; R16-E19 VanDerWaalsContact CD-OE2 3.26Å; R16-E19 WeakPolarHBondContact CD-OE2 3.4Å; R16-E19 IonicContact NE-OE2 2.75Å; R16-E19 PolarHBondContact O-N 3.08Å; E19-A21 VanDerWaalsContact C-N 3.27Å; E19-A21 PolarHBondContact O-N 3.49Å; E19-F22 PolarHBondContact O-N 3.29Å; E19-E23 WeakPolarHBondContact O-CB 3.4Å; E19-E23 PolarHBondContact O-N 3.26Å
20	I	67.1	Low	63.7	Low	84 Å²	84	97.7 Å²	97.7	43%	0.431	49%	0.491	S	S	.	.	H	α-helix	trans	-61.4	-39.3	177.4	-66.9	166.1	0	0	0	110.8	R16 L17 E18 F22 S24	R16-I20 HydrophobicContact CG-CD1 4.23Å; R16-I20 WeakPolarHBondContact O-CG1 3.42Å; R16-I20 PolarHBondContact O-N 2.97Å; R16-I20 VanDerWaalsContact O-N 3.09Å; L17-I20 PolarHBondContact O-N 3.09Å; E18-I20 PolarHBondContact O-N 3.28Å; I20-F22 VanDerWaalsContact C-N 3.35Å; I20-S24 WeakPolarHBondContact O-CB 3.13Å; I20-S24 PolarHBondContact O-N 3.36Å; I20-S24 VanDerWaalsContact O-N 3.13Å; I20-S24 PolarHBondContact O-OG 3.12Å
21	A	66.1	Low	63.2	Low	56 Å²	56	99.7 Å²	99.7	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-63.7	-41.8	177.3	0	0	0	0	0	111.3	L17 E18 E19 S24	L17-A21 WeakPolarHBondContact O-CB 3.36Å; L17-A21 PolarHBondContact O-N 3.45Å; E18-A21 WeakPolarHBondContact O-CB 3.18Å; E18-A21 PolarHBondContact O-N 2.89Å; E18-A21 VanDerWaalsContact O-N 3.14Å; E19-A21 VanDerWaalsContact C-N 3.27Å; E19-A21 PolarHBondContact O-N 3.49Å; A21-S24 PolarHBondContact O-OG 3.39Å
22	F	63	Low	62.5	Low	72 Å²	72	108 Å²	108	32%	0.316	53%	0.53	S	S	.	.	H	α-helix	trans	-70	-42.5	177.8	-67.9	-56.6	0	0	0	113	E18 E19 I20 S24 S25 P31	E18-F22 HydrophobicContact CB-CD2 4.38Å; E18-F22 HydrophobicContact CB-CE2 3.96Å; E18-F22 WeakPolarHBondContact O-CD2 3.42Å; E18-F22 WeakPolarHBondContact O-CG 3.39Å; E18-F22 PolarHBondContact O-N 2.91Å; E19-F22 PolarHBondContact O-N 3.29Å; I20-F22 VanDerWaalsContact C-N 3.35Å; F22-S24 PolarHBondContact O-N 3.35Å; F22-S25 PolarHBondContact O-N 3.2Å; F22-S25 PolarHBondContact O-OG 2.87Å; F22-P31 HydrophobicContact CE1-CG 3.81Å
23	E	65.6	Low	61.9	Low	163 Å²	163	109.8 Å²	109.8	76%	0.762	54%	0.539	S	S	*	.	H	α-helix	trans	-62.6	-30.7	177.8	-166.4	176	-165.7	0	0	111.8	E19 S25	E19-E23 WeakPolarHBondContact O-CB 3.4Å; E19-E23 PolarHBondContact O-N 3.26Å; E23-S25 VanDerWaalsContact C-N 3.28Å; E23-S25 PolarHBondContact O-N 3.03Å
24	S	60.6	Low	61.2	Low	91 Å²	91	108 Å²	108	64%	0.636	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-7.8	175.9	76	0	0	0	0	114.9	I20 A21 F22 D26	I20-S24 WeakPolarHBondContact O-CB 3.13Å; I20-S24 PolarHBondContact O-N 3.36Å; I20-S24 VanDerWaalsContact O-N 3.13Å; I20-S24 PolarHBondContact O-OG 3.12Å; A21-S24 PolarHBondContact O-OG 3.39Å; F22-S24 PolarHBondContact O-N 3.35Å; S24-D26 PolarHBondContact O-N 2.93Å
25	S	57.6	Low	60.6	Low	44 Å²	44	110.8 Å²	110.8	31%	0.308	54%	0.541	S	S	.	.			trans	-93.6	76.8	-172.8	71.5	0	0	0	0	113.1	F22 E23 N27	F22-S25 PolarHBondContact O-N 3.2Å; F22-S25 PolarHBondContact O-OG 2.87Å; E23-S25 VanDerWaalsContact C-N 3.28Å; E23-S25 PolarHBondContact O-N 3.03Å; S25-N27 PolarHBondContact O-N 3.01Å
26	D	55.8	Low	60.4	Low	149 Å²	149	112.1 Å²	112.1	80%	0.797	54%	0.544	S	S	*	.			trans	-77.1	23.2	176.1	-156.9	13.8	0	0	0	114	S24	S24-D26 PolarHBondContact O-N 2.93Å
27	N	56.4	Low	60.1	Low	111 Å²	111	110.7 Å²	110.7	59%	0.594	55%	0.547	S	S	*	.	S	Bend	trans	-151.9	99.3	-162.9	-70.3	-65.2	0	0	0	113.4	S25 W29	S25-N27 PolarHBondContact O-N 3.01Å; N27-W29 VanDerWaalsContact O-CD1 3.26Å; N27-W29 PolarHBondContact O-N 3.22Å
28	H	57.6	Low	59.6	Low	193 Å²	193	113.2 Å²	113.2	89%	0.894	57%	0.568	S	S	*	*	S	Bend	trans	43.9	-3.1	151.6	-76.3	82.4	0	0	0	121.5
29	W	59.6	Low	59.3	Low	227 Å²	227	115.1 Å²	115.1	86%	0.86	58%	0.584	S	S	*	*			trans	-120.1	21.5	-173	-62.9	99.4	0	0	0	111.4	N27 P31	N27-W29 VanDerWaalsContact O-CD1 3.26Å; N27-W29 PolarHBondContact O-N 3.22Å; W29-P31 VanDerWaalsContact O-CD 3.28Å; W29-P31 WeakPolarHBondContact O-CD 3.33Å
30	T	54.9	Low	59.5	Low	85 Å²	85	114.5 Å²	114.5	52%	0.521	58%	0.581	S	S	.	*			trans	-57.8	121.7	174.7	49.3	0	0	0	0	109	R32	T30-R32 PolarHBondContact O-N 2.96Å
31	P	53.8	Low	59.9	Low	82 Å²	82	112.6 Å²	112.6	53%	0.532	58%	0.575	S	S	.	*			trans	-63.7	107.6	174.2	-23.3	36.9	0	0	0	109.1	F22 W29 L33	F22-P31 HydrophobicContact CE1-CG 3.81Å; W29-P31 VanDerWaalsContact O-CD 3.28Å; W29-P31 WeakPolarHBondContact O-CD 3.33Å; P31-L33 PolarHBondContact O-N 2.86Å
32	R	54.3	Low	60.4	Low	215 Å²	215	111.4 Å²	111.4	81%	0.811	56%	0.561	S	S	*	*	S	Bend	trans	-67.4	7.8	179.1	-58.8	-176.8	-165.9	-135.5	0.7	114.5	T30	T30-R32 PolarHBondContact O-N 2.96Å
33	L	52.8	Low	61.3	Low	115 Å²	115	115.8 Å²	115.8	60%	0.602	58%	0.576	S	S	*	*			trans	-149.5	101.7	-174	-176.2	66.2	0	0	0	109.3	P31 K35	P31-L33 PolarHBondContact O-N 2.86Å; L33-K35 PolarHBondContact O-N 3.49Å
34	F	55.8	Low	62.2	Low	90 Å²	90	109 Å²	109	40%	0.395	54%	0.543	S	S	.	.			trans	-82.4	102.9	165.4	-168	-101.4	0	0	0	108.7	R36 I70	F34-R36 HydrophobicContact CE1-CG 3.95Å; F34-I70 HydrophobicContact CD2-CG2 4.37Å
35	K	56.7	Low	63.4	Low	164 Å²	164	106.4 Å²	106.4	71%	0.713	52%	0.522	S	S	*	.			trans	-107	111.6	172.2	-175.5	175.3	-179.2	178.4	0	108.3	L33 L37	L33-K35 PolarHBondContact O-N 3.49Å; K35-L37 PolarHBondContact O-N 3.32Å
36	R	62.9	Low	65	Low	64 Å²	64	108.4 Å²	108.4	24%	0.242	53%	0.526	C	S	.	.			trans	-54.9	129.2	170.5	-73.2	-169.9	176.4	115.2	-7.9	109.5	F34 E79 Y82	F34-R36 HydrophobicContact CE1-CG 3.95Å; R36-E79 IonicContact CZ-OE1 3.94Å; R36-E79 IonicContact CZ-OE2 3.94Å; R36-E79 VanDerWaalsContact CZ-OE2 3.24Å; R36-E79 IonicContact NE-OE1 3.24Å; R36-E79 IonicContact NH1-OE1 3.25Å; R36-E79 PolarHBondContact NH1-OE1 3.39Å; R36-E79 IonicContact NH1-OE2 2.69Å; R36-E79 PolarHBondContact NH1-OE2 3.19Å; R36-E79 IonicContact NH2-OE1 3.46Å; R36-E79 PolarHBondContact NH2-OE1 2.84Å; R36-E79 IonicContact NH2-OE2 3.14Å; R36-E79 PolarHBondContact NH2-OE2 2.83Å; R36-Y82 VanDerWaalsContact CZ-CD1 3.47Å; R36-Y82 VanDerWaalsContact NH1-CG 3.31Å
37	L	60.8	Low	66.5	Low	116 Å²	116	104.9 Å²	104.9	61%	0.607	50%	0.504	S	S	*	.			trans	-61.7	144.5	173.6	-81	92.9	0	0	0	109.1	K35 T39 H40	K35-L37 PolarHBondContact O-N 3.32Å; L37-T39 WeakPolarHBondContact CB-OG1 3.45Å; L37-T39 PolarHBondContact O-N 2.71Å; L37-H40 PolarHBondContact O-N 3.23Å
38	P	58.5	Low	68.1	Low	131 Å²	131	104 Å²	104	85%	0.851	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-3.1	177.2	26.3	-34.5	0	0	0	113.7
39	T	60.4	Low	69.6	Low	111 Å²	111	96.1 Å²	96.1	68%	0.681	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-8	175.7	54.7	0	0	0	0	113.5	L37 S41	L37-T39 WeakPolarHBondContact CB-OG1 3.45Å; L37-T39 PolarHBondContact O-N 2.71Å; T39-S41 PolarHBondContact O-N 2.92Å
40	H	69	Low	71.2	Confident	42 Å²	42	94.6 Å²	94.6	19%	0.194	48%	0.475	C	S	.	.			trans	-65.5	117.1	177.4	-172.6	-98.1	0	0	0	110.1	E15 L37 D42 Y44	E15-H40 IonicContact OE1-NE2 3.9Å; L37-H40 PolarHBondContact O-N 3.23Å; H40-D42 VanDerWaalsContact C-N 3.34Å; H40-D42 IonicContact CE1-OD1 3.05Å; H40-D42 PolarHBondContact CE1-OD1 3.25Å; H40-D42 IonicContact ND1-OD1 2.74Å; H40-D42 PolarHBondContact ND1-OD1 3.46Å; H40-D42 PolarHBondContact O-N 3.01Å; H40-Y44 AromaticContact CE1-CZ 3.97Å; H40-Y44 PolarHBondContact CE1-OH 2.75Å; H40-Y44 AromaticContact NE2-CZ 3.9Å; H40-Y44 PolarHBondContact NE2-OH 2.66Å
41	S	75.3	Confident	72.8	Confident	43 Å²	43	95 Å²	95	30%	0.301	47%	0.471	S	S	.	.			trans	-83.1	-9.6	-169	73.1	0	0	0	0	114.3	E11 T39 R43	E11-S41 PolarHBondContact OE1-OG 2.88Å; T39-S41 PolarHBondContact O-N 2.92Å; S41-R43 WeakPolarHBondContact O-CG 3.25Å; S41-R43 PolarHBondContact O-N 3.22Å; S41-R43 VanDerWaalsContact O-N 3.08Å
42	D	78.1	Confident	74.6	Confident	31 Å²	31	94.8 Å²	94.8	17%	0.166	47%	0.469	C	S	.	.			trans	55.4	17.2	-172.6	-69.8	-25.7	0	0	0	114	H40 Y82 T86 N90	H40-D42 VanDerWaalsContact C-N 3.34Å; H40-D42 IonicContact CE1-OD1 3.05Å; H40-D42 PolarHBondContact CE1-OD1 3.25Å; H40-D42 IonicContact ND1-OD1 2.74Å; H40-D42 PolarHBondContact ND1-OD1 3.46Å; H40-D42 PolarHBondContact O-N 3.01Å; D42-Y82 WeakPolarHBondContact OD1-CE1 3.2Å; D42-Y82 VanDerWaalsContact OD1-CZ 3.26Å; D42-Y82 PolarHBondContact OD1-OH 2.83Å; D42-Y82 PolarHBondContact OD2-OH 3.08Å; D42-T86 HydrophobicContact CB-CG2 3.86Å; D42-N90 PolarHBondContact O-ND2 2.58Å
43	R	80.7	Confident	76.3	Confident	165 Å²	165	89.8 Å²	89.8	62%	0.623	46%	0.462	S	S	*	.			trans	-99.3	107.4	-178	-68.1	-174.4	-58.9	178.2	2.4	110.2	S41	S41-R43 WeakPolarHBondContact O-CG 3.25Å; S41-R43 PolarHBondContact O-N 3.22Å; S41-R43 VanDerWaalsContact O-N 3.08Å
44	Y	83.8	Confident	78	Confident	21 Å²	21	88.6 Å²	88.6	8%	0.082	46%	0.464	C	S	.	.			trans	-108.1	-176.3	173.4	-63.6	-84.8	0	0	0	109.9	H40 H46 I59 M63 T86 N90	H40-Y44 AromaticContact CE1-CZ 3.97Å; H40-Y44 PolarHBondContact CE1-OH 2.75Å; H40-Y44 AromaticContact NE2-CZ 3.9Å; H40-Y44 PolarHBondContact NE2-OH 2.66Å; Y44-H46 PolarHBondContact O-N 2.98Å; Y44-I59 HydrophobicContact CD1-CG2 4.1Å; Y44-I59 HydrophobicContact CG-CG2 4.37Å; Y44-M63 HydrophobicContact CD1-CE 3.32Å; Y44-M63 HydrophobicContact CD2-CE 3.37Å; Y44-M63 HydrophobicContact CE1-CE 3.18Å; Y44-M63 HydrophobicContact CE2-CE 3.21Å; Y44-M63 HydrophobicContact CG-CE 3.4Å; Y44-M63 VanDerWaalsContact CG-CE 3.4Å; Y44-T86 HydrophobicContact CD2-CG2 3.72Å; Y44-T86 HydrophobicContact CE2-CG2 3.52Å; Y44-N90 PolarHBondContact N-OD1 3.33Å; Y44-N90 PolarHBondContact O-OD1 3.1Å
45	L	86.5	Confident	79.5	Confident	35 Å²	35	87.4 Å²	87.4	18%	0.183	46%	0.464	C	S	.	.			trans	-63.6	112.1	175.5	-175.2	68.2	0	0	0	110	F47 S49 H51 V55 K56 I59 Y92	L45-F47 PolarHBondContact O-N 2.85Å; L45-S49 VanDerWaalsContact CD1-OG 3.29Å; L45-S49 WeakPolarHBondContact CD1-OG 3.35Å; L45-S49 VanDerWaalsContact CG-OG 3.22Å; L45-S49 WeakPolarHBondContact CG-OG 2.88Å; L45-H51 WeakPolarHBondContact CD1-ND1 3.36Å; L45-H51 HydrophobicContact CD2-CB 3.76Å; L45-V55 HydrophobicContact CD2-CG1 3.78Å; L45-K56 HydrophobicContact CD2-CG 4.2Å; L45-I59 HydrophobicContact CB-CD1 3.41Å; L45-I59 VanDerWaalsContact CB-CD1 3.41Å; L45-I59 HydrophobicContact CD2-CD1 4.17Å; L45-I59 HydrophobicContact CG-CD1 4.43Å; L45-Y92 VanDerWaalsContact O-CE2 3.24Å; L45-Y92 WeakPolarHBondContact O-CE2 3.29Å; L45-Y92 PolarHBondContact O-OH 3.14Å
46	H	90.5	Very high	81	Confident	87 Å²	87	80.4 Å²	80.4	40%	0.403	43%	0.433	S	S	.	.			trans	-58.9	140.4	179.7	-164.7	-90.7	0	0	0	111.3	Y44 S48 S49 N90	Y44-H46 PolarHBondContact O-N 2.98Å; H46-S48 PolarHBondContact CE1-OG 3.39Å; H46-S48 PolarHBondContact ND1-N 2.97Å; H46-S48 PolarHBondContact ND1-OG 3.47Å; H46-S48 PolarHBondContact O-N 2.87Å; H46-S48 VanDerWaalsContact O-N 3.16Å; H46-S49 WeakPolarHBondContact O-CB 3.42Å; H46-S49 PolarHBondContact O-N 3.23Å; H46-S49 PolarHBondContact O-OG 3.21Å; H46-N90 WeakPolarHBondContact CA-O 3.4Å; H46-N90 VanDerWaalsContact CD2-C 3.46Å; H46-N90 PolarHBondContact CD2-O 2.79Å
47	F	88.6	Confident	82.2	Confident	75 Å²	75	78.9 Å²	78.9	33%	0.329	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.6	-174.7	-172.6	-97.5	0	0	0	113.4	L45 S49 K56 N90 G91 Y92 P93	L45-F47 PolarHBondContact O-N 2.85Å; F47-S49 VanDerWaalsContact C-N 3.26Å; F47-S49 PolarHBondContact O-N 2.8Å; F47-K56 HydrophobicContact CD2-CD 3.88Å; F47-K56 HydrophobicContact CE2-CD 4.18Å; F47-K56 HydrophobicContact CG-CD 4.46Å; F47-K56 WeakPolarHBondContact O-CE 3.46Å; F47-K56 PolarHBondContact O-NZ 3.21Å; F47-N90 PolarHBondContact N-O 3.3Å; F47-G91 VanDerWaalsContact CB-C 3.43Å; F47-G91 WeakPolarHBondContact CB-O 3.28Å; F47-Y92 HydrophobicContact CB-CD2 4.27Å; F47-Y92 HydrophobicContact CB-CG 4.41Å; F47-Y92 AromaticContact CD2-CD1 3.95Å; F47-Y92 HydrophobicContact CD2-CD1 3.95Å; F47-Y92 HydrophobicContact CD2-CE1 4.3Å; F47-Y92 HydrophobicContact CD2-CG 4.2Å; F47-P93 HydrophobicContact CE2-CG 4.16Å; F47-P93 HydrophobicContact CZ-CG 4.16Å
48	S	90	Very high	83.6	Confident	92 Å²	92	75.5 Å²	75.5	64%	0.643	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-1.8	175.5	67.1	0	0	0	0	114.7	H46	H46-S48 PolarHBondContact CE1-OG 3.39Å; H46-S48 PolarHBondContact ND1-N 2.97Å; H46-S48 PolarHBondContact ND1-OG 3.47Å; H46-S48 PolarHBondContact O-N 2.87Å; H46-S48 VanDerWaalsContact O-N 3.16Å
49	S	89.5	Confident	84.9	Confident	27 Å²	27	70.4 Å²	70.4	19%	0.189	40%	0.396	C	S	.	.	S	Bend	trans	-67.3	154.6	179.6	67	0	0	0	0	112.7	L45 H46 F47 H51 K56	L45-S49 VanDerWaalsContact CD1-OG 3.29Å; L45-S49 WeakPolarHBondContact CD1-OG 3.35Å; L45-S49 VanDerWaalsContact CG-OG 3.22Å; L45-S49 WeakPolarHBondContact CG-OG 2.88Å; H46-S49 WeakPolarHBondContact O-CB 3.42Å; H46-S49 PolarHBondContact O-N 3.23Å; H46-S49 PolarHBondContact O-OG 3.21Å; F47-S49 VanDerWaalsContact C-N 3.26Å; F47-S49 PolarHBondContact O-N 2.8Å; S49-H51 PolarHBondContact O-N 3.05Å; S49-H51 PolarHBondContact OG-ND1 3.16Å; S49-K56 PolarHBondContact O-NZ 3.05Å
50	H	92	Very high	86.3	Confident	196 Å²	196	67.2 Å²	67.2	91%	0.907	38%	0.377	S	S	*	.	S	Bend	trans	-75.4	62.1	178	-65.4	90.6	0	0	0	112.2
51	H	88.6	Confident	87.2	Confident	92 Å²	92	68.7 Å²	68.7	43%	0.426	39%	0.389	S	S	.	.	S	Bend	trans	-132.3	149.4	174.7	-65.7	84.8	0	0	0	109.7	L45 S49 V55 K56	L45-H51 WeakPolarHBondContact CD1-ND1 3.36Å; L45-H51 HydrophobicContact CD2-CB 3.76Å; S49-H51 PolarHBondContact O-N 3.05Å; S49-H51 PolarHBondContact OG-ND1 3.16Å; H51-V55 HydrophobicContact CB-CB 4.45Å; H51-V55 HydrophobicContact CB-CG1 4.49Å; H51-K56 PolarHBondContact O-NZ 3.25Å
52	P	92	Very high	87.7	Confident	78 Å²	78	67.9 Å²	67.9	51%	0.506	39%	0.387	S	S	.	.			trans	-62	151.7	178.1	27.4	-34.9	0	0	0	111.1	S54 V55	P52-S54 PolarHBondContact O-N 3.47Å; P52-S54 VanDerWaalsContact O-N 3.16Å; P52-V55 HydrophobicContact CG-CB 4.41Å; P52-V55 HydrophobicContact CG-CG2 3.77Å; P52-V55 PolarHBondContact O-N 2.8Å
53	V	88.8	Confident	88.1	Confident	110 Å²	110	66.9 Å²	66.9	67%	0.667	38%	0.381	S	S	*	.	H	α-helix	trans	-57.8	-30.7	-179.7	177.7	0	0	0	0	111.7	V55 K56 G57	V53-V55 VanDerWaalsContact C-N 3.32Å; V53-V55 PolarHBondContact O-N 3Å; V53-K56 PolarHBondContact O-N 2.53Å; V53-G57 PolarHBondContact O-N 2.9Å
54	S	89.3	Confident	88.4	Confident	91 Å²	91	61.2 Å²	61.2	64%	0.636	37%	0.365	S	S	*	.	H	α-helix	trans	-58.9	-38.6	175.7	54.4	0	0	0	0	113.4	P52 G58	P52-S54 PolarHBondContact O-N 3.47Å; P52-S54 VanDerWaalsContact O-N 3.16Å; S54-G58 PolarHBondContact O-N 3.08Å
55	V	88.4	Confident	88.6	Confident	64 Å²	64	64.8 Å²	64.8	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-68.3	-42	177.3	171.4	0	0	0	0	110.4	L45 H51 P52 V53 G58 I59	L45-V55 HydrophobicContact CD2-CG1 3.78Å; H51-V55 HydrophobicContact CB-CB 4.45Å; H51-V55 HydrophobicContact CB-CG1 4.49Å; P52-V55 HydrophobicContact CG-CB 4.41Å; P52-V55 HydrophobicContact CG-CG2 3.77Å; P52-V55 PolarHBondContact O-N 2.8Å; V53-V55 VanDerWaalsContact C-N 3.32Å; V53-V55 PolarHBondContact O-N 3Å; V55-G58 PolarHBondContact O-N 3.05Å; V55-I59 PolarHBondContact O-N 2.74Å
56	K	86.5	Confident	88.4	Confident	18 Å²	18	65 Å²	65	8%	0.078	38%	0.384	C	S	.	.	H	α-helix	trans	-65.1	-43.5	177.7	-66.9	167.1	-173.2	163.5	0	110.9	L45 F47 S49 H51 V53 I59 V60 Y92	L45-K56 HydrophobicContact CD2-CG 4.2Å; F47-K56 HydrophobicContact CD2-CD 3.88Å; F47-K56 HydrophobicContact CE2-CD 4.18Å; F47-K56 HydrophobicContact CG-CD 4.46Å; F47-K56 WeakPolarHBondContact O-CE 3.46Å; F47-K56 PolarHBondContact O-NZ 3.21Å; S49-K56 PolarHBondContact O-NZ 3.05Å; H51-K56 PolarHBondContact O-NZ 3.25Å; V53-K56 PolarHBondContact O-N 2.53Å; K56-I59 WeakPolarHBondContact O-CB 3.23Å; K56-I59 PolarHBondContact O-N 2.69Å; K56-V60 PolarHBondContact O-N 3.3Å; K56-Y92 HydrophobicContact CB-CE1 3.81Å; K56-Y92 WeakPolarHBondContact O-CE1 2.95Å; K56-Y92 PolarHBondContact O-OH 2.89Å
57	G	89.3	Confident	88.1	Confident	32 Å²	32	61.1 Å²	61.1	33%	0.33	37%	0.367	S	S	.	.	H	α-helix	trans	-60.2	-43.5	173.4	0	0	0	0	0	112.1	V53 I59 V60 T61	V53-G57 PolarHBondContact O-N 2.9Å; G57-I59 VanDerWaalsContact C-N 3.25Å; G57-I59 PolarHBondContact O-N 3.44Å; G57-V60 PolarHBondContact O-N 3.45Å; G57-T61 PolarHBondContact O-N 3.38Å; G57-T61 PolarHBondContact O-OG1 2.85Å
58	G	88.9	Confident	87.8	Confident	45 Å²	45	62.3 Å²	62.3	46%	0.464	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-32.2	176.5	0	0	0	0	0	114	S54 V55 G62	S54-G58 PolarHBondContact O-N 3.08Å; V55-G58 PolarHBondContact O-N 3.05Å; G58-G62 PolarHBondContact O-N 3.38Å
59	I	87.4	Confident	87.5	Confident	23 Å²	23	62.3 Å²	62.3	12%	0.118	37%	0.374	C	S	.	.	H	α-helix	trans	-66.6	-46.7	172.9	-67.2	165.8	0	0	0	110.6	Y44 L45 V55 K56 G57 G62 M63 Y92	Y44-I59 HydrophobicContact CD1-CG2 4.1Å; Y44-I59 HydrophobicContact CG-CG2 4.37Å; L45-I59 HydrophobicContact CB-CD1 3.41Å; L45-I59 VanDerWaalsContact CB-CD1 3.41Å; L45-I59 HydrophobicContact CD2-CD1 4.17Å; L45-I59 HydrophobicContact CG-CD1 4.43Å; V55-I59 PolarHBondContact O-N 2.74Å; K56-I59 WeakPolarHBondContact O-CB 3.23Å; K56-I59 PolarHBondContact O-N 2.69Å; G57-I59 VanDerWaalsContact C-N 3.25Å; G57-I59 PolarHBondContact O-N 3.44Å; I59-G62 PolarHBondContact O-N 2.94Å; I59-M63 HydrophobicContact CG2-CE 3.79Å; I59-M63 HydrophobicContact CG2-SD 4.17Å; I59-M63 VanDerWaalsContact O-CG 3.25Å; I59-M63 WeakPolarHBondContact O-CG 3.46Å; I59-M63 PolarHBondContact O-N 2.87Å; I59-Y92 WeakPolarHBondContact CD1-OH 3.23Å
60	V	88.2	Confident	87	Confident	45 Å²	45	63.6 Å²	63.6	27%	0.273	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-51	178.8	-179.1	0	0	0	0	110.6	K56 G57 G62 M63 V64 L87 Y92	K56-V60 PolarHBondContact O-N 3.3Å; G57-V60 PolarHBondContact O-N 3.45Å; V60-G62 PolarHBondContact O-N 3.35Å; V60-M63 PolarHBondContact O-N 3.35Å; V60-V64 WeakPolarHBondContact O-CG2 3.41Å; V60-V64 PolarHBondContact O-N 3.01Å; V60-L87 HydrophobicContact CB-CD1 4.31Å; V60-L87 HydrophobicContact CG1-CD1 3.91Å; V60-L87 HydrophobicContact CG2-CD1 3.85Å; V60-L87 HydrophobicContact CG2-CD2 3.87Å; V60-Y92 HydrophobicContact CG2-CD1 3.76Å; V60-Y92 HydrophobicContact CG2-CE1 3.62Å
61	T	88.4	Confident	86.4	Confident	73 Å²	73	55 Å²	55	45%	0.448	34%	0.34	S	S	.	.	H	α-helix	trans	-58.8	-47.1	177.9	-60.7	0	0	0	0	110.7	G57 M63 V64 D65	G57-T61 PolarHBondContact O-N 3.38Å; G57-T61 PolarHBondContact O-OG1 2.85Å; T61-M63 VanDerWaalsContact C-N 3.32Å; T61-M63 PolarHBondContact O-N 3.25Å; T61-V64 PolarHBondContact O-N 3.41Å; T61-D65 WeakPolarHBondContact CG2-OD2 3.43Å; T61-D65 VanDerWaalsContact O-CB 3.23Å; T61-D65 WeakPolarHBondContact O-CB 3.49Å; T61-D65 VanDerWaalsContact O-CG 3.28Å; T61-D65 PolarHBondContact O-N 2.83Å
62	G	86.5	Confident	86	Confident	26 Å²	26	54.1 Å²	54.1	27%	0.268	34%	0.338	S	S	.	.	H	α-helix	trans	-61.2	-36	177.4	0	0	0	0	0	113.5	G58 I59 V60 R66	G58-G62 PolarHBondContact O-N 3.38Å; I59-G62 PolarHBondContact O-N 2.94Å; V60-G62 PolarHBondContact O-N 3.35Å; G62-R66 WeakPolarHBondContact O-CB 3.33Å; G62-R66 WeakPolarHBondContact O-CD 3.29Å; G62-R66 WeakPolarHBondContact O-CG 3.48Å; G62-R66 PolarHBondContact O-N 3.21Å; G62-R66 PolarHBondContact O-NE 3.05Å
63	M	86.7	Confident	85.6	Confident	10 Å²	10	55.6 Å²	55.6	5%	0.049	35%	0.348	C	S	.	.	H	α-helix	trans	-65.8	-48.5	173.7	-71.4	167.5	168	0	0	112.2	Y44 I59 V60 T61 A67 I83 L87	Y44-M63 HydrophobicContact CD1-CE 3.32Å; Y44-M63 HydrophobicContact CD2-CE 3.37Å; Y44-M63 HydrophobicContact CE1-CE 3.18Å; Y44-M63 HydrophobicContact CE2-CE 3.21Å; Y44-M63 HydrophobicContact CG-CE 3.4Å; Y44-M63 VanDerWaalsContact CG-CE 3.4Å; I59-M63 HydrophobicContact CG2-CE 3.79Å; I59-M63 HydrophobicContact CG2-SD 4.17Å; I59-M63 VanDerWaalsContact O-CG 3.25Å; I59-M63 WeakPolarHBondContact O-CG 3.46Å; I59-M63 PolarHBondContact O-N 2.87Å; V60-M63 PolarHBondContact O-N 3.35Å; T61-M63 VanDerWaalsContact C-N 3.32Å; T61-M63 PolarHBondContact O-N 3.25Å; M63-A67 WeakPolarHBondContact O-CB 3.08Å; M63-A67 PolarHBondContact O-N 2.98Å; M63-A67 VanDerWaalsContact O-N 3.08Å; M63-I83 HydrophobicContact CB-CD1 4.17Å; M63-I83 HydrophobicContact CB-CG1 4.36Å; M63-I83 HydrophobicContact CB-CG2 3.82Å; M63-I83 HydrophobicContact CG-CG2 4.43Å; M63-I83 HydrophobicContact SD-CG2 3.86Å; M63-L87 HydrophobicContact CE-CD2 4.26Å; M63-L87 HydrophobicContact SD-CD1 4.25Å; M63-L87 HydrophobicContact SD-CD2 3.74Å; M63-L87 HydrophobicContact SD-CG 3.97Å
64	V	87.4	Confident	85.5	Confident	46 Å²	46	58.2 Å²	58.2	28%	0.279	35%	0.353	S	S	.	.	H	α-helix	trans	-71.7	-46.6	-174.9	174.9	0	0	0	0	111.4	V60 T61 R66 A67 I68 L80	V60-V64 WeakPolarHBondContact O-CG2 3.41Å; V60-V64 PolarHBondContact O-N 3.01Å; T61-V64 PolarHBondContact O-N 3.41Å; V64-R66 PolarHBondContact O-N 3.18Å; V64-A67 PolarHBondContact O-N 2.89Å; V64-A67 VanDerWaalsContact O-N 3.1Å; V64-I68 HydrophobicContact CG1-CD1 3.98Å; V64-I68 WeakPolarHBondContact O-CG1 3.22Å; V64-I68 PolarHBondContact O-N 3.05Å; V64-I68 VanDerWaalsContact O-N 3.16Å; V64-L80 HydrophobicContact CG1-CD2 4.25Å; V64-L80 HydrophobicContact CG2-CD2 4.41Å
65	D	86.5	Confident	85.2	Confident	96 Å²	96	58.8 Å²	58.8	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-28.6	-179.3	-72.5	-4.3	0	0	0	111.9	T61 P69	T61-D65 WeakPolarHBondContact CG2-OD2 3.43Å; T61-D65 VanDerWaalsContact O-CB 3.23Å; T61-D65 WeakPolarHBondContact O-CB 3.49Å; T61-D65 VanDerWaalsContact O-CG 3.28Å; T61-D65 PolarHBondContact O-N 2.83Å; D65-P69 WeakPolarHBondContact O-CD 3.5Å; D65-P69 WeakPolarHBondContact O-CG 3.25Å
66	R	83.1	Confident	85.1	Confident	39 Å²	39	57.7 Å²	57.7	15%	0.147	34%	0.335	C	S	.	.	H	α-helix	trans	-80.4	-38.3	173.2	-70.7	-178.1	-52.9	179.4	12.3	112.9	E15 G62 V64 I68 P69 I70	E15-R66 IonicContact OE1-NH2 2.58Å; E15-R66 IonicContact OE2-CZ 2.66Å; E15-R66 IonicContact OE2-NH1 3.13Å; E15-R66 PolarHBondContact OE2-NH1 3.42Å; E15-R66 IonicContact OE2-NH2 3.74Å; E15-R66 PolarHBondContact OE2-NH2 2.94Å; G62-R66 WeakPolarHBondContact O-CB 3.33Å; G62-R66 WeakPolarHBondContact O-CD 3.29Å; G62-R66 WeakPolarHBondContact O-CG 3.48Å; G62-R66 PolarHBondContact O-N 3.21Å; G62-R66 PolarHBondContact O-NE 3.05Å; V64-R66 PolarHBondContact O-N 3.18Å; R66-I68 VanDerWaalsContact C-N 3.29Å; R66-I68 PolarHBondContact O-N 3.31Å; R66-P69 VanDerWaalsContact O-CD 3.29Å; R66-P69 WeakPolarHBondContact O-CD 3.36Å; R66-I70 HydrophobicContact CB-CD1 4.08Å; R66-I70 VanDerWaalsContact O-CB 3.25Å; R66-I70 WeakPolarHBondContact O-CB 3.35Å; R66-I70 WeakPolarHBondContact O-CD1 3.3Å; R66-I70 WeakPolarHBondContact O-CG1 3.35Å; R66-I70 PolarHBondContact O-N 3.38Å
67	A	84.1	Confident	85.1	Confident	5 Å²	5	62.5 Å²	62.5	4%	0.041	36%	0.362	C	S	.	.	H	α-helix	trans	-62.2	-37.8	-180	0	0	0	0	0	112	M63 V64 C71 L76 E79 L80 I83	M63-A67 WeakPolarHBondContact O-CB 3.08Å; M63-A67 PolarHBondContact O-N 2.98Å; M63-A67 VanDerWaalsContact O-N 3.08Å; V64-A67 PolarHBondContact O-N 2.89Å; V64-A67 VanDerWaalsContact O-N 3.1Å; A67-C71 VanDerWaalsContact O-CB 3.23Å; A67-C71 WeakPolarHBondContact O-CB 3.32Å; A67-C71 PolarHBondContact O-N 3.35Å; A67-L76 HydrophobicContact CB-CD1 4.26Å; A67-L76 WeakPolarHBondContact O-CD1 3.47Å; A67-E79 HydrophobicContact CB-CG 3.93Å; A67-L80 HydrophobicContact CB-CD2 4.4Å; A67-I83 HydrophobicContact CB-CD1 3.78Å
68	I	82.5	Confident	85	Confident	100 Å²	100	64.8 Å²	64.8	51%	0.513	37%	0.371	S	S	.	.	H	α-helix	trans	-60	-51.9	-177.1	-67.8	165.7	0	0	0	113.5	V64 R66 L76	V64-I68 HydrophobicContact CG1-CD1 3.98Å; V64-I68 WeakPolarHBondContact O-CG1 3.22Å; V64-I68 PolarHBondContact O-N 3.05Å; V64-I68 VanDerWaalsContact O-N 3.16Å; R66-I68 VanDerWaalsContact C-N 3.29Å; R66-I68 PolarHBondContact O-N 3.31Å; I68-L76 HydrophobicContact CG1-CD1 4.44Å
69	P	83.3	Confident	84.9	Confident	93 Å²	93	64.1 Å²	64.1	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-82.4	-27.4	179.4	30.5	-35.9	0	0	0	114.1	D65 R66	D65-P69 WeakPolarHBondContact O-CD 3.5Å; D65-P69 WeakPolarHBondContact O-CG 3.25Å; R66-P69 VanDerWaalsContact O-CD 3.29Å; R66-P69 WeakPolarHBondContact O-CD 3.36Å
70	I	79	Confident	84.9	Confident	53 Å²	53	65.7 Å²	65.7	27%	0.272	36%	0.364	S	S	.	.	H	α-helix	trans	-83.7	-38.9	-174.5	-63.1	174	0	0	0	111.8	F34 R66	F34-I70 HydrophobicContact CD2-CG2 4.37Å; R66-I70 HydrophobicContact CB-CD1 4.08Å; R66-I70 VanDerWaalsContact O-CB 3.25Å; R66-I70 WeakPolarHBondContact O-CB 3.35Å; R66-I70 WeakPolarHBondContact O-CD1 3.3Å; R66-I70 WeakPolarHBondContact O-CG1 3.35Å; R66-I70 PolarHBondContact O-N 3.38Å
71	C	78.9	Confident	84.9	Confident	17 Å²	17	69.9 Å²	69.9	12%	0.115	38%	0.381	C	S	.	.	S	Bend	trans	-81.1	135	-175.9	-64.7	0	0	0	0	111.6	A67 L76	A67-C71 VanDerWaalsContact O-CB 3.23Å; A67-C71 WeakPolarHBondContact O-CB 3.32Å; A67-C71 PolarHBondContact O-N 3.35Å; C71-L76 HydrophobicContact CB-CB 4.39Å; C71-L76 HydrophobicContact CB-CD1 4.33Å
72	D	80.6	Confident	84.9	Confident	73 Å²	73	69.9 Å²	69.9	39%	0.39	37%	0.373	S	S	.	.			trans	-57.1	145.3	165.5	-66.6	-58.7	0	0	0	109.7	E74 F75 L76	D72-E74 PolarHBondContact O-N 3.26Å; D72-F75 HydrophobicContact CB-CD2 4.12Å; D72-F75 PolarHBondContact O-N 3.28Å; D72-L76 PolarHBondContact O-N 2.86Å; D72-L76 VanDerWaalsContact O-N 3.14Å
73	P	84.7	Confident	84.9	Confident	109 Å²	109	69.1 Å²	69.1	71%	0.708	36%	0.362	S	S	*	.	H	α-helix	trans	-53	-29.7	-175.9	-29	34.9	0	0	0	114.6	F75	P73-F75 VanDerWaalsContact C-N 3.35Å
74	E	85.6	Confident	85.1	Confident	165 Å²	165	71.2 Å²	71.2	77%	0.771	38%	0.382	S	S	*	.	H	α-helix	trans	-69	-30.1	178.2	-61.6	-177.8	176.8	0	0	113	D72	D72-E74 PolarHBondContact O-N 3.26Å
75	F	84.2	Confident	85.1	Confident	103 Å²	103	71.2 Å²	71.2	45%	0.452	38%	0.381	S	S	.	.	H	α-helix	trans	-103.3	-9	-177	-60.9	-67.2	0	0	0	113.9	D72 P73 N77 P78 E79	D72-F75 HydrophobicContact CB-CD2 4.12Å; D72-F75 PolarHBondContact O-N 3.28Å; P73-F75 VanDerWaalsContact C-N 3.35Å; F75-N77 PolarHBondContact O-N 3.19Å; F75-P78 VanDerWaalsContact O-CD 3.32Å; F75-P78 WeakPolarHBondContact O-CD 3.45Å; F75-E79 WeakPolarHBondContact O-CB 3.43Å; F75-E79 PolarHBondContact O-N 2.94Å
76	L	85.2	Confident	85.2	Confident	40 Å²	40	66.8 Å²	66.8	21%	0.209	36%	0.358	C	S	.	.	H	α-helix	trans	-57.9	-46.2	-179.7	-179.4	61.2	0	0	0	112.6	A67 I68 C71 D72 E79 L80	A67-L76 HydrophobicContact CB-CD1 4.26Å; A67-L76 WeakPolarHBondContact O-CD1 3.47Å; I68-L76 HydrophobicContact CG1-CD1 4.44Å; C71-L76 HydrophobicContact CB-CB 4.39Å; C71-L76 HydrophobicContact CB-CD1 4.33Å; D72-L76 PolarHBondContact O-N 2.86Å; D72-L76 VanDerWaalsContact O-N 3.14Å; L76-E79 PolarHBondContact O-N 3.25Å; L76-L80 HydrophobicContact CD1-CD1 4.2Å; L76-L80 HydrophobicContact CD1-CG 4.11Å; L76-L80 HydrophobicContact CG-CD1 4.08Å; L76-L80 HydrophobicContact CG-CG 4.39Å; L76-L80 VanDerWaalsContact O-CG 3.3Å; L76-L80 WeakPolarHBondContact O-CG 3.35Å; L76-L80 PolarHBondContact O-N 3.25Å
77	N	87.3	Confident	85.5	Confident	120 Å²	120	65.7 Å²	65.7	64%	0.642	36%	0.355	S	S	*	.	H	α-helix	trans	-64.4	-49.5	-179.8	-77	-49.5	0	0	0	113	F75 E79 L80 H81	F75-N77 PolarHBondContact O-N 3.19Å; N77-E79 PolarHBondContact O-N 3.04Å; N77-L80 PolarHBondContact O-N 3.48Å; N77-H81 PolarHBondContact O-N 2.75Å
78	P	87.3	Confident	85.8	Confident	79 Å²	79	70 Å²	70	51%	0.513	38%	0.375	S	S	.	.	H	α-helix	trans	-53.7	-40	170.1	-28.3	33.3	0	0	0	113.7	F75 H81 Y82	F75-P78 VanDerWaalsContact O-CD 3.32Å; F75-P78 WeakPolarHBondContact O-CD 3.45Å; P78-H81 PolarHBondContact O-N 3.48Å; P78-Y82 PolarHBondContact O-N 3.16Å
79	E	85.3	Confident	86.2	Confident	32 Å²	32	72.1 Å²	72.1	15%	0.15	38%	0.38	C	S	.	.	H	α-helix	trans	-67.1	-46.1	179.2	179.5	71.1	164.7	0	0	112.2	R36 A67 F75 L76 N77 H81 Y82 I83	R36-E79 IonicContact CZ-OE1 3.94Å; R36-E79 IonicContact CZ-OE2 3.94Å; R36-E79 VanDerWaalsContact CZ-OE2 3.24Å; R36-E79 IonicContact NE-OE1 3.24Å; R36-E79 IonicContact NH1-OE1 3.25Å; R36-E79 PolarHBondContact NH1-OE1 3.39Å; R36-E79 IonicContact NH1-OE2 2.69Å; R36-E79 PolarHBondContact NH1-OE2 3.19Å; R36-E79 IonicContact NH2-OE1 3.46Å; R36-E79 PolarHBondContact NH2-OE1 2.84Å; R36-E79 IonicContact NH2-OE2 3.14Å; R36-E79 PolarHBondContact NH2-OE2 2.83Å; A67-E79 HydrophobicContact CB-CG 3.93Å; F75-E79 WeakPolarHBondContact O-CB 3.43Å; F75-E79 PolarHBondContact O-N 2.94Å; L76-E79 PolarHBondContact O-N 3.25Å; N77-E79 PolarHBondContact O-N 3.04Å; E79-H81 VanDerWaalsContact C-N 3.28Å; E79-H81 PolarHBondContact O-N 3.05Å; E79-Y82 WeakPolarHBondContact O-CB 3.44Å; E79-Y82 PolarHBondContact O-N 3.26Å; E79-Y82 VanDerWaalsContact O-N 3.12Å; E79-I83 HydrophobicContact CG-CD1 4Å; E79-I83 WeakPolarHBondContact O-CG1 3.46Å; E79-I83 PolarHBondContact O-N 3.02Å
80	L	87.9	Confident	86.5	Confident	55 Å²	55	68.3 Å²	68.3	29%	0.288	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-39.2	176	-69.6	175.3	0	0	0	111.5	V64 A67 L76 N77 I83 A84	V64-L80 HydrophobicContact CG1-CD2 4.25Å; V64-L80 HydrophobicContact CG2-CD2 4.41Å; A67-L80 HydrophobicContact CB-CD2 4.4Å; L76-L80 HydrophobicContact CD1-CD1 4.2Å; L76-L80 HydrophobicContact CD1-CG 4.11Å; L76-L80 HydrophobicContact CG-CD1 4.08Å; L76-L80 HydrophobicContact CG-CG 4.39Å; L76-L80 VanDerWaalsContact O-CG 3.3Å; L76-L80 WeakPolarHBondContact O-CG 3.35Å; L76-L80 PolarHBondContact O-N 3.25Å; N77-L80 PolarHBondContact O-N 3.48Å; L80-I83 PolarHBondContact O-N 3.45Å; L80-A84 WeakPolarHBondContact O-CB 3.18Å; L80-A84 PolarHBondContact O-N 2.83Å
81	H	88.4	Confident	87	Confident	134 Å²	134	67.4 Å²	67.4	62%	0.62	36%	0.358	S	S	*	.	H	α-helix	trans	-64.4	-40.6	174.2	-177	-82.8	0	0	0	112	N77 P78 E79 A84 T85	N77-H81 PolarHBondContact O-N 2.75Å; P78-H81 PolarHBondContact O-N 3.48Å; E79-H81 VanDerWaalsContact C-N 3.28Å; E79-H81 PolarHBondContact O-N 3.05Å; H81-A84 PolarHBondContact O-N 3.47Å; H81-T85 WeakPolarHBondContact O-CB 3.1Å; H81-T85 PolarHBondContact O-N 2.98Å; H81-T85 PolarHBondContact O-OG1 2.85Å
82	Y	88.2	Confident	87.6	Confident	73 Å²	73	67.5 Å²	67.5	29%	0.286	36%	0.356	S	S	.	.	H	α-helix	trans	-61.1	-49.2	173.4	-178.3	-81.6	0	0	0	111.3	R36 D42 P78 E79 A84 T85 T86	R36-Y82 VanDerWaalsContact CZ-CD1 3.47Å; R36-Y82 VanDerWaalsContact NH1-CG 3.31Å; D42-Y82 WeakPolarHBondContact OD1-CE1 3.2Å; D42-Y82 VanDerWaalsContact OD1-CZ 3.26Å; D42-Y82 PolarHBondContact OD1-OH 2.83Å; D42-Y82 PolarHBondContact OD2-OH 3.08Å; P78-Y82 PolarHBondContact O-N 3.16Å; E79-Y82 WeakPolarHBondContact O-CB 3.44Å; E79-Y82 PolarHBondContact O-N 3.26Å; E79-Y82 VanDerWaalsContact O-N 3.12Å; Y82-A84 VanDerWaalsContact C-N 3.3Å; Y82-A84 PolarHBondContact O-N 2.84Å; Y82-T85 WeakPolarHBondContact O-CB 3.24Å; Y82-T85 PolarHBondContact O-N 3.44Å; Y82-T85 VanDerWaalsContact O-N 3.12Å; Y82-T86 WeakPolarHBondContact CE1-OG1 3.48Å; Y82-T86 WeakPolarHBondContact O-CB 3.39Å; Y82-T86 PolarHBondContact O-N 3.18Å; Y82-T86 PolarHBondContact O-OG1 2.95Å
83	I	87.8	Confident	87.9	Confident	9 Å²	9	68.2 Å²	68.2	5%	0.046	37%	0.365	C	S	.	.	H	α-helix	trans	-55.7	-47.6	178.1	-71.2	165	0	0	0	110	M63 A67 E79 L80 T85 T86 L87	M63-I83 HydrophobicContact CB-CD1 4.17Å; M63-I83 HydrophobicContact CB-CG1 4.36Å; M63-I83 HydrophobicContact CB-CG2 3.82Å; M63-I83 HydrophobicContact CG-CG2 4.43Å; M63-I83 HydrophobicContact SD-CG2 3.86Å; A67-I83 HydrophobicContact CB-CD1 3.78Å; E79-I83 HydrophobicContact CG-CD1 4Å; E79-I83 WeakPolarHBondContact O-CG1 3.46Å; E79-I83 PolarHBondContact O-N 3.02Å; L80-I83 PolarHBondContact O-N 3.45Å; I83-T85 PolarHBondContact O-N 3.37Å; I83-T86 PolarHBondContact O-N 2.67Å; I83-L87 HydrophobicContact CG2-CD1 3.82Å; I83-L87 HydrophobicContact CG2-CG 4.35Å; I83-L87 WeakPolarHBondContact O-CB 3.41Å; I83-L87 VanDerWaalsContact O-CG 3.29Å; I83-L87 WeakPolarHBondContact O-CG 3.35Å; I83-L87 PolarHBondContact O-N 3.46Å
84	A	89.3	Confident	87.8	Confident	55 Å²	55	69.5 Å²	69.5	46%	0.455	36%	0.359	S	S	.	.	H	α-helix	trans	-59.6	-44.9	177.1	0	0	0	0	0	112.4	L80 H81 Y82 T86 L87 E88	L80-A84 WeakPolarHBondContact O-CB 3.18Å; L80-A84 PolarHBondContact O-N 2.83Å; H81-A84 PolarHBondContact O-N 3.47Å; Y82-A84 VanDerWaalsContact C-N 3.3Å; Y82-A84 PolarHBondContact O-N 2.84Å; A84-T86 VanDerWaalsContact C-N 3.33Å; A84-T86 PolarHBondContact O-N 2.85Å; A84-L87 PolarHBondContact O-N 3.16Å; A84-E88 WeakPolarHBondContact O-CB 3.29Å; A84-E88 PolarHBondContact O-N 3.12Å
85	T	88.6	Confident	87	Confident	45 Å²	45	67.7 Å²	67.7	28%	0.276	36%	0.361	S	S	.	.	H	α-helix	trans	-63.3	-40.9	177.9	-56.7	0	0	0	0	111.3	H81 Y82 I83 E88 K89	H81-T85 WeakPolarHBondContact O-CB 3.1Å; H81-T85 PolarHBondContact O-N 2.98Å; H81-T85 PolarHBondContact O-OG1 2.85Å; Y82-T85 WeakPolarHBondContact O-CB 3.24Å; Y82-T85 PolarHBondContact O-N 3.44Å; Y82-T85 VanDerWaalsContact O-N 3.12Å; I83-T85 PolarHBondContact O-N 3.37Å; T85-E88 PolarHBondContact O-N 3.12Å; T85-K89 WeakPolarHBondContact O-CG 3.35Å; T85-K89 PolarHBondContact O-N 3.46Å
86	T	88.3	Confident	85.7	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.018	38%	0.375	C	S	.	.	H	α-helix	trans	-68.7	-42.2	178.3	-67.2	0	0	0	0	111.4	D42 Y44 Y82 I83 A84 E88 K89 N90	D42-T86 HydrophobicContact CB-CG2 3.86Å; Y44-T86 HydrophobicContact CD2-CG2 3.72Å; Y44-T86 HydrophobicContact CE2-CG2 3.52Å; Y82-T86 WeakPolarHBondContact CE1-OG1 3.48Å; Y82-T86 WeakPolarHBondContact O-CB 3.39Å; Y82-T86 PolarHBondContact O-N 3.18Å; Y82-T86 PolarHBondContact O-OG1 2.95Å; I83-T86 PolarHBondContact O-N 2.67Å; A84-T86 VanDerWaalsContact C-N 3.33Å; A84-T86 PolarHBondContact O-N 2.85Å; T86-E88 VanDerWaalsContact C-N 3.35Å; T86-E88 PolarHBondContact O-N 2.74Å; T86-K89 PolarHBondContact O-N 3.38Å; T86-N90 PolarHBondContact O-N 2.94Å; T86-N90 PolarHBondContact O-ND2 3.22Å
87	L	89.6	Confident	83.6	Confident	16 Å²	16	70.7 Å²	70.7	8%	0.084	40%	0.399	C	S	.	.	H	α-helix	trans	-61.3	-42.7	173.6	-73.3	172	0	0	0	111.7	V60 M63 I83 A84 K89 N90 G91 Y92	V60-L87 HydrophobicContact CB-CD1 4.31Å; V60-L87 HydrophobicContact CG1-CD1 3.91Å; V60-L87 HydrophobicContact CG2-CD1 3.85Å; V60-L87 HydrophobicContact CG2-CD2 3.87Å; M63-L87 HydrophobicContact CE-CD2 4.26Å; M63-L87 HydrophobicContact SD-CD1 4.25Å; M63-L87 HydrophobicContact SD-CD2 3.74Å; M63-L87 HydrophobicContact SD-CG 3.97Å; I83-L87 HydrophobicContact CG2-CD1 3.82Å; I83-L87 HydrophobicContact CG2-CG 4.35Å; I83-L87 WeakPolarHBondContact O-CB 3.41Å; I83-L87 VanDerWaalsContact O-CG 3.29Å; I83-L87 WeakPolarHBondContact O-CG 3.35Å; I83-L87 PolarHBondContact O-N 3.46Å; A84-L87 PolarHBondContact O-N 3.16Å; L87-K89 PolarHBondContact O-N 2.93Å; L87-N90 CarbonylContact O-C 3.38Å; L87-N90 WeakPolarHBondContact O-CA 2.94Å; L87-N90 PolarHBondContact O-N 3.16Å; L87-G91 PolarHBondContact O-N 3.46Å; L87-Y92 HydrophobicContact CB-CD2 4.39Å; L87-Y92 HydrophobicContact CB-CG 4.22Å; L87-Y92 HydrophobicContact CD2-CD1 4.12Å; L87-Y92 HydrophobicContact CD2-CD2 3.85Å; L87-Y92 HydrophobicContact CD2-CE1 4.19Å; L87-Y92 HydrophobicContact CD2-CE2 3.95Å; L87-Y92 HydrophobicContact CD2-CG 3.94Å; L87-Y92 WeakPolarHBondContact O-CB 3.47Å; L87-Y92 WeakPolarHBondContact O-CD2 3.09Å; L87-Y92 PolarHBondContact O-N 3.33Å
88	E	90.2	Very high	81.3	Confident	97 Å²	97	70.3 Å²	70.3	45%	0.453	40%	0.403	S	S	.	.	H	α-helix	trans	-59.2	-44.9	174.3	-179.8	174.9	-173.1	0	0	111.7	A84 T85 T86 N90 G91 K94	A84-E88 WeakPolarHBondContact O-CB 3.29Å; A84-E88 PolarHBondContact O-N 3.12Å; T85-E88 PolarHBondContact O-N 3.12Å; T86-E88 VanDerWaalsContact C-N 3.35Å; T86-E88 PolarHBondContact O-N 2.74Å; E88-N90 PolarHBondContact O-N 3.4Å; E88-G91 PolarHBondContact O-N 3.21Å; E88-K94 VanDerWaalsContact CD-NZ 3.25Å; E88-K94 WeakPolarHBondContact OE1-CE 3.42Å; E88-K94 IonicContact OE1-NZ 2.68Å; E88-K94 PolarHBondContact OE1-NZ 3.4Å; E88-K94 WeakPolarHBondContact OE2-CE 3.46Å; E88-K94 IonicContact OE2-NZ 3.21Å; E88-K94 PolarHBondContact OE2-NZ 2.99Å
89	K	89.7	Confident	78.9	Confident	144 Å²	144	72 Å²	72	63%	0.626	41%	0.413	S	S	*	.	H	α-helix	trans	-61.5	-27.3	174.4	-72.3	174.7	-176.1	173.8	0	113.1	T85 T86 L87 G91	T85-K89 WeakPolarHBondContact O-CG 3.35Å; T85-K89 PolarHBondContact O-N 3.46Å; T86-K89 PolarHBondContact O-N 3.38Å; L87-K89 PolarHBondContact O-N 2.93Å; K89-G91 VanDerWaalsContact C-N 3.28Å
90	N	89.5	Confident	77	Confident	13 Å²	13	80.1 Å²	80.1	7%	0.07	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	11.9	174.5	-72.1	-83.2	0	0	0	113.1	D42 Y44 H46 F47 T86 L87 E88 Y92	D42-N90 PolarHBondContact O-ND2 2.58Å; Y44-N90 PolarHBondContact N-OD1 3.33Å; Y44-N90 PolarHBondContact O-OD1 3.1Å; H46-N90 WeakPolarHBondContact CA-O 3.4Å; H46-N90 VanDerWaalsContact CD2-C 3.46Å; H46-N90 PolarHBondContact CD2-O 2.79Å; F47-N90 PolarHBondContact N-O 3.3Å; T86-N90 PolarHBondContact O-N 2.94Å; T86-N90 PolarHBondContact O-ND2 3.22Å; L87-N90 CarbonylContact O-C 3.38Å; L87-N90 WeakPolarHBondContact O-CA 2.94Å; L87-N90 PolarHBondContact O-N 3.16Å; E88-N90 PolarHBondContact O-N 3.4Å; N90-Y92 VanDerWaalsContact C-N 3.35Å; N90-Y92 HydrophobicContact CB-CD2 3.95Å; N90-Y92 HydrophobicContact CB-CE2 4.07Å; N90-Y92 PolarHBondContact O-N 2.94Å
91	G	91	Very high	76.4	Confident	33 Å²	33	81.4 Å²	81.4	34%	0.34	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	10.4	173.5	0	0	0	0	0	114.9	F47 L87 E88 K89	F47-G91 VanDerWaalsContact CB-C 3.43Å; F47-G91 WeakPolarHBondContact CB-O 3.28Å; L87-G91 PolarHBondContact O-N 3.46Å; E88-G91 PolarHBondContact O-N 3.21Å; K89-G91 VanDerWaalsContact C-N 3.28Å
92	Y	91.6	Very high	75.8	Confident	19 Å²	19	78.6 Å²	78.6	8%	0.075	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-69.2	140.8	176.8	-75.7	-108.9	0	0	0	110.6	L45 F47 K56 I59 V60 L87 N90	L45-Y92 VanDerWaalsContact O-CE2 3.24Å; L45-Y92 WeakPolarHBondContact O-CE2 3.29Å; L45-Y92 PolarHBondContact O-OH 3.14Å; F47-Y92 HydrophobicContact CB-CD2 4.27Å; F47-Y92 HydrophobicContact CB-CG 4.41Å; F47-Y92 AromaticContact CD2-CD1 3.95Å; F47-Y92 HydrophobicContact CD2-CD1 3.95Å; F47-Y92 HydrophobicContact CD2-CE1 4.3Å; F47-Y92 HydrophobicContact CD2-CG 4.2Å; K56-Y92 HydrophobicContact CB-CE1 3.81Å; K56-Y92 WeakPolarHBondContact O-CE1 2.95Å; K56-Y92 PolarHBondContact O-OH 2.89Å; I59-Y92 WeakPolarHBondContact CD1-OH 3.23Å; V60-Y92 HydrophobicContact CG2-CD1 3.76Å; V60-Y92 HydrophobicContact CG2-CE1 3.62Å; L87-Y92 HydrophobicContact CB-CD2 4.39Å; L87-Y92 HydrophobicContact CB-CG 4.22Å; L87-Y92 HydrophobicContact CD2-CD1 4.12Å; L87-Y92 HydrophobicContact CD2-CD2 3.85Å; L87-Y92 HydrophobicContact CD2-CE1 4.19Å; L87-Y92 HydrophobicContact CD2-CE2 3.95Å; L87-Y92 HydrophobicContact CD2-CG 3.94Å; L87-Y92 WeakPolarHBondContact O-CB 3.47Å; L87-Y92 WeakPolarHBondContact O-CD2 3.09Å; L87-Y92 PolarHBondContact O-N 3.33Å; N90-Y92 VanDerWaalsContact C-N 3.35Å; N90-Y92 HydrophobicContact CB-CD2 3.95Å; N90-Y92 HydrophobicContact CB-CE2 4.07Å; N90-Y92 PolarHBondContact O-N 2.94Å
93	P	87.2	Confident	75.1	Confident	89 Å²	89	78.9 Å²	78.9	58%	0.578	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-66	140.6	176.6	28.6	-34	0	0	0	110	F47	F47-P93 HydrophobicContact CE2-CG 4.16Å; F47-P93 HydrophobicContact CZ-CG 4.16Å
94	K	82.2	Confident	74.3	Confident	136 Å²	136	83 Å²	83	59%	0.591	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-61.8	143.1	169.1	-70.4	178.5	-180	169.7	0	108.9	E88 S96	E88-K94 VanDerWaalsContact CD-NZ 3.25Å; E88-K94 WeakPolarHBondContact OE1-CE 3.42Å; E88-K94 IonicContact OE1-NZ 2.68Å; E88-K94 PolarHBondContact OE1-NZ 3.4Å; E88-K94 WeakPolarHBondContact OE2-CE 3.46Å; E88-K94 IonicContact OE2-NZ 3.21Å; E88-K94 PolarHBondContact OE2-NZ 2.99Å; K94-S96 PolarHBondContact O-N 3.19Å
95	P	68.2	Low	73.4	Confident	126 Å²	126	84.8 Å²	84.8	82%	0.818	51%	0.51	S	S	*	.			trans	-55.6	112.2	167.2	23.3	-30.1	0	0	0	106.5	S97	P95-S97 PolarHBondContact O-N 2.68Å
96	S	57.1	Low	72.4	Confident	105 Å²	105	87.4 Å²	87.4	73%	0.734	53%	0.525	S	S	*	.			trans	-53.2	127.6	170.8	50.6	0	0	0	0	105.9	K94	K94-S96 PolarHBondContact O-N 3.19Å
97	S	41.3	Very low	71.3	Confident	101 Å²	101	93.4 Å²	93.4	71%	0.706	56%	0.562	S	S	*	*			trans	-39.6	135.2	165.4	50.6	0	0	0	0	108.4	P95	P95-S97 PolarHBondContact O-N 2.68Å
98	P	39.6	Very low	69.9	Low	113 Å²	113	99.4 Å²	99.4	73%	0.734	60%	0.598	S	S	*	*			trans	-50.4	138.7	175.7	21.6	-31.1	0	0	0	108.2
99	P	35.7	Very low	68.2	Low	113 Å²	113	99.6 Å²	99.6	73%	0.734	61%	0.61	S	S	*	*			trans	-54.4	146.1	173.4	24.8	-32	0	0	0	108.7
100	P	44.8	Very low	66.2	Low	203 Å²	203	95.5 Å²	95.5	100%	1.318	61%	0.609	S	S	*	*			trans	-56.3	0	-178.8	26.1	-35.5	0	0	0	112.8

Retrieved 100 of 100 residues in 272.2 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).