A0A077ZNI2_TRITR Loading...

DUF7041 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZNI2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 104 aa.

						>A0A077ZNI2_TRITR|A0A077ZNI2
MARTRSGSEPSTAPGTPQLSARSVFRHRNARDEETLFELALSAIAEETLETLRDFILTADQQTAPFTALKAVCLDKLMDDRAHQICQAITDEELAGRPPFVFHR
					

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	41.1	Very low	40	Very low	255 Å²	255	155.3 Å²	155.3	100%	1.256	87%	0.872	S	S	*	*				0	117.4	0	-79.1	173.3	167.5	0	0	107.9
2	A	42.6	Very low	39.5	Very low	100 Å²	100	151.7 Å²	151.7	83%	0.826	86%	0.857	S	S	*	*			trans	-126.5	121	176.6	0	0	0	0	0	108.4
3	R	43	Very low	39.8	Very low	255 Å²	255	146.3 Å²	146.3	96%	0.962	84%	0.843	S	S	*	*			trans	-138.3	124.5	156	-96.8	-172.7	171.3	-167.2	-3.2	108.7
4	T	45.1	Very low	40.4	Very low	128 Å²	128	143.4 Å²	143.4	79%	0.785	83%	0.832	S	S	*	*			trans	-81.1	144	-174.1	43.4	0	0	0	0	112.1
5	R	35.6	Very low	40.8	Very low	239 Å²	239	138.6 Å²	138.6	90%	0.902	83%	0.825	S	S	*	*				60.4	131.2	127.6	-152.2	-177.1	-165	-149.6	2.8	118.7
6	S	37.7	Very low	41.2	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	81%	0.81	S	S	*	*				120.9	122.5	128.6	-152.1	0	0	0	0	113.1
7	G	39.4	Very low	41.7	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	79%	0.794	S	S	*	*			trans	152.7	54.8	170.7	0	0	0	0	0	113.2
8	S	34.3	Very low	42.7	Very low	124 Å²	124	130.7 Å²	130.7	87%	0.867	78%	0.775	S	S	*	*			trans	-71.5	116.5	150	-60.1	0	0	0	0	106.5
9	E	40.3	Very low	43.4	Very low	192 Å²	192	127.8 Å²	127.8	90%	0.897	76%	0.755	S	S	*	*			trans	-158	152.6	149.4	-101.6	-161.3	93.5	0	0	109.5
10	P	41.1	Very low	44.4	Very low	92 Å²	92	124.5 Å²	124.5	60%	0.597	74%	0.739	S	S	*	*			trans	-93.2	138.4	-143	33.5	-28.5	0	0	0	111.1	T12	P10-T12 PolarHBondContact O-N 3.36Å
11	S	40.1	Very low	45.3	Very low	129 Å²	129	120.6 Å²	120.6	90%	0.902	72%	0.72	S	S	*	*			trans	-77.1	77.9	164.5	-169.4	0	0	0	0	108.4
12	T	34.4	Very low	46.2	Very low	112 Å²	112	118.5 Å²	118.5	69%	0.687	70%	0.699	S	S	*	*			trans	-60.6	139.6	164.3	-47.7	0	0	0	0	109.3	P10	P10-T12 PolarHBondContact O-N 3.36Å
13	A	42.4	Very low	47.4	Very low	82 Å²	82	115.7 Å²	115.7	68%	0.678	67%	0.673	S	S	*	*			trans	91.5	153.1	153.2	0	0	0	0	0	118.5
14	P	49.3	Very low	48.5	Very low	106 Å²	106	104.2 Å²	104.2	69%	0.688	63%	0.631	S	S	*	*			cis	-124.6	138.2	2.5	21.7	1.1	0	0	0	113.6	T16	P14-T16 PolarHBondContact O-N 3.49Å
15	G	45.6	Very low	49.4	Very low	71 Å²	71	100.3 Å²	100.3	73%	0.732	60%	0.603	S	S	*	*	S	Bend	trans	-49.7	133.2	150.1	0	0	0	0	0	107.7	P17	G15-P17 WeakPolarHBondContact O-CD 3.39Å
16	T	46.8	Very low	51	Low	95 Å²	95	98.7 Å²	98.7	58%	0.583	60%	0.597	S	S	*	*			trans	-44.4	106.7	-177.4	35.2	0	0	0	0	109.1	P14 Q18	P14-T16 PolarHBondContact O-N 3.49Å; T16-Q18 PolarHBondContact O-N 3.09Å; T16-Q18 PolarHBondContact O-OE1 3.04Å; T16-Q18 VanDerWaalsContact O-OE1 3.13Å
17	P	50.9	Low	52.5	Low	83 Å²	83	98.9 Å²	98.9	54%	0.539	58%	0.584	S	S	.	*			trans	-68	113.5	-179.7	25.4	-29.4	0	0	0	105.5	G15 L19	G15-P17 WeakPolarHBondContact O-CD 3.39Å; P17-L19 HydrophobicContact CB-CD2 4.48Å; P17-L19 HydrophobicContact CG-CD2 4.16Å; P17-L19 WeakPolarHBondContact O-CG 3.31Å; P17-L19 PolarHBondContact O-N 3.22Å
18	Q	59.4	Low	53.9	Low	95 Å²	95	103.1 Å²	103.1	44%	0.444	58%	0.578	S	S	.	*			trans	-53.5	100.5	160.6	-70.5	74.8	16.3	0	0	105.1	T16 S20 Q84	T16-Q18 PolarHBondContact O-N 3.09Å; T16-Q18 PolarHBondContact O-OE1 3.04Å; T16-Q18 VanDerWaalsContact O-OE1 3.13Å; Q18-S20 PolarHBondContact O-N 3.25Å; Q18-Q84 HydrophobicContact CG-CG 4.18Å
19	L	56.6	Low	55.7	Low	77 Å²	77	102.5 Å²	102.5	40%	0.403	57%	0.565	S	S	.	*			trans	-66.9	110.1	-169.3	-71.1	173.8	0	0	0	106.2	P17 A21 V24	P17-L19 HydrophobicContact CB-CD2 4.48Å; P17-L19 HydrophobicContact CG-CD2 4.16Å; P17-L19 WeakPolarHBondContact O-CG 3.31Å; P17-L19 PolarHBondContact O-N 3.22Å; L19-A21 PolarHBondContact O-N 3.4Å; L19-V24 HydrophobicContact CB-CG2 3.45Å; L19-V24 VanDerWaalsContact CB-CG2 3.45Å; L19-V24 HydrophobicContact CD1-CG2 4.2Å; L19-V24 HydrophobicContact CG-CG2 4.48Å
20	S	62	Low	57.2	Low	61 Å²	61	94.2 Å²	94.2	43%	0.427	53%	0.529	S	S	.	.			trans	-49.2	144.9	166	72	0	0	0	0	108.6	Q18 R22 S23 V24	Q18-S20 PolarHBondContact O-N 3.25Å; S20-R22 CarbonylContact O-C 3.6Å; S20-R22 PolarHBondContact O-N 3.06Å; S20-S23 WeakPolarHBondContact O-CA 3.41Å; S20-S23 WeakPolarHBondContact O-CB 3.21Å; S20-S23 PolarHBondContact O-N 3.27Å; S20-S23 PolarHBondContact OG-N 3.42Å; S20-S23 PolarHBondContact OG-OG 3.39Å; S20-S23 VanDerWaalsContact OG-OG 3.11Å; S20-V24 PolarHBondContact O-N 3.07Å
21	A	63.3	Low	58.9	Low	43 Å²	43	99.8 Å²	99.8	36%	0.355	54%	0.538	S	S	.	.	H	α-helix	trans	-48	-39.4	-179.3	0	0	0	0	0	111.7	L19 S23 V24 F25	L19-A21 PolarHBondContact O-N 3.4Å; A21-S23 VanDerWaalsContact C-N 3.34Å; A21-S23 PolarHBondContact O-N 2.98Å; A21-V24 WeakPolarHBondContact O-CB 3.47Å; A21-V24 PolarHBondContact O-N 2.83Å; A21-V24 VanDerWaalsContact O-N 3.12Å; A21-F25 VanDerWaalsContact C-CD2 3.42Å; A21-F25 HydrophobicContact CB-CD2 4.4Å; A21-F25 HydrophobicContact CB-CE2 3.65Å; A21-F25 HydrophobicContact CB-CZ 3.93Å; A21-F25 WeakPolarHBondContact O-CD2 3.44Å; A21-F25 WeakPolarHBondContact O-CE2 3.39Å; A21-F25 WeakPolarHBondContact O-CG 3.45Å; A21-F25 PolarHBondContact O-N 3Å
22	R	61	Low	61	Low	211 Å²	211	97.2 Å²	97.2	80%	0.796	51%	0.514	S	S	*	.	H	α-helix	trans	-57.5	-40.9	174.1	-163.9	171.1	72	172.1	2.5	113.7	S20 R26	S20-R22 CarbonylContact O-C 3.6Å; S20-R22 PolarHBondContact O-N 3.06Å; R22-R26 WeakPolarHBondContact O-CB 3.4Å; R22-R26 PolarHBondContact O-N 3.38Å; R22-R26 VanDerWaalsContact O-N 3.08Å
23	S	67	Low	63.3	Low	41 Å²	41	100 Å²	100	29%	0.287	52%	0.519	S	S	.	.	H	α-helix	trans	-69.5	-43	173.8	-57.1	0	0	0	0	111.4	S20 A21 F25 R26 H27	S20-S23 WeakPolarHBondContact O-CA 3.41Å; S20-S23 WeakPolarHBondContact O-CB 3.21Å; S20-S23 PolarHBondContact O-N 3.27Å; S20-S23 PolarHBondContact OG-N 3.42Å; S20-S23 PolarHBondContact OG-OG 3.39Å; S20-S23 VanDerWaalsContact OG-OG 3.11Å; A21-S23 VanDerWaalsContact C-N 3.34Å; A21-S23 PolarHBondContact O-N 2.98Å; S23-F25 VanDerWaalsContact C-N 3.34Å; S23-F25 PolarHBondContact O-N 3.11Å; S23-R26 PolarHBondContact O-N 3.45Å; S23-H27 WeakPolarHBondContact O-CB 3.3Å; S23-H27 PolarHBondContact O-CD2 2.96Å; S23-H27 PolarHBondContact O-N 3.39Å
24	V	66	Low	65.1	Low	13 Å²	13	103 Å²	103	8%	0.079	52%	0.519	C	S	.	.	H	α-helix	trans	-56.2	-49.8	175.9	179.7	0	0	0	0	110.5	L19 S20 A21 R26 H27 R28 L39	L19-V24 HydrophobicContact CB-CG2 3.45Å; L19-V24 VanDerWaalsContact CB-CG2 3.45Å; L19-V24 HydrophobicContact CD1-CG2 4.2Å; L19-V24 HydrophobicContact CG-CG2 4.48Å; S20-V24 PolarHBondContact O-N 3.07Å; A21-V24 WeakPolarHBondContact O-CB 3.47Å; A21-V24 PolarHBondContact O-N 2.83Å; A21-V24 VanDerWaalsContact O-N 3.12Å; V24-R26 VanDerWaalsContact C-N 3.35Å; V24-R26 PolarHBondContact O-N 2.99Å; V24-H27 PolarHBondContact O-N 3.17Å; V24-R28 WeakPolarHBondContact O-CB 3.37Å; V24-R28 WeakPolarHBondContact O-CG 3.29Å; V24-R28 PolarHBondContact O-N 3.1Å; V24-L39 HydrophobicContact CG1-CD2 4.48Å
25	F	64.4	Low	66.6	Low	47 Å²	47	100.1 Å²	100.1	21%	0.206	50%	0.5	C	S	.	.	H	α-helix	trans	-61.2	-42.5	178.1	-57	-40.5	0	0	0	112.2	A21 S23 R28 N29 A30 L36 L39 A40	A21-F25 VanDerWaalsContact C-CD2 3.42Å; A21-F25 HydrophobicContact CB-CD2 4.4Å; A21-F25 HydrophobicContact CB-CE2 3.65Å; A21-F25 HydrophobicContact CB-CZ 3.93Å; A21-F25 WeakPolarHBondContact O-CD2 3.44Å; A21-F25 WeakPolarHBondContact O-CE2 3.39Å; A21-F25 WeakPolarHBondContact O-CG 3.45Å; A21-F25 PolarHBondContact O-N 3Å; S23-F25 VanDerWaalsContact C-N 3.34Å; S23-F25 PolarHBondContact O-N 3.11Å; F25-R28 PolarHBondContact O-N 3.35Å; F25-N29 PolarHBondContact O-N 3.29Å; F25-A30 PolarHBondContact O-N 3.31Å; F25-L36 HydrophobicContact CB-CD2 3.53Å; F25-L36 HydrophobicContact CD1-CB 4.45Å; F25-L36 HydrophobicContact CD1-CD2 3.34Å; F25-L36 HydrophobicContact CD1-CG 4.48Å; F25-L36 HydrophobicContact CD2-CD2 3.93Å; F25-L36 HydrophobicContact CE1-CB 4.32Å; F25-L36 HydrophobicContact CE1-CD2 4.01Å; F25-L36 WeakPolarHBondContact CE1-O 3.37Å; F25-L36 HydrophobicContact CG-CD2 3.31Å; F25-L36 WeakPolarHBondContact CZ-O 3.49Å; F25-L39 HydrophobicContact CD1-CB 3.71Å; F25-L39 HydrophobicContact CD1-CD1 3.86Å; F25-L39 HydrophobicContact CD1-CG 4.47Å; F25-L39 HydrophobicContact CE1-CB 3.43Å; F25-L39 VanDerWaalsContact CE1-CB 3.43Å; F25-L39 HydrophobicContact CE1-CD1 4.44Å; F25-A40 HydrophobicContact CE1-CB 4.37Å; F25-A40 HydrophobicContact CZ-CB 3.87Å
26	R	69.5	Low	68.3	Low	205 Å²	205	99.3 Å²	99.3	77%	0.774	48%	0.478	S	S	*	.	H	α-helix	trans	-66.4	-42	178.5	-160.6	-178.3	93.7	154.5	5.7	112.2	R22 S23 V24 N29	R22-R26 WeakPolarHBondContact O-CB 3.4Å; R22-R26 PolarHBondContact O-N 3.38Å; R22-R26 VanDerWaalsContact O-N 3.08Å; S23-R26 PolarHBondContact O-N 3.45Å; V24-R26 VanDerWaalsContact C-N 3.35Å; V24-R26 PolarHBondContact O-N 2.99Å; R26-N29 PolarHBondContact O-N 3.23Å
27	H	68.8	Low	69.8	Low	125 Å²	125	101.1 Å²	101.1	58%	0.579	48%	0.478	S	S	*	.	H	α-helix	trans	-69.2	-34.5	178.9	-76.5	-64.9	0	0	0	112.4	S23 V24 N29	S23-H27 WeakPolarHBondContact O-CB 3.3Å; S23-H27 PolarHBondContact O-CD2 2.96Å; S23-H27 PolarHBondContact O-N 3.39Å; V24-H27 PolarHBondContact O-N 3.17Å; H27-N29 VanDerWaalsContact C-N 3.35Å
28	R	69.7	Low	71.3	Confident	162 Å²	162	102.6 Å²	102.6	61%	0.611	48%	0.478	S	S	*	.	H	α-helix	trans	-87.5	-2.6	178.3	-65.8	-174	-175.9	-164.5	7.4	113.9	V24 F25 A30 L39	V24-R28 WeakPolarHBondContact O-CB 3.37Å; V24-R28 WeakPolarHBondContact O-CG 3.29Å; V24-R28 PolarHBondContact O-N 3.1Å; F25-R28 PolarHBondContact O-N 3.35Å; R28-A30 PolarHBondContact O-N 2.9Å; R28-A30 VanDerWaalsContact O-N 3.13Å; R28-L39 HydrophobicContact CB-CD1 3.85Å; R28-L39 HydrophobicContact CG-CD1 4.38Å
29	N	70.1	Confident	72.3	Confident	111 Å²	111	98.6 Å²	98.6	59%	0.594	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	33.3	-178.5	-158.8	8.5	0	0	0	112.6	F25 R26 H27 R31	F25-N29 PolarHBondContact O-N 3.29Å; R26-N29 PolarHBondContact O-N 3.23Å; H27-N29 VanDerWaalsContact C-N 3.35Å; N29-R31 PolarHBondContact O-N 3.21Å
30	A	72	Confident	73.4	Confident	17 Å²	17	96.6 Å²	96.6	14%	0.14	46%	0.455	C	S	.	.			trans	-68.7	123.6	176.8	0	0	0	0	0	108.7	F25 R28 T35 L36 L39	F25-A30 PolarHBondContact O-N 3.31Å; R28-A30 PolarHBondContact O-N 2.9Å; R28-A30 VanDerWaalsContact O-N 3.13Å; A30-T35 HydrophobicContact CB-CG2 3.54Å; A30-L36 HydrophobicContact CB-CD2 3.74Å; A30-L36 HydrophobicContact CB-CG 4.24Å; A30-L39 HydrophobicContact CB-CD1 3.53Å
31	R	77	Confident	74.2	Confident	209 Å²	209	96.9 Å²	96.9	79%	0.789	45%	0.451	S	S	*	.			trans	-118.6	-24.8	-177.9	-71.6	-174.3	177.7	-170.8	-3.7	112.9	N29	N29-R31 PolarHBondContact O-N 3.21Å
32	D	84.4	Confident	74.9	Confident	75 Å²	75	98.2 Å²	98.2	40%	0.401	46%	0.458	S	S	.	.	S	Bend	trans	-86.1	145.6	175.3	60.6	104.4	0	0	0	110.9	E34 T35 L36	D32-E34 VanDerWaalsContact C-N 3.27Å; D32-E34 PolarHBondContact O-N 3.36Å; D32-T35 PolarHBondContact O-N 3.02Å; D32-T35 WeakPolarHBondContact OD1-CB 3.46Å; D32-T35 PolarHBondContact OD1-N 3.26Å; D32-T35 PolarHBondContact OD1-OG1 3.03Å; D32-T35 WeakPolarHBondContact OD2-CB 3.49Å; D32-T35 PolarHBondContact OD2-OG1 3.47Å; D32-L36 VanDerWaalsContact O-CG 3.3Å; D32-L36 WeakPolarHBondContact O-CG 3.36Å; D32-L36 PolarHBondContact O-N 3.43Å
33	E	82.8	Confident	75.8	Confident	171 Å²	171	91.1 Å²	91.1	80%	0.799	44%	0.444	S	S	*	.	H	α-helix	trans	-61.3	-36.4	-177.4	-174.6	176.4	169.9	0	0	112.3	L36 F37	E33-L36 PolarHBondContact O-N 3.39Å; E33-F37 WeakPolarHBondContact O-CB 3.37Å; E33-F37 PolarHBondContact O-N 2.96Å
34	E	79.8	Confident	76.5	Confident	144 Å²	144	92.2 Å²	92.2	67%	0.673	45%	0.446	S	S	*	.	H	α-helix	trans	-63.2	-52	178.8	-175.5	170.6	-164.5	0	0	111.4	D32 L36 F37 E38	D32-E34 VanDerWaalsContact C-N 3.27Å; D32-E34 PolarHBondContact O-N 3.36Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 2.9Å; E34-F37 WeakPolarHBondContact O-CB 3.45Å; E34-F37 PolarHBondContact O-N 2.91Å; E34-F37 VanDerWaalsContact O-N 3.09Å; E34-E38 WeakPolarHBondContact O-CG 3.27Å; E34-E38 PolarHBondContact O-N 3.45Å
35	T	82.2	Confident	77.3	Confident	46 Å²	46	94.2 Å²	94.2	28%	0.282	46%	0.464	S	S	.	.	H	α-helix	trans	-61.7	-39.8	175.6	-59.7	0	0	0	0	111	A30 D32 F37 E38 L39	A30-T35 HydrophobicContact CB-CG2 3.54Å; D32-T35 PolarHBondContact O-N 3.02Å; D32-T35 WeakPolarHBondContact OD1-CB 3.46Å; D32-T35 PolarHBondContact OD1-N 3.26Å; D32-T35 PolarHBondContact OD1-OG1 3.03Å; D32-T35 WeakPolarHBondContact OD2-CB 3.49Å; D32-T35 PolarHBondContact OD2-OG1 3.47Å; T35-F37 VanDerWaalsContact C-N 3.29Å; T35-F37 PolarHBondContact O-N 3.12Å; T35-E38 PolarHBondContact O-N 3.35Å; T35-L39 HydrophobicContact CG2-CD1 3.9Å; T35-L39 HydrophobicContact CG2-CG 4.08Å; T35-L39 WeakPolarHBondContact O-CB 3.46Å; T35-L39 WeakPolarHBondContact O-CG 3.26Å; T35-L39 PolarHBondContact O-N 3Å
36	L	80.8	Confident	78.4	Confident	55 Å²	55	97.5 Å²	97.5	29%	0.288	48%	0.48	S	S	.	.	H	α-helix	trans	-61.2	-40.6	175.1	-69.6	172.9	0	0	0	111.5	F25 A30 D32 E33 E34 A40	F25-L36 HydrophobicContact CB-CD2 3.53Å; F25-L36 HydrophobicContact CD1-CB 4.45Å; F25-L36 HydrophobicContact CD1-CD2 3.34Å; F25-L36 HydrophobicContact CD1-CG 4.48Å; F25-L36 HydrophobicContact CD2-CD2 3.93Å; F25-L36 HydrophobicContact CE1-CB 4.32Å; F25-L36 HydrophobicContact CE1-CD2 4.01Å; F25-L36 WeakPolarHBondContact CE1-O 3.37Å; F25-L36 HydrophobicContact CG-CD2 3.31Å; F25-L36 WeakPolarHBondContact CZ-O 3.49Å; A30-L36 HydrophobicContact CB-CD2 3.74Å; A30-L36 HydrophobicContact CB-CG 4.24Å; D32-L36 VanDerWaalsContact O-CG 3.3Å; D32-L36 WeakPolarHBondContact O-CG 3.36Å; D32-L36 PolarHBondContact O-N 3.43Å; E33-L36 PolarHBondContact O-N 3.39Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 2.9Å; L36-A40 WeakPolarHBondContact O-CB 3.3Å; L36-A40 PolarHBondContact O-N 3.15Å
37	F	78.1	Confident	79.2	Confident	132 Å²	132	93 Å²	93	58%	0.579	47%	0.468	S	S	*	.	H	α-helix	trans	-66.6	-48	177.3	-177.9	-109.1	0	0	0	111.9	E33 E34 T35 L39 A40 L41	E33-F37 WeakPolarHBondContact O-CB 3.37Å; E33-F37 PolarHBondContact O-N 2.96Å; E34-F37 WeakPolarHBondContact O-CB 3.45Å; E34-F37 PolarHBondContact O-N 2.91Å; E34-F37 VanDerWaalsContact O-N 3.09Å; T35-F37 VanDerWaalsContact C-N 3.29Å; T35-F37 PolarHBondContact O-N 3.12Å; F37-L39 VanDerWaalsContact C-N 3.3Å; F37-L39 PolarHBondContact O-N 3.04Å; F37-A40 WeakPolarHBondContact O-CB 3.4Å; F37-A40 PolarHBondContact O-N 3.42Å; F37-A40 VanDerWaalsContact O-N 3.14Å; F37-L41 HydrophobicContact CD1-CD1 3.94Å; F37-L41 HydrophobicContact CE1-CD1 3.44Å; F37-L41 VanDerWaalsContact CE1-CD1 3.44Å; F37-L41 HydrophobicContact CE1-CG 4.18Å; F37-L41 HydrophobicContact CE2-CG 4.43Å; F37-L41 HydrophobicContact CZ-CD1 3.77Å; F37-L41 HydrophobicContact CZ-CD2 4.28Å; F37-L41 HydrophobicContact CZ-CG 4.13Å; F37-L41 WeakPolarHBondContact O-CG 3.27Å; F37-L41 PolarHBondContact O-N 3.05Å
38	E	81.9	Confident	80	Confident	114 Å²	114	88.5 Å²	88.5	53%	0.533	45%	0.449	S	S	.	.	H	α-helix	trans	-58.6	-42.4	175.6	-71.1	-173.9	168.3	0	0	112.1	E34 T35 L41 S42	E34-E38 WeakPolarHBondContact O-CG 3.27Å; E34-E38 PolarHBondContact O-N 3.45Å; T35-E38 PolarHBondContact O-N 3.35Å; E38-L41 PolarHBondContact O-N 3.25Å; E38-S42 WeakPolarHBondContact O-CB 3.3Å; E38-S42 PolarHBondContact O-N 3.36Å
39	L	80.1	Confident	80.9	Confident	11 Å²	11	81.9 Å²	81.9	6%	0.058	43%	0.426	C	S	.	.	H	α-helix	trans	-66	-38.7	177	-73.5	-177.3	0	0	0	112.1	V24 F25 R28 A30 T35 F37 S42 A43	V24-L39 HydrophobicContact CG1-CD2 4.48Å; F25-L39 HydrophobicContact CD1-CB 3.71Å; F25-L39 HydrophobicContact CD1-CD1 3.86Å; F25-L39 HydrophobicContact CD1-CG 4.47Å; F25-L39 HydrophobicContact CE1-CB 3.43Å; F25-L39 VanDerWaalsContact CE1-CB 3.43Å; F25-L39 HydrophobicContact CE1-CD1 4.44Å; R28-L39 HydrophobicContact CB-CD1 3.85Å; R28-L39 HydrophobicContact CG-CD1 4.38Å; A30-L39 HydrophobicContact CB-CD1 3.53Å; T35-L39 HydrophobicContact CG2-CD1 3.9Å; T35-L39 HydrophobicContact CG2-CG 4.08Å; T35-L39 WeakPolarHBondContact O-CB 3.46Å; T35-L39 WeakPolarHBondContact O-CG 3.26Å; T35-L39 PolarHBondContact O-N 3Å; F37-L39 VanDerWaalsContact C-N 3.3Å; F37-L39 PolarHBondContact O-N 3.04Å; L39-S42 WeakPolarHBondContact CA-OG 3.38Å; L39-S42 PolarHBondContact O-N 3.39Å; L39-S42 PolarHBondContact O-OG 2.98Å; L39-A43 PolarHBondContact O-N 3Å; L39-A43 VanDerWaalsContact O-N 3.16Å
40	A	79.8	Confident	81.9	Confident	36 Å²	36	81.7 Å²	81.7	30%	0.298	42%	0.421	S	S	.	.	H	α-helix	trans	-60.9	-47.9	174.1	0	0	0	0	0	110.4	F25 L36 F37 S42 A43 I44	F25-A40 HydrophobicContact CE1-CB 4.37Å; F25-A40 HydrophobicContact CZ-CB 3.87Å; L36-A40 WeakPolarHBondContact O-CB 3.3Å; L36-A40 PolarHBondContact O-N 3.15Å; F37-A40 WeakPolarHBondContact O-CB 3.4Å; F37-A40 PolarHBondContact O-N 3.42Å; F37-A40 VanDerWaalsContact O-N 3.14Å; A40-S42 VanDerWaalsContact C-N 3.31Å; A40-S42 PolarHBondContact O-N 2.88Å; A40-A43 PolarHBondContact O-N 3.04Å; A40-A43 VanDerWaalsContact O-N 3.15Å; A40-I44 PolarHBondContact O-N 2.91Å
41	L	79.5	Confident	82.7	Confident	66 Å²	66	82.9 Å²	82.9	35%	0.346	43%	0.427	S	S	.	.	H	α-helix	trans	-59.7	-42.1	176.4	-70.6	178.7	0	0	0	111.5	F37 E38 A43 I44 L49	F37-L41 HydrophobicContact CD1-CD1 3.94Å; F37-L41 HydrophobicContact CE1-CD1 3.44Å; F37-L41 VanDerWaalsContact CE1-CD1 3.44Å; F37-L41 HydrophobicContact CE1-CG 4.18Å; F37-L41 HydrophobicContact CE2-CG 4.43Å; F37-L41 HydrophobicContact CZ-CD1 3.77Å; F37-L41 HydrophobicContact CZ-CD2 4.28Å; F37-L41 HydrophobicContact CZ-CG 4.13Å; F37-L41 WeakPolarHBondContact O-CG 3.27Å; F37-L41 PolarHBondContact O-N 3.05Å; E38-L41 PolarHBondContact O-N 3.25Å; L41-A43 PolarHBondContact O-N 3.31Å; L41-I44 PolarHBondContact O-N 3.42Å; L41-I44 VanDerWaalsContact O-N 3.14Å; L41-L49 HydrophobicContact CD2-CD2 4.13Å
42	S	78.9	Confident	83.4	Confident	72 Å²	72	74.8 Å²	74.8	50%	0.503	40%	0.399	S	S	.	.	H	α-helix	trans	-66.4	-20	178.8	78.4	0	0	0	0	114.3	E38 L39 A40	E38-S42 WeakPolarHBondContact O-CB 3.3Å; E38-S42 PolarHBondContact O-N 3.36Å; L39-S42 WeakPolarHBondContact CA-OG 3.38Å; L39-S42 PolarHBondContact O-N 3.39Å; L39-S42 PolarHBondContact O-OG 2.98Å; A40-S42 VanDerWaalsContact C-N 3.31Å; A40-S42 PolarHBondContact O-N 2.88Å
43	A	80.1	Confident	83.7	Confident	61 Å²	61	77.7 Å²	77.7	50%	0.504	40%	0.404	S	S	.	.	H	α-helix	trans	-86.5	-13.4	177.6	0	0	0	0	0	112.6	L39 A40 L41	L39-A43 PolarHBondContact O-N 3Å; L39-A43 VanDerWaalsContact O-N 3.16Å; A40-A43 PolarHBondContact O-N 3.04Å; A40-A43 VanDerWaalsContact O-N 3.15Å; L41-A43 PolarHBondContact O-N 3.31Å
44	I	81.1	Confident	84.2	Confident	64 Å²	64	73.8 Å²	73.8	33%	0.328	39%	0.389	S	S	.	.	S	Bend	trans	-84.3	132.6	175.1	-59	170.8	0	0	0	107.8	A40 L41 T48 L49	A40-I44 PolarHBondContact O-N 2.91Å; L41-I44 PolarHBondContact O-N 3.42Å; L41-I44 VanDerWaalsContact O-N 3.14Å; I44-T48 HydrophobicContact CG2-CG2 3.66Å; I44-L49 HydrophobicContact CB-CD2 4.05Å; I44-L49 HydrophobicContact CB-CG 4.08Å; I44-L49 HydrophobicContact CD1-CD2 4.07Å; I44-L49 HydrophobicContact CG2-CD2 3.84Å; I44-L49 HydrophobicContact CG2-CG 3.76Å
45	A	83.4	Confident	84.8	Confident	56 Å²	56	67.8 Å²	67.8	46%	0.463	36%	0.36	S	S	.	.			trans	-59.1	138.8	174.3	0	0	0	0	0	110.7	E47 T48 L49	A45-E47 PolarHBondContact O-N 2.79Å; A45-T48 WeakPolarHBondContact O-CA 3.43Å; A45-T48 WeakPolarHBondContact O-CB 3.44Å; A45-T48 PolarHBondContact O-N 3.07Å; A45-L49 PolarHBondContact O-N 2.8Å; A45-L49 VanDerWaalsContact O-N 3.07Å
46	E	86.1	Confident	85.3	Confident	115 Å²	115	71.2 Å²	71.2	54%	0.537	38%	0.376	S	S	.	.	H	α-helix	trans	-55.6	-38.3	-177.8	-172.9	65.9	-141.2	0	0	111.8	T48 L49 E50 R53	E46-T48 VanDerWaalsContact C-N 3.26Å; E46-T48 PolarHBondContact O-N 3.34Å; E46-L49 CarbonylContact O-C 3.59Å; E46-L49 WeakPolarHBondContact O-CB 3.39Å; E46-L49 PolarHBondContact O-N 2.83Å; E46-E50 WeakPolarHBondContact O-CB 3.39Å; E46-E50 PolarHBondContact O-N 3.12Å; E46-R53 IonicContact OE1-CZ 3.74Å; E46-R53 IonicContact OE1-NH1 3.04Å; E46-R53 PolarHBondContact OE1-NH1 3.46Å; E46-R53 IonicContact OE1-NH2 2.77Å
47	E	86.6	Confident	85.9	Confident	111 Å²	111	74.8 Å²	74.8	52%	0.519	40%	0.395	S	S	.	.	H	α-helix	trans	-58.7	-37.6	175.4	-168.8	-159.9	137.8	0	0	112.6	A45 T51 K76	A45-E47 PolarHBondContact O-N 2.79Å; E47-T51 WeakPolarHBondContact O-CB 3.39Å; E47-T51 PolarHBondContact O-N 3.36Å; E47-T51 PolarHBondContact O-OG1 2.87Å; E47-K76 IonicContact OE1-NZ 3.45Å; E47-K76 PolarHBondContact OE1-NZ 3.29Å
48	T	86.5	Confident	86.5	Confident	30 Å²	30	70.9 Å²	70.9	18%	0.184	38%	0.382	C	S	.	.	H	α-helix	trans	-71	-39.7	175.7	-61.7	0	0	0	0	110.7	I44 A45 E46 T51 L52 K76	I44-T48 HydrophobicContact CG2-CG2 3.66Å; A45-T48 WeakPolarHBondContact O-CA 3.43Å; A45-T48 WeakPolarHBondContact O-CB 3.44Å; A45-T48 PolarHBondContact O-N 3.07Å; E46-T48 VanDerWaalsContact C-N 3.26Å; E46-T48 PolarHBondContact O-N 3.34Å; T48-T51 PolarHBondContact O-N 3.4Å; T48-L52 HydrophobicContact CG2-CD1 4.29Å; T48-L52 VanDerWaalsContact O-CG 3.26Å; T48-L52 WeakPolarHBondContact O-CG 3.01Å; T48-L52 PolarHBondContact O-N 2.88Å; T48-K76 HydrophobicContact CG2-CB 4.02Å; T48-K76 HydrophobicContact CG2-CG 4.22Å
49	L	87.1	Confident	86.9	Confident	23 Å²	23	66.8 Å²	66.8	12%	0.12	37%	0.367	C	S	.	.	H	α-helix	trans	-63.2	-41.5	174.3	-70.3	176.2	0	0	0	112	L41 I44 A45 E46 L52 R53	L41-L49 HydrophobicContact CD2-CD2 4.13Å; I44-L49 HydrophobicContact CB-CD2 4.05Å; I44-L49 HydrophobicContact CB-CG 4.08Å; I44-L49 HydrophobicContact CD1-CD2 4.07Å; I44-L49 HydrophobicContact CG2-CD2 3.84Å; I44-L49 HydrophobicContact CG2-CG 3.76Å; A45-L49 PolarHBondContact O-N 2.8Å; A45-L49 VanDerWaalsContact O-N 3.07Å; E46-L49 CarbonylContact O-C 3.59Å; E46-L49 WeakPolarHBondContact O-CB 3.39Å; E46-L49 PolarHBondContact O-N 2.83Å; L49-L52 PolarHBondContact O-N 3.45Å; L49-R53 VanDerWaalsContact O-CG 3.29Å; L49-R53 WeakPolarHBondContact O-CG 3.41Å; L49-R53 PolarHBondContact O-N 3.41Å
50	E	91.1	Very high	87.4	Confident	108 Å²	108	72.6 Å²	72.6	51%	0.505	40%	0.398	S	S	.	.	H	α-helix	trans	-59.6	-49.9	174.3	-175	174.5	-169.5	0	0	110.8	E46 L52 R53 D54	E46-E50 WeakPolarHBondContact O-CB 3.39Å; E46-E50 PolarHBondContact O-N 3.12Å; E50-L52 VanDerWaalsContact C-N 3.26Å; E50-L52 PolarHBondContact O-N 2.77Å; E50-R53 WeakPolarHBondContact O-CB 3.49Å; E50-R53 PolarHBondContact O-N 3.04Å; E50-D54 PolarHBondContact O-N 3.39Å
51	T	90.6	Very high	88	Confident	41 Å²	41	77.5 Å²	77.5	25%	0.252	42%	0.415	S	S	.	.	H	α-helix	trans	-56.2	-41.7	176.2	-54.9	0	0	0	0	111.8	E47 T48 F55 V72 K76	E47-T51 WeakPolarHBondContact O-CB 3.39Å; E47-T51 PolarHBondContact O-N 3.36Å; E47-T51 PolarHBondContact O-OG1 2.87Å; T48-T51 PolarHBondContact O-N 3.4Å; T51-F55 WeakPolarHBondContact O-CB 2.93Å; T51-F55 PolarHBondContact O-N 3.37Å; T51-V72 HydrophobicContact CG2-CG1 3.65Å; T51-K76 WeakPolarHBondContact OG1-CE 3.3Å
52	L	90	Very high	88.5	Confident	39 Å²	39	78.2 Å²	78.2	20%	0.204	42%	0.417	C	S	.	.	H	α-helix	trans	-67.8	-39	177.2	-70.3	171.1	0	0	0	112.2	T48 L49 E50 F55 I56 L69 V72	T48-L52 HydrophobicContact CG2-CD1 4.29Å; T48-L52 VanDerWaalsContact O-CG 3.26Å; T48-L52 WeakPolarHBondContact O-CG 3.01Å; T48-L52 PolarHBondContact O-N 2.88Å; L49-L52 PolarHBondContact O-N 3.45Å; E50-L52 VanDerWaalsContact C-N 3.26Å; E50-L52 PolarHBondContact O-N 2.77Å; L52-F55 PolarHBondContact O-N 2.97Å; L52-I56 WeakPolarHBondContact O-CD1 3.29Å; L52-I56 VanDerWaalsContact O-CG1 3.27Å; L52-I56 WeakPolarHBondContact O-CG1 3.11Å; L52-I56 PolarHBondContact O-N 2.93Å; L52-L69 HydrophobicContact CD2-CD1 3.84Å; L52-V72 HydrophobicContact CD2-CG1 4.46Å
53	R	91.7	Very high	89.1	Confident	136 Å²	136	81.9 Å²	81.9	51%	0.513	44%	0.437	S	S	.	.	H	α-helix	trans	-64.5	-46.1	175.9	-73	168.3	-177	152.8	4.9	111	E46 L49 E50 F55 I56 L57	E46-R53 IonicContact OE1-CZ 3.74Å; E46-R53 IonicContact OE1-NH1 3.04Å; E46-R53 PolarHBondContact OE1-NH1 3.46Å; E46-R53 IonicContact OE1-NH2 2.77Å; L49-R53 VanDerWaalsContact O-CG 3.29Å; L49-R53 WeakPolarHBondContact O-CG 3.41Å; L49-R53 PolarHBondContact O-N 3.41Å; E50-R53 WeakPolarHBondContact O-CB 3.49Å; E50-R53 PolarHBondContact O-N 3.04Å; R53-F55 VanDerWaalsContact C-N 3.3Å; R53-F55 PolarHBondContact O-N 3.15Å; R53-I56 PolarHBondContact O-N 3.14Å; R53-I56 VanDerWaalsContact O-N 3.12Å; R53-L57 WeakPolarHBondContact O-CG 3.36Å; R53-L57 PolarHBondContact O-N 3.07Å
54	D	93.5	Very high	89.7	Confident	89 Å²	89	81.4 Å²	81.4	48%	0.476	43%	0.432	S	S	.	.	H	α-helix	trans	-62	-39.4	177.3	-73	-9.1	0	0	0	111.8	E50 L57 T58	E50-D54 PolarHBondContact O-N 3.39Å; D54-L57 PolarHBondContact O-N 3.09Å; D54-T58 PolarHBondContact O-N 2.87Å; D54-T58 PolarHBondContact O-OG1 2.91Å
55	F	92.4	Very high	90.1	Very high	18 Å²	18	81.1 Å²	81.1	8%	0.079	44%	0.435	C	S	.	.	H	α-helix	trans	-60.6	-45.3	173.1	-177.9	-87.2	0	0	0	111.7	T51 L52 R53 L57 T58 A59 Q62 P65 A68 L69 V72	T51-F55 WeakPolarHBondContact O-CB 2.93Å; T51-F55 PolarHBondContact O-N 3.37Å; L52-F55 PolarHBondContact O-N 2.97Å; R53-F55 VanDerWaalsContact C-N 3.3Å; R53-F55 PolarHBondContact O-N 3.15Å; F55-L57 VanDerWaalsContact C-N 3.29Å; F55-L57 PolarHBondContact O-N 3.36Å; F55-T58 CarbonylContact O-C 3.49Å; F55-T58 PolarHBondContact O-N 2.89Å; F55-T58 VanDerWaalsContact O-N 3.1Å; F55-T58 PolarHBondContact O-OG1 3.44Å; F55-A59 HydrophobicContact CE1-CB 4.28Å; F55-A59 PolarHBondContact O-N 3.37Å; F55-Q62 HydrophobicContact CE2-CG 4.21Å; F55-Q62 HydrophobicContact CZ-CG 4.25Å; F55-P65 WeakPolarHBondContact CZ-O 3.34Å; F55-A68 HydrophobicContact CE2-CB 3.59Å; F55-A68 HydrophobicContact CZ-CB 3.78Å; F55-L69 HydrophobicContact CD1-CB 4.14Å; F55-L69 HydrophobicContact CD1-CD1 3.68Å; F55-L69 HydrophobicContact CD1-CG 4.44Å; F55-L69 HydrophobicContact CE1-CB 3.54Å; F55-L69 HydrophobicContact CE1-CD1 3.99Å; F55-L69 HydrophobicContact CE1-CG 4.26Å; F55-L69 HydrophobicContact CG-CD1 4.3Å; F55-L69 HydrophobicContact CZ-CB 3.82Å; F55-L69 VanDerWaalsContact CZ-N 3.28Å; F55-V72 HydrophobicContact CD2-CG2 3.96Å; F55-V72 HydrophobicContact CE2-CG2 4.46Å
56	I	91.9	Very high	90.2	Very high	118 Å²	118	86 Å²	86	61%	0.605	45%	0.446	S	S	*	.	H	α-helix	trans	-61.3	-40.3	179.4	-69.7	162.9	0	0	0	110.9	L52 R53 T58 A59	L52-I56 WeakPolarHBondContact O-CD1 3.29Å; L52-I56 VanDerWaalsContact O-CG1 3.27Å; L52-I56 WeakPolarHBondContact O-CG1 3.11Å; L52-I56 PolarHBondContact O-N 2.93Å; R53-I56 PolarHBondContact O-N 3.14Å; R53-I56 VanDerWaalsContact O-N 3.12Å; I56-T58 PolarHBondContact O-N 3.43Å; I56-A59 WeakPolarHBondContact O-CB 3.36Å; I56-A59 PolarHBondContact O-N 3.08Å
57	L	92.8	Very high	90.5	Very high	131 Å²	131	85.1 Å²	85.1	69%	0.686	45%	0.448	S	S	*	.	H	α-helix	trans	-67.2	-19	177.9	-68.3	176	0	0	0	113.9	R53 D54 F55	R53-L57 WeakPolarHBondContact O-CG 3.36Å; R53-L57 PolarHBondContact O-N 3.07Å; D54-L57 PolarHBondContact O-N 3.09Å; F55-L57 VanDerWaalsContact C-N 3.29Å; F55-L57 PolarHBondContact O-N 3.36Å
58	T	92.6	Very high	90.7	Very high	50 Å²	50	81 Å²	81	31%	0.307	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	5.2	179.9	57.8	0	0	0	0	112.9	D54 F55 I56 D60 Q61	D54-T58 PolarHBondContact O-N 2.87Å; D54-T58 PolarHBondContact O-OG1 2.91Å; F55-T58 CarbonylContact O-C 3.49Å; F55-T58 PolarHBondContact O-N 2.89Å; F55-T58 VanDerWaalsContact O-N 3.1Å; F55-T58 PolarHBondContact O-OG1 3.44Å; I56-T58 PolarHBondContact O-N 3.43Å; T58-D60 VanDerWaalsContact C-N 3.26Å; T58-D60 PolarHBondContact O-N 3.44Å; T58-Q61 WeakPolarHBondContact O-CB 3.46Å; T58-Q61 PolarHBondContact O-N 3.21Å
59	A	89.5	Confident	90.8	Very high	28 Å²	28	82.2 Å²	82.2	23%	0.231	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-65	-29.2	-172.5	0	0	0	0	0	113.1	F55 I56 Q61 Q62 P65	F55-A59 HydrophobicContact CE1-CB 4.28Å; F55-A59 PolarHBondContact O-N 3.37Å; I56-A59 WeakPolarHBondContact O-CB 3.36Å; I56-A59 PolarHBondContact O-N 3.08Å; A59-Q61 PolarHBondContact O-N 3.44Å; A59-Q62 PolarHBondContact O-N 2.88Å; A59-P65 HydrophobicContact CB-CB 4.42Å
60	D	90.5	Very high	90.9	Very high	132 Å²	132	87.1 Å²	87.1	71%	0.706	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-67.1	-24.2	175.9	67.5	-58	0	0	0	112.9	T58 Q62	T58-D60 VanDerWaalsContact C-N 3.26Å; T58-D60 PolarHBondContact O-N 3.44Å; D60-Q62 VanDerWaalsContact C-N 3.34Å
61	Q	92.3	Very high	90.9	Very high	140 Å²	140	84.7 Å²	84.7	65%	0.654	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-83.9	-14.4	178.2	-56.3	172	16.3	0	0	112.1	T58 A59	T58-Q61 WeakPolarHBondContact O-CB 3.46Å; T58-Q61 PolarHBondContact O-N 3.21Å; A59-Q61 PolarHBondContact O-N 3.44Å
62	Q	89.3	Confident	90.9	Very high	80 Å²	80	84.5 Å²	84.5	37%	0.374	46%	0.456	S	S	.	.			trans	-83	130.5	-178.5	-60	-63.1	-16.3	0	0	110.9	F55 A59 D60 A64 P65 A68	F55-Q62 HydrophobicContact CE2-CG 4.21Å; F55-Q62 HydrophobicContact CZ-CG 4.25Å; A59-Q62 PolarHBondContact O-N 2.88Å; D60-Q62 VanDerWaalsContact C-N 3.34Å; Q62-A64 PolarHBondContact O-N 3.34Å; Q62-P65 HydrophobicContact CB-CB 4.1Å; Q62-A68 HydrophobicContact CG-CB 4.41Å
63	T	92	Very high	90.7	Very high	150 Å²	150	85.5 Å²	85.5	92%	0.92	47%	0.465	S	S	*	.	S	Bend	trans	-67.7	-26.9	175	-46.9	0	0	0	0	112.5
64	A	92.9	Very high	90.5	Very high	50 Å²	50	83.2 Å²	83.2	41%	0.413	46%	0.463	S	S	.	.	S	Bend	trans	-140.7	72.9	178.7	0	0	0	0	0	110.4	Q62 F66 T67 A68	Q62-A64 PolarHBondContact O-N 3.34Å; A64-F66 VanDerWaalsContact C-N 3.3Å; A64-F66 PolarHBondContact O-N 3.15Å; A64-T67 PolarHBondContact O-N 3.49Å; A64-T67 VanDerWaalsContact O-N 3.09Å; A64-A68 PolarHBondContact O-N 3.43Å
65	P	88.3	Confident	90.3	Very high	58 Å²	58	84 Å²	84	38%	0.377	47%	0.467	S	S	.	.	H	α-helix	trans	-59.9	-37.1	-168.4	20.9	-31.8	0	0	0	112.9	F55 A59 Q62 T67 A68 L69	F55-P65 WeakPolarHBondContact CZ-O 3.34Å; A59-P65 HydrophobicContact CB-CB 4.42Å; Q62-P65 HydrophobicContact CB-CB 4.1Å; P65-T67 PolarHBondContact O-N 2.76Å; P65-A68 PolarHBondContact O-N 3.16Å; P65-L69 VanDerWaalsContact O-CB 3.31Å; P65-L69 WeakPolarHBondContact O-CB 3.5Å; P65-L69 PolarHBondContact O-N 3.12Å
66	F	86.9	Confident	89.9	Confident	160 Å²	160	84.6 Å²	84.6	70%	0.702	47%	0.469	S	S	*	.	H	α-helix	trans	-66.1	-40.3	178	-174.4	-100.5	0	0	0	112.9	A64 K70	A64-F66 VanDerWaalsContact C-N 3.3Å; A64-F66 PolarHBondContact O-N 3.15Å; F66-K70 WeakPolarHBondContact O-CB 3.36Å; F66-K70 PolarHBondContact O-N 3.35Å
67	T	91.4	Very high	89.4	Confident	95 Å²	95	84.1 Å²	84.1	58%	0.583	47%	0.468	S	S	*	.	H	α-helix	trans	-66.4	-41.2	176.7	-57.6	0	0	0	0	110.9	A64 P65 K70 A71	A64-T67 PolarHBondContact O-N 3.49Å; A64-T67 VanDerWaalsContact O-N 3.09Å; P65-T67 PolarHBondContact O-N 2.76Å; T67-K70 PolarHBondContact O-N 2.73Å; T67-A71 PolarHBondContact O-N 3.32Å
68	A	91.7	Very high	88.8	Confident	24 Å²	24	84.5 Å²	84.5	20%	0.198	47%	0.468	C	S	.	.	H	α-helix	trans	-67.2	-43.8	177.7	0	0	0	0	0	111.7	F55 Q62 A64 P65 K70 A71 V72	F55-A68 HydrophobicContact CE2-CB 3.59Å; F55-A68 HydrophobicContact CZ-CB 3.78Å; Q62-A68 HydrophobicContact CG-CB 4.41Å; A64-A68 PolarHBondContact O-N 3.43Å; P65-A68 PolarHBondContact O-N 3.16Å; A68-K70 VanDerWaalsContact C-N 3.32Å; A68-K70 PolarHBondContact O-N 2.99Å; A68-A71 WeakPolarHBondContact O-CB 3.47Å; A68-A71 PolarHBondContact O-N 3.14Å; A68-A71 VanDerWaalsContact O-N 3.11Å; A68-V72 WeakPolarHBondContact O-CG2 3.44Å; A68-V72 PolarHBondContact O-N 3.24Å
69	L	89.2	Confident	88.2	Confident	56 Å²	56	84.9 Å²	84.9	29%	0.293	47%	0.468	S	S	.	.	H	α-helix	trans	-57.4	-45.9	173.6	179.7	61.4	0	0	0	111.2	L52 F55 P65 A71 V72 C73	L52-L69 HydrophobicContact CD2-CD1 3.84Å; F55-L69 HydrophobicContact CD1-CB 4.14Å; F55-L69 HydrophobicContact CD1-CD1 3.68Å; F55-L69 HydrophobicContact CD1-CG 4.44Å; F55-L69 HydrophobicContact CE1-CB 3.54Å; F55-L69 HydrophobicContact CE1-CD1 3.99Å; F55-L69 HydrophobicContact CE1-CG 4.26Å; F55-L69 HydrophobicContact CG-CD1 4.3Å; F55-L69 HydrophobicContact CZ-CB 3.82Å; F55-L69 VanDerWaalsContact CZ-N 3.28Å; P65-L69 VanDerWaalsContact O-CB 3.31Å; P65-L69 WeakPolarHBondContact O-CB 3.5Å; P65-L69 PolarHBondContact O-N 3.12Å; L69-A71 VanDerWaalsContact C-N 3.27Å; L69-A71 PolarHBondContact O-N 3.01Å; L69-V72 PolarHBondContact O-N 3.11Å; L69-C73 PolarHBondContact O-N 3.37Å; L69-C73 PolarHBondContact O-SG 2.88Å
70	K	88.7	Confident	87.5	Confident	126 Å²	126	87 Å²	87	55%	0.548	48%	0.475	S	S	.	.	H	α-helix	trans	-58.5	-41.5	177.1	-175.5	-176.3	177.8	-176.2	0	111.5	F66 T67 A68 C73 L74	F66-K70 WeakPolarHBondContact O-CB 3.36Å; F66-K70 PolarHBondContact O-N 3.35Å; T67-K70 PolarHBondContact O-N 2.73Å; A68-K70 VanDerWaalsContact C-N 3.32Å; A68-K70 PolarHBondContact O-N 2.99Å; K70-C73 PolarHBondContact O-N 3.46Å; K70-L74 HydrophobicContact CG-CD1 4.1Å; K70-L74 WeakPolarHBondContact O-CB 3.16Å; K70-L74 VanDerWaalsContact O-CG 3.29Å; K70-L74 WeakPolarHBondContact O-CG 3.37Å; K70-L74 PolarHBondContact O-N 2.81Å
71	A	91.3	Very high	86.8	Confident	58 Å²	58	89 Å²	89	48%	0.479	47%	0.473	S	S	.	.	H	α-helix	trans	-63.1	-45.6	177.2	0	0	0	0	0	111.4	T67 A68 L69 C73 L74 D75	T67-A71 PolarHBondContact O-N 3.32Å; A68-A71 WeakPolarHBondContact O-CB 3.47Å; A68-A71 PolarHBondContact O-N 3.14Å; A68-A71 VanDerWaalsContact O-N 3.11Å; L69-A71 VanDerWaalsContact C-N 3.27Å; L69-A71 PolarHBondContact O-N 3.01Å; A71-C73 PolarHBondContact O-N 3.3Å; A71-L74 PolarHBondContact O-N 2.99Å; A71-D75 WeakPolarHBondContact O-CB 3.44Å; A71-D75 PolarHBondContact O-N 3.07Å
72	V	89.4	Confident	85.9	Confident	36 Å²	36	84.5 Å²	84.5	22%	0.218	46%	0.46	C	S	.	.	H	α-helix	trans	-58.9	-46.8	175.5	172.6	0	0	0	0	111.4	T51 L52 F55 A68 L69 L74 D75 K76	T51-V72 HydrophobicContact CG2-CG1 3.65Å; L52-V72 HydrophobicContact CD2-CG1 4.46Å; F55-V72 HydrophobicContact CD2-CG2 3.96Å; F55-V72 HydrophobicContact CE2-CG2 4.46Å; A68-V72 WeakPolarHBondContact O-CG2 3.44Å; A68-V72 PolarHBondContact O-N 3.24Å; L69-V72 PolarHBondContact O-N 3.11Å; V72-L74 VanDerWaalsContact C-N 3.34Å; V72-L74 PolarHBondContact O-N 2.95Å; V72-D75 PolarHBondContact O-N 3.07Å; V72-K76 PolarHBondContact O-N 3.13Å
73	C	87.1	Confident	85	Confident	60 Å²	60	85.5 Å²	85.5	41%	0.405	47%	0.465	S	S	.	.	H	α-helix	trans	-62.9	-39.5	178.4	-67.1	0	0	0	0	112.5	L69 K70 A71 L77	L69-C73 PolarHBondContact O-N 3.37Å; L69-C73 PolarHBondContact O-SG 2.88Å; K70-C73 PolarHBondContact O-N 3.46Å; A71-C73 PolarHBondContact O-N 3.3Å; C73-L77 VanDerWaalsContact O-CB 3.3Å; C73-L77 WeakPolarHBondContact O-CB 3.34Å; C73-L77 PolarHBondContact O-N 3.17Å
74	L	87.6	Confident	84.3	Confident	89 Å²	89	81.3 Å²	81.3	47%	0.466	44%	0.435	S	S	.	.	H	α-helix	trans	-70.2	-40.4	178.6	-74.2	173.2	0	0	0	112.1	K70 A71 V72 L77 M78	K70-L74 HydrophobicContact CG-CD1 4.1Å; K70-L74 WeakPolarHBondContact O-CB 3.16Å; K70-L74 VanDerWaalsContact O-CG 3.29Å; K70-L74 WeakPolarHBondContact O-CG 3.37Å; K70-L74 PolarHBondContact O-N 2.81Å; A71-L74 PolarHBondContact O-N 2.99Å; V72-L74 VanDerWaalsContact C-N 3.34Å; V72-L74 PolarHBondContact O-N 2.95Å; L74-L77 PolarHBondContact O-N 2.81Å; L74-M78 WeakPolarHBondContact O-CG 3.3Å; L74-M78 PolarHBondContact O-N 3.36Å
75	D	88.5	Confident	83.3	Confident	106 Å²	106	83.1 Å²	83.1	57%	0.567	44%	0.436	S	S	*	.	H	α-helix	trans	-59.6	-50.4	176.1	-174.2	70.2	0	0	0	110.8	A71 V72 L77 M78 D79	A71-D75 WeakPolarHBondContact O-CB 3.44Å; A71-D75 PolarHBondContact O-N 3.07Å; V72-D75 PolarHBondContact O-N 3.07Å; D75-L77 PolarHBondContact O-N 3.49Å; D75-M78 WeakPolarHBondContact O-CB 3.37Å; D75-M78 PolarHBondContact O-N 3.3Å; D75-M78 VanDerWaalsContact O-N 3.15Å; D75-D79 PolarHBondContact O-N 2.72Å
76	K	84.3	Confident	82.6	Confident	29 Å²	29	84 Å²	84	13%	0.126	44%	0.443	C	S	.	.	H	α-helix	trans	-66.2	-34.2	177.2	-69.1	-66.3	179.2	-174	0	113.6	E47 T48 T51 V72 M78 D79 D80	E47-K76 IonicContact OE1-NZ 3.45Å; E47-K76 PolarHBondContact OE1-NZ 3.29Å; T48-K76 HydrophobicContact CG2-CB 4.02Å; T48-K76 HydrophobicContact CG2-CG 4.22Å; T51-K76 WeakPolarHBondContact OG1-CE 3.3Å; V72-K76 PolarHBondContact O-N 3.13Å; K76-M78 VanDerWaalsContact C-N 3.33Å; K76-D79 PolarHBondContact O-N 3.45Å; K76-D80 WeakPolarHBondContact O-CB 3.13Å; K76-D80 PolarHBondContact O-N 2.99Å
77	L	80.8	Confident	81.8	Confident	108 Å²	108	81.4 Å²	81.4	57%	0.565	43%	0.433	S	S	*	.	H	α-helix	trans	-65.2	-38.4	173.1	-178.8	65.8	0	0	0	112	C73 L74 D75 R81	C73-L77 VanDerWaalsContact O-CB 3.3Å; C73-L77 WeakPolarHBondContact O-CB 3.34Å; C73-L77 PolarHBondContact O-N 3.17Å; L74-L77 PolarHBondContact O-N 2.81Å; D75-L77 PolarHBondContact O-N 3.49Å; L77-R81 VanDerWaalsContact O-CB 3.3Å; L77-R81 WeakPolarHBondContact O-CB 3.1Å; L77-R81 PolarHBondContact O-N 3.3Å; L77-R81 VanDerWaalsContact O-N 3.07Å
78	M	80.4	Confident	80.9	Confident	140 Å²	140	79.3 Å²	79.3	69%	0.69	43%	0.426	S	S	*	.	H	α-helix	trans	-67.8	-40.6	175.2	-75	-178	54.8	0	0	111.4	L74 D75 K76 R81 A82	L74-M78 WeakPolarHBondContact O-CG 3.3Å; L74-M78 PolarHBondContact O-N 3.36Å; D75-M78 WeakPolarHBondContact O-CB 3.37Å; D75-M78 PolarHBondContact O-N 3.3Å; D75-M78 VanDerWaalsContact O-N 3.15Å; K76-M78 VanDerWaalsContact C-N 3.33Å; M78-R81 PolarHBondContact O-N 3.03Å; M78-A82 WeakPolarHBondContact O-CB 3.47Å; M78-A82 PolarHBondContact O-N 2.89Å
79	D	79.3	Confident	79.8	Confident	58 Å²	58	82.6 Å²	82.6	31%	0.31	44%	0.439	S	S	.	.	H	α-helix	trans	-65.1	-49.2	178.4	-165.1	36.6	0	0	0	111.6	D75 K76 R81 A82 H83	D75-D79 PolarHBondContact O-N 2.72Å; K76-D79 PolarHBondContact O-N 3.45Å; D79-R81 VanDerWaalsContact C-N 3.29Å; D79-R81 PolarHBondContact O-N 3.45Å; D79-A82 PolarHBondContact O-N 3.24Å; D79-A82 VanDerWaalsContact O-N 3.12Å; D79-H83 VanDerWaalsContact CG-CE1 3.46Å; D79-H83 WeakPolarHBondContact O-CB 3.37Å; D79-H83 PolarHBondContact O-N 2.87Å; D79-H83 PolarHBondContact O-ND1 3.47Å; D79-H83 IonicContact OD1-CE1 3.9Å; D79-H83 PolarHBondContact OD1-CE1 3.33Å; D79-H83 IonicContact OD1-ND1 2.87Å; D79-H83 PolarHBondContact OD1-ND1 2.81Å; D79-H83 VanDerWaalsContact OD1-ND1 3.15Å; D79-H83 IonicContact OD2-CE1 3.15Å; D79-H83 PolarHBondContact OD2-CE1 2.93Å; D79-H83 IonicContact OD2-ND1 3.79Å
80	D	75.3	Confident	79	Confident	73 Å²	73	83.2 Å²	83.2	39%	0.39	45%	0.445	S	S	.	.	H	α-helix	trans	-57.4	-42.6	174.3	178.4	60.3	0	0	0	111.3	K76 A82 H83 Q84	K76-D80 WeakPolarHBondContact O-CB 3.13Å; K76-D80 PolarHBondContact O-N 2.99Å; D80-A82 PolarHBondContact O-N 2.63Å; D80-H83 PolarHBondContact O-N 2.78Å; D80-Q84 VanDerWaalsContact CG-NE2 3.28Å; D80-Q84 WeakPolarHBondContact O-CB 3.44Å; D80-Q84 WeakPolarHBondContact O-CG 3.44Å; D80-Q84 PolarHBondContact O-N 3.38Å; D80-Q84 PolarHBondContact OD1-NE2 2.87Å; D80-Q84 PolarHBondContact OD2-NE2 3.13Å
81	R	77	Confident	77.9	Confident	172 Å²	172	80.9 Å²	80.9	65%	0.649	44%	0.438	S	S	*	.	H	α-helix	trans	-65.4	-40.2	176.1	-173.2	177.7	-178.7	-172.1	0.2	112.6	L77 M78 D79 Q84 I85	L77-R81 VanDerWaalsContact O-CB 3.3Å; L77-R81 WeakPolarHBondContact O-CB 3.1Å; L77-R81 PolarHBondContact O-N 3.3Å; L77-R81 VanDerWaalsContact O-N 3.07Å; M78-R81 PolarHBondContact O-N 3.03Å; D79-R81 VanDerWaalsContact C-N 3.29Å; D79-R81 PolarHBondContact O-N 3.45Å; R81-Q84 PolarHBondContact O-N 2.88Å; R81-I85 HydrophobicContact CG-CD1 4.17Å; R81-I85 VanDerWaalsContact O-CG1 3.27Å; R81-I85 WeakPolarHBondContact O-CG1 3.4Å; R81-I85 PolarHBondContact O-N 3.47Å
82	A	72.2	Confident	76.5	Confident	47 Å²	47	85.2 Å²	85.2	39%	0.388	45%	0.449	S	S	.	.	H	α-helix	trans	-64.5	-44.8	176	0	0	0	0	0	110.6	M78 D79 D80 Q84 I85 C86	M78-A82 WeakPolarHBondContact O-CB 3.47Å; M78-A82 PolarHBondContact O-N 2.89Å; D79-A82 PolarHBondContact O-N 3.24Å; D79-A82 VanDerWaalsContact O-N 3.12Å; D80-A82 PolarHBondContact O-N 2.63Å; A82-Q84 PolarHBondContact O-N 2.83Å; A82-I85 PolarHBondContact O-N 3Å; A82-C86 WeakPolarHBondContact O-CB 3.2Å; A82-C86 PolarHBondContact O-N 3.37Å; A82-C86 PolarHBondContact O-SG 2.95Å; A82-C86 VanDerWaalsContact O-SG 3.33Å
83	H	71.6	Confident	74.9	Confident	101 Å²	101	90.8 Å²	90.8	47%	0.468	47%	0.472	S	S	.	.	H	α-helix	trans	-58.7	-45.2	173.4	-77.7	88.6	0	0	0	111.8	D79 D80 I85 C86 Q87	D79-H83 VanDerWaalsContact CG-CE1 3.46Å; D79-H83 WeakPolarHBondContact O-CB 3.37Å; D79-H83 PolarHBondContact O-N 2.87Å; D79-H83 PolarHBondContact O-ND1 3.47Å; D79-H83 IonicContact OD1-CE1 3.9Å; D79-H83 PolarHBondContact OD1-CE1 3.33Å; D79-H83 IonicContact OD1-ND1 2.87Å; D79-H83 PolarHBondContact OD1-ND1 2.81Å; D79-H83 VanDerWaalsContact OD1-ND1 3.15Å; D79-H83 IonicContact OD2-CE1 3.15Å; D79-H83 PolarHBondContact OD2-CE1 2.93Å; D79-H83 IonicContact OD2-ND1 3.79Å; D80-H83 PolarHBondContact O-N 2.78Å; H83-I85 PolarHBondContact O-N 2.76Å; H83-C86 PolarHBondContact O-N 2.96Å; H83-Q87 WeakPolarHBondContact O-CB 3.45Å; H83-Q87 WeakPolarHBondContact O-CG 3.49Å; H83-Q87 PolarHBondContact O-N 3.34Å
84	Q	76.2	Confident	73.3	Confident	62 Å²	62	94.6 Å²	94.6	29%	0.29	49%	0.488	S	S	.	.	H	α-helix	trans	-61.6	-40.5	176.3	-74.4	169.9	5.7	0	0	112.5	Q18 D80 R81 A82 A88	Q18-Q84 HydrophobicContact CG-CG 4.18Å; D80-Q84 VanDerWaalsContact CG-NE2 3.28Å; D80-Q84 WeakPolarHBondContact O-CB 3.44Å; D80-Q84 WeakPolarHBondContact O-CG 3.44Å; D80-Q84 PolarHBondContact O-N 3.38Å; D80-Q84 PolarHBondContact OD1-NE2 2.87Å; D80-Q84 PolarHBondContact OD2-NE2 3.13Å; R81-Q84 PolarHBondContact O-N 2.88Å; A82-Q84 PolarHBondContact O-N 2.83Å; Q84-A88 VanDerWaalsContact O-CB 3.3Å; Q84-A88 WeakPolarHBondContact O-CB 3.49Å; Q84-A88 PolarHBondContact O-N 2.86Å
85	I	72.5	Confident	71.7	Confident	87 Å²	87	94.9 Å²	94.9	45%	0.446	50%	0.503	S	S	.	.	H	α-helix	trans	-66	-47	175.5	-69.4	165.2	0	0	0	110.4	R81 A82 H83 Q87 A88 I89	R81-I85 HydrophobicContact CG-CD1 4.17Å; R81-I85 VanDerWaalsContact O-CG1 3.27Å; R81-I85 WeakPolarHBondContact O-CG1 3.4Å; R81-I85 PolarHBondContact O-N 3.47Å; A82-I85 PolarHBondContact O-N 3Å; H83-I85 PolarHBondContact O-N 2.76Å; I85-Q87 VanDerWaalsContact C-N 3.32Å; I85-Q87 PolarHBondContact O-N 3.28Å; I85-A88 PolarHBondContact O-N 3.44Å; I85-I89 HydrophobicContact CG2-CD1 3.73Å; I85-I89 HydrophobicContact CG2-CG1 4.43Å; I85-I89 VanDerWaalsContact O-CG1 3.3Å; I85-I89 WeakPolarHBondContact O-CG1 3.22Å; I85-I89 PolarHBondContact O-N 3.24Å
86	C	73.1	Confident	69.9	Low	76 Å²	76	92.4 Å²	92.4	51%	0.514	50%	0.503	S	S	.	.	H	α-helix	trans	-60.9	-41.4	177.5	-71.6	0	0	0	0	111.8	A82 H83 T90	A82-C86 WeakPolarHBondContact O-CB 3.2Å; A82-C86 PolarHBondContact O-N 3.37Å; A82-C86 PolarHBondContact O-SG 2.95Å; A82-C86 VanDerWaalsContact O-SG 3.33Å; H83-C86 PolarHBondContact O-N 2.96Å; C86-T90 VanDerWaalsContact O-CB 3.27Å; C86-T90 WeakPolarHBondContact O-CB 3.29Å; C86-T90 PolarHBondContact O-N 3.45Å; C86-T90 PolarHBondContact O-OG1 2.89Å
87	Q	71.2	Confident	68.2	Low	106 Å²	106	99.5 Å²	99.5	50%	0.495	53%	0.529	S	S	.	.	H	α-helix	trans	-63.9	-48.4	174.3	-77.4	-176.2	-10.7	0	0	111	H83 I85 I89 T90 D91	H83-Q87 WeakPolarHBondContact O-CB 3.45Å; H83-Q87 WeakPolarHBondContact O-CG 3.49Å; H83-Q87 PolarHBondContact O-N 3.34Å; I85-Q87 VanDerWaalsContact C-N 3.32Å; I85-Q87 PolarHBondContact O-N 3.28Å; Q87-I89 VanDerWaalsContact C-N 3.32Å; Q87-I89 PolarHBondContact O-N 2.75Å; Q87-T90 PolarHBondContact O-N 3.33Å; Q87-D91 WeakPolarHBondContact O-CB 3.27Å; Q87-D91 PolarHBondContact O-N 3.22Å
88	A	72.2	Confident	66.5	Low	52 Å²	52	99.6 Å²	99.6	43%	0.43	54%	0.536	S	S	.	.	H	α-helix	trans	-58.8	-41.7	178.5	0	0	0	0	0	112.6	Q84 I85 E92	Q84-A88 VanDerWaalsContact O-CB 3.3Å; Q84-A88 WeakPolarHBondContact O-CB 3.49Å; Q84-A88 PolarHBondContact O-N 2.86Å; I85-A88 PolarHBondContact O-N 3.44Å; A88-E92 VanDerWaalsContact O-CB 3.29Å; A88-E92 WeakPolarHBondContact O-CB 2.96Å; A88-E92 PolarHBondContact O-N 3.36Å
89	I	68.9	Low	64.9	Low	92 Å²	92	98.5 Å²	98.5	47%	0.472	54%	0.539	S	S	.	.	H	α-helix	trans	-68.2	-45.7	176.7	-66.4	167.7	0	0	0	110.9	I85 Q87 E92 E93	I85-I89 HydrophobicContact CG2-CD1 3.73Å; I85-I89 HydrophobicContact CG2-CG1 4.43Å; I85-I89 VanDerWaalsContact O-CG1 3.3Å; I85-I89 WeakPolarHBondContact O-CG1 3.22Å; I85-I89 PolarHBondContact O-N 3.24Å; Q87-I89 VanDerWaalsContact C-N 3.32Å; Q87-I89 PolarHBondContact O-N 2.75Å; I89-E92 PolarHBondContact O-N 2.87Å; I89-E93 WeakPolarHBondContact O-CB 3.15Å; I89-E93 PolarHBondContact O-N 2.98Å
90	T	70.4	Confident	63.2	Low	69 Å²	69	102.3 Å²	102.3	42%	0.423	55%	0.553	S	S	.	*	H	α-helix	trans	-63.8	-43.6	179.1	-58.3	0	0	0	0	111	C86 Q87 E92 E93 L94	C86-T90 VanDerWaalsContact O-CB 3.27Å; C86-T90 WeakPolarHBondContact O-CB 3.29Å; C86-T90 PolarHBondContact O-N 3.45Å; C86-T90 PolarHBondContact O-OG1 2.89Å; Q87-T90 PolarHBondContact O-N 3.33Å; T90-E92 VanDerWaalsContact C-N 3.29Å; T90-E92 PolarHBondContact O-N 2.82Å; T90-E93 PolarHBondContact O-N 2.84Å; T90-L94 HydrophobicContact CG2-CD1 3.71Å; T90-L94 HydrophobicContact CG2-CG 4.12Å; T90-L94 VanDerWaalsContact O-CB 3.29Å; T90-L94 WeakPolarHBondContact O-CB 3.48Å; T90-L94 VanDerWaalsContact O-CG 3.24Å; T90-L94 WeakPolarHBondContact O-CG 3.44Å; T90-L94 PolarHBondContact O-N 2.74Å
91	D	66.1	Low	61.4	Low	77 Å²	77	104.2 Å²	104.2	41%	0.412	57%	0.567	S	S	.	*	H	α-helix	trans	-63.4	-37.5	176.3	-71.4	-19.6	0	0	0	110.5	Q87 A95	Q87-D91 WeakPolarHBondContact O-CB 3.27Å; Q87-D91 PolarHBondContact O-N 3.22Å; D91-A95 WeakPolarHBondContact O-CA 3.29Å; D91-A95 WeakPolarHBondContact O-CB 3.24Å; D91-A95 PolarHBondContact O-N 3.25Å
92	E	61.8	Low	59.7	Low	150 Å²	150	105.8 Å²	105.8	70%	0.701	58%	0.579	S	S	*	*	H	α-helix	trans	-66.6	-42.6	173.1	-173.8	172.8	-173.3	0	0	112.3	A88 I89 T90 G96	A88-E92 VanDerWaalsContact O-CB 3.29Å; A88-E92 WeakPolarHBondContact O-CB 2.96Å; A88-E92 PolarHBondContact O-N 3.36Å; I89-E92 PolarHBondContact O-N 2.87Å; T90-E92 VanDerWaalsContact C-N 3.29Å; T90-E92 PolarHBondContact O-N 2.82Å; E92-G96 PolarHBondContact O-N 2.8Å
93	E	55.5	Low	58.5	Low	152 Å²	152	111.7 Å²	111.7	71%	0.71	60%	0.598	S	S	*	*	H	α-helix	trans	-67	-40.7	177.9	-167.3	170.2	176.6	0	0	111.6	I89 T90	I89-E93 WeakPolarHBondContact O-CB 3.15Å; I89-E93 PolarHBondContact O-N 2.98Å; T90-E93 PolarHBondContact O-N 2.84Å
94	L	53.9	Low	57.2	Low	140 Å²	140	121.9 Å²	121.9	73%	0.733	63%	0.633	S	S	*	*	H	α-helix	trans	-77.1	-31.5	177.8	-67.6	178.5	0	0	0	113.2	T90 G96	T90-L94 HydrophobicContact CG2-CD1 3.71Å; T90-L94 HydrophobicContact CG2-CG 4.12Å; T90-L94 VanDerWaalsContact O-CB 3.29Å; T90-L94 WeakPolarHBondContact O-CB 3.48Å; T90-L94 VanDerWaalsContact O-CG 3.24Å; T90-L94 WeakPolarHBondContact O-CG 3.44Å; T90-L94 PolarHBondContact O-N 2.74Å; L94-G96 VanDerWaalsContact C-N 3.25Å; L94-G96 PolarHBondContact O-N 3.41Å
95	A	54.8	Low	56.2	Low	95 Å²	95	124.9 Å²	124.9	79%	0.785	65%	0.65	S	S	*	*	H	α-helix	trans	-77.3	-8.7	177.9	0	0	0	0	0	113.4	D91	D91-A95 WeakPolarHBondContact O-CA 3.29Å; D91-A95 WeakPolarHBondContact O-CB 3.24Å; D91-A95 PolarHBondContact O-N 3.25Å
96	G	50	Low	55.3	Low	55 Å²	55	126.9 Å²	126.9	57%	0.567	66%	0.661	S	S	*	*	S	Bend	trans	-118.4	-11.8	-153.7	0	0	0	0	0	120.1	E92 L94	E92-G96 PolarHBondContact O-N 2.8Å; L94-G96 VanDerWaalsContact C-N 3.25Å; L94-G96 PolarHBondContact O-N 3.41Å
97	R	48.4	Very low	54.4	Low	178 Å²	178	129.7 Å²	129.7	67%	0.672	67%	0.669	S	S	*	*			trans	-162.8	123.8	-179.8	-139.4	172.6	-162.8	158.6	12.4	117.1	F100	R97-F100 VanDerWaalsContact NH1-CE2 3.31Å
98	P	46.5	Very low	53.4	Low	110 Å²	110	131.1 Å²	131.1	71%	0.714	68%	0.679	S	S	*	*			trans	-64.6	143.7	159.9	26.9	-30.7	0	0	0	109.5	F100	P98-F100 PolarHBondContact O-N 3.18Å
99	P	46.1	Very low	52.2	Low	116 Å²	116	136.1 Å²	136.1	75%	0.753	70%	0.695	S	S	*	*			trans	-57	128.4	179.4	23.8	-32	0	0	0	108	V101	P99-V101 VanDerWaalsContact C-N 3.31Å; P99-V101 PolarHBondContact O-N 3.07Å
100	F	43	Very low	51.1	Low	138 Å²	138	139 Å²	139	61%	0.605	71%	0.71	S	S	*	*			trans	-53.4	97.3	175.5	-82.4	-83.6	0	0	0	109.6	R97 P98 F102	R97-F100 VanDerWaalsContact NH1-CE2 3.31Å; P98-F100 PolarHBondContact O-N 3.18Å; F100-F102 PolarHBondContact O-N 2.73Å; F100-F102 VanDerWaalsContact O-N 3.07Å
101	V	37.6	Very low	49.7	Very low	113 Å²	113	144 Å²	144	69%	0.685	73%	0.73	S	S	*	*			trans	-68.9	104.3	162.8	-96.9	0	0	0	0	106	P99 H103	P99-V101 VanDerWaalsContact C-N 3.31Å; P99-V101 PolarHBondContact O-N 3.07Å; V101-H103 VanDerWaalsContact C-N 3.29Å; V101-H103 PolarHBondContact O-N 2.88Å
102	F	41.7	Very low	48.4	Very low	206 Å²	206	149.2 Å²	149.2	90%	0.904	76%	0.755	S	S	*	*			trans	-57.5	93.7	166	-73.3	-92.6	0	0	0	108.2	F100	F100-F102 PolarHBondContact O-N 2.73Å; F100-F102 VanDerWaalsContact O-N 3.07Å
103	H	46.2	Very low	47.3	Very low	170 Å²	170	149.1 Å²	149.1	79%	0.787	76%	0.759	S	S	*	*			trans	-88.4	107.8	161.3	-76.8	-64.1	0	0	0	108	V101	V101-H103 VanDerWaalsContact C-N 3.29Å; V101-H103 PolarHBondContact O-N 2.88Å
104	R	44.3	Very low	46.6	Very low	316 Å²	316	148.8 Å²	148.8	100%	1.192	76%	0.763	S	S	*	*			trans	-57.3	0	167.4	-176.9	-177.5	-176.6	168.9	2	111.7

Retrieved 104 of 104 residues in 48.3 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).